NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
15993 | 1z8r | 6613 | cing | 1-original | 4 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 1H GLY 1 1H GLY 1 13.790 4.656 26.139 2 2H GLY 1 2H GLY 1 12.176 4.962 25.740 3 3H GLY 1 3H GLY 1 13.073 6.123 26.582 4 1HA GLY 1 1HA GLY 1 13.981 6.965 24.747 5 2HA GLY 1 2HA GLY 1 14.309 5.362 24.110 6 HA PRO 2 HA PRO 2 11.136 6.089 21.128 7 1HB PRO 2 1HB PRO 2 10.445 3.549 20.488 8 2HB PRO 2 2HB PRO 2 11.975 4.278 19.984 9 1HG PRO 2 1HG PRO 2 11.423 2.422 22.268 10 2HG PRO 2 2HG PRO 2 12.768 2.405 21.111 11 1HD PRO 2 1HD PRO 2 13.002 3.419 23.615 12 2HD PRO 2 2HD PRO 2 13.920 4.053 22.234 13 H TYR 3 H TYR 3 8.834 5.458 20.605 14 HA TYR 3 HA TYR 3 7.237 4.310 22.691 15 1HB TYR 3 1HB TYR 3 7.676 7.185 22.641 16 2HB TYR 3 2HB TYR 3 5.969 6.782 22.488 17 HD1 TYR 3 HD1 TYR 3 4.780 5.690 24.304 18 HD2 TYR 3 HD2 TYR 3 8.905 6.665 24.671 19 HE1 TYR 3 HE1 TYR 3 4.644 5.328 26.732 20 HE2 TYR 3 HE2 TYR 3 8.780 6.305 27.100 21 HH TYR 3 HH TYR 3 7.150 6.264 28.874 22 H GLY 4 H GLY 4 7.217 6.430 19.839 23 1HA GLY 4 1HA GLY 4 4.599 5.732 19.000 24 2HA GLY 4 2HA GLY 4 5.835 6.487 18.003 25 H HIS 5 H HIS 5 3.835 4.113 17.784 26 HA HIS 5 HA HIS 5 5.776 2.120 16.824 27 1HB HIS 5 1HB HIS 5 3.909 1.587 18.591 28 2HB HIS 5 2HB HIS 5 2.865 1.512 17.176 29 HD1 HIS 5 HD1 HIS 5 4.856 -0.596 19.225 30 HD2 HIS 5 HD2 HIS 5 4.100 -0.374 15.145 31 HE1 HIS 5 HE1 HIS 5 5.479 -2.851 18.302 32 HE2 HIS 5 HE2 HIS 5 4.922 -2.723 15.848 33 H GLN 6 H GLN 6 5.494 1.170 14.781 34 HA GLN 6 HA GLN 6 3.403 1.990 13.010 35 1HB GLN 6 1HB GLN 6 5.303 3.876 13.194 36 2HB GLN 6 2HB GLN 6 6.053 2.849 11.980 37 1HG GLN 6 1HG GLN 6 4.891 4.162 10.576 38 2HG GLN 6 2HG GLN 6 3.597 3.022 10.940 39 1HE2 GLN 6 1HE2 GLN 6 3.808 6.007 10.280 40 2HE2 GLN 6 2HE2 GLN 6 2.777 6.750 11.451 41 H SER 7 H SER 7 3.287 0.714 11.184 42 HA SER 7 HA SER 7 5.180 -1.529 11.120 43 1HB SER 7 1HB SER 7 2.941 -2.300 11.423 44 2HB SER 7 2HB SER 7 2.337 -1.255 10.138 45 HG SER 7 HG SER 7 2.669 -3.542 9.594 46 H GLY 8 H GLY 8 3.496 0.767 9.001 47 1HA GLY 8 1HA GLY 8 4.064 1.611 6.943 48 2HA GLY 8 2HA GLY 8 5.711 1.109 7.292 49 H ALA 9 H ALA 9 3.200 -1.272 7.322 50 HA ALA 9 HA ALA 9 3.391 -2.013 4.574 51 1HB ALA 9 1HB ALA 9 4.520 -4.203 6.174 52 2HB ALA 9 2HB ALA 9 5.572 -2.799 5.982 53 3HB ALA 9 3HB ALA 9 4.948 -3.636 4.560 54 H VAL 10 H VAL 10 2.543 -4.442 4.393 55 HA VAL 10 HA VAL 10 0.287 -4.694 6.277 56 HB VAL 10 HB VAL 10 0.275 -5.391 3.335 57 1HG1 VAL 10 1HG1 VAL 10 -1.562 -5.946 5.561 58 2HG1 VAL 10 2HG1 VAL 10 -1.361 -6.777 4.019 59 3HG1 VAL 10 3HG1 VAL 10 -2.322 -5.300 4.107 60 1HG2 VAL 10 1HG2 VAL 10 -0.654 -2.992 4.852 61 2HG2 VAL 10 2HG2 VAL 10 -1.523 -3.503 3.406 62 3HG2 VAL 10 3HG2 VAL 10 0.187 -3.088 3.305 63 H TYR 11 H TYR 11 0.701 -6.390 7.555 64 HA TYR 11 HA TYR 11 2.121 -8.711 6.486 65 1HB TYR 11 1HB TYR 11 2.172 -7.407 8.932 66 2HB TYR 11 2HB TYR 11 1.227 -8.851 9.269 67 HD1 TYR 11 HD1 TYR 11 4.513 -7.600 8.168 68 HD2 TYR 11 HD2 TYR 11 2.249 -11.009 9.319 69 HE1 TYR 11 HE1 TYR 11 6.590 -8.898 8.391 70 HE2 TYR 11 HE2 TYR 11 4.314 -12.315 9.549 71 HH TYR 11 HH TYR 11 7.342 -11.183 8.401 72 H VAL 12 H VAL 12 0.949 -10.300 5.600 73 HA VAL 12 HA VAL 12 -1.690 -10.886 6.767 74 HB VAL 12 HB VAL 12 -0.965 -11.310 3.866 75 1HG1 VAL 12 1HG1 VAL 12 -2.694 -12.791 4.457 76 2HG1 VAL 12 2HG1 VAL 12 -3.503 -11.414 3.710 77 3HG1 VAL 12 3HG1 VAL 12 -3.493 -11.586 5.465 78 1HG2 VAL 12 1HG2 VAL 12 -1.558 -8.886 5.216 79 2HG2 VAL 12 2HG2 VAL 12 -2.947 -9.308 4.219 80 3HG2 VAL 12 3HG2 VAL 12 -1.349 -9.160 3.487 81 H GLY 13 H GLY 13 -1.508 -12.686 7.933 82 1HA GLY 13 1HA GLY 13 -0.894 -14.808 8.581 83 2HA GLY 13 2HA GLY 13 -1.193 -15.203 6.897 84 H ASN 14 H ASN 14 0.419 -16.341 6.078 85 HA ASN 14 HA ASN 14 3.112 -16.044 7.143 86 1HB ASN 14 1HB ASN 14 3.619 -18.051 5.793 87 2HB ASN 14 2HB ASN 14 2.251 -18.302 6.874 88 1HD2 ASN 14 1HD2 ASN 14 2.777 -19.875 4.628 89 2HD2 ASN 14 2HD2 ASN 14 1.498 -19.650 3.489 90 H TYR 15 H TYR 15 1.606 -14.202 5.107 91 HA TYR 15 HA TYR 15 3.911 -13.921 3.288 92 1HB TYR 15 1HB TYR 15 0.971 -13.853 2.633 93 2HB TYR 15 2HB TYR 15 2.141 -13.008 1.632 94 HD1 TYR 15 HD1 TYR 15 4.349 -15.197 1.968 95 HD2 TYR 15 HD2 TYR 15 0.230 -15.316 0.930 96 HE1 TYR 15 HE1 TYR 15 4.726 -17.267 0.707 97 HE2 TYR 15 HE2 TYR 15 0.594 -17.389 -0.332 98 HH TYR 15 HH TYR 15 2.326 -19.309 -0.255 99 H LYS 16 H LYS 16 4.771 -11.911 3.355 100 HA LYS 16 HA LYS 16 3.121 -9.752 4.497 101 1HB LYS 16 1HB LYS 16 4.919 -10.283 6.007 102 2HB LYS 16 2HB LYS 16 6.096 -10.228 4.703 103 1HG LYS 16 1HG LYS 16 4.515 -7.775 5.215 104 2HG LYS 16 2HG LYS 16 5.750 -8.218 6.395 105 1HD LYS 16 1HD LYS 16 7.077 -8.566 4.035 106 2HD LYS 16 2HD LYS 16 6.031 -7.193 3.664 107 1HE LYS 16 1HE LYS 16 8.104 -6.345 4.509 108 2HE LYS 16 2HE LYS 16 6.863 -6.087 5.735 109 1HZ LYS 16 1HZ LYS 16 7.908 -8.541 6.330 110 2HZ LYS 16 2HZ LYS 16 8.252 -7.090 7.128 111 3HZ LYS 16 3HZ LYS 16 9.261 -7.629 5.883 112 H VAL 17 H VAL 17 2.516 -8.321 2.987 113 HA VAL 17 HA VAL 17 4.273 -7.937 0.677 114 HB VAL 17 HB VAL 17 2.488 -7.483 -0.640 115 1HG1 VAL 17 1HG1 VAL 17 0.754 -8.675 1.481 116 2HG1 VAL 17 2HG1 VAL 17 2.041 -9.622 0.734 117 3HG1 VAL 17 3HG1 VAL 17 0.746 -8.953 -0.262 118 1HG2 VAL 17 1HG2 VAL 17 1.035 -6.272 1.709 119 2HG2 VAL 17 2HG2 VAL 17 0.428 -6.340 0.053 120 3HG2 VAL 17 3HG2 VAL 17 1.870 -5.396 0.426 121 H VAL 18 H VAL 18 5.507 -6.215 0.544 122 HA VAL 18 HA VAL 18 4.666 -3.727 1.855 123 HB VAL 18 HB VAL 18 6.256 -4.827 3.367 124 1HG1 VAL 18 1HG1 VAL 18 7.444 -6.022 1.450 125 2HG1 VAL 18 2HG1 VAL 18 8.440 -5.423 2.776 126 3HG1 VAL 18 3HG1 VAL 18 8.366 -4.532 1.255 127 1HG2 VAL 18 1HG2 VAL 18 6.190 -2.299 2.957 128 2HG2 VAL 18 2HG2 VAL 18 7.703 -2.537 2.083 129 3HG2 VAL 18 3HG2 VAL 18 7.597 -2.959 3.791 130 H ASN 19 H ASN 19 5.842 -1.815 1.055 131 HA ASN 19 HA ASN 19 5.892 -1.695 -1.744 132 1HB ASN 19 1HB ASN 19 5.701 0.194 0.080 133 2HB ASN 19 2HB ASN 19 7.452 0.263 -0.099 134 1HD2 ASN 19 1HD2 ASN 19 4.551 1.408 -1.231 135 2HD2 ASN 19 2HD2 ASN 19 5.088 2.075 -2.732 136 H ARG 20 H ARG 20 7.535 -1.737 -3.244 137 HA ARG 20 HA ARG 20 9.729 -3.386 -2.789 138 1HB ARG 20 1HB ARG 20 8.623 -2.589 -5.011 139 2HB ARG 20 2HB ARG 20 9.791 -1.278 -4.922 140 1HG ARG 20 1HG ARG 20 11.545 -3.140 -4.658 141 2HG ARG 20 2HG ARG 20 10.278 -4.209 -5.261 142 1HD ARG 20 1HD ARG 20 10.086 -2.313 -7.107 143 2HD ARG 20 2HD ARG 20 11.768 -2.047 -6.648 144 HE ARG 20 HE ARG 20 11.300 -4.796 -7.114 145 1HH1 ARG 20 1HH1 ARG 20 11.671 -1.765 -8.802 146 2HH1 ARG 20 2HH1 ARG 20 12.273 -2.501 -10.248 147 1HH2 ARG 20 1HH2 ARG 20 12.091 -5.766 -9.016 148 2HH2 ARG 20 2HH2 ARG 20 12.512 -4.773 -10.371 149 H HIS 21 H HIS 21 9.578 0.162 -2.930 150 HA HIS 21 HA HIS 21 12.345 0.539 -2.412 151 1HB HIS 21 1HB HIS 21 10.626 2.194 -3.421 152 2HB HIS 21 2HB HIS 21 10.237 2.575 -1.747 153 HD1 HIS 21 HD1 HIS 21 12.456 3.317 -0.281 154 HD2 HIS 21 HD2 HIS 21 12.663 3.670 -4.416 155 HE1 HIS 21 HE1 HIS 21 14.355 4.905 -0.727 156 HE2 HIS 21 HE2 HIS 21 14.532 5.013 -3.237 157 H LEU 22 H LEU 22 9.870 -0.545 -0.422 158 HA LEU 22 HA LEU 22 11.222 0.448 1.992 159 1HB LEU 22 1HB LEU 22 8.727 0.909 1.555 160 2HB LEU 22 2HB LEU 22 8.487 -0.786 1.939 161 HG LEU 22 HG LEU 22 9.580 -0.361 4.157 162 1HD1 LEU 22 1HD1 LEU 22 10.461 1.946 3.064 163 2HD1 LEU 22 2HD1 LEU 22 10.327 1.661 4.798 164 3HD1 LEU 22 3HD1 LEU 22 9.047 2.523 3.945 165 1HD2 LEU 22 1HD2 LEU 22 7.577 1.041 4.996 166 2HD2 LEU 22 2HD2 LEU 22 7.271 -0.534 4.265 167 3HD2 LEU 22 3HD2 LEU 22 7.016 0.939 3.328 168 H ALA 23 H ALA 23 10.823 -2.336 0.092 169 HA ALA 23 HA ALA 23 10.811 -4.273 2.184 170 1HB ALA 23 1HB ALA 23 10.104 -5.377 0.370 171 2HB ALA 23 2HB ALA 23 11.819 -5.591 0.018 172 3HB ALA 23 3HB ALA 23 10.920 -4.275 -0.738 173 H THR 24 H THR 24 12.530 -5.613 2.851 174 HA THR 24 HA THR 24 15.158 -4.326 2.616 175 HB THR 24 HB THR 24 15.747 -5.546 4.665 176 HG1 THR 24 HG1 THR 24 14.623 -7.341 4.812 177 1HG2 THR 24 1HG2 THR 24 13.485 -3.691 4.581 178 2HG2 THR 24 2HG2 THR 24 14.959 -3.653 5.549 179 3HG2 THR 24 3HG2 THR 24 13.601 -4.661 6.049 180 H HIS 25 H HIS 25 17.040 -5.928 2.776 181 HA HIS 25 HA HIS 25 17.091 -7.548 0.523 182 1HB HIS 25 1HB HIS 25 19.000 -6.643 2.135 183 2HB HIS 25 2HB HIS 25 18.854 -8.256 2.825 184 HD1 HIS 25 HD1 HIS 25 21.326 -7.078 1.156 185 HD2 HIS 25 HD2 HIS 25 18.418 -9.711 -0.214 186 HE1 HIS 25 HE1 HIS 25 22.377 -8.291 -0.780 187 HE2 HIS 25 HE2 HIS 25 20.631 -9.943 -1.534 188 H VAL 26 H VAL 26 16.077 -8.244 3.774 189 HA VAL 26 HA VAL 26 16.072 -11.088 3.519 190 HB VAL 26 HB VAL 26 14.477 -9.432 5.476 191 1HG1 VAL 26 1HG1 VAL 26 15.088 -12.302 5.162 192 2HG1 VAL 26 2HG1 VAL 26 13.691 -11.509 5.890 193 3HG1 VAL 26 3HG1 VAL 26 15.194 -11.658 6.800 194 1HG2 VAL 26 1HG2 VAL 26 16.553 -8.653 6.000 195 2HG2 VAL 26 2HG2 VAL 26 17.373 -10.074 5.353 196 3HG2 VAL 26 3HG2 VAL 26 16.583 -10.153 6.928 197 H ASP 27 H ASP 27 13.753 -8.539 2.853 198 HA ASP 27 HA ASP 27 11.457 -10.184 2.701 199 1HB ASP 27 1HB ASP 27 12.129 -7.401 2.191 200 2HB ASP 27 2HB ASP 27 11.058 -8.030 0.944 201 H TRP 28 H TRP 28 13.805 -9.005 0.346 202 HA TRP 28 HA TRP 28 12.556 -10.329 -1.828 203 1HB TRP 28 1HB TRP 28 15.221 -8.971 -1.533 204 2HB TRP 28 2HB TRP 28 14.731 -9.765 -3.030 205 HD1 TRP 28 HD1 TRP 28 12.279 -8.792 -4.060 206 HE1 TRP 28 HE1 TRP 28 11.469 -6.352 -4.157 207 HE3 TRP 28 HE3 TRP 28 15.363 -6.779 -0.524 208 HZ2 TRP 28 HZ2 TRP 28 12.049 -3.897 -2.881 209 HZ3 TRP 28 HZ3 TRP 28 15.175 -4.381 -0.025 210 HH2 TRP 28 HH2 TRP 28 13.558 -2.969 -1.184 211 H GLN 29 H GLN 29 15.035 -11.143 0.466 212 HA GLN 29 HA GLN 29 16.243 -13.298 -0.839 213 1HB GLN 29 1HB GLN 29 15.880 -12.513 2.019 214 2HB GLN 29 2HB GLN 29 16.469 -14.131 1.665 215 1HG GLN 29 1HG GLN 29 17.801 -11.869 0.296 216 2HG GLN 29 2HG GLN 29 18.088 -12.062 2.024 217 1HE2 GLN 29 1HE2 GLN 29 19.046 -12.980 -1.031 218 2HE2 GLN 29 2HE2 GLN 29 20.002 -14.355 -0.611 219 H ASN 30 H ASN 30 13.367 -13.171 1.219 220 HA ASN 30 HA ASN 30 12.723 -15.923 0.382 221 1HB ASN 30 1HB ASN 30 11.833 -14.419 2.854 222 2HB ASN 30 2HB ASN 30 11.305 -16.040 2.413 223 1HD2 ASN 30 1HD2 ASN 30 12.679 -15.204 4.798 224 2HD2 ASN 30 2HD2 ASN 30 14.167 -16.079 4.850 225 H CYS 31 H CYS 31 12.216 -13.557 -1.174 226 HA CYS 31 HA CYS 31 9.429 -12.897 -0.902 227 1HB CYS 31 1HB CYS 31 10.883 -11.182 -1.727 228 2HB CYS 31 2HB CYS 31 11.499 -12.229 -2.998 229 HG CYS 31 HG CYS 31 8.637 -11.005 -3.025 230 H VAL 32 H VAL 32 7.736 -13.730 -1.949 231 HA VAL 32 HA VAL 32 8.204 -16.044 -3.674 232 HB VAL 32 HB VAL 32 5.735 -16.433 -3.377 233 1HG1 VAL 32 1HG1 VAL 32 6.809 -16.336 -0.631 234 2HG1 VAL 32 2HG1 VAL 32 7.787 -17.192 -1.824 235 3HG1 VAL 32 3HG1 VAL 32 6.119 -17.684 -1.535 236 1HG2 VAL 32 1HG2 VAL 32 4.541 -15.248 -1.662 237 2HG2 VAL 32 2HG2 VAL 32 5.180 -14.077 -2.814 238 3HG2 VAL 32 3HG2 VAL 32 5.976 -14.308 -1.256 239 H TRP 33 H TRP 33 6.550 -12.916 -3.606 240 HA TRP 33 HA TRP 33 6.478 -12.969 -6.534 241 1HB TRP 33 1HB TRP 33 4.255 -13.526 -6.266 242 2HB TRP 33 2HB TRP 33 4.128 -12.714 -4.710 243 HD1 TRP 33 HD1 TRP 33 3.500 -12.190 -8.389 244 HE1 TRP 33 HE1 TRP 33 2.520 -9.837 -8.765 245 HE3 TRP 33 HE3 TRP 33 4.263 -10.250 -3.736 246 HZ2 TRP 33 HZ2 TRP 33 2.126 -7.462 -7.264 247 HZ3 TRP 33 HZ3 TRP 33 3.568 -7.938 -3.283 248 HH2 TRP 33 HH2 TRP 33 2.524 -6.577 -5.019 249 H GLU 34 H GLU 34 6.412 -10.881 -7.525 250 HA GLU 34 HA GLU 34 6.522 -8.508 -5.913 251 1HB GLU 34 1HB GLU 34 8.785 -9.272 -5.531 252 2HB GLU 34 2HB GLU 34 9.037 -9.510 -7.254 253 1HG GLU 34 1HG GLU 34 8.226 -6.811 -6.778 254 2HG GLU 34 2HG GLU 34 9.574 -7.221 -5.717 255 H ASP 35 H ASP 35 5.447 -7.067 -7.068 256 HA ASP 35 HA ASP 35 5.593 -7.202 -10.002 257 1HB ASP 35 1HB ASP 35 3.344 -7.464 -8.900 258 2HB ASP 35 2HB ASP 35 3.496 -5.804 -8.333 259 H TYR 36 H TYR 36 7.004 -5.808 -10.822 260 HA TYR 36 HA TYR 36 8.059 -3.577 -9.508 261 1HB TYR 36 1HB TYR 36 8.945 -2.929 -11.730 262 2HB TYR 36 2HB TYR 36 9.230 -4.625 -11.355 263 HD1 TYR 36 HD1 TYR 36 8.008 -6.384 -12.546 264 HD2 TYR 36 HD2 TYR 36 7.470 -2.279 -13.523 265 HE1 TYR 36 HE1 TYR 36 6.939 -7.034 -14.662 266 HE2 TYR 36 HE2 TYR 36 6.399 -2.917 -15.641 267 HH TYR 36 HH TYR 36 6.354 -4.835 -17.178 268 H ASN 37 H ASN 37 5.511 -3.767 -11.986 269 HA ASN 37 HA ASN 37 5.039 -1.021 -12.223 270 1HB ASN 37 1HB ASN 37 3.567 -3.502 -12.894 271 2HB ASN 37 2HB ASN 37 2.592 -2.043 -12.749 272 1HD2 ASN 37 1HD2 ASN 37 4.083 -0.098 -13.755 273 2HD2 ASN 37 2HD2 ASN 37 4.490 -0.403 -15.407 274 H ARG 38 H ARG 38 4.119 -3.294 -9.772 275 HA ARG 38 HA ARG 38 2.258 -1.367 -8.590 276 1HB ARG 38 1HB ARG 38 1.741 -3.882 -8.908 277 2HB ARG 38 2HB ARG 38 2.796 -4.122 -7.522 278 1HG ARG 38 1HG ARG 38 1.368 -2.733 -6.151 279 2HG ARG 38 2HG ARG 38 0.336 -2.388 -7.540 280 1HD ARG 38 1HD ARG 38 0.725 -4.997 -6.102 281 2HD ARG 38 2HD ARG 38 -0.767 -4.082 -6.323 282 HE ARG 38 HE ARG 38 -0.105 -4.652 -8.849 283 1HH1 ARG 38 1HH1 ARG 38 -0.258 -6.671 -6.005 284 2HH1 ARG 38 2HH1 ARG 38 -0.644 -8.105 -6.894 285 1HH2 ARG 38 1HH2 ARG 38 -0.616 -6.539 -10.016 286 2HH2 ARG 38 2HH2 ARG 38 -0.847 -8.031 -9.169 287 H ASP 39 H ASP 39 5.495 -2.207 -8.405 288 HA ASP 39 HA ASP 39 7.153 -1.884 -6.872 289 1HB ASP 39 1HB ASP 39 5.379 0.409 -6.784 290 2HB ASP 39 2HB ASP 39 6.160 0.159 -5.226 291 H LEU 40 H LEU 40 5.203 -3.860 -6.231 292 HA LEU 40 HA LEU 40 5.457 -3.857 -3.304 293 1HB LEU 40 1HB LEU 40 3.161 -3.282 -3.819 294 2HB LEU 40 2HB LEU 40 3.028 -4.646 -4.910 295 HG LEU 40 HG LEU 40 3.542 -6.070 -2.790 296 1HD1 LEU 40 1HD1 LEU 40 3.785 -3.620 -1.626 297 2HD1 LEU 40 2HD1 LEU 40 3.441 -5.121 -0.766 298 3HD1 LEU 40 3HD1 LEU 40 2.121 -4.046 -1.227 299 1HD2 LEU 40 1HD2 LEU 40 0.849 -4.901 -2.556 300 2HD2 LEU 40 2HD2 LEU 40 1.346 -6.579 -2.776 301 3HD2 LEU 40 3HD2 LEU 40 1.291 -5.487 -4.162 302 H LEU 41 H LEU 41 5.701 -5.902 -2.343 303 HA LEU 41 HA LEU 41 5.897 -8.214 -4.086 304 1HB LEU 41 1HB LEU 41 8.126 -8.829 -3.427 305 2HB LEU 41 2HB LEU 41 8.135 -7.259 -4.188 306 HG LEU 41 HG LEU 41 9.371 -8.002 -1.794 307 1HD1 LEU 41 1HD1 LEU 41 9.620 -6.071 -3.639 308 2HD1 LEU 41 2HD1 LEU 41 10.467 -6.067 -2.090 309 3HD1 LEU 41 3HD1 LEU 41 8.987 -5.128 -2.289 310 1HD2 LEU 41 1HD2 LEU 41 8.402 -6.215 -0.257 311 2HD2 LEU 41 2HD2 LEU 41 7.540 -7.747 -0.376 312 3HD2 LEU 41 3HD2 LEU 41 6.947 -6.331 -1.238 313 H VAL 42 H VAL 42 6.022 -10.249 -2.959 314 HA VAL 42 HA VAL 42 5.029 -10.037 -0.199 315 HB VAL 42 HB VAL 42 4.195 -11.950 -2.381 316 1HG1 VAL 42 1HG1 VAL 42 4.611 -13.263 -0.339 317 2HG1 VAL 42 2HG1 VAL 42 2.897 -13.195 -0.735 318 3HG1 VAL 42 3HG1 VAL 42 3.544 -12.185 0.558 319 1HG2 VAL 42 1HG2 VAL 42 2.520 -10.499 -2.566 320 2HG2 VAL 42 2HG2 VAL 42 3.048 -9.613 -1.135 321 3HG2 VAL 42 3HG2 VAL 42 1.987 -11.013 -0.964 322 H SER 43 H SER 43 6.139 -11.017 1.298 323 HA SER 43 HA SER 43 8.062 -13.110 0.533 324 1HB SER 43 1HB SER 43 9.677 -12.250 1.980 325 2HB SER 43 2HB SER 43 8.956 -10.779 1.327 326 HG SER 43 HG SER 43 9.077 -10.583 3.548 327 H THR 44 H THR 44 8.464 -14.721 2.227 328 HA THR 44 HA THR 44 6.006 -15.196 3.727 329 HB THR 44 HB THR 44 6.563 -17.488 3.746 330 HG1 THR 44 HG1 THR 44 8.597 -18.252 3.277 331 1HG2 THR 44 1HG2 THR 44 6.206 -16.240 1.428 332 2HG2 THR 44 2HG2 THR 44 6.448 -17.986 1.564 333 3HG2 THR 44 3HG2 THR 44 7.802 -16.937 1.137 334 H THR 45 H THR 45 5.942 -15.691 5.883 335 HA THR 45 HA THR 45 8.389 -15.266 7.443 336 HB THR 45 HB THR 45 7.477 -13.143 7.667 337 HG1 THR 45 HG1 THR 45 6.087 -14.490 9.726 338 1HG2 THR 45 1HG2 THR 45 4.703 -13.781 8.326 339 2HG2 THR 45 2HG2 THR 45 5.148 -14.122 6.656 340 3HG2 THR 45 3HG2 THR 45 5.369 -12.503 7.312 341 H THR 46 H THR 46 8.083 -15.913 9.763 342 HA THR 46 HA THR 46 6.599 -18.423 9.837 343 HB THR 46 HB THR 46 8.878 -18.621 10.521 344 HG1 THR 46 HG1 THR 46 7.193 -19.637 11.861 345 1HG2 THR 46 1HG2 THR 46 9.092 -17.187 12.915 346 2HG2 THR 46 2HG2 THR 46 8.492 -16.050 11.707 347 3HG2 THR 46 3HG2 THR 46 9.987 -16.937 11.416 348 H ALA 47 H ALA 47 6.708 -15.289 11.409 349 HA ALA 47 HA ALA 47 4.736 -16.036 13.392 350 1HB ALA 47 1HB ALA 47 5.203 -14.060 14.434 351 2HB ALA 47 2HB ALA 47 5.464 -13.194 12.921 352 3HB ALA 47 3HB ALA 47 6.707 -14.280 13.540 353 H HIS 48 H HIS 48 2.600 -15.814 13.206 354 HA HIS 48 HA HIS 48 1.352 -15.198 10.781 355 1HB HIS 48 1HB HIS 48 0.472 -15.730 13.553 356 2HB HIS 48 2HB HIS 48 -0.665 -14.828 12.557 357 HD1 HIS 48 HD1 HIS 48 0.000 -16.350 9.866 358 HD2 HIS 48 HD2 HIS 48 -0.897 -18.123 13.516 359 HE1 HIS 48 HE1 HIS 48 -0.859 -18.646 9.305 360 HE2 HIS 48 HE2 HIS 48 -1.480 -19.665 11.524 361 H GLY 49 H GLY 49 0.137 -13.417 10.092 362 1HA GLY 49 1HA GLY 49 1.176 -10.879 10.985 363 2HA GLY 49 2HA GLY 49 0.048 -11.140 9.663 364 H CYS 50 H CYS 50 -0.547 -9.019 11.025 365 HA CYS 50 HA CYS 50 -2.808 -9.831 12.717 366 1HB CYS 50 1HB CYS 50 -0.613 -8.708 13.808 367 2HB CYS 50 2HB CYS 50 -1.500 -7.252 13.369 368 HG CYS 50 HG CYS 50 -2.672 -9.396 15.298 369 H ASP 51 H ASP 51 -2.740 -9.169 9.912 370 HA ASP 51 HA ASP 51 -4.587 -6.894 9.972 371 1HB ASP 51 1HB ASP 51 -2.139 -7.173 8.258 372 2HB ASP 51 2HB ASP 51 -3.534 -6.276 7.664 373 H THR 52 H THR 52 -6.261 -6.991 8.498 374 HA THR 52 HA THR 52 -6.425 -9.466 6.906 375 HB THR 52 HB THR 52 -8.689 -8.024 8.300 376 HG1 THR 52 HG1 THR 52 -8.021 -9.162 9.922 377 1HG2 THR 52 1HG2 THR 52 -9.420 -9.160 6.254 378 2HG2 THR 52 2HG2 THR 52 -10.068 -9.911 7.712 379 3HG2 THR 52 3HG2 THR 52 -8.721 -10.662 6.857 380 H ILE 53 H ILE 53 -6.377 -9.042 4.809 381 HA ILE 53 HA ILE 53 -6.864 -6.427 3.759 382 HB ILE 53 HB ILE 53 -6.779 -8.831 1.997 383 1HG1 ILE 53 1HG1 ILE 53 -4.747 -8.151 3.952 384 2HG1 ILE 53 2HG1 ILE 53 -4.850 -9.548 2.889 385 1HG2 ILE 53 1HG2 ILE 53 -7.118 -6.571 1.083 386 2HG2 ILE 53 2HG2 ILE 53 -5.648 -7.336 0.484 387 3HG2 ILE 53 3HG2 ILE 53 -5.550 -6.094 1.734 388 1HD1 ILE 53 1HD1 ILE 53 -3.460 -6.941 2.460 389 2HD1 ILE 53 2HD1 ILE 53 -3.940 -7.937 1.083 390 3HD1 ILE 53 3HD1 ILE 53 -2.842 -8.585 2.297 391 H ALA 54 H ALA 54 -8.590 -5.652 2.639 392 HA ALA 54 HA ALA 54 -11.059 -7.192 2.853 393 1HB ALA 54 1HB ALA 54 -10.406 -4.451 3.099 394 2HB ALA 54 2HB ALA 54 -11.977 -5.222 3.305 395 3HB ALA 54 3HB ALA 54 -11.495 -4.611 1.722 396 H ARG 55 H ARG 55 -12.142 -8.010 1.152 397 HA ARG 55 HA ARG 55 -10.894 -7.764 -1.477 398 1HB ARG 55 1HB ARG 55 -12.155 -9.877 -0.090 399 2HB ARG 55 2HB ARG 55 -13.190 -9.499 -1.460 400 1HG ARG 55 1HG ARG 55 -10.827 -9.526 -2.707 401 2HG ARG 55 2HG ARG 55 -10.471 -10.646 -1.391 402 1HD ARG 55 1HD ARG 55 -12.863 -11.592 -2.144 403 2HD ARG 55 2HD ARG 55 -12.319 -10.925 -3.682 404 HE ARG 55 HE ARG 55 -11.397 -13.300 -2.451 405 1HH1 ARG 55 1HH1 ARG 55 -10.281 -10.572 -4.320 406 2HH1 ARG 55 2HH1 ARG 55 -8.956 -11.436 -5.024 407 1HH2 ARG 55 1HH2 ARG 55 -9.654 -14.439 -3.376 408 2HH2 ARG 55 2HH2 ARG 55 -8.600 -13.632 -4.489 409 H CYS 56 H CYS 56 -12.483 -5.613 -0.230 410 HA CYS 56 HA CYS 56 -14.819 -5.483 -1.985 411 1HB CYS 56 1HB CYS 56 -15.561 -3.641 -0.586 412 2HB CYS 56 2HB CYS 56 -15.134 -5.015 0.426 413 H GLN 57 H GLN 57 -15.287 -3.283 -2.924 414 HA GLN 57 HA GLN 57 -12.810 -1.958 -3.801 415 1HB GLN 57 1HB GLN 57 -14.705 -3.406 -5.396 416 2HB GLN 57 2HB GLN 57 -14.729 -1.713 -5.869 417 1HG GLN 57 1HG GLN 57 -12.249 -1.823 -6.104 418 2HG GLN 57 2HG GLN 57 -12.357 -3.560 -5.823 419 1HE2 GLN 57 1HE2 GLN 57 -11.645 -4.192 -7.810 420 2HE2 GLN 57 2HE2 GLN 57 -12.526 -3.921 -9.272 421 H CYS 58 H CYS 58 -14.640 -1.212 -1.677 422 HA CYS 58 HA CYS 58 -16.491 0.741 -2.400 423 1HB CYS 58 1HB CYS 58 -14.757 0.849 0.072 424 2HB CYS 58 2HB CYS 58 -16.362 1.538 -0.139 425 H THR 59 H THR 59 -16.354 2.805 -3.061 426 HA THR 59 HA THR 59 -13.816 3.838 -3.877 427 HB THR 59 HB THR 59 -15.733 4.306 -5.246 428 HG1 THR 59 HG1 THR 59 -15.352 6.407 -5.550 429 1HG2 THR 59 1HG2 THR 59 -17.093 4.731 -2.810 430 2HG2 THR 59 2HG2 THR 59 -17.744 4.734 -4.450 431 3HG2 THR 59 3HG2 THR 59 -17.157 6.234 -3.731 432 H THR 60 H THR 60 -15.410 3.842 -0.931 433 HA THR 60 HA THR 60 -13.976 6.264 -0.064 434 HB THR 60 HB THR 60 -15.672 6.733 1.504 435 HG1 THR 60 HG1 THR 60 -16.059 4.723 2.359 436 1HG2 THR 60 1HG2 THR 60 -16.926 5.755 -1.038 437 2HG2 THR 60 2HG2 THR 60 -16.542 7.411 -0.565 438 3HG2 THR 60 3HG2 THR 60 -17.851 6.544 0.239 439 H GLY 61 H GLY 61 -12.495 6.050 1.486 440 1HA GLY 61 1HA GLY 61 -12.599 3.827 3.360 441 2HA GLY 61 2HA GLY 61 -11.225 3.829 2.261 442 H VAL 62 H VAL 62 -10.091 3.943 4.415 443 HA VAL 62 HA VAL 62 -9.665 6.772 5.083 444 HB VAL 62 HB VAL 62 -11.025 5.841 6.878 445 1HG1 VAL 62 1HG1 VAL 62 -8.800 3.848 7.289 446 2HG1 VAL 62 2HG1 VAL 62 -10.371 3.483 6.576 447 3HG1 VAL 62 3HG1 VAL 62 -10.267 4.006 8.257 448 1HG2 VAL 62 1HG2 VAL 62 -8.166 6.489 7.496 449 2HG2 VAL 62 2HG2 VAL 62 -9.329 6.153 8.777 450 3HG2 VAL 62 3HG2 VAL 62 -9.602 7.498 7.671 451 H TYR 63 H TYR 63 -7.617 7.358 4.937 452 HA TYR 63 HA TYR 63 -5.567 5.249 4.921 453 1HB TYR 63 1HB TYR 63 -4.302 6.524 3.387 454 2HB TYR 63 2HB TYR 63 -5.955 6.599 2.800 455 HD1 TYR 63 HD1 TYR 63 -3.539 8.521 4.897 456 HD2 TYR 63 HD2 TYR 63 -6.860 8.679 2.230 457 HE1 TYR 63 HE1 TYR 63 -3.385 10.973 4.856 458 HE2 TYR 63 HE2 TYR 63 -6.708 11.131 2.188 459 HH TYR 63 HH TYR 63 -5.798 12.950 3.759 460 H PHE 64 H PHE 64 -3.513 5.706 5.865 461 HA PHE 64 HA PHE 64 -3.744 7.421 8.214 462 1HB PHE 64 1HB PHE 64 -2.873 4.937 8.127 463 2HB PHE 64 2HB PHE 64 -1.356 5.701 7.664 464 HD1 PHE 64 HD1 PHE 64 0.122 5.904 9.394 465 HD2 PHE 64 HD2 PHE 64 -4.033 6.384 10.180 466 HE1 PHE 64 HE1 PHE 64 0.624 6.339 11.764 467 HE2 PHE 64 HE2 PHE 64 -3.539 6.822 12.550 468 HZ PHE 64 HZ PHE 64 -1.208 6.800 13.344 469 H CYS 65 H CYS 65 -2.336 9.097 8.683 470 HA CYS 65 HA CYS 65 -0.560 9.922 6.479 471 1HB CYS 65 1HB CYS 65 -2.698 11.294 6.870 472 2HB CYS 65 2HB CYS 65 -1.919 11.854 8.345 473 HG CYS 65 HG CYS 65 -0.145 13.060 6.928 474 H ALA 66 H ALA 66 1.475 10.559 6.975 475 HA ALA 66 HA ALA 66 2.508 9.864 9.548 476 1HB ALA 66 1HB ALA 66 4.670 10.675 8.609 477 2HB ALA 66 2HB ALA 66 3.801 11.153 7.151 478 3HB ALA 66 3HB ALA 66 3.867 9.455 7.620 479 H SER 67 H SER 67 2.045 12.916 7.796 480 HA SER 67 HA SER 67 3.158 14.588 9.778 481 1HB SER 67 1HB SER 67 1.962 14.912 7.226 482 2HB SER 67 2HB SER 67 1.091 15.966 8.338 483 HG SER 67 HG SER 67 3.483 16.342 7.260 484 H LYS 68 H LYS 68 -0.218 13.734 9.054 485 HA LYS 68 HA LYS 68 -1.252 15.145 11.318 486 1HB LYS 68 1HB LYS 68 -2.661 12.979 9.766 487 2HB LYS 68 2HB LYS 68 -3.383 14.292 10.684 488 1HG LYS 68 1HG LYS 68 -1.607 15.006 8.419 489 2HG LYS 68 2HG LYS 68 -3.202 14.351 8.050 490 1HD LYS 68 1HD LYS 68 -3.662 16.602 8.151 491 2HD LYS 68 2HD LYS 68 -4.004 16.113 9.813 492 1HE LYS 68 1HE LYS 68 -1.832 16.884 10.529 493 2HE LYS 68 2HE LYS 68 -1.377 17.253 8.866 494 1HZ LYS 68 1HZ LYS 68 -3.798 18.533 9.840 495 2HZ LYS 68 2HZ LYS 68 -2.557 19.155 8.874 496 3HZ LYS 68 3HZ LYS 68 -2.354 19.056 10.551 497 H SER 69 H SER 69 -0.090 11.922 10.721 498 HA SER 69 HA SER 69 0.214 10.113 12.065 499 1HB SER 69 1HB SER 69 -0.277 11.758 14.517 500 2HB SER 69 2HB SER 69 0.941 10.517 14.228 501 HG SER 69 HG SER 69 1.450 12.972 14.203 502 H LYS 70 H LYS 70 -2.543 11.119 11.314 503 HA LYS 70 HA LYS 70 -4.027 9.383 13.157 504 1HB LYS 70 1HB LYS 70 -5.258 11.880 12.016 505 2HB LYS 70 2HB LYS 70 -5.846 10.876 13.331 506 1HG LYS 70 1HG LYS 70 -4.776 12.102 14.832 507 2HG LYS 70 2HG LYS 70 -3.249 11.938 13.965 508 1HD LYS 70 1HD LYS 70 -3.612 14.231 13.945 509 2HD LYS 70 2HD LYS 70 -4.228 13.720 12.373 510 1HE LYS 70 1HE LYS 70 -5.753 14.523 14.827 511 2HE LYS 70 2HE LYS 70 -5.872 15.164 13.189 512 1HZ LYS 70 1HZ LYS 70 -6.817 13.022 12.495 513 2HZ LYS 70 2HZ LYS 70 -7.767 13.789 13.665 514 3HZ LYS 70 3HZ LYS 70 -6.779 12.487 14.100 515 H HIS 71 H HIS 71 -6.234 8.837 12.183 516 HA HIS 71 HA HIS 71 -5.772 7.880 9.489 517 1HB HIS 71 1HB HIS 71 -7.759 6.553 9.800 518 2HB HIS 71 2HB HIS 71 -6.799 6.446 11.269 519 HD1 HIS 71 HD1 HIS 71 -7.670 7.990 13.303 520 HD2 HIS 71 HD2 HIS 71 -10.329 7.386 10.169 521 HE1 HIS 71 HE1 HIS 71 -9.931 8.614 14.210 522 HE2 HIS 71 HE2 HIS 71 -11.537 8.144 12.327 523 H TYR 72 H TYR 72 -6.841 8.544 7.658 524 HA TYR 72 HA TYR 72 -8.697 10.814 7.974 525 1HB TYR 72 1HB TYR 72 -6.159 10.652 6.574 526 2HB TYR 72 2HB TYR 72 -7.458 11.127 5.489 527 HD1 TYR 72 HD1 TYR 72 -7.917 13.375 5.285 528 HD2 TYR 72 HD2 TYR 72 -6.154 11.964 8.895 529 HE1 TYR 72 HE1 TYR 72 -7.746 15.688 6.100 530 HE2 TYR 72 HE2 TYR 72 -5.978 14.275 9.721 531 HH TYR 72 HH TYR 72 -7.294 16.518 9.206 532 HA PRO 73 HA PRO 73 -11.146 8.002 5.403 533 1HB PRO 73 1HB PRO 73 -13.344 9.858 5.833 534 2HB PRO 73 2HB PRO 73 -13.170 8.201 6.415 535 1HG PRO 73 1HG PRO 73 -13.110 10.361 8.063 536 2HG PRO 73 2HG PRO 73 -12.235 8.855 8.402 537 1HD PRO 73 1HD PRO 73 -11.202 11.433 7.265 538 2HD PRO 73 2HD PRO 73 -10.470 10.362 8.482 539 H VAL 74 H VAL 74 -10.907 8.180 3.249 540 HA VAL 74 HA VAL 74 -11.750 10.659 1.940 541 HB VAL 74 HB VAL 74 -9.055 9.368 1.500 542 1HG1 VAL 74 1HG1 VAL 74 -8.688 11.372 0.019 543 2HG1 VAL 74 2HG1 VAL 74 -10.432 11.633 0.083 544 3HG1 VAL 74 3HG1 VAL 74 -9.787 10.142 -0.607 545 1HG2 VAL 74 1HG2 VAL 74 -8.597 10.621 3.323 546 2HG2 VAL 74 2HG2 VAL 74 -9.971 11.698 3.065 547 3HG2 VAL 74 3HG2 VAL 74 -8.496 11.909 2.122 548 H SER 75 H SER 75 -12.393 10.447 -0.188 549 HA SER 75 HA SER 75 -13.002 7.720 -1.036 550 1HB SER 75 1HB SER 75 -14.596 8.681 -2.530 551 2HB SER 75 2HB SER 75 -14.743 9.589 -1.025 552 HG SER 75 HG SER 75 -14.634 10.867 -3.007 553 H PHE 76 H PHE 76 -12.114 6.781 -2.836 554 HA PHE 76 HA PHE 76 -10.452 8.408 -4.595 555 1HB PHE 76 1HB PHE 76 -8.733 6.360 -4.297 556 2HB PHE 76 2HB PHE 76 -8.636 7.844 -3.358 557 HD1 PHE 76 HD1 PHE 76 -7.702 7.121 -1.353 558 HD2 PHE 76 HD2 PHE 76 -11.048 5.048 -2.960 559 HE1 PHE 76 HE1 PHE 76 -7.891 5.845 0.725 560 HE2 PHE 76 HE2 PHE 76 -11.247 3.755 -0.877 561 HZ PHE 76 HZ PHE 76 -9.671 4.152 0.971 562 H GLU 77 H GLU 77 -9.530 7.086 -6.398 563 HA GLU 77 HA GLU 77 -11.497 5.066 -7.252 564 1HB GLU 77 1HB GLU 77 -11.335 7.284 -8.531 565 2HB GLU 77 2HB GLU 77 -9.775 6.708 -9.101 566 1HG GLU 77 1HG GLU 77 -10.688 5.158 -10.475 567 2HG GLU 77 2HG GLU 77 -12.078 4.884 -9.426 568 H GLY 78 H GLY 78 -10.663 3.338 -8.636 569 1HA GLY 78 1HA GLY 78 -7.923 2.620 -7.828 570 2HA GLY 78 2HA GLY 78 -9.188 1.475 -8.247 571 HA PRO 79 HA PRO 79 -7.717 3.348 -12.462 572 1HB PRO 79 1HB PRO 79 -5.424 4.825 -12.392 573 2HB PRO 79 2HB PRO 79 -7.041 5.532 -12.294 574 1HG PRO 79 1HG PRO 79 -5.094 4.932 -10.108 575 2HG PRO 79 2HG PRO 79 -6.142 6.346 -10.320 576 1HD PRO 79 1HD PRO 79 -6.741 4.332 -8.615 577 2HD PRO 79 2HD PRO 79 -7.986 5.264 -9.465 578 H GLY 80 H GLY 80 -6.672 1.932 -13.708 579 1HA GLY 80 1HA GLY 80 -5.033 -0.076 -12.652 580 2HA GLY 80 2HA GLY 80 -5.222 0.281 -14.363 581 H LEU 81 H LEU 81 -3.826 1.887 -15.317 582 HA LEU 81 HA LEU 81 -1.205 1.892 -14.024 583 1HB LEU 81 1HB LEU 81 -1.942 1.333 -16.585 584 2HB LEU 81 2HB LEU 81 -1.416 3.001 -16.724 585 HG LEU 81 HG LEU 81 0.484 1.726 -17.200 586 1HD1 LEU 81 1HD1 LEU 81 1.874 1.941 -14.988 587 2HD1 LEU 81 2HD1 LEU 81 0.462 2.846 -14.455 588 3HD1 LEU 81 3HD1 LEU 81 1.352 3.368 -15.881 589 1HD2 LEU 81 1HD2 LEU 81 -0.706 -0.309 -15.924 590 2HD2 LEU 81 2HD2 LEU 81 0.526 0.122 -14.738 591 3HD2 LEU 81 3HD2 LEU 81 0.996 -0.306 -16.383 592 H VAL 82 H VAL 82 -0.529 3.624 -12.970 593 HA VAL 82 HA VAL 82 -1.446 6.273 -13.873 594 HB VAL 82 HB VAL 82 -0.924 5.480 -10.993 595 1HG1 VAL 82 1HG1 VAL 82 -2.394 7.945 -11.581 596 2HG1 VAL 82 2HG1 VAL 82 -0.712 7.961 -12.110 597 3HG1 VAL 82 3HG1 VAL 82 -1.101 7.641 -10.421 598 1HG2 VAL 82 1HG2 VAL 82 -3.362 5.789 -10.705 599 2HG2 VAL 82 2HG2 VAL 82 -2.967 4.446 -11.777 600 3HG2 VAL 82 3HG2 VAL 82 -3.521 5.979 -12.450 601 H GLU 83 H GLU 83 0.178 7.516 -14.524 602 HA GLU 83 HA GLU 83 2.898 6.726 -14.187 603 1HB GLU 83 1HB GLU 83 3.400 8.848 -15.388 604 2HB GLU 83 2HB GLU 83 2.242 7.825 -16.227 605 1HG GLU 83 1HG GLU 83 0.809 9.501 -16.305 606 2HG GLU 83 2HG GLU 83 0.782 9.570 -14.545 607 H VAL 84 H VAL 84 3.852 6.908 -12.258 608 HA VAL 84 HA VAL 84 3.133 9.016 -10.426 609 HB VAL 84 HB VAL 84 4.871 8.021 -8.954 610 1HG1 VAL 84 1HG1 VAL 84 3.640 5.969 -8.482 611 2HG1 VAL 84 2HG1 VAL 84 2.852 6.074 -10.057 612 3HG1 VAL 84 3HG1 VAL 84 2.541 7.304 -8.832 613 1HG2 VAL 84 1HG2 VAL 84 5.131 5.584 -10.540 614 2HG2 VAL 84 2HG2 VAL 84 6.341 6.474 -9.617 615 3HG2 VAL 84 3HG2 VAL 84 5.927 6.986 -11.251 616 H GLN 85 H GLN 85 4.078 10.901 -10.210 617 HA GLN 85 HA GLN 85 6.155 11.764 -11.944 618 1HB GLN 85 1HB GLN 85 5.382 13.285 -9.482 619 2HB GLN 85 2HB GLN 85 5.819 13.894 -11.072 620 1HG GLN 85 1HG GLN 85 3.518 12.408 -11.510 621 2HG GLN 85 2HG GLN 85 3.225 13.247 -9.986 622 1HE2 GLN 85 1HE2 GLN 85 2.747 13.471 -13.172 623 2HE2 GLN 85 2HE2 GLN 85 2.720 15.187 -13.370 624 H GLU 86 H GLU 86 8.265 12.482 -11.415 625 HA GLU 86 HA GLU 86 9.640 10.793 -9.606 626 1HB GLU 86 1HB GLU 86 11.588 12.374 -10.100 627 2HB GLU 86 2HB GLU 86 10.893 11.518 -11.465 628 1HG GLU 86 1HG GLU 86 9.887 13.419 -12.317 629 2HG GLU 86 2HG GLU 86 9.944 14.261 -10.768 630 H SER 87 H SER 87 9.189 10.987 -7.491 631 HA SER 87 HA SER 87 9.863 13.524 -6.208 632 1HB SER 87 1HB SER 87 7.200 12.779 -6.602 633 2HB SER 87 2HB SER 87 7.534 12.364 -4.921 634 HG SER 87 HG SER 87 7.832 14.882 -6.186 635 H GLU 88 H GLU 88 10.050 13.305 -3.829 636 HA GLU 88 HA GLU 88 11.042 12.356 -2.026 637 1HB GLU 88 1HB GLU 88 8.807 11.043 -2.305 638 2HB GLU 88 2HB GLU 88 9.848 9.711 -2.784 639 1HG GLU 88 1HG GLU 88 10.519 9.322 -0.693 640 2HG GLU 88 2HG GLU 88 10.694 11.038 -0.327 641 H TYR 89 H TYR 89 11.075 9.386 -3.964 642 HA TYR 89 HA TYR 89 13.888 9.657 -4.562 643 1HB TYR 89 1HB TYR 89 14.331 7.379 -3.427 644 2HB TYR 89 2HB TYR 89 14.258 8.811 -2.407 645 HD1 TYR 89 HD1 TYR 89 11.715 6.460 -3.838 646 HD2 TYR 89 HD2 TYR 89 13.265 8.387 -0.376 647 HE1 TYR 89 HE1 TYR 89 9.968 5.398 -2.473 648 HE2 TYR 89 HE2 TYR 89 11.524 7.328 1.000 649 HH TYR 89 HH TYR 89 8.867 6.237 0.085 650 H TYR 90 H TYR 90 11.206 9.171 -5.870 651 HA TYR 90 HA TYR 90 11.974 6.739 -7.337 652 1HB TYR 90 1HB TYR 90 9.828 6.700 -5.850 653 2HB TYR 90 2HB TYR 90 9.119 7.643 -7.157 654 HD1 TYR 90 HD1 TYR 90 10.909 4.448 -6.483 655 HD2 TYR 90 HD2 TYR 90 8.240 6.567 -9.030 656 HE1 TYR 90 HE1 TYR 90 10.456 2.374 -7.725 657 HE2 TYR 90 HE2 TYR 90 7.779 4.498 -10.278 658 HH TYR 90 HH TYR 90 9.663 1.710 -9.974 659 HA PRO 91 HA PRO 91 11.951 9.495 -10.837 660 1HB PRO 91 1HB PRO 91 12.496 7.717 -12.756 661 2HB PRO 91 2HB PRO 91 13.696 8.129 -11.523 662 1HG PRO 91 1HG PRO 91 11.906 5.739 -11.701 663 2HG PRO 91 2HG PRO 91 13.616 5.825 -11.242 664 1HD PRO 91 1HD PRO 91 11.526 5.680 -9.449 665 2HD PRO 91 2HD PRO 91 13.125 6.351 -9.074 666 H LYS 92 H LYS 92 10.602 10.127 -12.515 667 HA LYS 92 HA LYS 92 7.923 9.542 -12.431 668 1HB LYS 92 1HB LYS 92 8.976 11.479 -13.609 669 2HB LYS 92 2HB LYS 92 9.418 10.387 -14.914 670 1HG LYS 92 1HG LYS 92 7.443 10.697 -15.855 671 2HG LYS 92 2HG LYS 92 6.647 10.062 -14.415 672 1HD LYS 92 1HD LYS 92 5.753 12.100 -14.197 673 2HD LYS 92 2HD LYS 92 7.353 12.615 -13.660 674 1HE LYS 92 1HE LYS 92 6.802 12.520 -16.582 675 2HE LYS 92 2HE LYS 92 6.096 13.832 -15.640 676 1HZ LYS 92 1HZ LYS 92 8.897 13.288 -16.262 677 2HZ LYS 92 2HZ LYS 92 8.560 13.965 -14.750 678 3HZ LYS 92 3HZ LYS 92 8.079 14.766 -16.160 679 H ARG 93 H ARG 93 7.550 7.317 -12.308 680 HA ARG 93 HA ARG 93 7.924 5.876 -14.853 681 1HB ARG 93 1HB ARG 93 9.066 5.233 -12.404 682 2HB ARG 93 2HB ARG 93 7.705 4.129 -12.541 683 1HG ARG 93 1HG ARG 93 8.883 2.842 -13.897 684 2HG ARG 93 2HG ARG 93 9.026 4.174 -15.046 685 1HD ARG 93 1HD ARG 93 10.900 4.930 -13.306 686 2HD ARG 93 2HD ARG 93 10.950 3.192 -13.013 687 HE ARG 93 HE ARG 93 11.932 4.575 -15.308 688 1HH1 ARG 93 1HH1 ARG 93 10.543 1.559 -14.235 689 2HH1 ARG 93 2HH1 ARG 93 11.252 0.633 -15.514 690 1HH2 ARG 93 1HH2 ARG 93 12.865 3.359 -16.993 691 2HH2 ARG 93 2HH2 ARG 93 12.570 1.654 -17.080 692 H TYR 94 H TYR 94 6.469 3.930 -15.022 693 HA TYR 94 HA TYR 94 3.736 4.769 -14.490 694 1HB TYR 94 1HB TYR 94 5.082 2.913 -16.379 695 2HB TYR 94 2HB TYR 94 3.436 2.508 -15.907 696 HD1 TYR 94 HD1 TYR 94 4.978 5.842 -16.452 697 HD2 TYR 94 HD2 TYR 94 2.141 2.972 -17.785 698 HE1 TYR 94 HE1 TYR 94 4.130 7.456 -18.087 699 HE2 TYR 94 HE2 TYR 94 1.276 4.578 -19.425 700 HH TYR 94 HH TYR 94 1.958 6.567 -20.598 701 H GLN 95 H GLN 95 2.401 3.815 -13.053 702 HA GLN 95 HA GLN 95 3.325 1.333 -11.762 703 1HB GLN 95 1HB GLN 95 2.004 3.720 -10.464 704 2HB GLN 95 2HB GLN 95 2.271 2.179 -9.660 705 1HG GLN 95 1HG GLN 95 4.649 3.391 -10.892 706 2HG GLN 95 2HG GLN 95 3.957 4.273 -9.531 707 1HE2 GLN 95 1HE2 GLN 95 5.268 3.858 -7.887 708 2HE2 GLN 95 2HE2 GLN 95 5.737 2.286 -7.348 709 H SER 96 H SER 96 1.885 -0.294 -11.653 710 HA SER 96 HA SER 96 -0.813 0.243 -12.669 711 1HB SER 96 1HB SER 96 -0.893 -1.967 -13.430 712 2HB SER 96 2HB SER 96 0.796 -1.525 -13.680 713 HG SER 96 HG SER 96 1.102 -2.483 -11.495 714 H HIS 97 H HIS 97 -2.659 -0.515 -11.652 715 HA HIS 97 HA HIS 97 -4.047 -1.031 -9.935 716 1HB HIS 97 1HB HIS 97 -2.328 -3.076 -10.004 717 2HB HIS 97 2HB HIS 97 -1.936 -2.456 -8.403 718 HD1 HIS 97 HD1 HIS 97 -5.299 -2.908 -10.134 719 HD2 HIS 97 HD2 HIS 97 -3.291 -4.021 -6.672 720 HE1 HIS 97 HE1 HIS 97 -6.969 -4.210 -8.778 721 HE2 HIS 97 HE2 HIS 97 -5.758 -4.799 -6.650 722 H VAL 98 H VAL 98 -3.275 1.462 -9.680 723 HA VAL 98 HA VAL 98 -2.597 1.723 -6.823 724 HB VAL 98 HB VAL 98 -0.754 2.544 -8.265 725 1HG1 VAL 98 1HG1 VAL 98 -2.916 3.880 -9.620 726 2HG1 VAL 98 2HG1 VAL 98 -1.238 3.660 -10.117 727 3HG1 VAL 98 3HG1 VAL 98 -1.683 5.031 -9.100 728 1HG2 VAL 98 1HG2 VAL 98 -0.541 3.612 -6.288 729 2HG2 VAL 98 2HG2 VAL 98 -2.202 4.206 -6.306 730 3HG2 VAL 98 3HG2 VAL 98 -0.963 5.020 -7.266 731 H LEU 99 H LEU 99 -3.896 2.958 -5.586 732 HA LEU 99 HA LEU 99 -6.234 4.157 -6.896 733 1HB LEU 99 1HB LEU 99 -5.946 3.541 -3.964 734 2HB LEU 99 2HB LEU 99 -7.421 3.874 -4.855 735 HG LEU 99 HG LEU 99 -6.762 1.696 -6.172 736 1HD1 LEU 99 1HD1 LEU 99 -5.838 0.263 -4.012 737 2HD1 LEU 99 2HD1 LEU 99 -4.882 1.743 -3.949 738 3HD1 LEU 99 3HD1 LEU 99 -4.887 0.758 -5.411 739 1HD2 LEU 99 1HD2 LEU 99 -8.367 0.600 -4.962 740 2HD2 LEU 99 2HD2 LEU 99 -8.675 2.260 -4.452 741 3HD2 LEU 99 3HD2 LEU 99 -7.751 1.175 -3.413 742 H LEU 100 H LEU 100 -6.623 6.317 -6.749 743 HA LEU 100 HA LEU 100 -4.763 7.834 -5.055 744 1HB LEU 100 1HB LEU 100 -5.586 8.196 -7.849 745 2HB LEU 100 2HB LEU 100 -5.505 9.667 -6.892 746 HG LEU 100 HG LEU 100 -3.227 7.699 -7.066 747 1HD1 LEU 100 1HD1 LEU 100 -2.242 8.954 -8.768 748 2HD1 LEU 100 2HD1 LEU 100 -3.394 10.278 -8.582 749 3HD1 LEU 100 3HD1 LEU 100 -3.918 8.745 -9.279 750 1HD2 LEU 100 1HD2 LEU 100 -3.687 9.754 -5.305 751 2HD2 LEU 100 2HD2 LEU 100 -2.678 10.513 -6.537 752 3HD2 LEU 100 3HD2 LEU 100 -2.111 9.069 -5.700 753 H ALA 101 H ALA 101 -5.466 9.411 -3.760 754 HA ALA 101 HA ALA 101 -8.355 9.998 -3.718 755 1HB ALA 101 1HB ALA 101 -8.453 8.925 -1.767 756 2HB ALA 101 2HB ALA 101 -7.485 10.236 -1.094 757 3HB ALA 101 3HB ALA 101 -6.696 8.776 -1.684 758 H THR 102 H THR 102 -8.708 12.112 -4.010 759 HA THR 102 HA THR 102 -6.566 14.017 -3.536 760 HB THR 102 HB THR 102 -7.710 14.374 -5.575 761 HG1 THR 102 HG1 THR 102 -7.356 16.294 -4.381 762 1HG2 THR 102 1HG2 THR 102 -10.064 13.582 -4.103 763 2HG2 THR 102 2HG2 THR 102 -9.769 13.602 -5.841 764 3HG2 THR 102 3HG2 THR 102 -10.330 15.062 -5.026 765 H GLY 103 H GLY 103 -6.298 14.783 -1.549 766 1HA GLY 103 1HA GLY 103 -8.343 14.728 0.443 767 2HA GLY 103 2HA GLY 103 -6.760 15.473 0.600 768 H PHE 104 H PHE 104 -8.046 17.082 1.814 769 HA PHE 104 HA PHE 104 -9.170 19.090 -0.026 770 1HB PHE 104 1HB PHE 104 -10.282 17.938 2.437 771 2HB PHE 104 2HB PHE 104 -10.316 19.697 2.393 772 HD1 PHE 104 HD1 PHE 104 -11.592 16.624 0.895 773 HD2 PHE 104 HD2 PHE 104 -11.664 20.876 0.766 774 HE1 PHE 104 HE1 PHE 104 -13.600 16.543 -0.524 775 HE2 PHE 104 HE2 PHE 104 -13.673 20.804 -0.652 776 HZ PHE 104 HZ PHE 104 -14.644 18.634 -1.299 777 H SER 105 H SER 105 -6.428 18.750 0.934 778 HA SER 105 HA SER 105 -5.980 21.459 1.785 779 1HB SER 105 1HB SER 105 -4.847 19.334 3.593 780 2HB SER 105 2HB SER 105 -4.980 21.068 3.880 781 HG SER 105 HG SER 105 -6.623 19.294 4.732 782 H GLU 106 H GLU 106 -3.423 21.556 2.387 783 HA GLU 106 HA GLU 106 -2.137 20.659 -0.039 784 1HB GLU 106 1HB GLU 106 -1.209 22.382 2.255 785 2HB GLU 106 2HB GLU 106 -0.161 21.928 0.920 786 1HG GLU 106 1HG GLU 106 -2.482 22.920 -0.268 787 2HG GLU 106 2HG GLU 106 -2.139 24.006 1.078 788 HA PRO 107 HA PRO 107 0.568 18.399 3.397 789 1HB PRO 107 1HB PRO 107 -1.602 17.836 5.337 790 2HB PRO 107 2HB PRO 107 0.079 18.292 5.629 791 1HG PRO 107 1HG PRO 107 -1.904 20.032 6.023 792 2HG PRO 107 2HG PRO 107 -0.346 20.551 5.352 793 1HD PRO 107 1HD PRO 107 -2.947 20.066 3.954 794 2HD PRO 107 2HD PRO 107 -1.743 21.342 3.686 795 H GLY 108 H GLY 108 0.432 16.038 4.115 796 1HA GLY 108 1HA GLY 108 -0.661 13.921 3.972 797 2HA GLY 108 2HA GLY 108 -1.746 14.598 2.767 798 H ASP 109 H ASP 109 1.466 13.327 3.353 799 HA ASP 109 HA ASP 109 1.802 13.000 0.442 800 1HB ASP 109 1HB ASP 109 3.458 14.439 2.007 801 2HB ASP 109 2HB ASP 109 4.195 12.850 2.187 802 H ALA 110 H ALA 110 3.092 11.582 3.453 803 HA ALA 110 HA ALA 110 2.563 8.919 2.307 804 1HB ALA 110 1HB ALA 110 5.046 9.880 2.684 805 2HB ALA 110 2HB ALA 110 4.635 8.169 2.804 806 3HB ALA 110 3HB ALA 110 4.758 9.151 4.264 807 H GLY 111 H GLY 111 2.848 7.235 4.257 808 1HA GLY 111 1HA GLY 111 2.058 8.016 6.844 809 2HA GLY 111 2HA GLY 111 0.623 7.600 5.920 810 H GLY 112 H GLY 112 0.077 5.500 5.690 811 1HA GLY 112 1HA GLY 112 2.089 3.453 6.291 812 2HA GLY 112 2HA GLY 112 0.629 3.490 7.266 813 H ILE 113 H ILE 113 -1.120 2.425 6.560 814 HA ILE 113 HA ILE 113 -1.138 1.525 3.754 815 HB ILE 113 HB ILE 113 -2.153 -0.591 4.477 816 1HG1 ILE 113 1HG1 ILE 113 -1.608 -0.955 7.101 817 2HG1 ILE 113 2HG1 ILE 113 -2.027 0.755 7.113 818 1HG2 ILE 113 1HG2 ILE 113 0.010 -1.270 5.928 819 2HG2 ILE 113 2HG2 ILE 113 0.565 0.255 5.235 820 3HG2 ILE 113 3HG2 ILE 113 0.034 -1.053 4.177 821 1HD1 ILE 113 1HD1 ILE 113 -4.184 0.277 6.162 822 2HD1 ILE 113 2HD1 ILE 113 -3.935 -0.718 7.597 823 3HD1 ILE 113 3HD1 ILE 113 -3.765 -1.427 5.991 824 H LEU 114 H LEU 114 -3.126 1.380 2.734 825 HA LEU 114 HA LEU 114 -5.220 3.022 3.898 826 1HB LEU 114 1HB LEU 114 -4.599 3.445 1.602 827 2HB LEU 114 2HB LEU 114 -4.899 1.772 1.171 828 HG LEU 114 HG LEU 114 -7.293 2.080 1.619 829 1HD1 LEU 114 1HD1 LEU 114 -8.231 4.172 2.196 830 2HD1 LEU 114 2HD1 LEU 114 -6.692 5.003 1.978 831 3HD1 LEU 114 3HD1 LEU 114 -6.909 3.893 3.329 832 1HD2 LEU 114 1HD2 LEU 114 -6.069 2.674 -0.604 833 2HD2 LEU 114 2HD2 LEU 114 -6.513 4.328 -0.184 834 3HD2 LEU 114 3HD2 LEU 114 -7.766 3.103 -0.390 835 H ARG 115 H ARG 115 -6.762 2.125 5.107 836 HA ARG 115 HA ARG 115 -7.614 -0.619 4.450 837 1HB ARG 115 1HB ARG 115 -8.178 -0.899 6.832 838 2HB ARG 115 2HB ARG 115 -6.469 -0.580 6.579 839 1HG ARG 115 1HG ARG 115 -7.178 1.902 7.019 840 2HG ARG 115 2HG ARG 115 -8.558 1.141 7.815 841 1HD ARG 115 1HD ARG 115 -6.756 -0.298 9.001 842 2HD ARG 115 2HD ARG 115 -5.649 0.978 8.500 843 HE ARG 115 HE ARG 115 -7.654 1.124 10.558 844 1HH1 ARG 115 1HH1 ARG 115 -5.689 2.959 8.333 845 2HH1 ARG 115 2HH1 ARG 115 -5.763 4.413 9.271 846 1HH2 ARG 115 1HH2 ARG 115 -7.753 3.034 11.793 847 2HH2 ARG 115 2HH2 ARG 115 -6.934 4.455 11.236 848 H CYS 116 H CYS 116 -9.762 -1.124 4.439 849 HA CYS 116 HA CYS 116 -11.640 1.146 4.506 850 1HB CYS 116 1HB CYS 116 -11.404 -0.101 2.326 851 2HB CYS 116 2HB CYS 116 -12.014 -1.535 3.137 852 H GLU 117 H GLU 117 -13.905 0.490 5.225 853 HA GLU 117 HA GLU 117 -13.858 -0.491 7.823 854 1HB GLU 117 1HB GLU 117 -15.676 0.878 6.662 855 2HB GLU 117 2HB GLU 117 -16.277 -0.651 6.035 856 1HG GLU 117 1HG GLU 117 -16.091 -1.246 8.656 857 2HG GLU 117 2HG GLU 117 -16.435 0.482 8.741 858 H HIS 118 H HIS 118 -13.780 -2.213 4.863 859 HA HIS 118 HA HIS 118 -14.777 -4.678 6.035 860 1HB HIS 118 1HB HIS 118 -13.728 -4.115 3.255 861 2HB HIS 118 2HB HIS 118 -14.482 -5.616 3.782 862 HD2 HIS 118 HD2 HIS 118 -17.185 -5.675 3.474 863 HE1 HIS 118 HE1 HIS 118 -17.772 -1.524 2.815 864 HE2 HIS 118 HE2 HIS 118 -18.872 -3.787 2.946 865 H GLY 119 H GLY 119 -11.713 -3.271 4.934 866 1HA GLY 119 1HA GLY 119 -10.152 -4.825 6.661 867 2HA GLY 119 2HA GLY 119 -10.180 -5.644 5.110 868 H VAL 120 H VAL 120 -8.121 -5.376 4.505 869 HA VAL 120 HA VAL 120 -6.945 -2.691 4.482 870 HB VAL 120 HB VAL 120 -5.490 -5.210 3.732 871 1HG1 VAL 120 1HG1 VAL 120 -3.713 -3.640 4.990 872 2HG1 VAL 120 2HG1 VAL 120 -4.795 -2.418 4.321 873 3HG1 VAL 120 3HG1 VAL 120 -4.020 -3.590 3.256 874 1HG2 VAL 120 1HG2 VAL 120 -4.920 -4.438 6.427 875 2HG2 VAL 120 2HG2 VAL 120 -5.469 -5.992 5.803 876 3HG2 VAL 120 3HG2 VAL 120 -6.645 -4.758 6.256 877 H ILE 121 H ILE 121 -6.445 -1.619 2.630 878 HA ILE 121 HA ILE 121 -7.271 -2.878 0.112 879 HB ILE 121 HB ILE 121 -6.783 0.024 0.793 880 1HG1 ILE 121 1HG1 ILE 121 -9.239 0.111 0.029 881 2HG1 ILE 121 2HG1 ILE 121 -9.222 -1.641 0.215 882 1HG2 ILE 121 1HG2 ILE 121 -6.009 -0.327 -1.461 883 2HG2 ILE 121 2HG2 ILE 121 -7.566 0.501 -1.514 884 3HG2 ILE 121 3HG2 ILE 121 -7.474 -1.225 -1.865 885 1HD1 ILE 121 1HD1 ILE 121 -9.513 0.395 2.197 886 2HD1 ILE 121 2HD1 ILE 121 -8.118 -0.618 2.560 887 3HD1 ILE 121 3HD1 ILE 121 -9.704 -1.354 2.340 888 H GLY 122 H GLY 122 -4.711 -0.581 1.111 889 1HA GLY 122 1HA GLY 122 -2.660 -2.266 0.000 890 2HA GLY 122 2HA GLY 122 -3.023 -0.877 -1.010 891 H LEU 123 H LEU 123 -0.694 -0.491 -0.558 892 HA LEU 123 HA LEU 123 -0.352 0.954 1.987 893 1HB LEU 123 1HB LEU 123 2.158 0.586 1.430 894 2HB LEU 123 2HB LEU 123 1.226 -0.714 2.146 895 HG LEU 123 HG LEU 123 1.518 -0.561 -0.830 896 1HD1 LEU 123 1HD1 LEU 123 3.627 -1.146 1.139 897 2HD1 LEU 123 2HD1 LEU 123 3.751 -0.621 -0.540 898 3HD1 LEU 123 3HD1 LEU 123 3.449 -2.317 -0.167 899 1HD2 LEU 123 1HD2 LEU 123 0.707 -2.658 -0.813 900 2HD2 LEU 123 2HD2 LEU 123 0.091 -2.205 0.775 901 3HD2 LEU 123 3HD2 LEU 123 1.601 -3.105 0.639 902 H VAL 124 H VAL 124 1.219 2.770 1.870 903 HA VAL 124 HA VAL 124 0.431 4.654 -0.040 904 HB VAL 124 HB VAL 124 1.306 5.280 2.157 905 1HG1 VAL 124 1HG1 VAL 124 4.126 4.990 1.377 906 2HG1 VAL 124 2HG1 VAL 124 3.278 3.482 1.720 907 3HG1 VAL 124 3HG1 VAL 124 3.347 4.753 2.942 908 1HG2 VAL 124 1HG2 VAL 124 3.312 6.638 0.542 909 2HG2 VAL 124 2HG2 VAL 124 1.901 7.286 1.377 910 3HG2 VAL 124 3HG2 VAL 124 1.728 6.585 -0.231 911 H THR 125 H THR 125 0.824 4.509 -2.153 912 HA THR 125 HA THR 125 3.367 3.430 -3.091 913 HB THR 125 HB THR 125 0.733 4.031 -4.400 914 HG1 THR 125 HG1 THR 125 1.074 1.872 -5.117 915 1HG2 THR 125 1HG2 THR 125 3.335 4.156 -5.737 916 2HG2 THR 125 2HG2 THR 125 1.755 4.744 -6.258 917 3HG2 THR 125 3HG2 THR 125 2.177 3.044 -6.469 918 H MET 126 H MET 126 1.580 6.022 -4.726 919 HA MET 126 HA MET 126 3.854 7.812 -4.176 920 1HB MET 126 1HB MET 126 3.060 6.736 -6.711 921 2HB MET 126 2HB MET 126 2.839 8.480 -6.724 922 1HG MET 126 1HG MET 126 5.366 7.573 -5.570 923 2HG MET 126 2HG MET 126 5.155 7.213 -7.282 924 1HE MET 126 1HE MET 126 7.434 10.488 -6.696 925 2HE MET 126 2HE MET 126 7.465 8.724 -6.633 926 3HE MET 126 3HE MET 126 6.953 9.648 -5.221 927 H GLY 127 H GLY 127 3.363 10.123 -4.552 928 1HA GLY 127 1HA GLY 127 0.497 10.714 -4.159 929 2HA GLY 127 2HA GLY 127 1.719 11.418 -3.111 930 H GLY 128 H GLY 128 -0.151 12.887 -4.659 931 1HA GLY 128 1HA GLY 128 1.625 14.128 -6.667 932 2HA GLY 128 2HA GLY 128 -0.129 14.139 -6.768 933 H GLU 129 H GLU 129 -0.105 16.423 -6.950 934 HA GLU 129 HA GLU 129 1.059 18.078 -4.943 935 1HB GLU 129 1HB GLU 129 -1.153 18.841 -6.848 936 2HB GLU 129 2HB GLU 129 0.001 19.911 -6.064 937 1HG GLU 129 1HG GLU 129 1.810 18.933 -7.364 938 2HG GLU 129 2HG GLU 129 0.670 17.832 -8.134 939 H GLY 130 H GLY 130 -1.864 16.299 -5.152 940 1HA GLY 130 1HA GLY 130 -2.617 17.040 -2.498 941 2HA GLY 130 2HA GLY 130 -3.683 17.762 -3.694 942 H VAL 131 H VAL 131 -2.189 14.648 -4.212 943 HA VAL 131 HA VAL 131 -4.751 13.335 -3.619 944 HB VAL 131 HB VAL 131 -3.147 12.304 -5.904 945 1HG1 VAL 131 1HG1 VAL 131 -5.353 11.667 -6.733 946 2HG1 VAL 131 2HG1 VAL 131 -6.108 12.500 -5.374 947 3HG1 VAL 131 3HG1 VAL 131 -5.099 11.084 -5.089 948 1HG2 VAL 131 1HG2 VAL 131 -4.235 13.782 -7.491 949 2HG2 VAL 131 2HG2 VAL 131 -3.288 14.724 -6.339 950 3HG2 VAL 131 3HG2 VAL 131 -5.042 14.635 -6.175 951 H VAL 132 H VAL 132 -4.594 11.037 -3.201 952 HA VAL 132 HA VAL 132 -1.964 10.295 -2.088 953 HB VAL 132 HB VAL 132 -4.479 8.925 -1.235 954 1HG1 VAL 132 1HG1 VAL 132 -1.885 9.610 0.127 955 2HG1 VAL 132 2HG1 VAL 132 -2.412 8.026 -0.443 956 3HG1 VAL 132 3HG1 VAL 132 -3.243 8.800 0.907 957 1HG2 VAL 132 1HG2 VAL 132 -4.317 11.690 -1.043 958 2HG2 VAL 132 2HG2 VAL 132 -3.817 11.113 0.544 959 3HG2 VAL 132 3HG2 VAL 132 -5.377 10.625 -0.118 960 H GLY 133 H GLY 133 -0.937 8.741 -3.205 961 1HA GLY 133 1HA GLY 133 -2.533 6.914 -4.868 962 2HA GLY 133 2HA GLY 133 -0.809 7.206 -5.038 963 H PHE 134 H PHE 134 -2.920 4.898 -4.205 964 HA PHE 134 HA PHE 134 -1.059 3.690 -2.265 965 1HB PHE 134 1HB PHE 134 -4.076 3.580 -2.323 966 2HB PHE 134 2HB PHE 134 -3.096 2.479 -1.361 967 HD1 PHE 134 HD1 PHE 134 -4.953 5.385 -1.212 968 HD2 PHE 134 HD2 PHE 134 -1.226 3.786 0.063 969 HE1 PHE 134 HE1 PHE 134 -4.860 7.051 0.597 970 HE2 PHE 134 HE2 PHE 134 -1.124 5.444 1.874 971 HZ PHE 134 HZ PHE 134 -2.941 7.082 2.142 972 H ALA 135 H ALA 135 -0.462 1.600 -2.574 973 HA ALA 135 HA ALA 135 -1.150 0.395 -5.137 974 1HB ALA 135 1HB ALA 135 0.589 -1.324 -3.814 975 2HB ALA 135 2HB ALA 135 1.102 0.289 -3.317 976 3HB ALA 135 3HB ALA 135 1.019 -0.121 -5.030 977 H ASP 136 H ASP 136 -3.001 -0.725 -5.142 978 HA ASP 136 HA ASP 136 -4.179 -1.840 -2.834 979 1HB ASP 136 1HB ASP 136 -5.058 -1.228 -5.347 980 2HB ASP 136 2HB ASP 136 -5.047 -2.988 -5.392 981 H VAL 137 H VAL 137 -4.401 -3.879 -2.105 982 HA VAL 137 HA VAL 137 -2.451 -5.852 -3.059 983 HB VAL 137 HB VAL 137 -3.993 -5.907 -0.461 984 1HG1 VAL 137 1HG1 VAL 137 -2.069 -7.378 0.225 985 2HG1 VAL 137 2HG1 VAL 137 -1.595 -7.416 -1.472 986 3HG1 VAL 137 3HG1 VAL 137 -3.159 -8.064 -0.978 987 1HG2 VAL 137 1HG2 VAL 137 -2.650 -4.378 0.422 988 2HG2 VAL 137 2HG2 VAL 137 -1.984 -4.083 -1.184 989 3HG2 VAL 137 3HG2 VAL 137 -1.222 -5.262 -0.116 990 H ARG 138 H ARG 138 -5.470 -5.086 -3.734 991 HA ARG 138 HA ARG 138 -6.908 -7.500 -3.304 992 1HB ARG 138 1HB ARG 138 -7.408 -5.147 -5.128 993 2HB ARG 138 2HB ARG 138 -8.537 -6.476 -4.915 994 1HG ARG 138 1HG ARG 138 -7.700 -5.316 -2.381 995 2HG ARG 138 2HG ARG 138 -8.466 -4.140 -3.450 996 1HD ARG 138 1HD ARG 138 -9.613 -6.798 -2.607 997 2HD ARG 138 2HD ARG 138 -10.112 -5.216 -2.018 998 HE ARG 138 HE ARG 138 -11.112 -4.775 -4.106 999 1HH1 ARG 138 1HH1 ARG 138 -9.750 -7.993 -3.946 1000 2HH1 ARG 138 2HH1 ARG 138 -10.666 -8.576 -5.291 1001 1HH2 ARG 138 1HH2 ARG 138 -12.309 -5.551 -5.875 1002 2HH2 ARG 138 2HH2 ARG 138 -12.116 -7.194 -6.386 1003 H ASP 139 H ASP 139 -4.383 -6.817 -5.385 1004 HA ASP 139 HA ASP 139 -5.372 -8.570 -7.513 1005 1HB ASP 139 1HB ASP 139 -4.138 -6.305 -7.883 1006 2HB ASP 139 2HB ASP 139 -2.685 -7.240 -7.549 1007 H LEU 140 H LEU 140 -3.836 -8.927 -4.637 1008 HA LEU 140 HA LEU 140 -2.893 -11.547 -5.333 1009 1HB LEU 140 1HB LEU 140 -0.619 -11.260 -4.490 1010 2HB LEU 140 2HB LEU 140 -0.910 -10.281 -5.908 1011 HG LEU 140 HG LEU 140 0.194 -8.719 -4.720 1012 1HD1 LEU 140 1HD1 LEU 140 -1.203 -7.256 -3.379 1013 2HD1 LEU 140 2HD1 LEU 140 -2.440 -8.509 -3.285 1014 3HD1 LEU 140 3HD1 LEU 140 -2.045 -7.775 -4.840 1015 1HD2 LEU 140 1HD2 LEU 140 0.978 -9.063 -2.666 1016 2HD2 LEU 140 2HD2 LEU 140 0.192 -10.637 -2.782 1017 3HD2 LEU 140 3HD2 LEU 140 -0.633 -9.295 -1.986 1018 H LEU 141 H LEU 141 -4.878 -11.481 -3.914 1019 HA LEU 141 HA LEU 141 -4.506 -10.884 -1.145 1020 1HB LEU 141 1HB LEU 141 -6.680 -11.383 -2.859 1021 2HB LEU 141 2HB LEU 141 -6.750 -12.600 -1.598 1022 HG LEU 141 HG LEU 141 -8.043 -10.859 -0.756 1023 1HD1 LEU 141 1HD1 LEU 141 -7.074 -10.626 1.236 1024 2HD1 LEU 141 2HD1 LEU 141 -5.683 -9.776 0.559 1025 3HD1 LEU 141 3HD1 LEU 141 -5.734 -11.538 0.541 1026 1HD2 LEU 141 1HD2 LEU 141 -7.855 -9.004 -2.039 1027 2HD2 LEU 141 2HD2 LEU 141 -6.102 -9.141 -2.171 1028 3HD2 LEU 141 3HD2 LEU 141 -6.828 -8.482 -0.705 1029 H TRP 142 H TRP 142 -3.710 -13.588 -3.062 1030 HA TRP 142 HA TRP 142 -4.194 -15.729 -1.379 1031 1HB TRP 142 1HB TRP 142 -2.250 -16.842 -2.468 1032 2HB TRP 142 2HB TRP 142 -3.381 -16.123 -3.609 1033 HD1 TRP 142 HD1 TRP 142 -2.528 -13.573 -4.554 1034 HE1 TRP 142 HE1 TRP 142 -0.147 -12.901 -5.260 1035 HE3 TRP 142 HE3 TRP 142 0.101 -17.231 -2.142 1036 HZ2 TRP 142 HZ2 TRP 142 2.494 -13.798 -4.847 1037 HZ3 TRP 142 HZ3 TRP 142 2.554 -17.255 -2.349 1038 HH2 TRP 142 HH2 TRP 142 3.724 -15.572 -3.674 1039 H LEU 143 H LEU 143 -3.933 -14.850 0.731 1040 HA LEU 143 HA LEU 143 -1.314 -15.379 1.839 1041 1HB LEU 143 1HB LEU 143 -2.651 -12.710 2.301 1042 2HB LEU 143 2HB LEU 143 -1.179 -13.268 3.067 1043 HG LEU 143 HG LEU 143 -0.331 -13.409 0.554 1044 1HD1 LEU 143 1HD1 LEU 143 -1.887 -12.672 -0.871 1045 2HD1 LEU 143 2HD1 LEU 143 -1.464 -11.063 -0.284 1046 3HD1 LEU 143 3HD1 LEU 143 -2.838 -11.923 0.411 1047 1HD2 LEU 143 1HD2 LEU 143 0.828 -11.444 0.937 1048 2HD2 LEU 143 2HD2 LEU 143 0.377 -11.932 2.572 1049 3HD2 LEU 143 3HD2 LEU 143 -0.538 -10.674 1.744 1050 H GLU 144 H GLU 144 -4.570 -14.135 2.474 1051 HA GLU 144 HA GLU 144 -5.027 -16.170 4.466 1052 1HB GLU 144 1HB GLU 144 -4.778 -13.259 5.200 1053 2HB GLU 144 2HB GLU 144 -5.743 -14.369 6.161 1054 1HG GLU 144 1HG GLU 144 -3.422 -15.746 5.970 1055 2HG GLU 144 2HG GLU 144 -2.834 -14.084 5.958 1056 H ASP 145 H ASP 145 -7.300 -15.267 5.647 1057 HA ASP 145 HA ASP 145 -9.251 -15.637 3.684 1058 1HB ASP 145 1HB ASP 145 -9.251 -15.671 6.399 1059 2HB ASP 145 2HB ASP 145 -10.098 -14.156 6.097 1060 H ASP 146 H ASP 146 -10.654 -14.269 2.623 1061 HA ASP 146 HA ASP 146 -9.802 -11.459 2.501 1062 1HB ASP 146 1HB ASP 146 -11.085 -11.488 0.303 1063 2HB ASP 146 2HB ASP 146 -9.618 -12.460 0.359 1064 H ALA 147 H ALA 147 -11.404 -9.790 2.345 1065 HA ALA 147 HA ALA 147 -13.735 -10.366 3.985 1066 1HB ALA 147 1HB ALA 147 -12.136 -8.358 4.249 1067 2HB ALA 147 2HB ALA 147 -13.870 -8.089 4.413 1068 3HB ALA 147 3HB ALA 147 -13.049 -7.657 2.913 1069 H MET 148 H MET 148 -15.817 -10.307 3.322 1070 HA MET 148 HA MET 148 -16.305 -9.700 0.479 1071 1HB MET 148 1HB MET 148 -16.862 -12.077 2.009 1072 2HB MET 148 2HB MET 148 -18.363 -11.390 1.401 1073 1HG MET 148 1HG MET 148 -17.672 -11.581 -0.831 1074 2HG MET 148 2HG MET 148 -15.991 -11.845 -0.375 1075 1HE MET 148 1HE MET 148 -17.272 -13.897 -2.516 1076 2HE MET 148 2HE MET 148 -18.803 -13.282 -1.895 1077 3HE MET 148 3HE MET 148 -18.461 -15.011 -1.839 1078 H GLU 149 H GLU 149 -18.836 -9.437 0.174 1079 HA GLU 149 HA GLU 149 -19.656 -7.388 2.116 1080 1HB GLU 149 1HB GLU 149 -19.379 -7.137 -0.573 1081 2HB GLU 149 2HB GLU 149 -21.080 -7.569 -0.465 1082 1HG GLU 149 1HG GLU 149 -21.553 -5.467 0.008 1083 2HG GLU 149 2HG GLU 149 -20.634 -5.618 1.505 1084 H GLN 150 H GLN 150 -20.659 -10.314 0.484 1085 HA GLN 150 HA GLN 150 -23.378 -10.292 1.182 1086 1HB GLN 150 1HB GLN 150 -21.665 -12.760 0.903 1087 2HB GLN 150 2HB GLN 150 -23.396 -12.619 0.627 1088 1HG GLN 150 1HG GLN 150 -22.370 -10.777 -1.118 1089 2HG GLN 150 2HG GLN 150 -21.157 -12.056 -1.151 1090 1HE2 GLN 150 1HE2 GLN 150 -24.467 -11.220 -1.808 1091 2HE2 GLN 150 2HE2 GLN 150 -24.841 -12.609 -2.765 Start of MODEL 2 1 1H GLY 1 1H GLY 1 17.164 2.499 21.367 2 2H GLY 1 2H GLY 1 16.586 2.052 19.841 3 3H GLY 1 3H GLY 1 15.506 2.255 21.127 4 1HA GLY 1 1HA GLY 1 15.421 4.471 20.922 5 2HA GLY 1 2HA GLY 1 17.138 4.571 20.562 6 HA PRO 2 HA PRO 2 14.686 3.363 16.414 7 1HB PRO 2 1HB PRO 2 12.226 4.858 17.191 8 2HB PRO 2 2HB PRO 2 12.393 3.401 16.205 9 1HG PRO 2 1HG PRO 2 11.520 3.245 18.714 10 2HG PRO 2 2HG PRO 2 12.615 2.016 18.053 11 1HD PRO 2 1HD PRO 2 13.191 4.252 19.942 12 2HD PRO 2 2HD PRO 2 13.881 2.618 19.882 13 H TYR 3 H TYR 3 14.129 4.893 14.637 14 HA TYR 3 HA TYR 3 15.388 7.477 15.155 15 1HB TYR 3 1HB TYR 3 15.727 5.679 13.119 16 2HB TYR 3 2HB TYR 3 14.619 6.835 12.388 17 HD1 TYR 3 HD1 TYR 3 17.503 7.237 14.733 18 HD2 TYR 3 HD2 TYR 3 15.794 8.220 10.963 19 HE1 TYR 3 HE1 TYR 3 19.390 8.746 14.278 20 HE2 TYR 3 HE2 TYR 3 17.677 9.731 10.497 21 HH TYR 3 HH TYR 3 20.509 9.663 12.005 22 H GLY 4 H GLY 4 12.426 6.120 13.750 23 1HA GLY 4 1HA GLY 4 10.940 8.458 14.553 24 2HA GLY 4 2HA GLY 4 11.128 8.312 12.812 25 H HIS 5 H HIS 5 10.253 6.424 11.761 26 HA HIS 5 HA HIS 5 7.874 5.437 13.160 27 1HB HIS 5 1HB HIS 5 8.580 5.900 10.302 28 2HB HIS 5 2HB HIS 5 7.438 4.610 10.664 29 HD1 HIS 5 HD1 HIS 5 5.297 5.434 12.159 30 HD2 HIS 5 HD2 HIS 5 7.451 8.361 10.143 31 HE1 HIS 5 HE1 HIS 5 3.780 7.438 12.060 32 HE2 HIS 5 HE2 HIS 5 5.073 9.167 10.762 33 H GLN 6 H GLN 6 10.460 4.235 11.023 34 HA GLN 6 HA GLN 6 11.468 2.204 10.848 35 1HB GLN 6 1HB GLN 6 10.983 2.598 13.631 36 2HB GLN 6 2HB GLN 6 10.694 0.903 13.264 37 1HG GLN 6 1HG GLN 6 13.105 1.842 11.993 38 2HG GLN 6 2HG GLN 6 13.141 2.136 13.731 39 1HE2 GLN 6 1HE2 GLN 6 14.591 0.222 11.954 40 2HE2 GLN 6 2HE2 GLN 6 14.337 -1.327 12.674 41 H SER 7 H SER 7 10.594 0.912 9.372 42 HA SER 7 HA SER 7 9.286 -0.663 8.382 43 1HB SER 7 1HB SER 7 9.134 -1.288 11.242 44 2HB SER 7 2HB SER 7 7.738 -1.857 10.327 45 HG SER 7 HG SER 7 10.393 -2.652 10.206 46 H GLY 8 H GLY 8 7.452 -0.463 7.243 47 1HA GLY 8 1HA GLY 8 5.034 0.560 8.467 48 2HA GLY 8 2HA GLY 8 5.770 1.637 7.291 49 H ALA 9 H ALA 9 5.689 -1.889 7.154 50 HA ALA 9 HA ALA 9 4.224 -1.674 4.617 51 1HB ALA 9 1HB ALA 9 6.537 -2.845 4.888 52 2HB ALA 9 2HB ALA 9 5.291 -3.581 3.880 53 3HB ALA 9 3HB ALA 9 5.574 -4.182 5.514 54 H VAL 10 H VAL 10 3.141 -4.086 4.272 55 HA VAL 10 HA VAL 10 1.459 -4.579 6.636 56 HB VAL 10 HB VAL 10 0.186 -3.178 5.079 57 1HG1 VAL 10 1HG1 VAL 10 1.502 -4.451 3.090 58 2HG1 VAL 10 2HG1 VAL 10 0.023 -3.517 2.861 59 3HG1 VAL 10 3HG1 VAL 10 -0.059 -5.271 3.029 60 1HG2 VAL 10 1HG2 VAL 10 -1.162 -5.761 4.669 61 2HG2 VAL 10 2HG2 VAL 10 -1.734 -4.293 5.462 62 3HG2 VAL 10 3HG2 VAL 10 -0.684 -5.412 6.331 63 H TYR 11 H TYR 11 1.816 -6.612 7.243 64 HA TYR 11 HA TYR 11 2.240 -8.632 5.150 65 1HB TYR 11 1HB TYR 11 3.641 -9.845 6.600 66 2HB TYR 11 2HB TYR 11 4.105 -8.166 6.842 67 HD1 TYR 11 HD1 TYR 11 3.216 -11.173 8.443 68 HD2 TYR 11 HD2 TYR 11 2.905 -6.948 8.841 69 HE1 TYR 11 HE1 TYR 11 2.848 -11.434 10.859 70 HE2 TYR 11 HE2 TYR 11 2.535 -7.198 11.259 71 HH TYR 11 HH TYR 11 2.933 -8.780 13.028 72 H VAL 12 H VAL 12 0.945 -10.356 5.018 73 HA VAL 12 HA VAL 12 -1.143 -10.650 7.078 74 HB VAL 12 HB VAL 12 -1.370 -11.176 4.111 75 1HG1 VAL 12 1HG1 VAL 12 -2.980 -12.596 4.705 76 2HG1 VAL 12 2HG1 VAL 12 -3.909 -11.169 5.162 77 3HG1 VAL 12 3HG1 VAL 12 -2.975 -12.041 6.379 78 1HG2 VAL 12 1HG2 VAL 12 -3.264 -9.349 4.662 79 2HG2 VAL 12 2HG2 VAL 12 -1.639 -8.940 4.110 80 3HG2 VAL 12 3HG2 VAL 12 -2.029 -8.877 5.829 81 H GLY 13 H GLY 13 -1.281 -12.564 8.059 82 1HA GLY 13 1HA GLY 13 -0.759 -14.721 8.660 83 2HA GLY 13 2HA GLY 13 -1.086 -15.078 6.973 84 H ASN 14 H ASN 14 0.465 -16.307 6.175 85 HA ASN 14 HA ASN 14 3.179 -16.104 7.195 86 1HB ASN 14 1HB ASN 14 2.011 -18.009 5.156 87 2HB ASN 14 2HB ASN 14 3.605 -18.133 5.895 88 1HD2 ASN 14 1HD2 ASN 14 2.214 -20.293 6.161 89 2HD2 ASN 14 2HD2 ASN 14 1.519 -20.460 7.733 90 H TYR 15 H TYR 15 1.741 -14.167 5.228 91 HA TYR 15 HA TYR 15 3.993 -13.998 3.336 92 1HB TYR 15 1HB TYR 15 1.044 -13.690 2.803 93 2HB TYR 15 2HB TYR 15 2.240 -12.925 1.767 94 HD1 TYR 15 HD1 TYR 15 0.122 -15.102 1.135 95 HD2 TYR 15 HD2 TYR 15 4.288 -15.256 1.975 96 HE1 TYR 15 HE1 TYR 15 0.297 -17.184 -0.155 97 HE2 TYR 15 HE2 TYR 15 4.474 -17.335 0.692 98 HH TYR 15 HH TYR 15 3.082 -19.167 -0.070 99 H LYS 16 H LYS 16 4.801 -11.944 2.998 100 HA LYS 16 HA LYS 16 3.479 -9.750 4.446 101 1HB LYS 16 1HB LYS 16 5.369 -10.416 5.779 102 2HB LYS 16 2HB LYS 16 6.422 -10.420 4.371 103 1HG LYS 16 1HG LYS 16 6.600 -8.135 4.323 104 2HG LYS 16 2HG LYS 16 5.053 -7.888 5.134 105 1HD LYS 16 1HD LYS 16 6.031 -7.821 7.138 106 2HD LYS 16 2HD LYS 16 6.902 -9.324 6.830 107 1HE LYS 16 1HE LYS 16 8.774 -8.251 6.096 108 2HE LYS 16 2HE LYS 16 7.869 -6.876 5.464 109 1HZ LYS 16 1HZ LYS 16 7.970 -5.798 7.421 110 2HZ LYS 16 2HZ LYS 16 9.322 -6.779 7.685 111 3HZ LYS 16 3HZ LYS 16 7.826 -7.205 8.349 112 H VAL 17 H VAL 17 2.828 -8.257 3.010 113 HA VAL 17 HA VAL 17 4.418 -7.940 0.570 114 HB VAL 17 HB VAL 17 2.566 -7.436 -0.618 115 1HG1 VAL 17 1HG1 VAL 17 0.902 -8.902 -0.159 116 2HG1 VAL 17 2HG1 VAL 17 0.788 -8.421 1.533 117 3HG1 VAL 17 3HG1 VAL 17 2.096 -9.481 1.003 118 1HG2 VAL 17 1HG2 VAL 17 1.361 -6.096 1.799 119 2HG2 VAL 17 2HG2 VAL 17 0.620 -6.172 0.199 120 3HG2 VAL 17 3HG2 VAL 17 2.135 -5.299 0.429 121 H VAL 18 H VAL 18 5.715 -6.281 0.368 122 HA VAL 18 HA VAL 18 5.075 -3.763 1.729 123 HB VAL 18 HB VAL 18 6.707 -4.966 3.131 124 1HG1 VAL 18 1HG1 VAL 18 8.660 -4.701 0.861 125 2HG1 VAL 18 2HG1 VAL 18 7.750 -6.181 1.173 126 3HG1 VAL 18 3HG1 VAL 18 8.867 -5.560 2.388 127 1HG2 VAL 18 1HG2 VAL 18 8.213 -2.725 1.854 128 2HG2 VAL 18 2HG2 VAL 18 8.048 -3.133 3.561 129 3HG2 VAL 18 3HG2 VAL 18 6.695 -2.407 2.694 130 H ASN 19 H ASN 19 6.271 -1.906 0.850 131 HA ASN 19 HA ASN 19 6.175 -1.802 -1.952 132 1HB ASN 19 1HB ASN 19 6.106 0.112 -0.173 133 2HB ASN 19 2HB ASN 19 7.858 0.105 -0.355 134 1HD2 ASN 19 1HD2 ASN 19 5.149 1.577 -1.359 135 2HD2 ASN 19 2HD2 ASN 19 5.656 2.129 -2.916 136 H ARG 20 H ARG 20 7.753 -1.908 -3.530 137 HA ARG 20 HA ARG 20 9.901 -3.635 -3.155 138 1HB ARG 20 1HB ARG 20 8.779 -2.925 -5.340 139 2HB ARG 20 2HB ARG 20 9.828 -1.515 -5.295 140 1HG ARG 20 1HG ARG 20 11.693 -3.368 -4.992 141 2HG ARG 20 2HG ARG 20 10.486 -4.358 -5.814 142 1HD ARG 20 1HD ARG 20 11.125 -3.488 -7.754 143 2HD ARG 20 2HD ARG 20 10.613 -1.898 -7.193 144 HE ARG 20 HE ARG 20 12.811 -1.343 -6.853 145 1HH1 ARG 20 1HH1 ARG 20 12.565 -4.795 -7.300 146 2HH1 ARG 20 2HH1 ARG 20 14.278 -5.032 -7.386 147 1HH2 ARG 20 1HH2 ARG 20 15.064 -1.652 -6.965 148 2HH2 ARG 20 2HH2 ARG 20 15.697 -3.248 -7.195 149 H HIS 21 H HIS 21 9.884 -0.082 -3.313 150 HA HIS 21 HA HIS 21 12.684 0.174 -2.879 151 1HB HIS 21 1HB HIS 21 10.531 1.902 -3.486 152 2HB HIS 21 2HB HIS 21 11.249 2.505 -1.996 153 HD1 HIS 21 HD1 HIS 21 12.965 4.209 -2.453 154 HD2 HIS 21 HD2 HIS 21 12.841 1.323 -5.440 155 HE1 HIS 21 HE1 HIS 21 14.729 4.884 -4.113 156 HE2 HIS 21 HE2 HIS 21 14.694 3.077 -5.868 157 H LEU 22 H LEU 22 10.200 -0.760 -0.831 158 HA LEU 22 HA LEU 22 11.623 0.198 1.553 159 1HB LEU 22 1HB LEU 22 9.151 0.746 1.162 160 2HB LEU 22 2HB LEU 22 8.846 -0.944 1.514 161 HG LEU 22 HG LEU 22 10.011 -0.576 3.732 162 1HD1 LEU 22 1HD1 LEU 22 9.480 2.333 3.314 163 2HD1 LEU 22 2HD1 LEU 22 11.020 1.634 2.816 164 3HD1 LEU 22 3HD1 LEU 22 10.513 1.540 4.503 165 1HD2 LEU 22 1HD2 LEU 22 7.692 1.246 3.720 166 2HD2 LEU 22 2HD2 LEU 22 8.009 -0.186 4.699 167 3HD2 LEU 22 3HD2 LEU 22 7.422 -0.361 3.045 168 H ALA 23 H ALA 23 11.093 -2.589 -0.318 169 HA ALA 23 HA ALA 23 11.035 -4.521 1.764 170 1HB ALA 23 1HB ALA 23 10.395 -5.695 -0.014 171 2HB ALA 23 2HB ALA 23 12.097 -5.780 -0.469 172 3HB ALA 23 3HB ALA 23 11.069 -4.508 -1.129 173 H THR 24 H THR 24 12.704 -5.907 2.453 174 HA THR 24 HA THR 24 15.375 -4.701 2.248 175 HB THR 24 HB THR 24 15.900 -5.865 4.326 176 HG1 THR 24 HG1 THR 24 14.557 -7.280 5.236 177 1HG2 THR 24 1HG2 THR 24 14.882 -3.726 4.667 178 2HG2 THR 24 2HG2 THR 24 14.259 -4.857 5.869 179 3HG2 THR 24 3HG2 THR 24 13.270 -4.417 4.477 180 H HIS 25 H HIS 25 17.200 -6.361 2.448 181 HA HIS 25 HA HIS 25 17.220 -8.017 0.220 182 1HB HIS 25 1HB HIS 25 19.191 -7.152 1.641 183 2HB HIS 25 2HB HIS 25 18.916 -8.571 2.646 184 HD1 HIS 25 HD1 HIS 25 18.131 -9.947 -0.403 185 HD2 HIS 25 HD2 HIS 25 21.722 -8.590 1.186 186 HE1 HIS 25 HE1 HIS 25 19.931 -11.109 -1.720 187 HE2 HIS 25 HE2 HIS 25 22.094 -10.204 -0.801 188 H VAL 26 H VAL 26 16.149 -8.629 3.468 189 HA VAL 26 HA VAL 26 16.049 -11.476 3.248 190 HB VAL 26 HB VAL 26 14.530 -9.730 5.187 191 1HG1 VAL 26 1HG1 VAL 26 15.339 -12.633 5.238 192 2HG1 VAL 26 2HG1 VAL 26 13.703 -11.976 5.183 193 3HG1 VAL 26 3HG1 VAL 26 14.692 -11.760 6.627 194 1HG2 VAL 26 1HG2 VAL 26 16.363 -9.731 6.633 195 2HG2 VAL 26 2HG2 VAL 26 17.074 -9.398 5.054 196 3HG2 VAL 26 3HG2 VAL 26 17.182 -11.016 5.746 197 H ASP 27 H ASP 27 13.826 -8.851 2.550 198 HA ASP 27 HA ASP 27 11.471 -10.409 2.419 199 1HB ASP 27 1HB ASP 27 12.285 -7.666 1.648 200 2HB ASP 27 2HB ASP 27 10.959 -8.346 0.712 201 H TRP 28 H TRP 28 13.858 -9.355 0.042 202 HA TRP 28 HA TRP 28 12.549 -10.668 -2.105 203 1HB TRP 28 1HB TRP 28 15.258 -9.392 -1.850 204 2HB TRP 28 2HB TRP 28 14.733 -10.196 -3.330 205 HD1 TRP 28 HD1 TRP 28 12.314 -9.167 -4.373 206 HE1 TRP 28 HE1 TRP 28 11.572 -6.706 -4.502 207 HE3 TRP 28 HE3 TRP 28 15.460 -7.191 -0.870 208 HZ2 TRP 28 HZ2 TRP 28 12.225 -4.252 -3.264 209 HZ3 TRP 28 HZ3 TRP 28 15.339 -4.783 -0.405 210 HH2 TRP 28 HH2 TRP 28 13.761 -3.341 -1.580 211 H GLN 29 H GLN 29 14.995 -11.537 0.199 212 HA GLN 29 HA GLN 29 16.130 -13.746 -1.082 213 1HB GLN 29 1HB GLN 29 15.946 -12.739 1.674 214 2HB GLN 29 2HB GLN 29 16.142 -14.482 1.559 215 1HG GLN 29 1HG GLN 29 17.943 -12.443 0.271 216 2HG GLN 29 2HG GLN 29 18.277 -13.299 1.776 217 1HE2 GLN 29 1HE2 GLN 29 19.059 -15.338 1.710 218 2HE2 GLN 29 2HE2 GLN 29 19.433 -16.187 0.252 219 H ASN 30 H ASN 30 13.263 -13.502 0.984 220 HA ASN 30 HA ASN 30 12.529 -16.237 0.167 221 1HB ASN 30 1HB ASN 30 12.859 -15.420 2.713 222 2HB ASN 30 2HB ASN 30 11.165 -14.993 2.490 223 1HD2 ASN 30 1HD2 ASN 30 11.213 -16.692 4.291 224 2HD2 ASN 30 2HD2 ASN 30 10.947 -18.323 3.786 225 H CYS 31 H CYS 31 12.070 -13.900 -1.414 226 HA CYS 31 HA CYS 31 9.320 -13.118 -1.097 227 1HB CYS 31 1HB CYS 31 10.859 -11.498 -1.991 228 2HB CYS 31 2HB CYS 31 11.344 -12.593 -3.278 229 HG CYS 31 HG CYS 31 9.382 -10.605 -3.739 230 H VAL 32 H VAL 32 7.572 -13.887 -2.100 231 HA VAL 32 HA VAL 32 7.899 -16.244 -3.804 232 HB VAL 32 HB VAL 32 5.420 -16.525 -3.429 233 1HG1 VAL 32 1HG1 VAL 32 7.506 -17.361 -1.939 234 2HG1 VAL 32 2HG1 VAL 32 5.830 -17.823 -1.636 235 3HG1 VAL 32 3HG1 VAL 32 6.562 -16.507 -0.718 236 1HG2 VAL 32 1HG2 VAL 32 5.841 -14.416 -1.319 237 2HG2 VAL 32 2HG2 VAL 32 4.353 -15.300 -1.651 238 3HG2 VAL 32 3HG2 VAL 32 4.981 -14.157 -2.837 239 H TRP 33 H TRP 33 6.371 -13.059 -3.695 240 HA TRP 33 HA TRP 33 6.169 -13.132 -6.617 241 1HB TRP 33 1HB TRP 33 3.948 -13.629 -6.194 242 2HB TRP 33 2HB TRP 33 3.924 -12.731 -4.683 243 HD1 TRP 33 HD1 TRP 33 3.111 -12.399 -8.340 244 HE1 TRP 33 HE1 TRP 33 2.181 -10.042 -8.802 245 HE3 TRP 33 HE3 TRP 33 4.210 -10.207 -3.865 246 HZ2 TRP 33 HZ2 TRP 33 1.947 -7.571 -7.432 247 HZ3 TRP 33 HZ3 TRP 33 3.608 -7.849 -3.520 248 HH2 TRP 33 HH2 TRP 33 2.503 -6.564 -5.275 249 H GLU 34 H GLU 34 6.143 -11.062 -7.628 250 HA GLU 34 HA GLU 34 6.411 -8.669 -6.067 251 1HB GLU 34 1HB GLU 34 8.660 -9.584 -5.787 252 2HB GLU 34 2HB GLU 34 8.831 -9.738 -7.530 253 1HG GLU 34 1HG GLU 34 8.128 -7.043 -6.839 254 2HG GLU 34 2HG GLU 34 9.541 -7.565 -5.923 255 H ASP 35 H ASP 35 5.410 -7.163 -7.212 256 HA ASP 35 HA ASP 35 5.389 -7.397 -10.144 257 1HB ASP 35 1HB ASP 35 3.411 -6.396 -8.150 258 2HB ASP 35 2HB ASP 35 3.432 -5.641 -9.740 259 H TYR 36 H TYR 36 6.822 -6.137 -11.100 260 HA TYR 36 HA TYR 36 8.107 -3.941 -9.921 261 1HB TYR 36 1HB TYR 36 8.602 -5.431 -12.098 262 2HB TYR 36 2HB TYR 36 7.896 -4.023 -12.881 263 HD1 TYR 36 HD1 TYR 36 10.437 -4.830 -10.259 264 HD2 TYR 36 HD2 TYR 36 9.326 -2.323 -13.512 265 HE1 TYR 36 HE1 TYR 36 12.599 -3.669 -10.095 266 HE2 TYR 36 HE2 TYR 36 11.485 -1.155 -13.357 267 HH TYR 36 HH TYR 36 14.072 -2.322 -11.413 268 H ASN 37 H ASN 37 5.370 -4.101 -12.174 269 HA ASN 37 HA ASN 37 5.086 -1.314 -12.514 270 1HB ASN 37 1HB ASN 37 3.257 -3.664 -12.936 271 2HB ASN 37 2HB ASN 37 2.672 -2.017 -13.150 272 1HD2 ASN 37 1HD2 ASN 37 2.351 -2.147 -15.324 273 2HD2 ASN 37 2HD2 ASN 37 3.634 -2.310 -16.470 274 H ARG 38 H ARG 38 4.180 -3.474 -9.974 275 HA ARG 38 HA ARG 38 2.473 -1.409 -8.780 276 1HB ARG 38 1HB ARG 38 1.471 -3.651 -9.036 277 2HB ARG 38 2HB ARG 38 2.743 -4.323 -8.027 278 1HG ARG 38 1HG ARG 38 0.597 -3.964 -6.842 279 2HG ARG 38 2HG ARG 38 1.961 -3.110 -6.118 280 1HD ARG 38 1HD ARG 38 0.120 -1.789 -8.086 281 2HD ARG 38 2HD ARG 38 -0.244 -1.836 -6.363 282 HE ARG 38 HE ARG 38 2.082 -0.762 -6.164 283 1HH1 ARG 38 1HH1 ARG 38 -0.178 -0.158 -8.763 284 2HH1 ARG 38 2HH1 ARG 38 0.465 1.408 -9.115 285 1HH2 ARG 38 1HH2 ARG 38 2.913 1.297 -6.628 286 2HH2 ARG 38 2HH2 ARG 38 2.212 2.237 -7.902 287 H ASP 39 H ASP 39 5.620 -2.377 -8.707 288 HA ASP 39 HA ASP 39 7.324 -2.310 -7.178 289 1HB ASP 39 1HB ASP 39 6.207 0.153 -7.452 290 2HB ASP 39 2HB ASP 39 6.085 -0.066 -5.709 291 H LEU 40 H LEU 40 5.270 -4.104 -6.443 292 HA LEU 40 HA LEU 40 5.556 -4.028 -3.520 293 1HB LEU 40 1HB LEU 40 3.298 -3.310 -4.028 294 2HB LEU 40 2HB LEU 40 3.058 -4.694 -5.076 295 HG LEU 40 HG LEU 40 3.574 -6.028 -2.840 296 1HD1 LEU 40 1HD1 LEU 40 2.033 -4.283 -1.276 297 2HD1 LEU 40 2HD1 LEU 40 3.339 -3.311 -1.953 298 3HD1 LEU 40 3HD1 LEU 40 3.711 -4.764 -1.025 299 1HD2 LEU 40 1HD2 LEU 40 0.853 -5.022 -2.698 300 2HD2 LEU 40 2HD2 LEU 40 1.442 -6.643 -3.068 301 3HD2 LEU 40 3HD2 LEU 40 1.330 -5.433 -4.346 302 H LEU 41 H LEU 41 5.943 -5.991 -2.545 303 HA LEU 41 HA LEU 41 5.859 -8.384 -4.213 304 1HB LEU 41 1HB LEU 41 8.085 -9.087 -3.642 305 2HB LEU 41 2HB LEU 41 8.128 -7.537 -4.444 306 HG LEU 41 HG LEU 41 9.454 -8.273 -2.106 307 1HD1 LEU 41 1HD1 LEU 41 9.710 -6.404 -3.985 308 2HD1 LEU 41 2HD1 LEU 41 10.581 -6.351 -2.451 309 3HD1 LEU 41 3HD1 LEU 41 9.115 -5.395 -2.667 310 1HD2 LEU 41 1HD2 LEU 41 7.694 -7.939 -0.608 311 2HD2 LEU 41 2HD2 LEU 41 7.134 -6.494 -1.445 312 3HD2 LEU 41 3HD2 LEU 41 8.639 -6.454 -0.536 313 H VAL 42 H VAL 42 5.946 -10.399 -3.048 314 HA VAL 42 HA VAL 42 5.113 -10.088 -0.243 315 HB VAL 42 HB VAL 42 4.058 -11.981 -2.344 316 1HG1 VAL 42 1HG1 VAL 42 2.828 -13.175 -0.603 317 2HG1 VAL 42 2HG1 VAL 42 3.626 -12.207 0.636 318 3HG1 VAL 42 3HG1 VAL 42 4.565 -13.325 -0.348 319 1HG2 VAL 42 1HG2 VAL 42 1.950 -11.036 -0.871 320 2HG2 VAL 42 2HG2 VAL 42 2.509 -10.373 -2.411 321 3HG2 VAL 42 3HG2 VAL 42 3.053 -9.656 -0.894 322 H SER 43 H SER 43 6.201 -11.158 1.226 323 HA SER 43 HA SER 43 8.013 -13.320 0.383 324 1HB SER 43 1HB SER 43 9.706 -12.543 1.811 325 2HB SER 43 2HB SER 43 9.063 -11.055 1.119 326 HG SER 43 HG SER 43 8.539 -12.155 3.676 327 H THR 44 H THR 44 8.402 -14.957 2.058 328 HA THR 44 HA THR 44 5.987 -15.312 3.662 329 HB THR 44 HB THR 44 6.418 -17.628 3.654 330 HG1 THR 44 HG1 THR 44 9.029 -17.027 2.721 331 1HG2 THR 44 1HG2 THR 44 6.219 -18.131 1.476 332 2HG2 THR 44 2HG2 THR 44 7.608 -17.150 1.006 333 3HG2 THR 44 3HG2 THR 44 6.055 -16.378 1.339 334 H THR 45 H THR 45 5.956 -15.043 5.755 335 HA THR 45 HA THR 45 8.510 -14.984 7.221 336 HB THR 45 HB THR 45 7.647 -12.819 7.386 337 HG1 THR 45 HG1 THR 45 7.000 -12.632 9.522 338 1HG2 THR 45 1HG2 THR 45 5.551 -12.709 6.504 339 2HG2 THR 45 2HG2 THR 45 5.172 -12.561 8.221 340 3HG2 THR 45 3HG2 THR 45 4.975 -14.113 7.405 341 H THR 46 H THR 46 8.352 -15.606 9.532 342 HA THR 46 HA THR 46 6.501 -17.873 9.840 343 HB THR 46 HB THR 46 8.918 -17.560 11.565 344 HG1 THR 46 HG1 THR 46 10.146 -18.613 9.938 345 1HG2 THR 46 1HG2 THR 46 8.354 -20.127 10.306 346 2HG2 THR 46 2HG2 THR 46 7.053 -19.530 11.336 347 3HG2 THR 46 3HG2 THR 46 8.677 -19.731 11.993 348 H ALA 47 H ALA 47 5.656 -15.227 10.401 349 HA ALA 47 HA ALA 47 5.282 -15.412 13.318 350 1HB ALA 47 1HB ALA 47 5.775 -13.236 13.658 351 2HB ALA 47 2HB ALA 47 5.091 -12.728 12.114 352 3HB ALA 47 3HB ALA 47 6.706 -13.433 12.173 353 H HIS 48 H HIS 48 3.312 -14.112 14.029 354 HA HIS 48 HA HIS 48 1.069 -14.981 12.424 355 1HB HIS 48 1HB HIS 48 1.457 -13.975 15.197 356 2HB HIS 48 2HB HIS 48 -0.126 -13.735 14.466 357 HD1 HIS 48 HD1 HIS 48 2.306 -16.642 14.881 358 HD2 HIS 48 HD2 HIS 48 -1.767 -15.822 14.934 359 HE1 HIS 48 HE1 HIS 48 1.189 -18.824 15.444 360 HE2 HIS 48 HE2 HIS 48 -1.270 -18.285 15.549 361 H GLY 49 H GLY 49 -0.419 -13.697 11.400 362 1HA GLY 49 1HA GLY 49 0.456 -10.972 10.839 363 2HA GLY 49 2HA GLY 49 -0.778 -11.869 9.967 364 H CYS 50 H CYS 50 -0.888 -9.148 10.985 365 HA CYS 50 HA CYS 50 -3.142 -9.445 12.862 366 1HB CYS 50 1HB CYS 50 -0.790 -8.066 13.321 367 2HB CYS 50 2HB CYS 50 -1.900 -6.798 12.812 368 HG CYS 50 HG CYS 50 -2.680 -8.653 15.176 369 H ASP 51 H ASP 51 -1.793 -7.440 10.258 370 HA ASP 51 HA ASP 51 -4.060 -5.864 9.799 371 1HB ASP 51 1HB ASP 51 -1.967 -6.750 7.801 372 2HB ASP 51 2HB ASP 51 -3.080 -5.401 7.594 373 H THR 52 H THR 52 -5.897 -6.140 8.659 374 HA THR 52 HA THR 52 -6.291 -8.756 7.359 375 HB THR 52 HB THR 52 -8.385 -7.037 8.703 376 HG1 THR 52 HG1 THR 52 -7.913 -8.050 10.462 377 1HG2 THR 52 1HG2 THR 52 -8.969 -8.763 6.805 378 2HG2 THR 52 2HG2 THR 52 -9.959 -8.611 8.257 379 3HG2 THR 52 3HG2 THR 52 -8.781 -9.917 8.125 380 H ILE 53 H ILE 53 -6.411 -8.590 5.226 381 HA ILE 53 HA ILE 53 -7.027 -6.066 3.962 382 HB ILE 53 HB ILE 53 -6.809 -8.537 2.336 383 1HG1 ILE 53 1HG1 ILE 53 -4.807 -7.772 4.298 384 2HG1 ILE 53 2HG1 ILE 53 -4.887 -9.206 3.285 385 1HG2 ILE 53 1HG2 ILE 53 -7.152 -6.350 1.310 386 2HG2 ILE 53 2HG2 ILE 53 -5.606 -7.049 0.832 387 3HG2 ILE 53 3HG2 ILE 53 -5.657 -5.768 2.043 388 1HD1 ILE 53 1HD1 ILE 53 -2.845 -8.110 2.822 389 2HD1 ILE 53 2HD1 ILE 53 -3.648 -6.552 2.625 390 3HD1 ILE 53 3HD1 ILE 53 -3.902 -7.832 1.438 391 H ALA 54 H ALA 54 -8.829 -5.542 2.825 392 HA ALA 54 HA ALA 54 -11.146 -7.266 3.247 393 1HB ALA 54 1HB ALA 54 -12.470 -5.298 2.662 394 2HB ALA 54 2HB ALA 54 -10.991 -4.407 2.300 395 3HB ALA 54 3HB ALA 54 -11.320 -4.940 3.949 396 H ARG 55 H ARG 55 -12.149 -8.346 1.675 397 HA ARG 55 HA ARG 55 -11.151 -8.087 -1.063 398 1HB ARG 55 1HB ARG 55 -11.399 -10.339 0.115 399 2HB ARG 55 2HB ARG 55 -13.137 -10.115 -0.031 400 1HG ARG 55 1HG ARG 55 -12.178 -9.654 -2.590 401 2HG ARG 55 2HG ARG 55 -11.213 -11.007 -1.996 402 1HD ARG 55 1HD ARG 55 -13.229 -12.238 -1.446 403 2HD ARG 55 2HD ARG 55 -14.226 -10.868 -1.934 404 HE ARG 55 HE ARG 55 -12.698 -11.495 -4.134 405 1HH1 ARG 55 1HH1 ARG 55 -15.027 -13.153 -2.133 406 2HH1 ARG 55 2HH1 ARG 55 -15.588 -14.173 -3.415 407 1HH2 ARG 55 1HH2 ARG 55 -13.435 -12.836 -5.821 408 2HH2 ARG 55 2HH2 ARG 55 -14.684 -13.994 -5.508 409 H CYS 56 H CYS 56 -12.580 -5.954 -0.153 410 HA CYS 56 HA CYS 56 -15.293 -6.172 -1.221 411 1HB CYS 56 1HB CYS 56 -15.513 -3.855 -0.228 412 2HB CYS 56 2HB CYS 56 -15.190 -5.138 0.936 413 H GLN 57 H GLN 57 -16.082 -4.254 -2.458 414 HA GLN 57 HA GLN 57 -14.021 -3.295 -4.332 415 1HB GLN 57 1HB GLN 57 -16.220 -4.873 -4.926 416 2HB GLN 57 2HB GLN 57 -16.764 -3.254 -5.343 417 1HG GLN 57 1HG GLN 57 -15.423 -3.127 -7.129 418 2HG GLN 57 2HG GLN 57 -14.079 -3.915 -6.305 419 1HE2 GLN 57 1HE2 GLN 57 -14.287 -6.277 -6.006 420 2HE2 GLN 57 2HE2 GLN 57 -15.026 -7.193 -7.271 421 H CYS 58 H CYS 58 -15.069 -2.132 -1.800 422 HA CYS 58 HA CYS 58 -16.803 0.020 -2.381 423 1HB CYS 58 1HB CYS 58 -16.333 0.802 -0.184 424 2HB CYS 58 2HB CYS 58 -16.297 -0.954 -0.095 425 H THR 59 H THR 59 -16.399 2.189 -2.750 426 HA THR 59 HA THR 59 -13.735 2.764 -3.838 427 HB THR 59 HB THR 59 -16.213 4.423 -4.263 428 HG1 THR 59 HG1 THR 59 -16.556 3.204 -6.136 429 1HG2 THR 59 1HG2 THR 59 -13.691 4.071 -5.861 430 2HG2 THR 59 2HG2 THR 59 -14.211 5.514 -4.989 431 3HG2 THR 59 3HG2 THR 59 -15.111 4.966 -6.404 432 H THR 60 H THR 60 -14.931 2.992 -0.950 433 HA THR 60 HA THR 60 -13.756 5.636 -0.443 434 HB THR 60 HB THR 60 -15.452 6.106 1.243 435 HG1 THR 60 HG1 THR 60 -17.020 4.705 1.736 436 1HG2 THR 60 1HG2 THR 60 -17.399 6.450 -0.118 437 2HG2 THR 60 2HG2 THR 60 -16.818 5.283 -1.307 438 3HG2 THR 60 3HG2 THR 60 -15.953 6.801 -1.065 439 H GLY 61 H GLY 61 -12.161 5.564 0.993 440 1HA GLY 61 1HA GLY 61 -12.256 3.661 3.199 441 2HA GLY 61 2HA GLY 61 -10.922 3.475 2.071 442 H VAL 62 H VAL 62 -10.418 3.963 4.723 443 HA VAL 62 HA VAL 62 -9.727 6.816 4.841 444 HB VAL 62 HB VAL 62 -11.010 5.973 6.750 445 1HG1 VAL 62 1HG1 VAL 62 -8.678 4.099 7.108 446 2HG1 VAL 62 2HG1 VAL 62 -10.359 3.670 6.794 447 3HG1 VAL 62 3HG1 VAL 62 -9.908 4.397 8.336 448 1HG2 VAL 62 1HG2 VAL 62 -9.920 7.603 7.792 449 2HG2 VAL 62 2HG2 VAL 62 -8.438 7.268 6.896 450 3HG2 VAL 62 3HG2 VAL 62 -8.789 6.385 8.381 451 H TYR 63 H TYR 63 -7.670 7.502 4.876 452 HA TYR 63 HA TYR 63 -5.569 5.446 4.764 453 1HB TYR 63 1HB TYR 63 -4.298 6.885 3.350 454 2HB TYR 63 2HB TYR 63 -5.932 6.854 2.704 455 HD1 TYR 63 HD1 TYR 63 -3.747 8.875 4.958 456 HD2 TYR 63 HD2 TYR 63 -6.982 8.873 2.185 457 HE1 TYR 63 HE1 TYR 63 -3.794 11.331 5.018 458 HE2 TYR 63 HE2 TYR 63 -7.031 11.329 2.243 459 HH TYR 63 HH TYR 63 -6.353 13.153 3.749 460 H PHE 64 H PHE 64 -3.449 6.073 5.638 461 HA PHE 64 HA PHE 64 -3.784 7.355 8.213 462 1HB PHE 64 1HB PHE 64 -2.480 5.202 7.814 463 2HB PHE 64 2HB PHE 64 -1.230 6.208 7.088 464 HD1 PHE 64 HD1 PHE 64 -0.487 8.257 8.593 465 HD2 PHE 64 HD2 PHE 64 -2.300 4.690 10.041 466 HE1 PHE 64 HE1 PHE 64 0.466 8.682 10.821 467 HE2 PHE 64 HE2 PHE 64 -1.352 5.108 12.272 468 HZ PHE 64 HZ PHE 64 0.033 7.107 12.665 469 H CYS 65 H CYS 65 -3.171 9.356 8.732 470 HA CYS 65 HA CYS 65 -1.723 10.916 6.708 471 1HB CYS 65 1HB CYS 65 -4.075 11.524 7.823 472 2HB CYS 65 2HB CYS 65 -3.019 12.243 9.034 473 HG CYS 65 HG CYS 65 -3.101 14.171 7.510 474 H ALA 66 H ALA 66 0.122 12.043 7.199 475 HA ALA 66 HA ALA 66 1.502 11.200 9.625 476 1HB ALA 66 1HB ALA 66 3.486 11.668 8.553 477 2HB ALA 66 2HB ALA 66 2.767 12.916 7.535 478 3HB ALA 66 3HB ALA 66 2.456 11.213 7.196 479 H SER 67 H SER 67 0.596 14.196 7.951 480 HA SER 67 HA SER 67 1.653 15.923 9.950 481 1HB SER 67 1HB SER 67 -0.330 16.371 7.714 482 2HB SER 67 2HB SER 67 0.224 17.660 8.782 483 HG SER 67 HG SER 67 1.802 17.812 7.403 484 H LYS 68 H LYS 68 -1.412 14.327 9.468 485 HA LYS 68 HA LYS 68 -2.647 15.827 11.646 486 1HB LYS 68 1HB LYS 68 -3.625 14.093 9.452 487 2HB LYS 68 2HB LYS 68 -4.547 14.056 10.948 488 1HG LYS 68 1HG LYS 68 -3.891 16.532 9.364 489 2HG LYS 68 2HG LYS 68 -5.437 15.680 9.351 490 1HD LYS 68 1HD LYS 68 -4.522 16.335 12.040 491 2HD LYS 68 2HD LYS 68 -4.744 17.760 11.023 492 1HE LYS 68 1HE LYS 68 -6.990 16.435 10.417 493 2HE LYS 68 2HE LYS 68 -6.730 15.822 12.049 494 1HZ LYS 68 1HZ LYS 68 -6.468 18.253 12.688 495 2HZ LYS 68 2HZ LYS 68 -8.030 17.721 12.320 496 3HZ LYS 68 3HZ LYS 68 -7.153 18.617 11.185 497 H SER 69 H SER 69 -1.201 12.745 10.988 498 HA SER 69 HA SER 69 -0.751 10.937 12.294 499 1HB SER 69 1HB SER 69 0.134 12.759 13.795 500 2HB SER 69 2HB SER 69 -1.414 12.729 14.639 501 HG SER 69 HG SER 69 -0.026 11.380 15.729 502 H LYS 70 H LYS 70 -3.542 11.611 11.446 503 HA LYS 70 HA LYS 70 -4.911 9.739 13.244 504 1HB LYS 70 1HB LYS 70 -6.282 12.148 12.055 505 2HB LYS 70 2HB LYS 70 -6.920 11.029 13.249 506 1HG LYS 70 1HG LYS 70 -5.970 12.115 14.955 507 2HG LYS 70 2HG LYS 70 -4.464 12.383 14.076 508 1HD LYS 70 1HD LYS 70 -5.333 14.532 14.382 509 2HD LYS 70 2HD LYS 70 -5.784 14.114 12.728 510 1HE LYS 70 1HE LYS 70 -7.806 14.857 13.428 511 2HE LYS 70 2HE LYS 70 -7.945 13.192 13.991 512 1HZ LYS 70 1HZ LYS 70 -7.183 13.922 16.177 513 2HZ LYS 70 2HZ LYS 70 -8.593 14.735 15.716 514 3HZ LYS 70 3HZ LYS 70 -7.098 15.521 15.630 515 H HIS 71 H HIS 71 -7.008 8.966 12.195 516 HA HIS 71 HA HIS 71 -6.350 8.047 9.527 517 1HB HIS 71 1HB HIS 71 -8.021 7.140 11.715 518 2HB HIS 71 2HB HIS 71 -8.914 7.124 10.199 519 HD1 HIS 71 HD1 HIS 71 -8.822 4.453 10.640 520 HD2 HIS 71 HD2 HIS 71 -5.239 6.299 9.628 521 HE1 HIS 71 HE1 HIS 71 -7.293 2.597 9.905 522 HE2 HIS 71 HE2 HIS 71 -5.162 3.748 9.211 523 H TYR 72 H TYR 72 -7.075 8.945 7.712 524 HA TYR 72 HA TYR 72 -9.273 10.893 7.908 525 1HB TYR 72 1HB TYR 72 -6.677 10.943 6.612 526 2HB TYR 72 2HB TYR 72 -7.969 11.292 5.469 527 HD1 TYR 72 HD1 TYR 72 -8.394 13.526 5.145 528 HD2 TYR 72 HD2 TYR 72 -7.116 12.229 8.995 529 HE1 TYR 72 HE1 TYR 72 -8.473 15.848 5.950 530 HE2 TYR 72 HE2 TYR 72 -7.192 14.548 9.810 531 HH TYR 72 HH TYR 72 -8.788 16.954 8.356 532 HA PRO 73 HA PRO 73 -11.371 7.866 5.288 533 1HB PRO 73 1HB PRO 73 -13.744 9.505 5.574 534 2HB PRO 73 2HB PRO 73 -13.429 7.902 6.240 535 1HG PRO 73 1HG PRO 73 -13.646 10.163 7.762 536 2HG PRO 73 2HG PRO 73 -12.712 8.735 8.241 537 1HD PRO 73 1HD PRO 73 -11.762 11.323 7.079 538 2HD PRO 73 2HD PRO 73 -11.030 10.315 8.346 539 H VAL 74 H VAL 74 -11.069 8.024 3.140 540 HA VAL 74 HA VAL 74 -12.042 10.419 1.762 541 HB VAL 74 HB VAL 74 -9.267 9.282 1.398 542 1HG1 VAL 74 1HG1 VAL 74 -10.774 11.406 -0.099 543 2HG1 VAL 74 2HG1 VAL 74 -9.961 9.976 -0.736 544 3HG1 VAL 74 3HG1 VAL 74 -9.013 11.318 -0.096 545 1HG2 VAL 74 1HG2 VAL 74 -8.901 10.593 3.196 546 2HG2 VAL 74 2HG2 VAL 74 -10.350 11.561 2.923 547 3HG2 VAL 74 3HG2 VAL 74 -8.890 11.875 1.985 548 H SER 75 H SER 75 -12.689 10.125 -0.334 549 HA SER 75 HA SER 75 -13.053 7.352 -1.175 550 1HB SER 75 1HB SER 75 -14.158 9.546 -2.833 551 2HB SER 75 2HB SER 75 -14.919 8.050 -2.291 552 HG SER 75 HG SER 75 -14.847 10.546 -1.093 553 H PHE 76 H PHE 76 -12.062 6.491 -2.950 554 HA PHE 76 HA PHE 76 -10.545 8.284 -4.696 555 1HB PHE 76 1HB PHE 76 -8.732 6.300 -4.484 556 2HB PHE 76 2HB PHE 76 -8.692 7.759 -3.501 557 HD1 PHE 76 HD1 PHE 76 -10.850 4.732 -3.254 558 HD2 PHE 76 HD2 PHE 76 -7.848 7.139 -1.448 559 HE1 PHE 76 HE1 PHE 76 -10.989 3.371 -1.208 560 HE2 PHE 76 HE2 PHE 76 -7.978 5.799 0.593 561 HZ PHE 76 HZ PHE 76 -9.552 3.902 0.720 562 H GLU 77 H GLU 77 -9.548 7.048 -6.547 563 HA GLU 77 HA GLU 77 -11.462 5.019 -7.491 564 1HB GLU 77 1HB GLU 77 -10.006 7.235 -8.890 565 2HB GLU 77 2HB GLU 77 -10.478 5.803 -9.794 566 1HG GLU 77 1HG GLU 77 -12.419 7.422 -8.173 567 2HG GLU 77 2HG GLU 77 -12.072 7.748 -9.871 568 H GLY 78 H GLY 78 -10.580 3.347 -8.914 569 1HA GLY 78 1HA GLY 78 -7.849 2.634 -8.073 570 2HA GLY 78 2HA GLY 78 -9.090 1.490 -8.557 571 HA PRO 79 HA PRO 79 -7.544 3.514 -12.678 572 1HB PRO 79 1HB PRO 79 -5.257 4.994 -12.504 573 2HB PRO 79 2HB PRO 79 -6.878 5.693 -12.423 574 1HG PRO 79 1HG PRO 79 -4.986 5.024 -10.208 575 2HG PRO 79 2HG PRO 79 -6.028 6.445 -10.401 576 1HD PRO 79 1HD PRO 79 -6.675 4.386 -8.776 577 2HD PRO 79 2HD PRO 79 -7.898 5.335 -9.640 578 H GLY 80 H GLY 80 -6.456 2.146 -13.949 579 1HA GLY 80 1HA GLY 80 -4.830 0.114 -12.917 580 2HA GLY 80 2HA GLY 80 -4.985 0.520 -14.621 581 H LEU 81 H LEU 81 -3.485 1.916 -15.581 582 HA LEU 81 HA LEU 81 -0.925 1.976 -14.213 583 1HB LEU 81 1HB LEU 81 -1.592 1.492 -16.787 584 2HB LEU 81 2HB LEU 81 -1.149 3.186 -16.880 585 HG LEU 81 HG LEU 81 0.831 2.096 -17.367 586 1HD1 LEU 81 1HD1 LEU 81 0.747 2.859 -14.494 587 2HD1 LEU 81 2HD1 LEU 81 1.548 3.653 -15.844 588 3HD1 LEU 81 3HD1 LEU 81 2.211 2.163 -15.177 589 1HD2 LEU 81 1HD2 LEU 81 0.968 0.244 -15.110 590 2HD2 LEU 81 2HD2 LEU 81 1.377 0.002 -16.809 591 3HD2 LEU 81 3HD2 LEU 81 -0.303 -0.106 -16.282 592 H VAL 82 H VAL 82 -0.273 3.665 -13.075 593 HA VAL 82 HA VAL 82 -1.139 6.349 -13.916 594 HB VAL 82 HB VAL 82 -0.770 5.491 -11.030 595 1HG1 VAL 82 1HG1 VAL 82 -2.160 7.787 -10.937 596 2HG1 VAL 82 2HG1 VAL 82 -1.212 8.073 -12.397 597 3HG1 VAL 82 3HG1 VAL 82 -0.399 7.716 -10.873 598 1HG2 VAL 82 1HG2 VAL 82 -2.756 4.439 -11.834 599 2HG2 VAL 82 2HG2 VAL 82 -3.267 5.904 -12.671 600 3HG2 VAL 82 3HG2 VAL 82 -3.253 5.856 -10.909 601 H GLU 83 H GLU 83 0.530 7.597 -14.428 602 HA GLU 83 HA GLU 83 3.210 6.738 -13.982 603 1HB GLU 83 1HB GLU 83 3.761 9.029 -14.960 604 2HB GLU 83 2HB GLU 83 2.850 7.929 -15.986 605 1HG GLU 83 1HG GLU 83 0.852 9.117 -15.674 606 2HG GLU 83 2HG GLU 83 1.503 10.011 -14.301 607 H VAL 84 H VAL 84 4.045 6.790 -12.004 608 HA VAL 84 HA VAL 84 3.254 8.716 -10.042 609 HB VAL 84 HB VAL 84 4.846 7.662 -8.572 610 1HG1 VAL 84 1HG1 VAL 84 4.032 5.361 -8.626 611 2HG1 VAL 84 2HG1 VAL 84 3.443 5.608 -10.270 612 3HG1 VAL 84 3HG1 VAL 84 2.731 6.511 -8.933 613 1HG2 VAL 84 1HG2 VAL 84 6.803 7.055 -9.462 614 2HG2 VAL 84 2HG2 VAL 84 6.109 6.863 -11.070 615 3HG2 VAL 84 3HG2 VAL 84 5.991 5.551 -9.899 616 H GLN 85 H GLN 85 4.035 10.671 -9.751 617 HA GLN 85 HA GLN 85 6.092 11.747 -11.383 618 1HB GLN 85 1HB GLN 85 5.783 13.795 -10.031 619 2HB GLN 85 2HB GLN 85 4.262 13.144 -10.626 620 1HG GLN 85 1HG GLN 85 3.585 12.450 -8.531 621 2HG GLN 85 2HG GLN 85 5.231 12.419 -7.898 622 1HE2 GLN 85 1HE2 GLN 85 2.425 14.319 -8.476 623 2HE2 GLN 85 2HE2 GLN 85 2.970 15.761 -7.696 624 H GLU 86 H GLU 86 8.135 12.567 -10.774 625 HA GLU 86 HA GLU 86 9.578 10.884 -9.017 626 1HB GLU 86 1HB GLU 86 11.497 12.300 -9.519 627 2HB GLU 86 2HB GLU 86 10.599 11.948 -10.988 628 1HG GLU 86 1HG GLU 86 9.481 14.304 -10.056 629 2HG GLU 86 2HG GLU 86 11.209 14.486 -9.758 630 H SER 87 H SER 87 9.085 10.944 -6.906 631 HA SER 87 HA SER 87 9.567 13.458 -5.491 632 1HB SER 87 1HB SER 87 6.983 11.953 -5.519 633 2HB SER 87 2HB SER 87 7.482 12.759 -4.032 634 HG SER 87 HG SER 87 6.309 14.229 -5.189 635 H GLU 88 H GLU 88 9.802 13.168 -3.152 636 HA GLU 88 HA GLU 88 10.830 12.214 -1.373 637 1HB GLU 88 1HB GLU 88 8.664 10.681 -1.922 638 2HB GLU 88 2HB GLU 88 9.936 9.472 -2.012 639 1HG GLU 88 1HG GLU 88 10.306 9.504 0.197 640 2HG GLU 88 2HG GLU 88 10.081 11.248 0.316 641 H TYR 89 H TYR 89 10.992 9.342 -3.459 642 HA TYR 89 HA TYR 89 13.775 9.747 -4.053 643 1HB TYR 89 1HB TYR 89 14.407 7.528 -2.936 644 2HB TYR 89 2HB TYR 89 14.194 8.924 -1.884 645 HD1 TYR 89 HD1 TYR 89 13.101 8.500 0.093 646 HD2 TYR 89 HD2 TYR 89 12.027 6.241 -3.351 647 HE1 TYR 89 HE1 TYR 89 11.461 7.249 1.431 648 HE2 TYR 89 HE2 TYR 89 10.384 4.986 -2.021 649 HH TYR 89 HH TYR 89 9.053 5.352 0.087 650 H TYR 90 H TYR 90 11.151 9.162 -5.366 651 HA TYR 90 HA TYR 90 12.006 6.761 -6.832 652 1HB TYR 90 1HB TYR 90 9.818 6.722 -5.341 653 2HB TYR 90 2HB TYR 90 9.121 7.502 -6.757 654 HD1 TYR 90 HD1 TYR 90 8.132 6.125 -8.314 655 HD2 TYR 90 HD2 TYR 90 11.334 4.587 -5.973 656 HE1 TYR 90 HE1 TYR 90 7.860 3.933 -9.394 657 HE2 TYR 90 HE2 TYR 90 11.072 2.391 -7.047 658 HH TYR 90 HH TYR 90 9.241 1.917 -9.840 659 HA PRO 91 HA PRO 91 12.098 9.663 -10.240 660 1HB PRO 91 1HB PRO 91 12.449 7.313 -11.951 661 2HB PRO 91 2HB PRO 91 13.568 8.640 -11.631 662 1HG PRO 91 1HG PRO 91 13.986 6.141 -10.702 663 2HG PRO 91 2HG PRO 91 14.509 7.586 -9.818 664 1HD PRO 91 1HD PRO 91 12.112 5.847 -9.361 665 2HD PRO 91 2HD PRO 91 13.218 6.581 -8.180 666 H LYS 92 H LYS 92 10.754 10.313 -11.904 667 HA LYS 92 HA LYS 92 8.082 9.613 -11.839 668 1HB LYS 92 1HB LYS 92 8.962 11.698 -12.832 669 2HB LYS 92 2HB LYS 92 9.584 10.771 -14.190 670 1HG LYS 92 1HG LYS 92 7.625 10.837 -15.223 671 2HG LYS 92 2HG LYS 92 6.786 10.228 -13.795 672 1HD LYS 92 1HD LYS 92 5.802 12.249 -13.784 673 2HD LYS 92 2HD LYS 92 7.314 12.793 -13.055 674 1HE LYS 92 1HE LYS 92 7.375 14.253 -14.753 675 2HE LYS 92 2HE LYS 92 7.918 12.876 -15.711 676 1HZ LYS 92 1HZ LYS 92 5.090 13.734 -15.419 677 2HZ LYS 92 2HZ LYS 92 5.656 12.474 -16.395 678 3HZ LYS 92 3HZ LYS 92 6.074 14.073 -16.753 679 H ARG 93 H ARG 93 7.739 7.400 -11.936 680 HA ARG 93 HA ARG 93 8.256 6.172 -14.568 681 1HB ARG 93 1HB ARG 93 9.231 5.344 -12.063 682 2HB ARG 93 2HB ARG 93 7.976 4.191 -12.495 683 1HG ARG 93 1HG ARG 93 10.205 3.490 -13.244 684 2HG ARG 93 2HG ARG 93 9.080 3.709 -14.586 685 1HD ARG 93 1HD ARG 93 10.461 5.168 -15.531 686 2HD ARG 93 2HD ARG 93 10.401 6.185 -14.093 687 HE ARG 93 HE ARG 93 12.509 5.486 -13.614 688 1HH1 ARG 93 1HH1 ARG 93 10.997 3.053 -15.607 689 2HH1 ARG 93 2HH1 ARG 93 12.417 2.066 -15.698 690 1HH2 ARG 93 1HH2 ARG 93 14.378 4.189 -13.732 691 2HH2 ARG 93 2HH2 ARG 93 14.337 2.711 -14.633 692 H TYR 94 H TYR 94 6.871 4.071 -14.762 693 HA TYR 94 HA TYR 94 4.090 4.873 -14.339 694 1HB TYR 94 1HB TYR 94 5.516 3.151 -16.306 695 2HB TYR 94 2HB TYR 94 3.841 2.757 -15.939 696 HD1 TYR 94 HD1 TYR 94 2.447 3.497 -17.615 697 HD2 TYR 94 HD2 TYR 94 5.689 5.965 -16.404 698 HE1 TYR 94 HE1 TYR 94 1.699 5.232 -19.181 699 HE2 TYR 94 HE2 TYR 94 4.956 7.708 -17.962 700 HH TYR 94 HH TYR 94 3.432 7.553 -20.322 701 H GLN 95 H GLN 95 2.732 3.790 -13.035 702 HA GLN 95 HA GLN 95 3.568 1.165 -12.008 703 1HB GLN 95 1HB GLN 95 2.506 3.487 -10.393 704 2HB GLN 95 2HB GLN 95 2.626 1.843 -9.780 705 1HG GLN 95 1HG GLN 95 5.144 2.537 -10.869 706 2HG GLN 95 2HG GLN 95 4.611 3.871 -9.848 707 1HE2 GLN 95 1HE2 GLN 95 6.068 3.528 -8.225 708 2HE2 GLN 95 2HE2 GLN 95 6.031 2.144 -7.190 709 H SER 96 H SER 96 1.995 -0.359 -11.992 710 HA SER 96 HA SER 96 -0.677 0.513 -12.844 711 1HB SER 96 1HB SER 96 0.905 -1.370 -13.954 712 2HB SER 96 2HB SER 96 -0.017 -2.373 -12.835 713 HG SER 96 HG SER 96 -1.263 -0.535 -14.584 714 H HIS 97 H HIS 97 -2.528 -0.067 -11.801 715 HA HIS 97 HA HIS 97 -3.931 -0.831 -10.187 716 1HB HIS 97 1HB HIS 97 -1.827 -2.739 -10.134 717 2HB HIS 97 2HB HIS 97 -2.248 -2.370 -8.465 718 HD1 HIS 97 HD1 HIS 97 -4.164 -3.652 -7.559 719 HD2 HIS 97 HD2 HIS 97 -4.248 -3.465 -11.709 720 HE1 HIS 97 HE1 HIS 97 -6.114 -5.078 -8.257 721 HE2 HIS 97 HE2 HIS 97 -6.100 -5.009 -10.776 722 H VAL 98 H VAL 98 -3.177 1.636 -9.809 723 HA VAL 98 HA VAL 98 -2.550 1.786 -6.931 724 HB VAL 98 HB VAL 98 -0.689 2.689 -8.299 725 1HG1 VAL 98 1HG1 VAL 98 -1.242 3.775 -10.162 726 2HG1 VAL 98 2HG1 VAL 98 -1.508 5.167 -9.109 727 3HG1 VAL 98 3HG1 VAL 98 -2.866 4.141 -9.579 728 1HG2 VAL 98 1HG2 VAL 98 -0.558 3.684 -6.273 729 2HG2 VAL 98 2HG2 VAL 98 -2.208 4.305 -6.347 730 3HG2 VAL 98 3HG2 VAL 98 -0.919 5.117 -7.240 731 H LEU 99 H LEU 99 -3.836 3.066 -5.676 732 HA LEU 99 HA LEU 99 -6.204 4.198 -6.992 733 1HB LEU 99 1HB LEU 99 -5.780 3.362 -4.123 734 2HB LEU 99 2HB LEU 99 -7.255 4.070 -4.751 735 HG LEU 99 HG LEU 99 -6.936 1.946 -6.431 736 1HD1 LEU 99 1HD1 LEU 99 -5.774 1.222 -3.760 737 2HD1 LEU 99 2HD1 LEU 99 -5.101 0.941 -5.366 738 3HD1 LEU 99 3HD1 LEU 99 -6.508 0.026 -4.827 739 1HD2 LEU 99 1HD2 LEU 99 -8.517 0.821 -4.627 740 2HD2 LEU 99 2HD2 LEU 99 -9.047 2.188 -5.608 741 3HD2 LEU 99 3HD2 LEU 99 -8.493 2.451 -3.954 742 H LEU 100 H LEU 100 -6.652 6.349 -6.842 743 HA LEU 100 HA LEU 100 -4.832 7.914 -5.149 744 1HB LEU 100 1HB LEU 100 -5.606 8.225 -7.956 745 2HB LEU 100 2HB LEU 100 -5.616 9.711 -7.020 746 HG LEU 100 HG LEU 100 -3.251 7.839 -7.138 747 1HD1 LEU 100 1HD1 LEU 100 -2.282 9.160 -8.794 748 2HD1 LEU 100 2HD1 LEU 100 -3.475 10.444 -8.600 749 3HD1 LEU 100 3HD1 LEU 100 -3.939 8.914 -9.347 750 1HD2 LEU 100 1HD2 LEU 100 -2.214 9.242 -5.736 751 2HD2 LEU 100 2HD2 LEU 100 -3.833 9.816 -5.339 752 3HD2 LEU 100 3HD2 LEU 100 -2.863 10.673 -6.535 753 H ALA 101 H ALA 101 -5.589 9.487 -3.868 754 HA ALA 101 HA ALA 101 -8.489 10.018 -3.883 755 1HB ALA 101 1HB ALA 101 -6.858 8.807 -1.813 756 2HB ALA 101 2HB ALA 101 -8.615 8.904 -1.955 757 3HB ALA 101 3HB ALA 101 -7.713 10.235 -1.235 758 H THR 102 H THR 102 -8.867 12.135 -4.152 759 HA THR 102 HA THR 102 -6.759 14.055 -3.616 760 HB THR 102 HB THR 102 -7.887 14.448 -5.651 761 HG1 THR 102 HG1 THR 102 -7.594 16.328 -4.307 762 1HG2 THR 102 1HG2 THR 102 -9.919 13.599 -5.930 763 2HG2 THR 102 2HG2 THR 102 -10.515 15.075 -5.170 764 3HG2 THR 102 3HG2 THR 102 -10.262 13.624 -4.201 765 H GLY 103 H GLY 103 -6.503 14.780 -1.617 766 1HA GLY 103 1HA GLY 103 -8.712 14.807 0.267 767 2HA GLY 103 2HA GLY 103 -7.036 15.203 0.612 768 H PHE 104 H PHE 104 -6.318 17.303 0.408 769 HA PHE 104 HA PHE 104 -8.045 19.356 -0.655 770 1HB PHE 104 1HB PHE 104 -8.674 18.776 1.848 771 2HB PHE 104 2HB PHE 104 -7.267 19.774 2.200 772 HD1 PHE 104 HD1 PHE 104 -10.101 19.990 -0.224 773 HD2 PHE 104 HD2 PHE 104 -7.850 21.887 2.849 774 HE1 PHE 104 HE1 PHE 104 -11.481 22.012 -0.467 775 HE2 PHE 104 HE2 PHE 104 -9.227 23.912 2.613 776 HZ PHE 104 HZ PHE 104 -11.045 23.977 0.953 777 H SER 105 H SER 105 -5.184 18.658 1.327 778 HA SER 105 HA SER 105 -3.431 20.012 -0.430 779 1HB SER 105 1HB SER 105 -4.290 22.065 0.419 780 2HB SER 105 2HB SER 105 -4.257 21.474 2.080 781 HG SER 105 HG SER 105 -2.342 22.746 0.732 782 H GLU 106 H GLU 106 -2.521 17.892 -0.103 783 HA GLU 106 HA GLU 106 -0.996 17.684 2.410 784 1HB GLU 106 1HB GLU 106 -2.724 15.775 1.097 785 2HB GLU 106 2HB GLU 106 -1.096 15.130 1.246 786 1HG GLU 106 1HG GLU 106 -2.271 14.448 3.169 787 2HG GLU 106 2HG GLU 106 -1.188 15.742 3.679 788 HA PRO 107 HA PRO 107 2.159 18.479 -0.862 789 1HB PRO 107 1HB PRO 107 3.717 18.675 1.673 790 2HB PRO 107 2HB PRO 107 3.738 19.729 0.255 791 1HG PRO 107 1HG PRO 107 2.496 20.484 2.483 792 2HG PRO 107 2HG PRO 107 1.805 20.844 0.890 793 1HD PRO 107 1HD PRO 107 0.999 18.778 2.885 794 2HD PRO 107 2HD PRO 107 -0.007 19.731 1.776 795 H GLY 108 H GLY 108 3.065 16.800 2.161 796 1HA GLY 108 1HA GLY 108 4.511 14.818 0.557 797 2HA GLY 108 2HA GLY 108 4.675 15.064 2.289 798 H ASP 109 H ASP 109 4.524 12.606 2.010 799 HA ASP 109 HA ASP 109 1.870 11.830 2.830 800 1HB ASP 109 1HB ASP 109 2.290 11.647 0.160 801 2HB ASP 109 2HB ASP 109 2.882 10.071 0.677 802 H ALA 110 H ALA 110 2.852 11.273 4.770 803 HA ALA 110 HA ALA 110 4.608 8.908 4.645 804 1HB ALA 110 1HB ALA 110 5.701 9.666 6.680 805 2HB ALA 110 2HB ALA 110 4.660 11.088 6.730 806 3HB ALA 110 3HB ALA 110 5.824 10.893 5.420 807 H GLY 111 H GLY 111 2.273 8.007 4.603 808 1HA GLY 111 1HA GLY 111 1.155 7.841 7.315 809 2HA GLY 111 2HA GLY 111 0.322 7.392 5.835 810 H GLY 112 H GLY 112 0.385 5.315 5.153 811 1HA GLY 112 1HA GLY 112 2.419 3.463 5.755 812 2HA GLY 112 2HA GLY 112 1.131 3.286 6.937 813 H ILE 113 H ILE 113 -0.852 2.444 6.312 814 HA ILE 113 HA ILE 113 -0.986 1.402 3.559 815 HB ILE 113 HB ILE 113 -2.118 -0.608 4.435 816 1HG1 ILE 113 1HG1 ILE 113 -1.305 0.483 7.140 817 2HG1 ILE 113 2HG1 ILE 113 -2.955 0.363 6.536 818 1HG2 ILE 113 1HG2 ILE 113 0.683 0.097 4.970 819 2HG2 ILE 113 2HG2 ILE 113 0.002 -1.263 4.076 820 3HG2 ILE 113 3HG2 ILE 113 0.087 -1.319 5.837 821 1HD1 ILE 113 1HD1 ILE 113 -1.347 -1.605 7.861 822 2HD1 ILE 113 2HD1 ILE 113 -1.889 -2.202 6.292 823 3HD1 ILE 113 3HD1 ILE 113 -3.067 -1.634 7.475 824 H LEU 114 H LEU 114 -3.023 1.322 2.593 825 HA LEU 114 HA LEU 114 -4.965 3.143 3.756 826 1HB LEU 114 1HB LEU 114 -4.510 3.489 1.443 827 2HB LEU 114 2HB LEU 114 -4.746 1.791 1.072 828 HG LEU 114 HG LEU 114 -7.150 2.032 1.611 829 1HD1 LEU 114 1HD1 LEU 114 -6.619 4.989 1.718 830 2HD1 LEU 114 2HD1 LEU 114 -6.799 3.980 3.152 831 3HD1 LEU 114 3HD1 LEU 114 -8.139 4.146 2.018 832 1HD2 LEU 114 1HD2 LEU 114 -7.699 2.799 -0.469 833 2HD2 LEU 114 2HD2 LEU 114 -5.972 2.522 -0.692 834 3HD2 LEU 114 3HD2 LEU 114 -6.571 4.153 -0.391 835 H ARG 115 H ARG 115 -6.424 2.378 5.118 836 HA ARG 115 HA ARG 115 -7.574 -0.286 4.599 837 1HB ARG 115 1HB ARG 115 -7.169 1.072 7.269 838 2HB ARG 115 2HB ARG 115 -7.942 -0.488 7.026 839 1HG ARG 115 1HG ARG 115 -5.743 -1.209 5.944 840 2HG ARG 115 2HG ARG 115 -5.059 0.247 6.669 841 1HD ARG 115 1HD ARG 115 -6.662 -1.512 8.432 842 2HD ARG 115 2HD ARG 115 -5.091 -2.120 7.911 843 HE ARG 115 HE ARG 115 -4.540 0.387 8.777 844 1HH1 ARG 115 1HH1 ARG 115 -6.184 -2.337 10.209 845 2HH1 ARG 115 2HH1 ARG 115 -5.733 -1.918 11.828 846 1HH2 ARG 115 1HH2 ARG 115 -3.946 0.941 10.905 847 2HH2 ARG 115 2HH2 ARG 115 -4.463 -0.057 12.223 848 H CYS 116 H CYS 116 -9.785 -0.568 4.882 849 HA CYS 116 HA CYS 116 -11.353 1.909 5.194 850 1HB CYS 116 1HB CYS 116 -13.043 0.927 3.688 851 2HB CYS 116 2HB CYS 116 -11.489 1.108 2.882 852 H GLU 117 H GLU 117 -13.780 1.189 5.680 853 HA GLU 117 HA GLU 117 -13.806 0.142 8.261 854 1HB GLU 117 1HB GLU 117 -16.266 -0.018 7.972 855 2HB GLU 117 2HB GLU 117 -15.610 1.534 7.469 856 1HG GLU 117 1HG GLU 117 -15.684 0.776 5.128 857 2HG GLU 117 2HG GLU 117 -16.417 -0.735 5.664 858 H HIS 118 H HIS 118 -13.660 -1.496 5.255 859 HA HIS 118 HA HIS 118 -14.679 -3.989 6.353 860 1HB HIS 118 1HB HIS 118 -13.578 -3.512 3.585 861 2HB HIS 118 2HB HIS 118 -14.596 -4.844 4.120 862 HD2 HIS 118 HD2 HIS 118 -17.297 -3.886 4.903 863 HE1 HIS 118 HE1 HIS 118 -17.059 -0.654 2.163 864 HE2 HIS 118 HE2 HIS 118 -18.565 -1.996 3.672 865 H GLY 119 H GLY 119 -11.604 -2.533 5.407 866 1HA GLY 119 1HA GLY 119 -10.008 -4.070 7.021 867 2HA GLY 119 2HA GLY 119 -10.145 -5.008 5.545 868 H VAL 120 H VAL 120 -8.237 -4.852 4.594 869 HA VAL 120 HA VAL 120 -6.943 -2.218 4.373 870 HB VAL 120 HB VAL 120 -5.661 -4.900 3.865 871 1HG1 VAL 120 1HG1 VAL 120 -3.669 -3.246 4.571 872 2HG1 VAL 120 2HG1 VAL 120 -4.765 -2.101 3.795 873 3HG1 VAL 120 3HG1 VAL 120 -4.185 -3.509 2.906 874 1HG2 VAL 120 1HG2 VAL 120 -5.260 -5.214 6.036 875 2HG2 VAL 120 2HG2 VAL 120 -6.540 -4.034 6.324 876 3HG2 VAL 120 3HG2 VAL 120 -4.854 -3.518 6.294 877 H ILE 121 H ILE 121 -6.541 -1.311 2.426 878 HA ILE 121 HA ILE 121 -7.489 -2.770 0.057 879 HB ILE 121 HB ILE 121 -7.161 0.198 0.506 880 1HG1 ILE 121 1HG1 ILE 121 -9.657 0.142 0.104 881 2HG1 ILE 121 2HG1 ILE 121 -9.560 -1.615 0.217 882 1HG2 ILE 121 1HG2 ILE 121 -8.555 -0.002 -1.803 883 2HG2 ILE 121 2HG2 ILE 121 -7.460 -1.376 -1.959 884 3HG2 ILE 121 3HG2 ILE 121 -6.811 0.245 -1.715 885 1HD1 ILE 121 1HD1 ILE 121 -8.265 -0.320 2.446 886 2HD1 ILE 121 2HD1 ILE 121 -9.526 -1.553 2.423 887 3HD1 ILE 121 3HD1 ILE 121 -9.955 0.153 2.289 888 H GLY 122 H GLY 122 -4.912 -0.473 1.021 889 1HA GLY 122 1HA GLY 122 -2.986 -2.009 -0.492 890 2HA GLY 122 2HA GLY 122 -3.369 -0.454 -1.208 891 H LEU 123 H LEU 123 -1.006 -0.211 -0.881 892 HA LEU 123 HA LEU 123 -0.458 0.854 1.808 893 1HB LEU 123 1HB LEU 123 1.987 0.291 1.214 894 2HB LEU 123 2HB LEU 123 0.926 -0.999 1.749 895 HG LEU 123 HG LEU 123 1.205 -0.512 -1.181 896 1HD1 LEU 123 1HD1 LEU 123 3.486 -0.681 0.216 897 2HD1 LEU 123 2HD1 LEU 123 3.281 -1.375 -1.393 898 3HD1 LEU 123 3HD1 LEU 123 3.122 -2.397 0.035 899 1HD2 LEU 123 1HD2 LEU 123 1.180 -3.173 0.147 900 2HD2 LEU 123 2HD2 LEU 123 0.470 -2.666 -1.386 901 3HD2 LEU 123 3HD2 LEU 123 -0.308 -2.227 0.134 902 H VAL 124 H VAL 124 1.285 2.513 1.827 903 HA VAL 124 HA VAL 124 0.669 4.659 0.168 904 HB VAL 124 HB VAL 124 2.906 5.603 0.966 905 1HG1 VAL 124 1HG1 VAL 124 0.715 4.715 2.818 906 2HG1 VAL 124 2HG1 VAL 124 0.966 6.300 2.086 907 3HG1 VAL 124 3HG1 VAL 124 2.046 5.736 3.361 908 1HG2 VAL 124 1HG2 VAL 124 2.885 3.284 2.868 909 2HG2 VAL 124 2HG2 VAL 124 4.163 4.461 2.567 910 3HG2 VAL 124 3HG2 VAL 124 3.801 3.225 1.363 911 H THR 125 H THR 125 0.988 4.852 -1.944 912 HA THR 125 HA THR 125 3.393 3.644 -3.124 913 HB THR 125 HB THR 125 0.662 4.233 -4.219 914 HG1 THR 125 HG1 THR 125 1.376 2.152 -3.360 915 1HG2 THR 125 1HG2 THR 125 1.772 5.135 -6.030 916 2HG2 THR 125 2HG2 THR 125 1.691 3.428 -6.453 917 3HG2 THR 125 3HG2 THR 125 3.185 4.104 -5.807 918 H MET 126 H MET 126 1.475 6.258 -4.571 919 HA MET 126 HA MET 126 3.739 8.076 -4.079 920 1HB MET 126 1HB MET 126 3.426 6.927 -6.493 921 2HB MET 126 2HB MET 126 2.401 8.339 -6.702 922 1HG MET 126 1HG MET 126 4.396 9.146 -7.436 923 2HG MET 126 2HG MET 126 4.466 9.603 -5.736 924 1HE MET 126 1HE MET 126 6.483 10.012 -5.430 925 2HE MET 126 2HE MET 126 7.766 9.387 -6.467 926 3HE MET 126 3HE MET 126 7.613 8.809 -4.807 927 H GLY 127 H GLY 127 3.199 10.377 -4.444 928 1HA GLY 127 1HA GLY 127 0.325 10.921 -4.068 929 2HA GLY 127 2HA GLY 127 1.515 11.617 -2.980 930 H GLY 128 H GLY 128 -0.291 13.168 -4.444 931 1HA GLY 128 1HA GLY 128 1.508 14.455 -6.407 932 2HA GLY 128 2HA GLY 128 -0.241 14.428 -6.576 933 H GLU 129 H GLU 129 -0.240 16.718 -6.720 934 HA GLU 129 HA GLU 129 0.790 18.353 -4.624 935 1HB GLU 129 1HB GLU 129 -1.329 19.106 -6.637 936 2HB GLU 129 2HB GLU 129 -0.256 20.188 -5.761 937 1HG GLU 129 1HG GLU 129 1.007 18.129 -7.467 938 2HG GLU 129 2HG GLU 129 0.172 19.452 -8.278 939 H GLY 130 H GLY 130 -2.084 16.525 -5.015 940 1HA GLY 130 1HA GLY 130 -2.988 17.213 -2.392 941 2HA GLY 130 2HA GLY 130 -4.008 17.923 -3.635 942 H VAL 131 H VAL 131 -2.406 14.843 -4.063 943 HA VAL 131 HA VAL 131 -4.959 13.462 -3.618 944 HB VAL 131 HB VAL 131 -3.252 12.503 -5.858 945 1HG1 VAL 131 1HG1 VAL 131 -6.231 12.631 -5.415 946 2HG1 VAL 131 2HG1 VAL 131 -5.199 11.226 -5.153 947 3HG1 VAL 131 3HG1 VAL 131 -5.427 11.860 -6.782 948 1HG2 VAL 131 1HG2 VAL 131 -5.164 14.819 -6.148 949 2HG2 VAL 131 2HG2 VAL 131 -4.330 13.985 -7.460 950 3HG2 VAL 131 3HG2 VAL 131 -3.408 14.915 -6.279 951 H VAL 132 H VAL 132 -4.764 11.163 -3.238 952 HA VAL 132 HA VAL 132 -2.156 10.455 -2.053 953 HB VAL 132 HB VAL 132 -4.658 9.019 -1.278 954 1HG1 VAL 132 1HG1 VAL 132 -2.173 9.807 0.228 955 2HG1 VAL 132 2HG1 VAL 132 -2.521 8.224 -0.468 956 3HG1 VAL 132 3HG1 VAL 132 -3.500 8.835 0.865 957 1HG2 VAL 132 1HG2 VAL 132 -4.125 11.201 0.544 958 2HG2 VAL 132 2HG2 VAL 132 -5.645 10.689 -0.190 959 3HG2 VAL 132 3HG2 VAL 132 -4.574 11.792 -1.054 960 H GLY 133 H GLY 133 -1.080 8.935 -3.165 961 1HA GLY 133 1HA GLY 133 -2.622 7.088 -4.863 962 2HA GLY 133 2HA GLY 133 -0.916 7.456 -5.054 963 H PHE 134 H PHE 134 -2.941 5.068 -4.188 964 HA PHE 134 HA PHE 134 -0.982 3.899 -2.324 965 1HB PHE 134 1HB PHE 134 -3.993 3.710 -2.282 966 2HB PHE 134 2HB PHE 134 -2.955 2.615 -1.375 967 HD1 PHE 134 HD1 PHE 134 -1.047 3.968 -0.016 968 HD2 PHE 134 HD2 PHE 134 -4.889 5.442 -1.087 969 HE1 PHE 134 HE1 PHE 134 -0.928 5.596 1.824 970 HE2 PHE 134 HE2 PHE 134 -4.779 7.074 0.750 971 HZ PHE 134 HZ PHE 134 -2.794 7.153 2.207 972 H ALA 135 H ALA 135 -0.449 1.763 -2.574 973 HA ALA 135 HA ALA 135 -1.068 0.603 -5.172 974 1HB ALA 135 1HB ALA 135 1.005 0.160 -3.085 975 2HB ALA 135 2HB ALA 135 1.180 0.359 -4.827 976 3HB ALA 135 3HB ALA 135 0.611 -1.176 -4.168 977 H ASP 136 H ASP 136 -2.817 -0.641 -5.340 978 HA ASP 136 HA ASP 136 -4.218 -1.662 -3.114 979 1HB ASP 136 1HB ASP 136 -4.972 -1.120 -5.592 980 2HB ASP 136 2HB ASP 136 -4.646 -2.835 -5.820 981 H VAL 137 H VAL 137 -4.329 -3.599 -2.178 982 HA VAL 137 HA VAL 137 -2.317 -5.600 -2.919 983 HB VAL 137 HB VAL 137 -3.957 -5.362 -0.384 984 1HG1 VAL 137 1HG1 VAL 137 -1.900 -7.338 -1.291 985 2HG1 VAL 137 2HG1 VAL 137 -3.461 -7.624 -0.523 986 3HG1 VAL 137 3HG1 VAL 137 -2.115 -6.990 0.423 987 1HG2 VAL 137 1HG2 VAL 137 -2.357 -4.094 0.522 988 2HG2 VAL 137 2HG2 VAL 137 -1.824 -3.805 -1.136 989 3HG2 VAL 137 3HG2 VAL 137 -1.064 -5.074 -0.173 990 H ARG 138 H ARG 138 -5.377 -4.937 -3.697 991 HA ARG 138 HA ARG 138 -6.707 -7.406 -3.230 992 1HB ARG 138 1HB ARG 138 -7.292 -5.091 -5.073 993 2HB ARG 138 2HB ARG 138 -8.346 -6.489 -4.921 994 1HG ARG 138 1HG ARG 138 -7.773 -5.489 -2.309 995 2HG ARG 138 2HG ARG 138 -8.294 -4.151 -3.334 996 1HD ARG 138 1HD ARG 138 -9.773 -6.760 -3.013 997 2HD ARG 138 2HD ARG 138 -10.162 -5.269 -2.161 998 HE ARG 138 HE ARG 138 -10.905 -4.326 -4.189 999 1HH1 ARG 138 1HH1 ARG 138 -9.916 -7.661 -4.562 1000 2HH1 ARG 138 2HH1 ARG 138 -10.749 -7.863 -6.065 1001 1HH2 ARG 138 1HH2 ARG 138 -11.994 -4.603 -6.163 1002 2HH2 ARG 138 2HH2 ARG 138 -11.925 -6.132 -6.973 1003 H ASP 139 H ASP 139 -4.191 -6.652 -5.292 1004 HA ASP 139 HA ASP 139 -5.065 -8.463 -7.414 1005 1HB ASP 139 1HB ASP 139 -2.862 -7.767 -8.475 1006 2HB ASP 139 2HB ASP 139 -4.065 -6.496 -8.280 1007 H LEU 140 H LEU 140 -3.777 -8.879 -4.477 1008 HA LEU 140 HA LEU 140 -2.727 -11.453 -5.119 1009 1HB LEU 140 1HB LEU 140 -0.481 -11.140 -4.224 1010 2HB LEU 140 2HB LEU 140 -0.744 -10.154 -5.643 1011 HG LEU 140 HG LEU 140 0.316 -8.597 -4.397 1012 1HD1 LEU 140 1HD1 LEU 140 -2.395 -8.413 -3.116 1013 2HD1 LEU 140 2HD1 LEU 140 -1.910 -7.657 -4.633 1014 3HD1 LEU 140 3HD1 LEU 140 -1.166 -7.150 -3.115 1015 1HD2 LEU 140 1HD2 LEU 140 -0.682 -9.239 -1.719 1016 2HD2 LEU 140 2HD2 LEU 140 0.955 -8.886 -2.273 1017 3HD2 LEU 140 3HD2 LEU 140 0.282 -10.503 -2.483 1018 H LEU 141 H LEU 141 -4.851 -10.955 -3.686 1019 HA LEU 141 HA LEU 141 -4.444 -10.514 -0.924 1020 1HB LEU 141 1HB LEU 141 -6.628 -10.818 -2.641 1021 2HB LEU 141 2HB LEU 141 -6.780 -12.109 -1.464 1022 HG LEU 141 HG LEU 141 -7.981 -10.396 -0.484 1023 1HD1 LEU 141 1HD1 LEU 141 -6.978 -10.286 1.494 1024 2HD1 LEU 141 2HD1 LEU 141 -5.610 -9.381 0.843 1025 3HD1 LEU 141 3HD1 LEU 141 -5.638 -11.139 0.733 1026 1HD2 LEU 141 1HD2 LEU 141 -6.864 -8.032 -0.357 1027 2HD2 LEU 141 2HD2 LEU 141 -7.739 -8.539 -1.801 1028 3HD2 LEU 141 3HD2 LEU 141 -5.978 -8.612 -1.766 1029 H TRP 142 H TRP 142 -3.814 -13.251 -2.859 1030 HA TRP 142 HA TRP 142 -4.436 -15.366 -1.188 1031 1HB TRP 142 1HB TRP 142 -2.538 -16.585 -2.281 1032 2HB TRP 142 2HB TRP 142 -3.674 -15.842 -3.402 1033 HD1 TRP 142 HD1 TRP 142 -2.760 -13.354 -4.430 1034 HE1 TRP 142 HE1 TRP 142 -0.376 -12.775 -5.204 1035 HE3 TRP 142 HE3 TRP 142 -0.193 -17.037 -1.988 1036 HZ2 TRP 142 HZ2 TRP 142 2.243 -13.748 -4.828 1037 HZ3 TRP 142 HZ3 TRP 142 2.251 -17.145 -2.251 1038 HH2 TRP 142 HH2 TRP 142 3.444 -15.534 -3.641 1039 H LEU 143 H LEU 143 -4.124 -14.589 0.922 1040 HA LEU 143 HA LEU 143 -1.515 -15.236 2.005 1041 1HB LEU 143 1HB LEU 143 -2.820 -12.569 2.575 1042 2HB LEU 143 2HB LEU 143 -1.380 -13.187 3.356 1043 HG LEU 143 HG LEU 143 -0.479 -13.236 0.845 1044 1HD1 LEU 143 1HD1 LEU 143 -2.033 -12.402 -0.537 1045 2HD1 LEU 143 2HD1 LEU 143 -1.485 -10.840 0.073 1046 3HD1 LEU 143 3HD1 LEU 143 -2.915 -11.605 0.766 1047 1HD2 LEU 143 1HD2 LEU 143 -0.577 -10.537 2.084 1048 2HD2 LEU 143 2HD2 LEU 143 0.790 -11.428 1.418 1049 3HD2 LEU 143 3HD2 LEU 143 0.150 -11.852 3.006 1050 H GLU 144 H GLU 144 -4.800 -14.077 2.632 1051 HA GLU 144 HA GLU 144 -5.122 -16.108 4.694 1052 1HB GLU 144 1HB GLU 144 -4.477 -13.555 5.454 1053 2HB GLU 144 2HB GLU 144 -6.230 -13.506 5.499 1054 1HG GLU 144 1HG GLU 144 -5.152 -14.081 7.656 1055 2HG GLU 144 2HG GLU 144 -6.314 -15.276 7.084 1056 H ASP 145 H ASP 145 -7.622 -15.075 5.642 1057 HA ASP 145 HA ASP 145 -9.314 -15.967 3.501 1058 1HB ASP 145 1HB ASP 145 -11.151 -15.547 5.175 1059 2HB ASP 145 2HB ASP 145 -9.901 -16.665 5.713 1060 H ASP 146 H ASP 146 -10.978 -14.804 2.491 1061 HA ASP 146 HA ASP 146 -10.381 -11.996 2.107 1062 1HB ASP 146 1HB ASP 146 -12.270 -13.929 0.774 1063 2HB ASP 146 2HB ASP 146 -12.300 -12.206 0.415 1064 H ALA 147 H ALA 147 -11.963 -10.308 2.277 1065 HA ALA 147 HA ALA 147 -13.740 -10.715 4.551 1066 1HB ALA 147 1HB ALA 147 -12.081 -8.736 4.182 1067 2HB ALA 147 2HB ALA 147 -13.661 -8.441 4.906 1068 3HB ALA 147 3HB ALA 147 -13.390 -8.075 3.202 1069 H MET 148 H MET 148 -15.920 -10.628 4.479 1070 HA MET 148 HA MET 148 -17.251 -11.078 2.036 1071 1HB MET 148 1HB MET 148 -18.441 -10.243 4.687 1072 2HB MET 148 2HB MET 148 -19.311 -10.976 3.346 1073 1HG MET 148 1HG MET 148 -18.976 -12.879 4.461 1074 2HG MET 148 2HG MET 148 -17.362 -12.809 3.754 1075 1HE MET 148 1HE MET 148 -18.003 -14.417 6.801 1076 2HE MET 148 2HE MET 148 -19.390 -13.358 6.547 1077 3HE MET 148 3HE MET 148 -18.394 -13.176 7.991 1078 H GLU 149 H GLU 149 -19.475 -9.666 1.831 1079 HA GLU 149 HA GLU 149 -18.545 -6.900 1.424 1080 1HB GLU 149 1HB GLU 149 -19.028 -8.163 -0.653 1081 2HB GLU 149 2HB GLU 149 -20.681 -8.398 -0.103 1082 1HG GLU 149 1HG GLU 149 -20.735 -5.811 0.032 1083 2HG GLU 149 2HG GLU 149 -19.336 -5.903 -1.036 1084 H GLN 150 H GLN 150 -19.923 -5.188 1.920 1085 HA GLN 150 HA GLN 150 -22.322 -5.888 3.479 1086 1HB GLN 150 1HB GLN 150 -19.964 -4.334 4.259 1087 2HB GLN 150 2HB GLN 150 -21.481 -3.499 4.562 1088 1HG GLN 150 1HG GLN 150 -22.017 -5.991 5.522 1089 2HG GLN 150 2HG GLN 150 -20.304 -5.813 5.900 1090 1HE2 GLN 150 1HE2 GLN 150 -23.016 -3.528 5.843 1091 2HE2 GLN 150 2HE2 GLN 150 -22.822 -2.991 7.474 Start of MODEL 3 1 1H GLY 1 1H GLY 1 6.144 -5.513 18.836 2 2H GLY 1 2H GLY 1 5.427 -5.644 17.311 3 3H GLY 1 3H GLY 1 4.545 -5.009 18.608 4 1HA GLY 1 1HA GLY 1 6.758 -3.774 17.094 5 2HA GLY 1 2HA GLY 1 5.149 -3.134 17.397 6 HA PRO 2 HA PRO 2 7.987 -2.856 21.482 7 1HB PRO 2 1HB PRO 2 10.394 -2.078 19.905 8 2HB PRO 2 2HB PRO 2 10.286 -2.979 21.421 9 1HG PRO 2 1HG PRO 2 10.801 -4.237 19.133 10 2HG PRO 2 2HG PRO 2 9.741 -4.967 20.354 11 1HD PRO 2 1HD PRO 2 9.035 -3.644 17.774 12 2HD PRO 2 2HD PRO 2 8.276 -5.034 18.576 13 H TYR 3 H TYR 3 6.512 -1.095 21.544 14 HA TYR 3 HA TYR 3 5.930 1.098 21.668 15 1HB TYR 3 1HB TYR 3 8.750 0.998 22.124 16 2HB TYR 3 2HB TYR 3 8.389 2.448 21.193 17 HD1 TYR 3 HD1 TYR 3 8.363 4.284 22.588 18 HD2 TYR 3 HD2 TYR 3 6.576 0.666 23.936 19 HE1 TYR 3 HE1 TYR 3 7.626 5.420 24.641 20 HE2 TYR 3 HE2 TYR 3 5.833 1.791 25.992 21 HH TYR 3 HH TYR 3 6.854 4.068 27.315 22 H GLY 4 H GLY 4 6.178 3.297 20.438 23 1HA GLY 4 1HA GLY 4 6.073 4.469 18.457 24 2HA GLY 4 2HA GLY 4 6.986 3.172 17.700 25 H HIS 5 H HIS 5 5.739 3.144 15.837 26 HA HIS 5 HA HIS 5 3.194 1.755 16.123 27 1HB HIS 5 1HB HIS 5 3.045 4.418 15.849 28 2HB HIS 5 2HB HIS 5 3.189 3.977 14.150 29 HD1 HIS 5 HD1 HIS 5 1.466 1.409 14.177 30 HD2 HIS 5 HD2 HIS 5 0.382 4.992 15.982 31 HE1 HIS 5 HE1 HIS 5 -1.043 1.347 14.344 32 HE2 HIS 5 HE2 HIS 5 -1.681 3.553 15.377 33 H GLN 6 H GLN 6 3.026 0.155 14.691 34 HA GLN 6 HA GLN 6 5.100 -0.262 12.764 35 1HB GLN 6 1HB GLN 6 3.057 -1.829 14.026 36 2HB GLN 6 2HB GLN 6 2.963 -2.065 12.287 37 1HG GLN 6 1HG GLN 6 5.040 -3.025 12.163 38 2HG GLN 6 2HG GLN 6 5.617 -2.224 13.623 39 1HE2 GLN 6 1HE2 GLN 6 6.323 -4.027 14.664 40 2HE2 GLN 6 2HE2 GLN 6 5.277 -5.283 15.224 41 H SER 7 H SER 7 4.596 1.841 11.660 42 HA SER 7 HA SER 7 2.481 1.477 9.641 43 1HB SER 7 1HB SER 7 3.689 4.044 10.701 44 2HB SER 7 2HB SER 7 2.495 3.948 9.405 45 HG SER 7 HG SER 7 2.040 2.848 11.971 46 H GLY 8 H GLY 8 3.286 0.833 7.760 47 1HA GLY 8 1HA GLY 8 4.986 2.260 6.150 48 2HA GLY 8 2HA GLY 8 6.041 1.188 7.059 49 H ALA 9 H ALA 9 4.703 -1.128 7.208 50 HA ALA 9 HA ALA 9 4.068 -1.839 4.420 51 1HB ALA 9 1HB ALA 9 5.694 -3.540 6.304 52 2HB ALA 9 2HB ALA 9 6.376 -2.523 5.035 53 3HB ALA 9 3HB ALA 9 5.327 -3.877 4.613 54 H VAL 10 H VAL 10 2.887 -3.934 4.243 55 HA VAL 10 HA VAL 10 1.216 -4.443 6.616 56 HB VAL 10 HB VAL 10 -0.066 -3.110 5.012 57 1HG1 VAL 10 1HG1 VAL 10 1.296 -4.185 3.044 58 2HG1 VAL 10 2HG1 VAL 10 -0.353 -3.610 2.794 59 3HG1 VAL 10 3HG1 VAL 10 -0.045 -5.331 3.028 60 1HG2 VAL 10 1HG2 VAL 10 -1.369 -4.596 6.313 61 2HG2 VAL 10 2HG2 VAL 10 -0.894 -5.984 5.335 62 3HG2 VAL 10 3HG2 VAL 10 -1.957 -4.752 4.658 63 H TYR 11 H TYR 11 1.807 -6.416 7.278 64 HA TYR 11 HA TYR 11 2.260 -8.488 5.253 65 1HB TYR 11 1HB TYR 11 3.667 -9.604 6.749 66 2HB TYR 11 2HB TYR 11 4.019 -7.908 7.056 67 HD1 TYR 11 HD1 TYR 11 3.208 -11.004 8.526 68 HD2 TYR 11 HD2 TYR 11 2.651 -6.816 9.014 69 HE1 TYR 11 HE1 TYR 11 2.724 -11.354 10.909 70 HE2 TYR 11 HE2 TYR 11 2.164 -7.153 11.401 71 HH TYR 11 HH TYR 11 2.871 -9.134 13.162 72 H VAL 12 H VAL 12 0.906 -10.137 5.021 73 HA VAL 12 HA VAL 12 -1.185 -10.505 7.065 74 HB VAL 12 HB VAL 12 -1.462 -11.005 4.101 75 1HG1 VAL 12 1HG1 VAL 12 -2.899 -12.160 6.043 76 2HG1 VAL 12 2HG1 VAL 12 -3.575 -11.719 4.474 77 3HG1 VAL 12 3HG1 VAL 12 -3.806 -10.658 5.863 78 1HG2 VAL 12 1HG2 VAL 12 -3.159 -8.953 4.731 79 2HG2 VAL 12 2HG2 VAL 12 -1.589 -8.784 3.943 80 3HG2 VAL 12 3HG2 VAL 12 -1.727 -8.573 5.687 81 H GLY 13 H GLY 13 -1.500 -12.492 7.873 82 1HA GLY 13 1HA GLY 13 -1.046 -14.688 8.381 83 2HA GLY 13 2HA GLY 13 -1.216 -14.937 6.650 84 H ASN 14 H ASN 14 0.401 -16.166 5.970 85 HA ASN 14 HA ASN 14 3.028 -15.948 7.210 86 1HB ASN 14 1HB ASN 14 1.946 -17.878 5.148 87 2HB ASN 14 2HB ASN 14 3.570 -17.947 5.829 88 1HD2 ASN 14 1HD2 ASN 14 3.571 -17.930 8.298 89 2HD2 ASN 14 2HD2 ASN 14 2.434 -18.984 9.058 90 H TYR 15 H TYR 15 1.744 -13.985 5.210 91 HA TYR 15 HA TYR 15 4.091 -13.805 3.440 92 1HB TYR 15 1HB TYR 15 1.177 -13.444 2.749 93 2HB TYR 15 2HB TYR 15 2.452 -12.724 1.778 94 HD1 TYR 15 HD1 TYR 15 0.279 -14.937 1.180 95 HD2 TYR 15 HD2 TYR 15 4.453 -15.014 1.993 96 HE1 TYR 15 HE1 TYR 15 0.477 -17.044 -0.065 97 HE2 TYR 15 HE2 TYR 15 4.660 -17.116 0.750 98 HH TYR 15 HH TYR 15 3.458 -18.344 -1.016 99 H LYS 16 H LYS 16 4.790 -11.687 2.979 100 HA LYS 16 HA LYS 16 3.450 -9.534 4.456 101 1HB LYS 16 1HB LYS 16 5.331 -10.220 5.821 102 2HB LYS 16 2HB LYS 16 6.413 -10.126 4.438 103 1HG LYS 16 1HG LYS 16 6.458 -7.822 4.458 104 2HG LYS 16 2HG LYS 16 4.919 -7.695 5.312 105 1HD LYS 16 1HD LYS 16 5.920 -8.382 7.368 106 2HD LYS 16 2HD LYS 16 7.426 -8.816 6.555 107 1HE LYS 16 1HE LYS 16 7.407 -6.303 5.829 108 2HE LYS 16 2HE LYS 16 6.328 -6.118 7.212 109 1HZ LYS 16 1HZ LYS 16 8.939 -7.481 7.464 110 2HZ LYS 16 2HZ LYS 16 7.981 -6.804 8.682 111 3HZ LYS 16 3HZ LYS 16 8.806 -5.800 7.601 112 H VAL 17 H VAL 17 2.819 -8.045 3.000 113 HA VAL 17 HA VAL 17 4.473 -7.716 0.603 114 HB VAL 17 HB VAL 17 2.648 -7.314 -0.629 115 1HG1 VAL 17 1HG1 VAL 17 0.850 -8.622 -0.080 116 2HG1 VAL 17 2HG1 VAL 17 0.839 -8.100 1.604 117 3HG1 VAL 17 3HG1 VAL 17 2.061 -9.242 1.042 118 1HG2 VAL 17 1HG2 VAL 17 1.418 -5.760 1.645 119 2HG2 VAL 17 2HG2 VAL 17 0.741 -5.913 0.022 120 3HG2 VAL 17 3HG2 VAL 17 2.280 -5.087 0.261 121 H VAL 18 H VAL 18 5.766 -6.060 0.440 122 HA VAL 18 HA VAL 18 5.080 -3.537 1.767 123 HB VAL 18 HB VAL 18 6.659 -4.767 3.226 124 1HG1 VAL 18 1HG1 VAL 18 7.866 -6.003 1.504 125 2HG1 VAL 18 2HG1 VAL 18 8.975 -5.076 2.514 126 3HG1 VAL 18 3HG1 VAL 18 8.559 -4.497 0.901 127 1HG2 VAL 18 1HG2 VAL 18 6.582 -2.263 3.063 128 2HG2 VAL 18 2HG2 VAL 18 7.975 -2.360 1.986 129 3HG2 VAL 18 3HG2 VAL 18 8.107 -2.927 3.651 130 H ASN 19 H ASN 19 6.339 -1.685 0.959 131 HA ASN 19 HA ASN 19 6.354 -1.551 -1.845 132 1HB ASN 19 1HB ASN 19 7.191 0.220 0.382 133 2HB ASN 19 2HB ASN 19 7.918 0.550 -1.187 134 1HD2 ASN 19 1HD2 ASN 19 6.796 2.556 -1.147 135 2HD2 ASN 19 2HD2 ASN 19 5.125 2.633 -1.578 136 H ARG 20 H ARG 20 7.994 -1.659 -3.359 137 HA ARG 20 HA ARG 20 10.092 -3.429 -2.919 138 1HB ARG 20 1HB ARG 20 10.859 -2.892 -5.103 139 2HB ARG 20 2HB ARG 20 9.108 -2.756 -5.142 140 1HG ARG 20 1HG ARG 20 9.291 -0.326 -4.964 141 2HG ARG 20 2HG ARG 20 11.050 -0.465 -4.915 142 1HD ARG 20 1HD ARG 20 9.498 -1.644 -7.185 143 2HD ARG 20 2HD ARG 20 9.878 0.077 -7.163 144 HE ARG 20 HE ARG 20 11.660 -2.051 -7.767 145 1HH1 ARG 20 1HH1 ARG 20 11.513 1.090 -6.252 146 2HH1 ARG 20 2HH1 ARG 20 13.181 1.449 -6.549 147 1HH2 ARG 20 1HH2 ARG 20 13.854 -1.580 -8.157 148 2HH2 ARG 20 2HH2 ARG 20 14.510 -0.065 -7.630 149 H HIS 21 H HIS 21 10.176 0.127 -3.019 150 HA HIS 21 HA HIS 21 12.967 0.296 -2.519 151 1HB HIS 21 1HB HIS 21 11.233 2.071 -3.444 152 2HB HIS 21 2HB HIS 21 11.137 2.523 -1.745 153 HD1 HIS 21 HD1 HIS 21 13.446 2.557 -4.682 154 HD2 HIS 21 HD2 HIS 21 13.423 3.766 -0.707 155 HE1 HIS 21 HE1 HIS 21 15.463 4.034 -4.417 156 HE2 HIS 21 HE2 HIS 21 15.484 4.671 -1.980 157 H LEU 22 H LEU 22 10.483 -0.683 -0.509 158 HA LEU 22 HA LEU 22 11.940 0.213 1.884 159 1HB LEU 22 1HB LEU 22 9.343 0.697 1.301 160 2HB LEU 22 2HB LEU 22 9.192 -0.802 2.200 161 HG LEU 22 HG LEU 22 10.709 0.438 3.950 162 1HD1 LEU 22 1HD1 LEU 22 11.278 2.443 2.998 163 2HD1 LEU 22 2HD1 LEU 22 9.838 2.907 3.905 164 3HD1 LEU 22 3HD1 LEU 22 9.730 2.615 2.169 165 1HD2 LEU 22 1HD2 LEU 22 7.972 1.547 3.943 166 2HD2 LEU 22 2HD2 LEU 22 8.837 0.660 5.198 167 3HD2 LEU 22 3HD2 LEU 22 8.108 -0.209 3.847 168 H ALA 23 H ALA 23 11.551 -2.498 -0.009 169 HA ALA 23 HA ALA 23 11.317 -4.374 2.200 170 1HB ALA 23 1HB ALA 23 10.253 -5.330 0.442 171 2HB ALA 23 2HB ALA 23 11.865 -5.979 0.151 172 3HB ALA 23 3HB ALA 23 11.304 -4.572 -0.753 173 H THR 24 H THR 24 12.946 -5.226 3.273 174 HA THR 24 HA THR 24 15.643 -4.460 2.696 175 HB THR 24 HB THR 24 15.269 -4.617 4.980 176 HG1 THR 24 HG1 THR 24 17.123 -5.724 4.753 177 1HG2 THR 24 1HG2 THR 24 13.603 -6.986 4.342 178 2HG2 THR 24 2HG2 THR 24 13.267 -5.612 5.394 179 3HG2 THR 24 3HG2 THR 24 14.362 -6.886 5.932 180 H HIS 25 H HIS 25 17.431 -6.089 2.608 181 HA HIS 25 HA HIS 25 17.233 -7.675 0.353 182 1HB HIS 25 1HB HIS 25 19.331 -6.855 1.599 183 2HB HIS 25 2HB HIS 25 19.159 -8.308 2.579 184 HD1 HIS 25 HD1 HIS 25 21.679 -8.173 1.045 185 HD2 HIS 25 HD2 HIS 25 18.188 -9.685 -0.627 186 HE1 HIS 25 HE1 HIS 25 22.425 -9.642 -0.855 187 HE2 HIS 25 HE2 HIS 25 20.300 -10.620 -1.791 188 H VAL 26 H VAL 26 16.476 -8.465 3.665 189 HA VAL 26 HA VAL 26 16.407 -11.293 3.296 190 HB VAL 26 HB VAL 26 16.670 -10.280 5.527 191 1HG1 VAL 26 1HG1 VAL 26 15.316 -8.705 6.313 192 2HG1 VAL 26 2HG1 VAL 26 13.901 -9.733 6.079 193 3HG1 VAL 26 3HG1 VAL 26 14.481 -8.716 4.760 194 1HG2 VAL 26 1HG2 VAL 26 15.541 -12.578 4.990 195 2HG2 VAL 26 2HG2 VAL 26 14.105 -11.796 5.650 196 3HG2 VAL 26 3HG2 VAL 26 15.556 -11.954 6.641 197 H ASP 27 H ASP 27 14.103 -8.692 2.848 198 HA ASP 27 HA ASP 27 11.774 -10.297 2.723 199 1HB ASP 27 1HB ASP 27 12.486 -7.503 1.911 200 2HB ASP 27 2HB ASP 27 10.993 -8.210 1.298 201 H TRP 28 H TRP 28 14.032 -9.028 0.317 202 HA TRP 28 HA TRP 28 12.646 -10.207 -1.862 203 1HB TRP 28 1HB TRP 28 15.481 -9.171 -1.775 204 2HB TRP 28 2HB TRP 28 14.558 -9.533 -3.231 205 HD1 TRP 28 HD1 TRP 28 14.385 -7.133 -0.214 206 HE1 TRP 28 HE1 TRP 28 13.310 -4.938 -0.981 207 HE3 TRP 28 HE3 TRP 28 13.242 -8.442 -5.012 208 HZ2 TRP 28 HZ2 TRP 28 12.105 -3.898 -3.289 209 HZ3 TRP 28 HZ3 TRP 28 12.118 -6.784 -6.442 210 HH2 TRP 28 HH2 TRP 28 11.564 -4.560 -5.602 211 H GLN 29 H GLN 29 15.259 -11.151 0.235 212 HA GLN 29 HA GLN 29 16.341 -13.282 -1.192 213 1HB GLN 29 1HB GLN 29 17.377 -12.425 0.832 214 2HB GLN 29 2HB GLN 29 15.997 -12.937 1.792 215 1HG GLN 29 1HG GLN 29 17.719 -14.508 2.158 216 2HG GLN 29 2HG GLN 29 16.522 -15.291 1.127 217 1HE2 GLN 29 1HE2 GLN 29 19.052 -16.289 1.302 218 2HE2 GLN 29 2HE2 GLN 29 19.891 -16.036 -0.187 219 H ASN 30 H ASN 30 13.582 -13.196 1.024 220 HA ASN 30 HA ASN 30 12.872 -15.919 0.155 221 1HB ASN 30 1HB ASN 30 12.822 -14.592 2.757 222 2HB ASN 30 2HB ASN 30 11.282 -15.345 2.355 223 1HD2 ASN 30 1HD2 ASN 30 11.143 -17.557 2.196 224 2HD2 ASN 30 2HD2 ASN 30 12.401 -18.614 2.726 225 H CYS 31 H CYS 31 12.334 -13.440 -1.287 226 HA CYS 31 HA CYS 31 9.561 -12.803 -0.928 227 1HB CYS 31 1HB CYS 31 10.926 -11.051 -1.762 228 2HB CYS 31 2HB CYS 31 11.608 -12.074 -3.020 229 HG CYS 31 HG CYS 31 9.893 -11.142 -4.484 230 H VAL 32 H VAL 32 7.840 -13.662 -1.884 231 HA VAL 32 HA VAL 32 8.236 -15.938 -3.663 232 HB VAL 32 HB VAL 32 5.761 -16.280 -3.328 233 1HG1 VAL 32 1HG1 VAL 32 7.850 -17.067 -1.799 234 2HG1 VAL 32 2HG1 VAL 32 6.185 -17.596 -1.555 235 3HG1 VAL 32 3HG1 VAL 32 6.838 -16.268 -0.594 236 1HG2 VAL 32 1HG2 VAL 32 5.271 -13.919 -2.715 237 2HG2 VAL 32 2HG2 VAL 32 6.089 -14.198 -1.178 238 3HG2 VAL 32 3HG2 VAL 32 4.626 -15.098 -1.574 239 H TRP 33 H TRP 33 6.612 -12.786 -3.562 240 HA TRP 33 HA TRP 33 6.458 -12.879 -6.490 241 1HB TRP 33 1HB TRP 33 4.258 -13.433 -6.168 242 2HB TRP 33 2HB TRP 33 4.180 -12.652 -4.595 243 HD1 TRP 33 HD1 TRP 33 3.275 -12.123 -8.185 244 HE1 TRP 33 HE1 TRP 33 2.270 -9.772 -8.489 245 HE3 TRP 33 HE3 TRP 33 4.472 -10.146 -3.644 246 HZ2 TRP 33 HZ2 TRP 33 2.027 -7.380 -6.980 247 HZ3 TRP 33 HZ3 TRP 33 3.831 -7.826 -3.148 248 HH2 TRP 33 HH2 TRP 33 2.635 -6.477 -4.791 249 H GLU 34 H GLU 34 6.326 -10.839 -7.532 250 HA GLU 34 HA GLU 34 6.500 -8.403 -6.011 251 1HB GLU 34 1HB GLU 34 8.801 -9.150 -5.785 252 2HB GLU 34 2HB GLU 34 8.919 -9.410 -7.520 253 1HG GLU 34 1HG GLU 34 8.132 -6.696 -6.783 254 2HG GLU 34 2HG GLU 34 9.723 -7.169 -6.189 255 H ASP 35 H ASP 35 5.378 -6.965 -7.152 256 HA ASP 35 HA ASP 35 5.239 -7.286 -10.073 257 1HB ASP 35 1HB ASP 35 3.303 -6.384 -8.013 258 2HB ASP 35 2HB ASP 35 3.228 -5.579 -9.576 259 H TYR 36 H TYR 36 6.416 -5.929 -11.224 260 HA TYR 36 HA TYR 36 7.660 -3.622 -10.158 261 1HB TYR 36 1HB TYR 36 8.178 -3.154 -12.615 262 2HB TYR 36 2HB TYR 36 8.771 -4.677 -11.960 263 HD1 TYR 36 HD1 TYR 36 8.156 -6.725 -12.936 264 HD2 TYR 36 HD2 TYR 36 6.044 -3.185 -13.991 265 HE1 TYR 36 HE1 TYR 36 7.012 -7.951 -14.735 266 HE2 TYR 36 HE2 TYR 36 4.894 -4.401 -15.793 267 HH TYR 36 HH TYR 36 4.818 -7.714 -16.019 268 H ASN 37 H ASN 37 4.650 -4.155 -11.842 269 HA ASN 37 HA ASN 37 4.151 -1.486 -12.618 270 1HB ASN 37 1HB ASN 37 1.775 -2.243 -12.799 271 2HB ASN 37 2HB ASN 37 2.916 -3.277 -13.652 272 1HD2 ASN 37 1HD2 ASN 37 1.892 -5.180 -13.597 273 2HD2 ASN 37 2HD2 ASN 37 1.436 -6.012 -12.153 274 H ARG 38 H ARG 38 3.829 -3.164 -9.594 275 HA ARG 38 HA ARG 38 2.523 -0.777 -8.463 276 1HB ARG 38 1HB ARG 38 2.067 -3.660 -8.026 277 2HB ARG 38 2HB ARG 38 2.063 -2.664 -6.577 278 1HG ARG 38 1HG ARG 38 0.381 -1.191 -7.690 279 2HG ARG 38 2HG ARG 38 0.298 -2.376 -8.995 280 1HD ARG 38 1HD ARG 38 -0.353 -2.839 -6.090 281 2HD ARG 38 2HD ARG 38 -1.501 -2.755 -7.425 282 HE ARG 38 HE ARG 38 -0.263 -4.783 -8.297 283 1HH1 ARG 38 1HH1 ARG 38 -0.542 -4.080 -4.882 284 2HH1 ARG 38 2HH1 ARG 38 -0.369 -5.733 -4.408 285 1HH2 ARG 38 1HH2 ARG 38 -0.044 -6.951 -7.664 286 2HH2 ARG 38 2HH2 ARG 38 -0.087 -7.362 -5.982 287 H ASP 39 H ASP 39 5.440 -2.269 -8.676 288 HA ASP 39 HA ASP 39 7.358 -2.279 -7.443 289 1HB ASP 39 1HB ASP 39 6.012 0.268 -6.563 290 2HB ASP 39 2HB ASP 39 7.596 -0.192 -5.946 291 H LEU 40 H LEU 40 5.290 -3.898 -6.423 292 HA LEU 40 HA LEU 40 5.862 -3.777 -3.536 293 1HB LEU 40 1HB LEU 40 3.548 -3.161 -3.951 294 2HB LEU 40 2HB LEU 40 3.305 -4.610 -4.906 295 HG LEU 40 HG LEU 40 3.884 -5.893 -2.745 296 1HD1 LEU 40 1HD1 LEU 40 2.833 -3.580 -1.249 297 2HD1 LEU 40 2HD1 LEU 40 4.517 -3.476 -1.763 298 3HD1 LEU 40 3HD1 LEU 40 3.982 -4.825 -0.761 299 1HD2 LEU 40 1HD2 LEU 40 1.331 -4.447 -2.368 300 2HD2 LEU 40 2HD2 LEU 40 1.661 -6.179 -2.409 301 3HD2 LEU 40 3HD2 LEU 40 1.563 -5.265 -3.916 302 H LEU 41 H LEU 41 6.038 -5.798 -2.450 303 HA LEU 41 HA LEU 41 6.128 -8.190 -4.101 304 1HB LEU 41 1HB LEU 41 8.340 -8.854 -3.397 305 2HB LEU 41 2HB LEU 41 8.390 -7.348 -4.274 306 HG LEU 41 HG LEU 41 9.663 -7.928 -1.875 307 1HD1 LEU 41 1HD1 LEU 41 9.115 -5.123 -2.744 308 2HD1 LEU 41 2HD1 LEU 41 10.063 -6.213 -3.756 309 3HD1 LEU 41 3HD1 LEU 41 10.603 -5.835 -2.120 310 1HD2 LEU 41 1HD2 LEU 41 8.722 -6.112 -0.380 311 2HD2 LEU 41 2HD2 LEU 41 7.833 -7.631 -0.445 312 3HD2 LEU 41 3HD2 LEU 41 7.250 -6.228 -1.335 313 H VAL 42 H VAL 42 6.214 -10.186 -2.904 314 HA VAL 42 HA VAL 42 5.297 -9.854 -0.130 315 HB VAL 42 HB VAL 42 4.280 -11.749 -2.248 316 1HG1 VAL 42 1HG1 VAL 42 3.021 -12.943 -0.509 317 2HG1 VAL 42 2HG1 VAL 42 3.854 -12.006 0.731 318 3HG1 VAL 42 3HG1 VAL 42 4.758 -13.124 -0.282 319 1HG2 VAL 42 1HG2 VAL 42 2.146 -10.839 -0.797 320 2HG2 VAL 42 2HG2 VAL 42 2.724 -10.145 -2.315 321 3HG2 VAL 42 3HG2 VAL 42 3.238 -9.449 -0.779 322 H SER 43 H SER 43 6.340 -10.914 1.368 323 HA SER 43 HA SER 43 8.188 -13.069 0.593 324 1HB SER 43 1HB SER 43 9.812 -12.289 2.098 325 2HB SER 43 2HB SER 43 9.189 -10.800 1.390 326 HG SER 43 HG SER 43 8.981 -11.758 3.968 327 H THR 44 H THR 44 8.510 -14.712 2.281 328 HA THR 44 HA THR 44 6.024 -15.092 3.766 329 HB THR 44 HB THR 44 6.487 -17.405 3.781 330 HG1 THR 44 HG1 THR 44 9.136 -16.684 3.079 331 1HG2 THR 44 1HG2 THR 44 7.778 -16.918 1.185 332 2HG2 THR 44 2HG2 THR 44 6.211 -16.147 1.453 333 3HG2 THR 44 3HG2 THR 44 6.372 -17.900 1.599 334 H THR 45 H THR 45 5.891 -14.790 5.844 335 HA THR 45 HA THR 45 8.360 -14.803 7.453 336 HB THR 45 HB THR 45 7.635 -12.582 7.503 337 HG1 THR 45 HG1 THR 45 7.843 -13.454 9.625 338 1HG2 THR 45 1HG2 THR 45 5.126 -12.164 8.203 339 2HG2 THR 45 2HG2 THR 45 4.895 -13.703 7.373 340 3HG2 THR 45 3HG2 THR 45 5.607 -12.337 6.514 341 H THR 46 H THR 46 8.380 -15.918 9.359 342 HA THR 46 HA THR 46 6.143 -17.748 9.789 343 HB THR 46 HB THR 46 7.880 -18.717 11.493 344 HG1 THR 46 HG1 THR 46 9.597 -17.511 11.537 345 1HG2 THR 46 1HG2 THR 46 7.439 -19.185 8.736 346 2HG2 THR 46 2HG2 THR 46 8.022 -20.304 9.969 347 3HG2 THR 46 3HG2 THR 46 9.168 -19.326 9.053 348 H ALA 47 H ALA 47 5.492 -15.200 10.504 349 HA ALA 47 HA ALA 47 5.545 -15.305 13.451 350 1HB ALA 47 1HB ALA 47 6.827 -13.403 12.511 351 2HB ALA 47 2HB ALA 47 5.469 -12.901 13.518 352 3HB ALA 47 3HB ALA 47 5.343 -12.816 11.762 353 H HIS 48 H HIS 48 3.654 -13.816 14.309 354 HA HIS 48 HA HIS 48 1.223 -14.981 13.229 355 1HB HIS 48 1HB HIS 48 1.875 -13.452 15.738 356 2HB HIS 48 2HB HIS 48 0.209 -13.766 15.265 357 HD1 HIS 48 HD1 HIS 48 3.385 -15.782 15.857 358 HD2 HIS 48 HD2 HIS 48 -0.739 -16.098 16.251 359 HE1 HIS 48 HE1 HIS 48 2.983 -18.011 16.951 360 HE2 HIS 48 HE2 HIS 48 0.476 -18.217 17.100 361 H GLY 49 H GLY 49 -0.041 -13.964 11.825 362 1HA GLY 49 1HA GLY 49 0.461 -11.340 10.916 363 2HA GLY 49 2HA GLY 49 -0.961 -12.299 10.538 364 H CYS 50 H CYS 50 -1.470 -9.741 10.735 365 HA CYS 50 HA CYS 50 -3.090 -9.561 13.125 366 1HB CYS 50 1HB CYS 50 -0.674 -7.886 12.690 367 2HB CYS 50 2HB CYS 50 -2.109 -7.075 13.308 368 HG CYS 50 HG CYS 50 -0.656 -7.919 15.308 369 H ASP 51 H ASP 51 -1.909 -7.864 10.239 370 HA ASP 51 HA ASP 51 -4.240 -6.234 9.989 371 1HB ASP 51 1HB ASP 51 -2.007 -6.871 8.054 372 2HB ASP 51 2HB ASP 51 -3.297 -5.720 7.713 373 H THR 52 H THR 52 -5.971 -6.434 8.611 374 HA THR 52 HA THR 52 -6.293 -9.054 7.297 375 HB THR 52 HB THR 52 -8.452 -7.372 8.591 376 HG1 THR 52 HG1 THR 52 -7.026 -8.451 10.069 377 1HG2 THR 52 1HG2 THR 52 -8.542 -9.778 6.906 378 2HG2 THR 52 2HG2 THR 52 -9.763 -8.539 7.196 379 3HG2 THR 52 3HG2 THR 52 -9.516 -9.827 8.376 380 H ILE 53 H ILE 53 -6.422 -8.890 5.155 381 HA ILE 53 HA ILE 53 -6.706 -6.356 3.873 382 HB ILE 53 HB ILE 53 -6.977 -8.977 2.432 383 1HG1 ILE 53 1HG1 ILE 53 -4.963 -8.886 4.062 384 2HG1 ILE 53 2HG1 ILE 53 -4.666 -9.343 2.393 385 1HG2 ILE 53 1HG2 ILE 53 -6.124 -6.201 1.728 386 2HG2 ILE 53 2HG2 ILE 53 -7.356 -7.213 0.974 387 3HG2 ILE 53 3HG2 ILE 53 -5.646 -7.574 0.734 388 1HD1 ILE 53 1HD1 ILE 53 -3.945 -6.828 3.822 389 2HD1 ILE 53 2HD1 ILE 53 -4.137 -6.822 2.069 390 3HD1 ILE 53 3HD1 ILE 53 -2.947 -7.882 2.819 391 H ALA 54 H ALA 54 -8.384 -5.483 2.803 392 HA ALA 54 HA ALA 54 -11.012 -6.324 3.534 393 1HB ALA 54 1HB ALA 54 -11.537 -4.206 3.092 394 2HB ALA 54 2HB ALA 54 -10.913 -4.318 1.448 395 3HB ALA 54 3HB ALA 54 -9.824 -3.940 2.780 396 H ARG 55 H ARG 55 -9.246 -6.115 0.452 397 HA ARG 55 HA ARG 55 -9.503 -7.230 -1.517 398 1HB ARG 55 1HB ARG 55 -9.856 -9.183 0.160 399 2HB ARG 55 2HB ARG 55 -11.556 -9.024 -0.259 400 1HG ARG 55 1HG ARG 55 -9.738 -9.161 -2.556 401 2HG ARG 55 2HG ARG 55 -9.782 -10.611 -1.552 402 1HD ARG 55 1HD ARG 55 -11.815 -11.173 -2.278 403 2HD ARG 55 2HD ARG 55 -12.431 -9.535 -2.064 404 HE ARG 55 HE ARG 55 -12.229 -9.268 -4.311 405 1HH1 ARG 55 1HH1 ARG 55 -9.931 -11.697 -3.311 406 2HH1 ARG 55 2HH1 ARG 55 -9.380 -12.017 -4.920 407 1HH2 ARG 55 1HH2 ARG 55 -11.505 -9.689 -6.429 408 2HH2 ARG 55 2HH2 ARG 55 -10.272 -10.877 -6.691 409 H CYS 56 H CYS 56 -11.528 -5.183 -0.307 410 HA CYS 56 HA CYS 56 -13.775 -5.675 -2.122 411 1HB CYS 56 1HB CYS 56 -14.874 -3.812 -0.890 412 2HB CYS 56 2HB CYS 56 -14.416 -5.154 0.154 413 H GLN 57 H GLN 57 -14.659 -3.689 -3.236 414 HA GLN 57 HA GLN 57 -12.445 -2.004 -4.209 415 1HB GLN 57 1HB GLN 57 -13.359 -3.794 -5.802 416 2HB GLN 57 2HB GLN 57 -14.812 -2.809 -5.888 417 1HG GLN 57 1HG GLN 57 -12.627 -1.086 -6.328 418 2HG GLN 57 2HG GLN 57 -12.356 -2.527 -7.306 419 1HE2 GLN 57 1HE2 GLN 57 -14.296 0.278 -6.812 420 2HE2 GLN 57 2HE2 GLN 57 -15.249 0.138 -8.246 421 H CYS 58 H CYS 58 -14.094 -1.280 -2.045 422 HA CYS 58 HA CYS 58 -16.299 0.309 -2.771 423 1HB CYS 58 1HB CYS 58 -14.458 0.680 -0.398 424 2HB CYS 58 2HB CYS 58 -16.090 1.319 -0.560 425 H THR 59 H THR 59 -16.464 2.639 -2.775 426 HA THR 59 HA THR 59 -14.178 3.857 -4.118 427 HB THR 59 HB THR 59 -16.719 5.352 -3.739 428 HG1 THR 59 HG1 THR 59 -17.858 4.111 -5.070 429 1HG2 THR 59 1HG2 THR 59 -14.530 5.761 -5.293 430 2HG2 THR 59 2HG2 THR 59 -16.129 6.443 -5.590 431 3HG2 THR 59 3HG2 THR 59 -15.631 4.969 -6.421 432 H THR 60 H THR 60 -15.754 3.872 -1.070 433 HA THR 60 HA THR 60 -14.263 6.292 -0.294 434 HB THR 60 HB THR 60 -15.926 6.810 1.301 435 HG1 THR 60 HG1 THR 60 -16.842 4.173 0.873 436 1HG2 THR 60 1HG2 THR 60 -17.205 5.828 -1.223 437 2HG2 THR 60 2HG2 THR 60 -16.816 7.482 -0.754 438 3HG2 THR 60 3HG2 THR 60 -18.125 6.621 0.056 439 H GLY 61 H GLY 61 -12.637 6.007 1.063 440 1HA GLY 61 1HA GLY 61 -12.746 3.802 3.002 441 2HA GLY 61 2HA GLY 61 -11.352 3.921 1.937 442 H VAL 62 H VAL 62 -10.178 4.074 4.027 443 HA VAL 62 HA VAL 62 -9.960 6.891 4.788 444 HB VAL 62 HB VAL 62 -11.344 6.019 6.530 445 1HG1 VAL 62 1HG1 VAL 62 -10.747 4.082 7.873 446 2HG1 VAL 62 2HG1 VAL 62 -9.290 3.843 6.907 447 3HG1 VAL 62 3HG1 VAL 62 -10.879 3.639 6.170 448 1HG2 VAL 62 1HG2 VAL 62 -10.204 7.115 8.089 449 2HG2 VAL 62 2HG2 VAL 62 -8.828 7.136 6.986 450 3HG2 VAL 62 3HG2 VAL 62 -8.986 5.843 8.175 451 H TYR 63 H TYR 63 -7.947 7.592 4.917 452 HA TYR 63 HA TYR 63 -5.769 5.614 4.912 453 1HB TYR 63 1HB TYR 63 -4.417 7.228 3.729 454 2HB TYR 63 2HB TYR 63 -5.952 7.069 2.886 455 HD1 TYR 63 HD1 TYR 63 -4.052 9.237 5.218 456 HD2 TYR 63 HD2 TYR 63 -7.334 8.955 2.525 457 HE1 TYR 63 HE1 TYR 63 -4.350 11.675 5.334 458 HE2 TYR 63 HE2 TYR 63 -7.643 11.391 2.637 459 HH TYR 63 HH TYR 63 -5.593 13.471 3.434 460 H PHE 64 H PHE 64 -4.464 5.558 6.641 461 HA PHE 64 HA PHE 64 -4.573 7.841 8.503 462 1HB PHE 64 1HB PHE 64 -4.121 6.246 10.310 463 2HB PHE 64 2HB PHE 64 -5.580 5.807 9.428 464 HD1 PHE 64 HD1 PHE 64 -5.619 3.845 7.988 465 HD2 PHE 64 HD2 PHE 64 -2.156 4.870 10.239 466 HE1 PHE 64 HE1 PHE 64 -4.713 1.590 7.612 467 HE2 PHE 64 HE2 PHE 64 -1.242 2.616 9.866 468 HZ PHE 64 HZ PHE 64 -2.521 0.973 8.551 469 H CYS 65 H CYS 65 -2.692 8.488 9.569 470 HA CYS 65 HA CYS 65 -0.485 8.996 9.753 471 1HB CYS 65 1HB CYS 65 -0.346 6.095 8.987 472 2HB CYS 65 2HB CYS 65 1.121 7.039 9.221 473 HG CYS 65 HG CYS 65 -0.445 7.398 11.676 474 H ALA 66 H ALA 66 -1.942 9.297 7.113 475 HA ALA 66 HA ALA 66 0.260 9.106 5.208 476 1HB ALA 66 1HB ALA 66 -1.289 9.364 3.515 477 2HB ALA 66 2HB ALA 66 -2.408 10.269 4.533 478 3HB ALA 66 3HB ALA 66 -2.234 8.528 4.748 479 H SER 67 H SER 67 -1.841 11.567 6.655 480 HA SER 67 HA SER 67 0.096 13.614 5.793 481 1HB SER 67 1HB SER 67 -2.516 13.549 5.066 482 2HB SER 67 2HB SER 67 -2.625 14.497 6.550 483 HG SER 67 HG SER 67 -2.037 16.082 5.302 484 H LYS 68 H LYS 68 -2.037 12.510 8.369 485 HA LYS 68 HA LYS 68 -0.446 14.090 10.276 486 1HB LYS 68 1HB LYS 68 -3.296 14.109 9.812 487 2HB LYS 68 2HB LYS 68 -2.949 13.597 11.457 488 1HG LYS 68 1HG LYS 68 -1.323 15.858 10.788 489 2HG LYS 68 2HG LYS 68 -3.016 16.209 10.440 490 1HD LYS 68 1HD LYS 68 -3.644 16.040 12.632 491 2HD LYS 68 2HD LYS 68 -2.369 14.884 13.022 492 1HE LYS 68 1HE LYS 68 -0.741 16.809 12.685 493 2HE LYS 68 2HE LYS 68 -2.152 17.865 12.700 494 1HZ LYS 68 1HZ LYS 68 -1.955 15.974 14.897 495 2HZ LYS 68 2HZ LYS 68 -2.441 17.594 14.902 496 3HZ LYS 68 3HZ LYS 68 -0.795 17.206 14.883 497 H SER 69 H SER 69 -1.414 13.079 12.627 498 HA SER 69 HA SER 69 -0.430 10.321 12.520 499 1HB SER 69 1HB SER 69 -0.554 10.766 15.146 500 2HB SER 69 2HB SER 69 0.803 11.335 14.176 501 HG SER 69 HG SER 69 -0.404 12.863 15.672 502 H LYS 70 H LYS 70 -3.079 10.962 11.636 503 HA LYS 70 HA LYS 70 -4.591 9.205 13.408 504 1HB LYS 70 1HB LYS 70 -5.785 11.778 12.376 505 2HB LYS 70 2HB LYS 70 -6.515 10.632 13.490 506 1HG LYS 70 1HG LYS 70 -5.821 12.024 15.083 507 2HG LYS 70 2HG LYS 70 -4.225 11.323 14.807 508 1HD LYS 70 1HD LYS 70 -3.743 13.557 14.604 509 2HD LYS 70 2HD LYS 70 -4.102 13.150 12.926 510 1HE LYS 70 1HE LYS 70 -5.818 14.597 14.917 511 2HE LYS 70 2HE LYS 70 -5.283 15.133 13.324 512 1HZ LYS 70 1HZ LYS 70 -7.202 12.920 13.823 513 2HZ LYS 70 2HZ LYS 70 -6.722 13.502 12.309 514 3HZ LYS 70 3HZ LYS 70 -7.624 14.487 13.346 515 H HIS 71 H HIS 71 -6.759 8.646 12.333 516 HA HIS 71 HA HIS 71 -6.176 7.810 9.622 517 1HB HIS 71 1HB HIS 71 -8.635 7.316 11.319 518 2HB HIS 71 2HB HIS 71 -8.243 6.510 9.806 519 HD1 HIS 71 HD1 HIS 71 -8.440 4.297 11.321 520 HD2 HIS 71 HD2 HIS 71 -5.207 6.785 12.111 521 HE1 HIS 71 HE1 HIS 71 -6.824 2.899 12.649 522 HE2 HIS 71 HE2 HIS 71 -4.838 4.399 13.040 523 H TYR 72 H TYR 72 -7.178 8.540 7.784 524 HA TYR 72 HA TYR 72 -9.078 10.772 8.112 525 1HB TYR 72 1HB TYR 72 -6.552 10.575 6.604 526 2HB TYR 72 2HB TYR 72 -7.885 11.310 5.725 527 HD1 TYR 72 HD1 TYR 72 -5.957 11.561 8.901 528 HD2 TYR 72 HD2 TYR 72 -8.424 13.553 6.062 529 HE1 TYR 72 HE1 TYR 72 -5.497 13.706 10.017 530 HE2 TYR 72 HE2 TYR 72 -7.976 15.701 7.169 531 HH TYR 72 HH TYR 72 -6.363 16.724 8.623 532 HA PRO 73 HA PRO 73 -11.443 8.005 5.420 533 1HB PRO 73 1HB PRO 73 -13.659 9.847 5.811 534 2HB PRO 73 2HB PRO 73 -13.495 8.181 6.369 535 1HG PRO 73 1HG PRO 73 -13.490 10.315 8.054 536 2HG PRO 73 2HG PRO 73 -12.625 8.804 8.394 537 1HD PRO 73 1HD PRO 73 -11.561 11.402 7.341 538 2HD PRO 73 2HD PRO 73 -10.863 10.305 8.554 539 H VAL 74 H VAL 74 -11.163 8.192 3.275 540 HA VAL 74 HA VAL 74 -11.950 10.697 1.971 541 HB VAL 74 HB VAL 74 -9.399 10.485 2.400 542 1HG1 VAL 74 1HG1 VAL 74 -9.639 8.714 -0.028 543 2HG1 VAL 74 2HG1 VAL 74 -9.208 8.165 1.591 544 3HG1 VAL 74 3HG1 VAL 74 -8.147 9.275 0.726 545 1HG2 VAL 74 1HG2 VAL 74 -10.477 12.178 0.976 546 2HG2 VAL 74 2HG2 VAL 74 -10.389 11.061 -0.386 547 3HG2 VAL 74 3HG2 VAL 74 -8.907 11.667 0.354 548 H SER 75 H SER 75 -12.292 10.506 -0.331 549 HA SER 75 HA SER 75 -13.205 7.817 -1.080 550 1HB SER 75 1HB SER 75 -13.911 10.487 -2.330 551 2HB SER 75 2HB SER 75 -14.634 8.928 -2.721 552 HG SER 75 HG SER 75 -15.757 10.398 -1.158 553 H PHE 76 H PHE 76 -12.055 6.711 -2.542 554 HA PHE 76 HA PHE 76 -10.301 8.238 -4.348 555 1HB PHE 76 1HB PHE 76 -9.143 5.683 -4.024 556 2HB PHE 76 2HB PHE 76 -8.506 7.230 -3.493 557 HD1 PHE 76 HD1 PHE 76 -7.722 7.184 -1.366 558 HD2 PHE 76 HD2 PHE 76 -11.201 4.927 -2.304 559 HE1 PHE 76 HE1 PHE 76 -7.872 6.463 0.975 560 HE2 PHE 76 HE2 PHE 76 -11.361 4.196 0.037 561 HZ PHE 76 HZ PHE 76 -9.698 4.966 1.685 562 H GLU 77 H GLU 77 -9.651 7.097 -6.286 563 HA GLU 77 HA GLU 77 -11.801 5.362 -7.299 564 1HB GLU 77 1HB GLU 77 -10.394 7.683 -8.435 565 2HB GLU 77 2HB GLU 77 -10.518 6.315 -9.532 566 1HG GLU 77 1HG GLU 77 -12.952 6.286 -9.188 567 2HG GLU 77 2HG GLU 77 -12.802 7.699 -8.145 568 H GLY 78 H GLY 78 -11.117 3.723 -8.886 569 1HA GLY 78 1HA GLY 78 -8.460 2.686 -8.158 570 2HA GLY 78 2HA GLY 78 -9.807 1.715 -8.726 571 HA PRO 79 HA PRO 79 -8.100 3.910 -12.683 572 1HB PRO 79 1HB PRO 79 -5.719 5.209 -12.438 573 2HB PRO 79 2HB PRO 79 -7.284 6.012 -12.259 574 1HG PRO 79 1HG PRO 79 -5.415 5.010 -10.148 575 2HG PRO 79 2HG PRO 79 -6.330 6.528 -10.206 576 1HD PRO 79 1HD PRO 79 -7.145 4.416 -8.736 577 2HD PRO 79 2HD PRO 79 -8.288 5.526 -9.515 578 H GLY 80 H GLY 80 -7.132 2.574 -14.061 579 1HA GLY 80 1HA GLY 80 -5.670 0.344 -13.203 580 2HA GLY 80 2HA GLY 80 -5.828 0.875 -14.870 581 H LEU 81 H LEU 81 -4.262 2.323 -15.735 582 HA LEU 81 HA LEU 81 -1.674 2.020 -14.429 583 1HB LEU 81 1HB LEU 81 -2.352 1.614 -16.975 584 2HB LEU 81 2HB LEU 81 -1.874 3.300 -17.081 585 HG LEU 81 HG LEU 81 0.095 2.214 -17.572 586 1HD1 LEU 81 1HD1 LEU 81 1.584 2.381 -15.639 587 2HD1 LEU 81 2HD1 LEU 81 0.179 2.530 -14.589 588 3HD1 LEU 81 3HD1 LEU 81 0.519 3.777 -15.786 589 1HD2 LEU 81 1HD2 LEU 81 -0.983 0.097 -15.840 590 2HD2 LEU 81 2HD2 LEU 81 0.773 0.253 -15.878 591 3HD2 LEU 81 3HD2 LEU 81 -0.121 -0.020 -17.373 592 H VAL 82 H VAL 82 -0.826 3.567 -13.269 593 HA VAL 82 HA VAL 82 -1.411 6.368 -13.953 594 HB VAL 82 HB VAL 82 -1.123 5.199 -11.167 595 1HG1 VAL 82 1HG1 VAL 82 -1.231 8.056 -12.113 596 2HG1 VAL 82 2HG1 VAL 82 -0.012 7.286 -11.097 597 3HG1 VAL 82 3HG1 VAL 82 -1.632 7.581 -10.462 598 1HG2 VAL 82 1HG2 VAL 82 -3.411 6.162 -10.887 599 2HG2 VAL 82 2HG2 VAL 82 -3.325 4.836 -12.048 600 3HG2 VAL 82 3HG2 VAL 82 -3.427 6.501 -12.617 601 H GLU 83 H GLU 83 0.367 7.461 -14.490 602 HA GLU 83 HA GLU 83 2.934 6.246 -14.321 603 1HB GLU 83 1HB GLU 83 1.748 8.552 -15.604 604 2HB GLU 83 2HB GLU 83 3.307 8.964 -14.905 605 1HG GLU 83 1HG GLU 83 3.563 6.470 -16.236 606 2HG GLU 83 2HG GLU 83 2.755 7.601 -17.321 607 H VAL 84 H VAL 84 3.931 6.034 -12.438 608 HA VAL 84 HA VAL 84 3.574 7.853 -10.265 609 HB VAL 84 HB VAL 84 4.001 5.603 -9.659 610 1HG1 VAL 84 1HG1 VAL 84 6.363 5.781 -11.497 611 2HG1 VAL 84 2HG1 VAL 84 5.006 4.657 -11.551 612 3HG1 VAL 84 3HG1 VAL 84 6.218 4.518 -10.277 613 1HG2 VAL 84 1HG2 VAL 84 6.699 6.260 -8.932 614 2HG2 VAL 84 2HG2 VAL 84 5.257 6.179 -7.922 615 3HG2 VAL 84 3HG2 VAL 84 5.665 7.677 -8.757 616 H GLN 85 H GLN 85 4.434 9.787 -10.186 617 HA GLN 85 HA GLN 85 6.669 10.577 -11.796 618 1HB GLN 85 1HB GLN 85 4.693 12.038 -11.170 619 2HB GLN 85 2HB GLN 85 5.392 12.151 -9.561 620 1HG GLN 85 1HG GLN 85 7.306 13.284 -10.376 621 2HG GLN 85 2HG GLN 85 6.872 12.944 -12.052 622 1HE2 GLN 85 1HE2 GLN 85 7.288 15.375 -11.974 623 2HE2 GLN 85 2HE2 GLN 85 5.901 16.372 -11.718 624 H GLU 86 H GLU 86 8.712 11.325 -11.048 625 HA GLU 86 HA GLU 86 9.803 9.752 -8.965 626 1HB GLU 86 1HB GLU 86 11.043 10.630 -10.981 627 2HB GLU 86 2HB GLU 86 11.058 12.201 -10.193 628 1HG GLU 86 1HG GLU 86 12.230 11.116 -8.263 629 2HG GLU 86 2HG GLU 86 12.376 9.669 -9.258 630 H SER 87 H SER 87 9.025 10.089 -6.975 631 HA SER 87 HA SER 87 9.631 12.652 -5.724 632 1HB SER 87 1HB SER 87 6.957 11.803 -6.368 633 2HB SER 87 2HB SER 87 7.147 11.892 -4.617 634 HG SER 87 HG SER 87 6.854 13.948 -4.926 635 H GLU 88 H GLU 88 10.144 12.507 -3.560 636 HA GLU 88 HA GLU 88 10.890 11.542 -1.645 637 1HB GLU 88 1HB GLU 88 8.353 10.942 -1.698 638 2HB GLU 88 2HB GLU 88 8.920 9.310 -2.014 639 1HG GLU 88 1HG GLU 88 8.672 9.333 0.277 640 2HG GLU 88 2HG GLU 88 10.393 9.653 0.071 641 H TYR 89 H TYR 89 9.920 8.493 -3.196 642 HA TYR 89 HA TYR 89 12.673 7.830 -3.801 643 1HB TYR 89 1HB TYR 89 12.387 5.623 -2.492 644 2HB TYR 89 2HB TYR 89 12.781 7.081 -1.586 645 HD1 TYR 89 HD1 TYR 89 11.683 7.270 0.424 646 HD2 TYR 89 HD2 TYR 89 9.661 5.422 -2.831 647 HE1 TYR 89 HE1 TYR 89 9.714 6.915 1.855 648 HE2 TYR 89 HE2 TYR 89 7.688 5.062 -1.410 649 HH TYR 89 HH TYR 89 6.993 6.590 1.195 650 H TYR 90 H TYR 90 9.961 8.107 -5.113 651 HA TYR 90 HA TYR 90 9.764 5.404 -6.265 652 1HB TYR 90 1HB TYR 90 7.773 7.370 -5.481 653 2HB TYR 90 2HB TYR 90 7.568 6.879 -7.158 654 HD1 TYR 90 HD1 TYR 90 7.066 4.539 -7.714 655 HD2 TYR 90 HD2 TYR 90 7.351 5.841 -3.674 656 HE1 TYR 90 HE1 TYR 90 5.930 2.486 -6.979 657 HE2 TYR 90 HE2 TYR 90 6.216 3.792 -2.927 658 HH TYR 90 HH TYR 90 4.630 1.681 -5.077 659 HA PRO 91 HA PRO 91 11.841 7.361 -9.762 660 1HB PRO 91 1HB PRO 91 11.190 4.779 -11.057 661 2HB PRO 91 2HB PRO 91 12.752 5.581 -10.864 662 1HG PRO 91 1HG PRO 91 12.125 3.422 -9.423 663 2HG PRO 91 2HG PRO 91 13.062 4.756 -8.724 664 1HD PRO 91 1HD PRO 91 10.165 4.089 -8.377 665 2HD PRO 91 2HD PRO 91 11.342 4.666 -7.178 666 H LYS 92 H LYS 92 11.212 8.275 -11.691 667 HA LYS 92 HA LYS 92 8.435 8.646 -12.126 668 1HB LYS 92 1HB LYS 92 10.058 10.386 -12.670 669 2HB LYS 92 2HB LYS 92 10.802 9.343 -13.874 670 1HG LYS 92 1HG LYS 92 9.497 10.436 -15.318 671 2HG LYS 92 2HG LYS 92 8.217 9.381 -14.718 672 1HD LYS 92 1HD LYS 92 7.164 11.062 -13.662 673 2HD LYS 92 2HD LYS 92 8.674 11.766 -13.078 674 1HE LYS 92 1HE LYS 92 8.239 12.001 -15.972 675 2HE LYS 92 2HE LYS 92 7.072 12.872 -14.979 676 1HZ LYS 92 1HZ LYS 92 8.624 14.322 -14.272 677 2HZ LYS 92 2HZ LYS 92 9.415 13.881 -15.700 678 3HZ LYS 92 3HZ LYS 92 9.865 13.172 -14.232 679 H ARG 93 H ARG 93 7.982 6.269 -12.268 680 HA ARG 93 HA ARG 93 8.242 5.351 -15.058 681 1HB ARG 93 1HB ARG 93 9.421 4.121 -12.960 682 2HB ARG 93 2HB ARG 93 7.865 3.302 -12.961 683 1HG ARG 93 1HG ARG 93 8.317 2.168 -14.845 684 2HG ARG 93 2HG ARG 93 9.145 3.534 -15.593 685 1HD ARG 93 1HD ARG 93 10.368 1.974 -13.338 686 2HD ARG 93 2HD ARG 93 10.540 1.469 -15.018 687 HE ARG 93 HE ARG 93 11.275 4.207 -14.568 688 1HH1 ARG 93 1HH1 ARG 93 12.395 0.903 -14.478 689 2HH1 ARG 93 2HH1 ARG 93 14.062 1.332 -14.672 690 1HH2 ARG 93 1HH2 ARG 93 13.467 4.772 -14.823 691 2HH2 ARG 93 2HH2 ARG 93 14.670 3.528 -14.868 692 H TYR 94 H TYR 94 6.620 3.277 -15.187 693 HA TYR 94 HA TYR 94 3.975 4.444 -14.753 694 1HB TYR 94 1HB TYR 94 5.116 2.435 -16.641 695 2HB TYR 94 2HB TYR 94 3.403 2.327 -16.249 696 HD1 TYR 94 HD1 TYR 94 1.876 3.614 -17.435 697 HD2 TYR 94 HD2 TYR 94 5.971 4.759 -17.418 698 HE1 TYR 94 HE1 TYR 94 1.381 5.370 -19.077 699 HE2 TYR 94 HE2 TYR 94 5.492 6.517 -19.063 700 HH TYR 94 HH TYR 94 3.757 6.974 -20.823 701 H GLN 95 H GLN 95 2.509 3.606 -13.374 702 HA GLN 95 HA GLN 95 3.052 0.963 -12.207 703 1HB GLN 95 1HB GLN 95 2.511 3.548 -10.784 704 2HB GLN 95 2HB GLN 95 2.064 2.018 -10.042 705 1HG GLN 95 1HG GLN 95 4.785 2.013 -11.055 706 2HG GLN 95 2HG GLN 95 4.503 3.276 -9.857 707 1HE2 GLN 95 1HE2 GLN 95 3.309 2.511 -7.873 708 2HE2 GLN 95 2HE2 GLN 95 3.786 0.984 -7.220 709 H SER 96 H SER 96 1.355 -0.378 -12.287 710 HA SER 96 HA SER 96 -1.257 0.770 -12.973 711 1HB SER 96 1HB SER 96 -1.799 -1.252 -14.022 712 2HB SER 96 2HB SER 96 -0.083 -1.054 -14.380 713 HG SER 96 HG SER 96 -0.931 -3.175 -13.505 714 H HIS 97 H HIS 97 -3.196 -0.254 -12.096 715 HA HIS 97 HA HIS 97 -4.552 -0.841 -10.375 716 1HB HIS 97 1HB HIS 97 -2.121 -2.476 -9.654 717 2HB HIS 97 2HB HIS 97 -3.638 -2.574 -8.767 718 HD1 HIS 97 HD1 HIS 97 -5.782 -3.099 -10.512 719 HD2 HIS 97 HD2 HIS 97 -1.967 -4.328 -11.607 720 HE1 HIS 97 HE1 HIS 97 -6.125 -4.884 -12.249 721 HE2 HIS 97 HE2 HIS 97 -3.805 -5.682 -12.825 722 H VAL 98 H VAL 98 -3.811 1.622 -9.981 723 HA VAL 98 HA VAL 98 -3.003 1.721 -7.147 724 HB VAL 98 HB VAL 98 -1.299 2.654 -8.797 725 1HG1 VAL 98 1HG1 VAL 98 -1.804 5.121 -9.316 726 2HG1 VAL 98 2HG1 VAL 98 -3.496 4.654 -9.146 727 3HG1 VAL 98 3HG1 VAL 98 -2.485 3.876 -10.365 728 1HG2 VAL 98 1HG2 VAL 98 -2.391 4.166 -6.465 729 2HG2 VAL 98 2HG2 VAL 98 -1.021 4.790 -7.385 730 3HG2 VAL 98 3HG2 VAL 98 -0.908 3.217 -6.591 731 H LEU 99 H LEU 99 -4.115 3.085 -5.794 732 HA LEU 99 HA LEU 99 -6.607 4.206 -6.880 733 1HB LEU 99 1HB LEU 99 -5.866 3.131 -4.171 734 2HB LEU 99 2HB LEU 99 -7.255 4.182 -4.379 735 HG LEU 99 HG LEU 99 -8.314 2.579 -5.849 736 1HD1 LEU 99 1HD1 LEU 99 -6.484 1.655 -7.037 737 2HD1 LEU 99 2HD1 LEU 99 -7.236 0.328 -6.152 738 3HD1 LEU 99 3HD1 LEU 99 -5.740 1.049 -5.557 739 1HD2 LEU 99 1HD2 LEU 99 -8.277 0.556 -4.199 740 2HD2 LEU 99 2HD2 LEU 99 -8.945 2.105 -3.685 741 3HD2 LEU 99 3HD2 LEU 99 -7.315 1.642 -3.197 742 H LEU 100 H LEU 100 -7.175 6.350 -6.415 743 HA LEU 100 HA LEU 100 -5.178 7.896 -4.918 744 1HB LEU 100 1HB LEU 100 -5.858 8.122 -7.736 745 2HB LEU 100 2HB LEU 100 -6.010 9.647 -6.881 746 HG LEU 100 HG LEU 100 -3.529 7.922 -6.962 747 1HD1 LEU 100 1HD1 LEU 100 -2.624 9.394 -8.494 748 2HD1 LEU 100 2HD1 LEU 100 -3.798 10.659 -8.132 749 3HD1 LEU 100 3HD1 LEU 100 -4.289 9.238 -9.052 750 1HD2 LEU 100 1HD2 LEU 100 -2.594 9.243 -5.411 751 2HD2 LEU 100 2HD2 LEU 100 -4.253 9.647 -4.977 752 3HD2 LEU 100 3HD2 LEU 100 -3.342 10.702 -6.057 753 H ALA 101 H ALA 101 -5.896 9.533 -3.676 754 HA ALA 101 HA ALA 101 -8.689 10.387 -3.855 755 1HB ALA 101 1HB ALA 101 -8.937 8.673 -2.262 756 2HB ALA 101 2HB ALA 101 -8.840 10.163 -1.327 757 3HB ALA 101 3HB ALA 101 -7.434 9.106 -1.445 758 H THR 102 H THR 102 -9.065 12.450 -3.013 759 HA THR 102 HA THR 102 -6.619 13.969 -2.430 760 HB THR 102 HB THR 102 -7.660 14.903 -4.313 761 HG1 THR 102 HG1 THR 102 -7.254 16.643 -3.128 762 1HG2 THR 102 1HG2 THR 102 -10.145 14.096 -3.017 763 2HG2 THR 102 2HG2 THR 102 -9.761 14.292 -4.728 764 3HG2 THR 102 3HG2 THR 102 -10.210 15.695 -3.759 765 H GLY 103 H GLY 103 -6.313 14.932 -0.524 766 1HA GLY 103 1HA GLY 103 -8.616 15.195 1.302 767 2HA GLY 103 2HA GLY 103 -7.129 14.438 1.852 768 H PHE 104 H PHE 104 -8.139 17.427 0.186 769 HA PHE 104 HA PHE 104 -5.948 18.976 0.952 770 1HB PHE 104 1HB PHE 104 -8.712 19.559 0.004 771 2HB PHE 104 2HB PHE 104 -7.793 20.883 0.712 772 HD1 PHE 104 HD1 PHE 104 -6.699 22.222 -0.781 773 HD2 PHE 104 HD2 PHE 104 -7.165 18.090 -1.688 774 HE1 PHE 104 HE1 PHE 104 -5.539 22.565 -2.924 775 HE2 PHE 104 HE2 PHE 104 -6.006 18.425 -3.831 776 HZ PHE 104 HZ PHE 104 -5.191 20.664 -4.452 777 H SER 105 H SER 105 -5.385 18.810 3.083 778 HA SER 105 HA SER 105 -6.970 20.358 4.941 779 1HB SER 105 1HB SER 105 -6.367 17.439 5.473 780 2HB SER 105 2HB SER 105 -6.993 18.572 6.671 781 HG SER 105 HG SER 105 -8.758 18.902 5.086 782 H GLU 106 H GLU 106 -4.168 18.212 4.551 783 HA GLU 106 HA GLU 106 -2.461 20.250 5.717 784 1HB GLU 106 1HB GLU 106 -3.281 17.857 7.156 785 2HB GLU 106 2HB GLU 106 -1.533 17.952 6.985 786 1HG GLU 106 1HG GLU 106 -1.529 19.287 8.747 787 2HG GLU 106 2HG GLU 106 -2.287 20.512 7.731 788 HA PRO 107 HA PRO 107 0.527 19.017 2.735 789 1HB PRO 107 1HB PRO 107 2.469 18.779 4.985 790 2HB PRO 107 2HB PRO 107 2.603 19.687 3.474 791 1HG PRO 107 1HG PRO 107 2.092 20.938 5.766 792 2HG PRO 107 2HG PRO 107 1.303 21.441 4.260 793 1HD PRO 107 1HD PRO 107 0.196 19.891 6.557 794 2HD PRO 107 2HD PRO 107 -0.600 21.082 5.508 795 H GLY 108 H GLY 108 1.213 17.142 1.826 796 1HA GLY 108 1HA GLY 108 1.498 14.787 3.577 797 2HA GLY 108 2HA GLY 108 0.478 14.712 2.149 798 H ASP 109 H ASP 109 2.495 12.912 2.432 799 HA ASP 109 HA ASP 109 3.966 13.288 0.042 800 1HB ASP 109 1HB ASP 109 5.154 14.582 2.134 801 2HB ASP 109 2HB ASP 109 5.939 13.008 2.212 802 H ALA 110 H ALA 110 4.350 11.652 3.190 803 HA ALA 110 HA ALA 110 4.227 9.080 1.768 804 1HB ALA 110 1HB ALA 110 6.089 8.217 2.824 805 2HB ALA 110 2HB ALA 110 6.022 9.394 4.136 806 3HB ALA 110 3HB ALA 110 6.580 9.886 2.537 807 H GLY 111 H GLY 111 3.320 7.349 2.927 808 1HA GLY 111 1HA GLY 111 2.227 7.932 5.580 809 2HA GLY 111 2HA GLY 111 1.090 7.549 4.297 810 H GLY 112 H GLY 112 0.382 5.712 5.457 811 1HA GLY 112 1HA GLY 112 2.351 3.514 5.576 812 2HA GLY 112 2HA GLY 112 0.938 3.638 6.615 813 H ILE 113 H ILE 113 -0.847 2.573 6.034 814 HA ILE 113 HA ILE 113 -1.068 1.668 3.243 815 HB ILE 113 HB ILE 113 -2.046 -0.438 4.011 816 1HG1 ILE 113 1HG1 ILE 113 -1.174 0.260 6.809 817 2HG1 ILE 113 2HG1 ILE 113 -2.805 0.607 6.242 818 1HG2 ILE 113 1HG2 ILE 113 0.126 -0.906 3.614 819 2HG2 ILE 113 2HG2 ILE 113 0.161 -1.157 5.359 820 3HG2 ILE 113 3HG2 ILE 113 0.710 0.375 4.676 821 1HD1 ILE 113 1HD1 ILE 113 -1.694 -2.145 5.968 822 2HD1 ILE 113 2HD1 ILE 113 -3.371 -1.617 6.103 823 3HD1 ILE 113 3HD1 ILE 113 -2.321 -1.590 7.520 824 H LEU 114 H LEU 114 -3.132 1.544 2.361 825 HA LEU 114 HA LEU 114 -5.099 3.235 3.670 826 1HB LEU 114 1HB LEU 114 -4.784 3.725 1.378 827 2HB LEU 114 2HB LEU 114 -4.869 2.035 0.921 828 HG LEU 114 HG LEU 114 -7.241 1.978 1.293 829 1HD1 LEU 114 1HD1 LEU 114 -8.496 3.599 2.327 830 2HD1 LEU 114 2HD1 LEU 114 -7.330 4.876 1.985 831 3HD1 LEU 114 3HD1 LEU 114 -6.997 3.693 3.248 832 1HD2 LEU 114 1HD2 LEU 114 -7.969 3.372 -0.462 833 2HD2 LEU 114 2HD2 LEU 114 -6.289 2.982 -0.830 834 3HD2 LEU 114 3HD2 LEU 114 -6.701 4.557 -0.151 835 H ARG 115 H ARG 115 -6.704 2.453 4.869 836 HA ARG 115 HA ARG 115 -7.486 -0.359 4.460 837 1HB ARG 115 1HB ARG 115 -6.853 1.174 6.894 838 2HB ARG 115 2HB ARG 115 -8.285 0.159 7.008 839 1HG ARG 115 1HG ARG 115 -7.036 -1.801 6.512 840 2HG ARG 115 2HG ARG 115 -5.611 -0.854 6.077 841 1HD ARG 115 1HD ARG 115 -5.206 -1.704 8.247 842 2HD ARG 115 2HD ARG 115 -5.603 0.002 8.449 843 HE ARG 115 HE ARG 115 -7.960 -1.466 8.711 844 1HH1 ARG 115 1HH1 ARG 115 -4.926 -1.050 10.384 845 2HH1 ARG 115 2HH1 ARG 115 -5.592 -1.410 11.942 846 1HH2 ARG 115 1HH2 ARG 115 -8.838 -1.941 10.758 847 2HH2 ARG 115 2HH2 ARG 115 -7.813 -1.917 12.154 848 H CYS 116 H CYS 116 -9.571 -0.890 4.318 849 HA CYS 116 HA CYS 116 -11.541 1.293 4.248 850 1HB CYS 116 1HB CYS 116 -11.110 -0.114 2.171 851 2HB CYS 116 2HB CYS 116 -11.815 -1.468 3.042 852 H GLU 117 H GLU 117 -13.802 0.578 4.914 853 HA GLU 117 HA GLU 117 -13.823 -0.255 7.563 854 1HB GLU 117 1HB GLU 117 -16.040 -0.309 5.512 855 2HB GLU 117 2HB GLU 117 -16.286 -0.571 7.233 856 1HG GLU 117 1HG GLU 117 -15.878 1.623 7.769 857 2HG GLU 117 2HG GLU 117 -14.911 1.908 6.322 858 H HIS 118 H HIS 118 -13.621 -2.139 4.698 859 HA HIS 118 HA HIS 118 -14.575 -4.568 5.975 860 1HB HIS 118 1HB HIS 118 -13.390 -4.177 3.221 861 2HB HIS 118 2HB HIS 118 -14.217 -5.617 3.804 862 HD2 HIS 118 HD2 HIS 118 -16.865 -5.642 3.225 863 HE1 HIS 118 HE1 HIS 118 -17.335 -1.498 2.442 864 HE2 HIS 118 HE2 HIS 118 -18.474 -3.745 2.514 865 H GLY 119 H GLY 119 -11.524 -3.116 4.950 866 1HA GLY 119 1HA GLY 119 -9.925 -4.396 6.803 867 2HA GLY 119 2HA GLY 119 -9.936 -5.454 5.398 868 H VAL 120 H VAL 120 -7.856 -5.204 4.770 869 HA VAL 120 HA VAL 120 -6.742 -2.540 4.396 870 HB VAL 120 HB VAL 120 -5.375 -5.100 3.609 871 1HG1 VAL 120 1HG1 VAL 120 -3.501 -3.478 4.678 872 2HG1 VAL 120 2HG1 VAL 120 -4.623 -2.296 4.002 873 3HG1 VAL 120 3HG1 VAL 120 -3.917 -3.536 2.966 874 1HG2 VAL 120 1HG2 VAL 120 -5.282 -5.822 5.700 875 2HG2 VAL 120 2HG2 VAL 120 -6.251 -4.452 6.241 876 3HG2 VAL 120 3HG2 VAL 120 -4.494 -4.322 6.182 877 H ILE 121 H ILE 121 -6.465 -1.550 2.443 878 HA ILE 121 HA ILE 121 -7.482 -3.002 0.096 879 HB ILE 121 HB ILE 121 -7.367 -0.048 0.690 880 1HG1 ILE 121 1HG1 ILE 121 -9.548 -2.075 0.228 881 2HG1 ILE 121 2HG1 ILE 121 -9.318 -1.008 1.607 882 1HG2 ILE 121 1HG2 ILE 121 -8.313 0.288 -1.591 883 2HG2 ILE 121 2HG2 ILE 121 -7.951 -1.402 -1.944 884 3HG2 ILE 121 3HG2 ILE 121 -6.642 -0.275 -1.591 885 1HD1 ILE 121 1HD1 ILE 121 -11.210 -0.344 0.207 886 2HD1 ILE 121 2HD1 ILE 121 -10.113 -0.121 -1.155 887 3HD1 ILE 121 3HD1 ILE 121 -9.963 0.902 0.274 888 H GLY 122 H GLY 122 -4.974 -0.607 0.981 889 1HA GLY 122 1HA GLY 122 -3.047 -2.013 -0.644 890 2HA GLY 122 2HA GLY 122 -3.544 -0.472 -1.319 891 H LEU 123 H LEU 123 -1.081 -0.340 -1.014 892 HA LEU 123 HA LEU 123 -0.557 0.877 1.613 893 1HB LEU 123 1HB LEU 123 1.931 0.320 0.858 894 2HB LEU 123 2HB LEU 123 0.950 -0.803 1.774 895 HG LEU 123 HG LEU 123 2.214 -1.845 -0.095 896 1HD1 LEU 123 1HD1 LEU 123 -0.280 -2.411 0.800 897 2HD1 LEU 123 2HD1 LEU 123 0.632 -3.411 -0.330 898 3HD1 LEU 123 3HD1 LEU 123 -0.563 -2.264 -0.934 899 1HD2 LEU 123 1HD2 LEU 123 2.108 -1.143 -2.209 900 2HD2 LEU 123 2HD2 LEU 123 1.403 0.333 -1.552 901 3HD2 LEU 123 3HD2 LEU 123 0.357 -0.952 -2.155 902 H VAL 124 H VAL 124 1.176 2.545 1.566 903 HA VAL 124 HA VAL 124 0.530 4.626 -0.147 904 HB VAL 124 HB VAL 124 1.681 4.932 2.006 905 1HG1 VAL 124 1HG1 VAL 124 4.239 4.153 0.640 906 2HG1 VAL 124 2HG1 VAL 124 3.287 3.002 1.577 907 3HG1 VAL 124 3HG1 VAL 124 3.949 4.438 2.355 908 1HG2 VAL 124 1HG2 VAL 124 2.501 6.209 -0.506 909 2HG2 VAL 124 2HG2 VAL 124 3.603 6.462 0.846 910 3HG2 VAL 124 3HG2 VAL 124 1.908 6.924 0.993 911 H THR 125 H THR 125 1.029 5.128 -2.168 912 HA THR 125 HA THR 125 3.342 3.805 -3.419 913 HB THR 125 HB THR 125 0.572 4.280 -4.489 914 HG1 THR 125 HG1 THR 125 1.395 2.246 -3.522 915 1HG2 THR 125 1HG2 THR 125 1.834 3.251 -6.638 916 2HG2 THR 125 2HG2 THR 125 3.060 4.371 -6.042 917 3HG2 THR 125 3HG2 THR 125 1.445 4.961 -6.438 918 H MET 126 H MET 126 1.295 6.269 -4.939 919 HA MET 126 HA MET 126 3.556 8.148 -4.667 920 1HB MET 126 1HB MET 126 2.570 7.025 -7.035 921 2HB MET 126 2HB MET 126 1.959 8.675 -7.017 922 1HG MET 126 1HG MET 126 4.818 7.774 -6.867 923 2HG MET 126 2HG MET 126 4.036 8.668 -8.168 924 1HE MET 126 1HE MET 126 6.112 8.526 -5.389 925 2HE MET 126 2HE MET 126 6.256 10.121 -4.646 926 3HE MET 126 3HE MET 126 6.926 9.831 -6.254 927 H GLY 127 H GLY 127 3.092 10.035 -3.758 928 1HA GLY 127 1HA GLY 127 0.247 10.792 -3.539 929 2HA GLY 127 2HA GLY 127 1.483 11.212 -2.364 930 H GLY 128 H GLY 128 -0.449 12.595 -4.482 931 1HA GLY 128 1HA GLY 128 1.447 14.268 -5.898 932 2HA GLY 128 2HA GLY 128 -0.305 14.384 -5.966 933 H GLU 129 H GLU 129 0.035 16.700 -5.828 934 HA GLU 129 HA GLU 129 1.199 17.871 -3.503 935 1HB GLU 129 1HB GLU 129 -0.754 19.159 -5.413 936 2HB GLU 129 2HB GLU 129 0.402 19.970 -4.365 937 1HG GLU 129 1HG GLU 129 2.242 19.158 -5.656 938 2HG GLU 129 2HG GLU 129 1.176 18.133 -6.616 939 H GLY 130 H GLY 130 -1.874 16.505 -4.184 940 1HA GLY 130 1HA GLY 130 -2.756 17.088 -1.490 941 2HA GLY 130 2HA GLY 130 -3.726 17.842 -2.745 942 H VAL 131 H VAL 131 -2.281 14.800 -3.486 943 HA VAL 131 HA VAL 131 -4.817 13.426 -2.914 944 HB VAL 131 HB VAL 131 -3.289 12.594 -5.326 945 1HG1 VAL 131 1HG1 VAL 131 -6.235 12.771 -4.724 946 2HG1 VAL 131 2HG1 VAL 131 -5.234 11.329 -4.548 947 3HG1 VAL 131 3HG1 VAL 131 -5.504 12.025 -6.145 948 1HG2 VAL 131 1HG2 VAL 131 -4.366 14.204 -6.758 949 2HG2 VAL 131 2HG2 VAL 131 -3.436 15.057 -5.526 950 3HG2 VAL 131 3HG2 VAL 131 -5.190 14.932 -5.379 951 H VAL 132 H VAL 132 -4.634 11.096 -2.700 952 HA VAL 132 HA VAL 132 -1.948 10.273 -1.805 953 HB VAL 132 HB VAL 132 -3.002 8.794 -0.201 954 1HG1 VAL 132 1HG1 VAL 132 -2.859 10.600 1.098 955 2HG1 VAL 132 2HG1 VAL 132 -4.587 10.821 0.812 956 3HG1 VAL 132 3HG1 VAL 132 -3.410 11.667 -0.194 957 1HG2 VAL 132 1HG2 VAL 132 -4.983 7.972 -0.940 958 2HG2 VAL 132 2HG2 VAL 132 -5.446 9.485 -1.718 959 3HG2 VAL 132 3HG2 VAL 132 -5.624 9.300 0.027 960 H GLY 133 H GLY 133 -1.025 8.788 -3.074 961 1HA GLY 133 1HA GLY 133 -2.755 7.096 -4.743 962 2HA GLY 133 2HA GLY 133 -1.052 7.406 -5.031 963 H PHE 134 H PHE 134 -3.288 5.229 -3.796 964 HA PHE 134 HA PHE 134 -1.210 3.802 -2.272 965 1HB PHE 134 1HB PHE 134 -4.225 3.650 -2.098 966 2HB PHE 134 2HB PHE 134 -3.136 2.570 -1.236 967 HD1 PHE 134 HD1 PHE 134 -5.066 5.430 -0.922 968 HD2 PHE 134 HD2 PHE 134 -1.239 3.888 0.123 969 HE1 PHE 134 HE1 PHE 134 -4.920 7.050 0.922 970 HE2 PHE 134 HE2 PHE 134 -1.087 5.506 1.970 971 HZ PHE 134 HZ PHE 134 -2.930 7.089 2.373 972 H ALA 135 H ALA 135 -0.688 1.713 -2.789 973 HA ALA 135 HA ALA 135 -1.605 0.773 -5.386 974 1HB ALA 135 1HB ALA 135 0.180 -1.103 -4.383 975 2HB ALA 135 2HB ALA 135 0.774 0.442 -3.771 976 3HB ALA 135 3HB ALA 135 0.548 0.208 -5.504 977 H ASP 136 H ASP 136 -3.238 -0.598 -5.578 978 HA ASP 136 HA ASP 136 -4.553 -1.716 -3.347 979 1HB ASP 136 1HB ASP 136 -5.223 -1.224 -5.957 980 2HB ASP 136 2HB ASP 136 -5.138 -2.982 -5.927 981 H VAL 137 H VAL 137 -4.566 -3.672 -2.447 982 HA VAL 137 HA VAL 137 -2.421 -5.519 -3.148 983 HB VAL 137 HB VAL 137 -4.339 -5.491 -0.805 984 1HG1 VAL 137 1HG1 VAL 137 -3.760 -7.737 -0.983 985 2HG1 VAL 137 2HG1 VAL 137 -2.570 -7.100 0.151 986 3HG1 VAL 137 3HG1 VAL 137 -2.125 -7.371 -1.531 987 1HG2 VAL 137 1HG2 VAL 137 -2.197 -3.846 -1.268 988 2HG2 VAL 137 2HG2 VAL 137 -1.489 -5.132 -0.290 989 3HG2 VAL 137 3HG2 VAL 137 -2.876 -4.225 0.314 990 H ARG 138 H ARG 138 -5.334 -5.065 -4.371 991 HA ARG 138 HA ARG 138 -6.607 -7.591 -4.146 992 1HB ARG 138 1HB ARG 138 -6.925 -5.428 -6.231 993 2HB ARG 138 2HB ARG 138 -8.008 -6.797 -6.014 994 1HG ARG 138 1HG ARG 138 -7.839 -5.610 -3.499 995 2HG ARG 138 2HG ARG 138 -7.942 -4.266 -4.637 996 1HD ARG 138 1HD ARG 138 -9.839 -6.604 -4.439 997 2HD ARG 138 2HD ARG 138 -10.162 -4.947 -3.929 998 HE ARG 138 HE ARG 138 -9.548 -4.662 -6.540 999 1HH1 ARG 138 1HH1 ARG 138 -11.780 -6.747 -4.850 1000 2HH1 ARG 138 2HH1 ARG 138 -12.900 -6.824 -6.167 1001 1HH2 ARG 138 1HH2 ARG 138 -11.021 -4.763 -8.274 1002 2HH2 ARG 138 2HH2 ARG 138 -12.470 -5.699 -8.112 1003 H ASP 139 H ASP 139 -3.782 -6.751 -5.730 1004 HA ASP 139 HA ASP 139 -4.193 -8.659 -7.909 1005 1HB ASP 139 1HB ASP 139 -2.333 -6.397 -7.427 1006 2HB ASP 139 2HB ASP 139 -1.711 -7.750 -8.369 1007 H LEU 140 H LEU 140 -3.516 -9.082 -4.847 1008 HA LEU 140 HA LEU 140 -2.159 -11.517 -5.218 1009 1HB LEU 140 1HB LEU 140 -0.034 -11.044 -4.139 1010 2HB LEU 140 2HB LEU 140 -0.212 -10.110 -5.606 1011 HG LEU 140 HG LEU 140 0.627 -8.458 -4.314 1012 1HD1 LEU 140 1HD1 LEU 140 -1.067 -7.084 -3.203 1013 2HD1 LEU 140 2HD1 LEU 140 -2.214 -8.417 -3.331 1014 3HD1 LEU 140 3HD1 LEU 140 -1.601 -7.644 -4.791 1015 1HD2 LEU 140 1HD2 LEU 140 0.530 -10.313 -2.355 1016 2HD2 LEU 140 2HD2 LEU 140 -0.587 -9.102 -1.725 1017 3HD2 LEU 140 3HD2 LEU 140 1.069 -8.650 -2.128 1018 H LEU 141 H LEU 141 -4.460 -10.967 -4.012 1019 HA LEU 141 HA LEU 141 -4.319 -10.443 -1.240 1020 1HB LEU 141 1HB LEU 141 -6.320 -10.886 -3.159 1021 2HB LEU 141 2HB LEU 141 -6.568 -12.091 -1.908 1022 HG LEU 141 HG LEU 141 -7.881 -10.253 -1.273 1023 1HD1 LEU 141 1HD1 LEU 141 -5.997 -11.207 0.370 1024 2HD1 LEU 141 2HD1 LEU 141 -7.185 -9.997 0.853 1025 3HD1 LEU 141 3HD1 LEU 141 -5.561 -9.500 0.373 1026 1HD2 LEU 141 1HD2 LEU 141 -6.069 -8.749 -2.741 1027 2HD2 LEU 141 2HD2 LEU 141 -5.910 -8.153 -1.090 1028 3HD2 LEU 141 3HD2 LEU 141 -7.488 -8.152 -1.881 1029 H TRP 142 H TRP 142 -3.483 -13.213 -3.027 1030 HA TRP 142 HA TRP 142 -4.200 -15.289 -1.332 1031 1HB TRP 142 1HB TRP 142 -2.241 -16.519 -2.323 1032 2HB TRP 142 2HB TRP 142 -3.359 -15.831 -3.494 1033 HD1 TRP 142 HD1 TRP 142 -2.473 -13.365 -4.580 1034 HE1 TRP 142 HE1 TRP 142 -0.085 -12.741 -5.299 1035 HE3 TRP 142 HE3 TRP 142 0.121 -16.899 -1.947 1036 HZ2 TRP 142 HZ2 TRP 142 2.541 -13.632 -4.823 1037 HZ3 TRP 142 HZ3 TRP 142 2.576 -16.945 -2.143 1038 HH2 TRP 142 HH2 TRP 142 3.758 -15.343 -3.549 1039 H LEU 143 H LEU 143 -3.964 -14.457 0.780 1040 HA LEU 143 HA LEU 143 -1.375 -15.064 1.948 1041 1HB LEU 143 1HB LEU 143 -2.754 -12.422 2.449 1042 2HB LEU 143 2HB LEU 143 -1.353 -13.012 3.315 1043 HG LEU 143 HG LEU 143 -0.321 -13.061 0.847 1044 1HD1 LEU 143 1HD1 LEU 143 -1.245 -10.726 -0.041 1045 2HD1 LEU 143 2HD1 LEU 143 -2.721 -11.340 0.709 1046 3HD1 LEU 143 3HD1 LEU 143 -1.915 -12.276 -0.551 1047 1HD2 LEU 143 1HD2 LEU 143 0.928 -11.287 1.522 1048 2HD2 LEU 143 2HD2 LEU 143 0.153 -11.659 3.062 1049 3HD2 LEU 143 3HD2 LEU 143 -0.474 -10.357 2.050 1050 H GLU 144 H GLU 144 -4.673 -13.908 2.515 1051 HA GLU 144 HA GLU 144 -5.181 -16.036 4.384 1052 1HB GLU 144 1HB GLU 144 -4.550 -13.313 5.296 1053 2HB GLU 144 2HB GLU 144 -6.041 -13.961 5.957 1054 1HG GLU 144 1HG GLU 144 -4.282 -16.048 6.251 1055 2HG GLU 144 2HG GLU 144 -3.278 -14.633 6.558 1056 H ASP 145 H ASP 145 -7.487 -15.123 5.560 1057 HA ASP 145 HA ASP 145 -9.385 -15.429 3.532 1058 1HB ASP 145 1HB ASP 145 -11.023 -14.618 5.295 1059 2HB ASP 145 2HB ASP 145 -10.024 -15.996 5.750 1060 H ASP 146 H ASP 146 -10.604 -14.041 2.342 1061 HA ASP 146 HA ASP 146 -9.806 -11.214 2.419 1062 1HB ASP 146 1HB ASP 146 -10.872 -11.200 0.090 1063 2HB ASP 146 2HB ASP 146 -9.358 -12.079 0.271 1064 H ALA 147 H ALA 147 -11.415 -9.569 2.143 1065 HA ALA 147 HA ALA 147 -13.990 -10.343 3.314 1066 1HB ALA 147 1HB ALA 147 -13.549 -8.603 4.632 1067 2HB ALA 147 2HB ALA 147 -13.905 -7.575 3.244 1068 3HB ALA 147 3HB ALA 147 -12.241 -8.048 3.586 1069 H MET 148 H MET 148 -15.962 -9.548 2.462 1070 HA MET 148 HA MET 148 -15.980 -8.206 -0.095 1071 1HB MET 148 1HB MET 148 -15.692 -10.838 -0.345 1072 2HB MET 148 2HB MET 148 -17.433 -10.808 -0.102 1073 1HG MET 148 1HG MET 148 -17.822 -9.652 -2.062 1074 2HG MET 148 2HG MET 148 -16.178 -9.022 -2.137 1075 1HE MET 148 1HE MET 148 -18.682 -11.114 -3.211 1076 2HE MET 148 2HE MET 148 -18.123 -12.780 -3.073 1077 3HE MET 148 3HE MET 148 -17.943 -11.914 -4.598 1078 H GLU 149 H GLU 149 -18.060 -10.254 1.962 1079 HA GLU 149 HA GLU 149 -20.442 -8.873 1.424 1080 1HB GLU 149 1HB GLU 149 -19.671 -10.487 3.860 1081 2HB GLU 149 2HB GLU 149 -21.308 -9.983 3.463 1082 1HG GLU 149 1HG GLU 149 -21.032 -11.252 1.296 1083 2HG GLU 149 2HG GLU 149 -19.558 -11.926 1.988 1084 H GLN 150 H GLN 150 -21.734 -7.779 3.246 1085 HA GLN 150 HA GLN 150 -19.988 -5.825 4.596 1086 1HB GLN 150 1HB GLN 150 -21.671 -5.195 2.606 1087 2HB GLN 150 2HB GLN 150 -22.793 -5.088 3.955 1088 1HG GLN 150 1HG GLN 150 -20.502 -3.725 4.785 1089 2HG GLN 150 2HG GLN 150 -20.762 -3.242 3.110 1090 1HE2 GLN 150 1HE2 GLN 150 -21.272 -2.188 6.041 1091 2HE2 GLN 150 2HE2 GLN 150 -22.808 -1.415 5.876 Start of MODEL 4 1 1H GLY 1 1H GLY 1 12.040 5.989 20.047 2 2H GLY 1 2H GLY 1 12.713 7.164 21.060 3 3H GLY 1 3H GLY 1 11.074 6.772 21.194 4 1HA GLY 1 1HA GLY 1 12.275 5.756 22.996 5 2HA GLY 1 2HA GLY 1 11.646 4.527 21.910 6 HA PRO 2 HA PRO 2 16.072 3.457 22.532 7 1HB PRO 2 1HB PRO 2 15.708 0.778 22.286 8 2HB PRO 2 2HB PRO 2 15.461 1.645 23.807 9 1HG PRO 2 1HG PRO 2 13.440 0.745 21.789 10 2HG PRO 2 2HG PRO 2 13.372 0.654 23.560 11 1HD PRO 2 1HD PRO 2 12.087 2.576 22.153 12 2HD PRO 2 2HD PRO 2 12.749 2.863 23.776 13 H TYR 3 H TYR 3 13.755 2.497 20.081 14 HA TYR 3 HA TYR 3 15.956 2.370 18.130 15 1HB TYR 3 1HB TYR 3 14.372 0.223 18.863 16 2HB TYR 3 2HB TYR 3 13.600 0.803 17.390 17 HD1 TYR 3 HD1 TYR 3 15.658 1.588 15.625 18 HD2 TYR 3 HD2 TYR 3 15.714 -1.597 18.444 19 HE1 TYR 3 HE1 TYR 3 17.359 0.433 14.276 20 HE2 TYR 3 HE2 TYR 3 17.415 -2.761 17.104 21 HH TYR 3 HH TYR 3 18.132 -2.765 14.639 22 H GLY 4 H GLY 4 12.384 2.459 18.149 23 1HA GLY 4 1HA GLY 4 10.943 4.010 17.219 24 2HA GLY 4 2HA GLY 4 12.331 5.025 16.860 25 H HIS 5 H HIS 5 10.286 2.437 15.712 26 HA HIS 5 HA HIS 5 11.560 2.613 13.067 27 1HB HIS 5 1HB HIS 5 11.308 0.360 14.273 28 2HB HIS 5 2HB HIS 5 9.590 0.499 13.918 29 HD1 HIS 5 HD1 HIS 5 12.757 0.918 11.831 30 HD2 HIS 5 HD2 HIS 5 9.033 -0.921 11.699 31 HE1 HIS 5 HE1 HIS 5 12.668 -0.262 9.612 32 HE2 HIS 5 HE2 HIS 5 10.441 -1.441 9.593 33 H GLN 6 H GLN 6 10.498 4.563 12.496 34 HA GLN 6 HA GLN 6 7.712 4.940 12.584 35 1HB GLN 6 1HB GLN 6 8.107 6.756 10.957 36 2HB GLN 6 2HB GLN 6 9.224 6.815 12.315 37 1HG GLN 6 1HG GLN 6 10.873 6.936 10.848 38 2HG GLN 6 2HG GLN 6 10.518 5.267 10.405 39 1HE2 GLN 6 1HE2 GLN 6 10.857 5.302 8.267 40 2HE2 GLN 6 2HE2 GLN 6 10.017 6.318 7.151 41 H SER 7 H SER 7 9.799 3.356 10.277 42 HA SER 7 HA SER 7 8.087 3.271 8.066 43 1HB SER 7 1HB SER 7 9.888 0.963 8.729 44 2HB SER 7 2HB SER 7 9.546 1.693 7.160 45 HG SER 7 HG SER 7 11.653 2.144 8.390 46 H GLY 8 H GLY 8 6.702 1.619 7.284 47 1HA GLY 8 1HA GLY 8 5.913 -0.519 9.077 48 2HA GLY 8 2HA GLY 8 4.701 0.731 8.843 49 H ALA 9 H ALA 9 4.937 -2.197 8.060 50 HA ALA 9 HA ALA 9 4.233 -1.820 5.223 51 1HB ALA 9 1HB ALA 9 5.596 -4.238 6.403 52 2HB ALA 9 2HB ALA 9 6.396 -2.978 5.464 53 3HB ALA 9 3HB ALA 9 5.167 -3.993 4.710 54 H VAL 10 H VAL 10 3.192 -4.207 4.587 55 HA VAL 10 HA VAL 10 0.928 -4.489 6.457 56 HB VAL 10 HB VAL 10 0.931 -5.067 3.491 57 1HG1 VAL 10 1HG1 VAL 10 -1.598 -4.586 4.894 58 2HG1 VAL 10 2HG1 VAL 10 -0.751 -6.052 5.390 59 3HG1 VAL 10 3HG1 VAL 10 -1.177 -5.809 3.695 60 1HG2 VAL 10 1HG2 VAL 10 -0.488 -2.759 4.765 61 2HG2 VAL 10 2HG2 VAL 10 -0.028 -2.995 3.078 62 3HG2 VAL 10 3HG2 VAL 10 1.204 -2.618 4.283 63 H TYR 11 H TYR 11 1.398 -6.241 7.685 64 HA TYR 11 HA TYR 11 2.478 -8.636 6.385 65 1HB TYR 11 1HB TYR 11 3.620 -7.895 8.405 66 2HB TYR 11 2HB TYR 11 2.108 -7.918 9.303 67 HD1 TYR 11 HD1 TYR 11 5.035 -9.710 8.546 68 HD2 TYR 11 HD2 TYR 11 0.904 -10.263 9.397 69 HE1 TYR 11 HE1 TYR 11 5.493 -12.024 9.234 70 HE2 TYR 11 HE2 TYR 11 1.350 -12.580 10.083 71 HH TYR 11 HH TYR 11 3.127 -13.972 10.821 72 H VAL 12 H VAL 12 1.069 -10.085 5.661 73 HA VAL 12 HA VAL 12 -1.427 -10.490 7.173 74 HB VAL 12 HB VAL 12 -1.107 -10.845 4.191 75 1HG1 VAL 12 1HG1 VAL 12 -2.871 -12.200 4.617 76 2HG1 VAL 12 2HG1 VAL 12 -3.741 -10.666 4.597 77 3HG1 VAL 12 3HG1 VAL 12 -3.267 -11.389 6.134 78 1HG2 VAL 12 1HG2 VAL 12 -2.929 -8.820 4.634 79 2HG2 VAL 12 2HG2 VAL 12 -1.266 -8.626 4.079 80 3HG2 VAL 12 3HG2 VAL 12 -1.644 -8.487 5.796 81 H GLY 13 H GLY 13 -1.232 -12.339 8.269 82 1HA GLY 13 1HA GLY 13 -0.803 -14.543 8.755 83 2HA GLY 13 2HA GLY 13 -1.190 -14.837 7.068 84 H ASN 14 H ASN 14 0.310 -16.127 6.240 85 HA ASN 14 HA ASN 14 3.060 -15.988 7.165 86 1HB ASN 14 1HB ASN 14 1.828 -17.840 5.116 87 2HB ASN 14 2HB ASN 14 3.402 -18.024 5.885 88 1HD2 ASN 14 1HD2 ASN 14 3.008 -17.652 8.458 89 2HD2 ASN 14 2HD2 ASN 14 1.862 -18.771 9.104 90 H TYR 15 H TYR 15 1.594 -14.026 5.223 91 HA TYR 15 HA TYR 15 3.831 -13.853 3.310 92 1HB TYR 15 1HB TYR 15 0.876 -13.617 2.796 93 2HB TYR 15 2HB TYR 15 2.024 -12.762 1.779 94 HD1 TYR 15 HD1 TYR 15 0.127 -14.661 0.678 95 HD2 TYR 15 HD2 TYR 15 4.011 -15.353 2.260 96 HE1 TYR 15 HE1 TYR 15 0.323 -16.669 -0.706 97 HE2 TYR 15 HE2 TYR 15 4.216 -17.362 0.867 98 HH TYR 15 HH TYR 15 3.240 -18.251 -1.249 99 H LYS 16 H LYS 16 4.816 -11.894 3.381 100 HA LYS 16 HA LYS 16 3.326 -9.665 4.610 101 1HB LYS 16 1HB LYS 16 5.238 -10.593 5.972 102 2HB LYS 16 2HB LYS 16 6.320 -10.043 4.698 103 1HG LYS 16 1HG LYS 16 4.963 -7.769 5.175 104 2HG LYS 16 2HG LYS 16 4.900 -8.515 6.773 105 1HD LYS 16 1HD LYS 16 7.091 -8.186 7.139 106 2HD LYS 16 2HD LYS 16 7.531 -8.656 5.496 107 1HE LYS 16 1HE LYS 16 7.549 -6.531 4.763 108 2HE LYS 16 2HE LYS 16 6.116 -6.094 5.693 109 1HZ LYS 16 1HZ LYS 16 8.381 -5.053 6.295 110 2HZ LYS 16 2HZ LYS 16 8.686 -6.527 7.065 111 3HZ LYS 16 3HZ LYS 16 7.367 -5.582 7.542 112 H VAL 17 H VAL 17 2.821 -8.165 3.130 113 HA VAL 17 HA VAL 17 4.608 -7.860 0.831 114 HB VAL 17 HB VAL 17 2.856 -7.360 -0.486 115 1HG1 VAL 17 1HG1 VAL 17 1.183 -8.369 1.804 116 2HG1 VAL 17 2HG1 VAL 17 2.168 -9.399 0.765 117 3HG1 VAL 17 3HG1 VAL 17 0.826 -8.481 0.080 118 1HG2 VAL 17 1HG2 VAL 17 0.923 -5.978 0.135 119 2HG2 VAL 17 2HG2 VAL 17 2.452 -5.166 0.473 120 3HG2 VAL 17 3HG2 VAL 17 1.529 -5.889 1.791 121 H VAL 18 H VAL 18 5.951 -6.237 0.735 122 HA VAL 18 HA VAL 18 5.270 -3.700 2.038 123 HB VAL 18 HB VAL 18 6.747 -4.937 3.575 124 1HG1 VAL 18 1HG1 VAL 18 9.113 -4.651 1.855 125 2HG1 VAL 18 2HG1 VAL 18 7.974 -5.910 1.375 126 3HG1 VAL 18 3HG1 VAL 18 8.679 -5.927 2.992 127 1HG2 VAL 18 1HG2 VAL 18 8.235 -2.634 2.331 128 2HG2 VAL 18 2HG2 VAL 18 8.265 -3.161 4.014 129 3HG2 VAL 18 3HG2 VAL 18 6.804 -2.437 3.344 130 H ASN 19 H ASN 19 6.613 -1.878 1.266 131 HA ASN 19 HA ASN 19 6.711 -1.750 -1.528 132 1HB ASN 19 1HB ASN 19 7.938 -0.027 0.622 133 2HB ASN 19 2HB ASN 19 8.123 0.344 -1.089 134 1HD2 ASN 19 1HD2 ASN 19 6.529 1.369 -2.123 135 2HD2 ASN 19 2HD2 ASN 19 4.998 1.768 -1.430 136 H ARG 20 H ARG 20 8.364 -1.946 -3.015 137 HA ARG 20 HA ARG 20 10.371 -3.808 -2.536 138 1HB ARG 20 1HB ARG 20 11.302 -3.142 -4.700 139 2HB ARG 20 2HB ARG 20 9.554 -3.297 -4.779 140 1HG ARG 20 1HG ARG 20 9.812 -1.350 -5.914 141 2HG ARG 20 2HG ARG 20 9.663 -0.704 -4.279 142 1HD ARG 20 1HD ARG 20 11.588 0.354 -4.712 143 2HD ARG 20 2HD ARG 20 12.345 -1.216 -4.462 144 HE ARG 20 HE ARG 20 12.670 -1.411 -6.744 145 1HH1 ARG 20 1HH1 ARG 20 10.727 1.409 -6.049 146 2HH1 ARG 20 2HH1 ARG 20 10.897 2.068 -7.640 147 1HH2 ARG 20 1HH2 ARG 20 12.889 -0.541 -8.834 148 2HH2 ARG 20 2HH2 ARG 20 12.122 0.962 -9.221 149 H HIS 21 H HIS 21 10.617 -0.262 -2.660 150 HA HIS 21 HA HIS 21 13.403 -0.202 -2.135 151 1HB HIS 21 1HB HIS 21 13.026 2.204 -1.646 152 2HB HIS 21 2HB HIS 21 12.319 1.696 -3.176 153 HD1 HIS 21 HD1 HIS 21 11.486 3.219 0.060 154 HD2 HIS 21 HD2 HIS 21 9.444 1.457 -3.101 155 HE1 HIS 21 HE1 HIS 21 9.079 3.882 0.361 156 HE2 HIS 21 HE2 HIS 21 7.877 2.875 -1.611 157 H LEU 22 H LEU 22 10.809 -1.007 -0.144 158 HA LEU 22 HA LEU 22 12.335 -0.280 2.261 159 1HB LEU 22 1HB LEU 22 9.869 0.553 1.733 160 2HB LEU 22 2HB LEU 22 9.459 -0.999 2.439 161 HG LEU 22 HG LEU 22 11.212 -0.017 4.289 162 1HD1 LEU 22 1HD1 LEU 22 11.534 2.148 3.721 163 2HD1 LEU 22 2HD1 LEU 22 10.011 2.350 4.586 164 3HD1 LEU 22 3HD1 LEU 22 10.019 2.256 2.825 165 1HD2 LEU 22 1HD2 LEU 22 9.331 0.233 5.695 166 2HD2 LEU 22 2HD2 LEU 22 8.915 -1.041 4.549 167 3HD2 LEU 22 3HD2 LEU 22 8.266 0.585 4.334 168 H ALA 23 H ALA 23 11.818 -2.925 0.357 169 HA ALA 23 HA ALA 23 11.285 -4.787 2.525 170 1HB ALA 23 1HB ALA 23 11.381 -4.937 -0.413 171 2HB ALA 23 2HB ALA 23 10.289 -5.710 0.733 172 3HB ALA 23 3HB ALA 23 11.888 -6.389 0.449 173 H THR 24 H THR 24 12.762 -5.890 3.641 174 HA THR 24 HA THR 24 15.537 -5.271 3.322 175 HB THR 24 HB THR 24 15.885 -6.670 5.269 176 HG1 THR 24 HG1 THR 24 14.671 -8.409 5.168 177 1HG2 THR 24 1HG2 THR 24 15.001 -4.540 5.858 178 2HG2 THR 24 2HG2 THR 24 14.210 -5.756 6.861 179 3HG2 THR 24 3HG2 THR 24 13.357 -5.059 5.484 180 H HIS 25 H HIS 25 17.227 -6.979 3.208 181 HA HIS 25 HA HIS 25 17.077 -8.425 0.853 182 1HB HIS 25 1HB HIS 25 18.832 -9.122 3.213 183 2HB HIS 25 2HB HIS 25 19.134 -9.503 1.521 184 HD1 HIS 25 HD1 HIS 25 20.053 -7.621 0.027 185 HD2 HIS 25 HD2 HIS 25 19.394 -6.474 3.967 186 HE1 HIS 25 HE1 HIS 25 21.200 -5.397 0.281 187 HE2 HIS 25 HE2 HIS 25 20.737 -4.693 2.655 188 H VAL 26 H VAL 26 16.093 -9.327 4.070 189 HA VAL 26 HA VAL 26 15.888 -12.126 3.592 190 HB VAL 26 HB VAL 26 14.342 -10.517 5.628 191 1HG1 VAL 26 1HG1 VAL 26 15.272 -13.248 6.211 192 2HG1 VAL 26 2HG1 VAL 26 14.024 -13.117 4.972 193 3HG1 VAL 26 3HG1 VAL 26 13.738 -12.465 6.585 194 1HG2 VAL 26 1HG2 VAL 26 16.499 -9.921 6.171 195 2HG2 VAL 26 2HG2 VAL 26 17.180 -11.440 5.588 196 3HG2 VAL 26 3HG2 VAL 26 16.301 -11.398 7.116 197 H ASP 27 H ASP 27 13.760 -9.384 3.079 198 HA ASP 27 HA ASP 27 11.373 -10.864 2.699 199 1HB ASP 27 1HB ASP 27 12.271 -8.073 2.057 200 2HB ASP 27 2HB ASP 27 10.783 -8.684 1.340 201 H TRP 28 H TRP 28 13.869 -9.593 0.545 202 HA TRP 28 HA TRP 28 12.622 -10.610 -1.794 203 1HB TRP 28 1HB TRP 28 15.471 -9.683 -1.421 204 2HB TRP 28 2HB TRP 28 14.668 -9.951 -2.966 205 HD1 TRP 28 HD1 TRP 28 14.294 -7.683 0.134 206 HE1 TRP 28 HE1 TRP 28 13.353 -5.422 -0.620 207 HE3 TRP 28 HE3 TRP 28 13.546 -8.739 -4.802 208 HZ2 TRP 28 HZ2 TRP 28 12.384 -4.245 -2.969 209 HZ3 TRP 28 HZ3 TRP 28 12.597 -6.983 -6.244 210 HH2 TRP 28 HH2 TRP 28 12.030 -4.784 -5.349 211 H GLN 29 H GLN 29 15.006 -11.761 0.463 212 HA GLN 29 HA GLN 29 16.131 -13.860 -0.979 213 1HB GLN 29 1HB GLN 29 17.001 -13.123 1.179 214 2HB GLN 29 2HB GLN 29 15.540 -13.679 1.982 215 1HG GLN 29 1HG GLN 29 17.022 -15.375 2.426 216 2HG GLN 29 2HG GLN 29 16.173 -15.988 1.009 217 1HE2 GLN 29 1HE2 GLN 29 18.915 -13.814 1.625 218 2HE2 GLN 29 2HE2 GLN 29 19.985 -14.568 0.498 219 H ASN 30 H ASN 30 13.199 -13.776 1.003 220 HA ASN 30 HA ASN 30 12.454 -16.402 -0.106 221 1HB ASN 30 1HB ASN 30 12.294 -15.293 2.599 222 2HB ASN 30 2HB ASN 30 10.771 -15.984 2.048 223 1HD2 ASN 30 1HD2 ASN 30 10.505 -18.073 2.331 224 2HD2 ASN 30 2HD2 ASN 30 11.761 -19.231 2.594 225 H CYS 31 H CYS 31 12.086 -13.810 -1.366 226 HA CYS 31 HA CYS 31 9.370 -12.996 -1.073 227 1HB CYS 31 1HB CYS 31 10.911 -11.368 -1.869 228 2HB CYS 31 2HB CYS 31 11.480 -12.426 -3.154 229 HG CYS 31 HG CYS 31 8.726 -10.977 -3.199 230 H VAL 32 H VAL 32 7.605 -13.826 -1.933 231 HA VAL 32 HA VAL 32 7.822 -16.056 -3.781 232 HB VAL 32 HB VAL 32 5.350 -16.256 -3.440 233 1HG1 VAL 32 1HG1 VAL 32 7.380 -16.492 -1.307 234 2HG1 VAL 32 2HG1 VAL 32 6.334 -17.719 -2.023 235 3HG1 VAL 32 3HG1 VAL 32 5.692 -16.613 -0.805 236 1HG2 VAL 32 1HG2 VAL 32 4.948 -13.868 -2.925 237 2HG2 VAL 32 2HG2 VAL 32 5.759 -14.101 -1.375 238 3HG2 VAL 32 3HG2 VAL 32 4.260 -14.962 -1.724 239 H TRP 33 H TRP 33 6.433 -12.796 -3.645 240 HA TRP 33 HA TRP 33 6.338 -12.798 -6.574 241 1HB TRP 33 1HB TRP 33 4.092 -13.166 -6.351 242 2HB TRP 33 2HB TRP 33 4.029 -12.476 -4.735 243 HD1 TRP 33 HD1 TRP 33 3.446 -11.609 -8.363 244 HE1 TRP 33 HE1 TRP 33 2.571 -9.192 -8.529 245 HE3 TRP 33 HE3 TRP 33 4.254 -10.131 -3.551 246 HZ2 TRP 33 HZ2 TRP 33 2.269 -6.945 -6.821 247 HZ3 TRP 33 HZ3 TRP 33 3.657 -7.839 -2.895 248 HH2 TRP 33 HH2 TRP 33 2.687 -6.286 -4.506 249 H GLU 34 H GLU 34 6.403 -10.708 -7.544 250 HA GLU 34 HA GLU 34 6.739 -8.369 -5.895 251 1HB GLU 34 1HB GLU 34 8.963 -9.370 -5.702 252 2HB GLU 34 2HB GLU 34 9.091 -9.457 -7.453 253 1HG GLU 34 1HG GLU 34 8.493 -6.773 -6.587 254 2HG GLU 34 2HG GLU 34 9.945 -7.392 -5.804 255 H ASP 35 H ASP 35 5.735 -6.806 -6.971 256 HA ASP 35 HA ASP 35 5.677 -6.922 -9.909 257 1HB ASP 35 1HB ASP 35 3.709 -6.134 -7.860 258 2HB ASP 35 2HB ASP 35 3.776 -5.081 -9.270 259 H TYR 36 H TYR 36 6.969 -5.559 -10.931 260 HA TYR 36 HA TYR 36 8.323 -3.436 -9.631 261 1HB TYR 36 1HB TYR 36 9.021 -2.838 -12.015 262 2HB TYR 36 2HB TYR 36 9.477 -4.433 -11.429 263 HD1 TYR 36 HD1 TYR 36 8.571 -6.424 -12.421 264 HD2 TYR 36 HD2 TYR 36 7.227 -2.590 -13.684 265 HE1 TYR 36 HE1 TYR 36 7.489 -7.454 -14.375 266 HE2 TYR 36 HE2 TYR 36 6.141 -3.610 -15.641 267 HH TYR 36 HH TYR 36 5.589 -6.896 -15.934 268 H ASN 37 H ASN 37 5.480 -3.579 -11.709 269 HA ASN 37 HA ASN 37 5.242 -0.770 -12.067 270 1HB ASN 37 1HB ASN 37 3.102 -2.900 -12.268 271 2HB ASN 37 2HB ASN 37 3.005 -1.267 -12.918 272 1HD2 ASN 37 1HD2 ASN 37 3.082 -4.119 -14.043 273 2HD2 ASN 37 2HD2 ASN 37 4.217 -4.002 -15.339 274 H ARG 38 H ARG 38 4.706 -2.777 -9.396 275 HA ARG 38 HA ARG 38 2.964 -0.748 -8.160 276 1HB ARG 38 1HB ARG 38 3.124 -3.725 -7.728 277 2HB ARG 38 2HB ARG 38 2.361 -2.653 -6.561 278 1HG ARG 38 1HG ARG 38 0.492 -3.003 -7.717 279 2HG ARG 38 2HG ARG 38 1.177 -1.897 -8.910 280 1HD ARG 38 1HD ARG 38 1.945 -3.653 -10.261 281 2HD ARG 38 2HD ARG 38 1.766 -4.838 -8.968 282 HE ARG 38 HE ARG 38 -0.766 -3.988 -9.365 283 1HH1 ARG 38 1HH1 ARG 38 1.704 -5.186 -11.519 284 2HH1 ARG 38 2HH1 ARG 38 0.573 -5.875 -12.635 285 1HH2 ARG 38 1HH2 ARG 38 -2.255 -4.893 -10.832 286 2HH2 ARG 38 2HH2 ARG 38 -1.675 -5.708 -12.245 287 H ASP 39 H ASP 39 6.073 -1.964 -8.196 288 HA ASP 39 HA ASP 39 7.851 -1.885 -6.767 289 1HB ASP 39 1HB ASP 39 6.231 0.542 -6.126 290 2HB ASP 39 2HB ASP 39 7.589 0.148 -5.078 291 H LEU 40 H LEU 40 5.760 -3.664 -6.050 292 HA LEU 40 HA LEU 40 6.154 -3.750 -3.138 293 1HB LEU 40 1HB LEU 40 3.902 -2.968 -3.525 294 2HB LEU 40 2HB LEU 40 3.600 -4.269 -4.658 295 HG LEU 40 HG LEU 40 3.923 -5.872 -2.720 296 1HD1 LEU 40 1HD1 LEU 40 4.278 -5.161 -0.623 297 2HD1 LEU 40 2HD1 LEU 40 3.217 -3.765 -0.809 298 3HD1 LEU 40 3HD1 LEU 40 4.877 -3.695 -1.401 299 1HD2 LEU 40 1HD2 LEU 40 1.724 -4.922 -3.723 300 2HD2 LEU 40 2HD2 LEU 40 1.628 -4.026 -2.204 301 3HD2 LEU 40 3HD2 LEU 40 1.674 -5.789 -2.186 302 H LEU 41 H LEU 41 6.146 -5.859 -2.213 303 HA LEU 41 HA LEU 41 6.109 -8.128 -4.016 304 1HB LEU 41 1HB LEU 41 8.292 -8.967 -3.421 305 2HB LEU 41 2HB LEU 41 8.420 -7.402 -4.181 306 HG LEU 41 HG LEU 41 9.647 -8.267 -1.809 307 1HD1 LEU 41 1HD1 LEU 41 10.497 -6.686 -3.486 308 2HD1 LEU 41 2HD1 LEU 41 10.660 -6.085 -1.837 309 3HD1 LEU 41 3HD1 LEU 41 9.380 -5.466 -2.878 310 1HD2 LEU 41 1HD2 LEU 41 7.395 -6.385 -1.228 311 2HD2 LEU 41 2HD2 LEU 41 8.888 -6.324 -0.308 312 3HD2 LEU 41 3HD2 LEU 41 7.928 -7.801 -0.329 313 H VAL 42 H VAL 42 6.079 -10.191 -2.950 314 HA VAL 42 HA VAL 42 5.170 -9.976 -0.161 315 HB VAL 42 HB VAL 42 4.201 -11.796 -2.370 316 1HG1 VAL 42 1HG1 VAL 42 3.338 -12.065 0.500 317 2HG1 VAL 42 2HG1 VAL 42 4.623 -13.052 -0.186 318 3HG1 VAL 42 3HG1 VAL 42 2.995 -13.144 -0.851 319 1HG2 VAL 42 1HG2 VAL 42 2.483 -10.402 -2.466 320 2HG2 VAL 42 2HG2 VAL 42 3.250 -9.384 -1.246 321 3HG2 VAL 42 3HG2 VAL 42 2.140 -10.668 -0.756 322 H SER 43 H SER 43 6.170 -11.131 1.315 323 HA SER 43 HA SER 43 8.005 -13.262 0.450 324 1HB SER 43 1HB SER 43 9.683 -12.524 1.872 325 2HB SER 43 2HB SER 43 8.995 -10.991 1.337 326 HG SER 43 HG SER 43 8.566 -12.341 3.788 327 H THR 44 H THR 44 8.352 -14.950 2.064 328 HA THR 44 HA THR 44 5.900 -15.383 3.589 329 HB THR 44 HB THR 44 6.456 -17.717 3.570 330 HG1 THR 44 HG1 THR 44 8.952 -16.836 2.571 331 1HG2 THR 44 1HG2 THR 44 5.820 -16.359 1.358 332 2HG2 THR 44 2HG2 THR 44 6.019 -18.116 1.412 333 3HG2 THR 44 3HG2 THR 44 7.340 -17.096 0.841 334 H THR 45 H THR 45 5.843 -15.921 5.726 335 HA THR 45 HA THR 45 8.330 -15.784 7.262 336 HB THR 45 HB THR 45 7.677 -13.560 7.500 337 HG1 THR 45 HG1 THR 45 6.208 -14.744 9.605 338 1HG2 THR 45 1HG2 THR 45 5.620 -12.668 7.322 339 2HG2 THR 45 2HG2 THR 45 4.851 -13.982 8.211 340 3HG2 THR 45 3HG2 THR 45 5.267 -14.194 6.512 341 H THR 46 H THR 46 7.837 -16.290 9.652 342 HA THR 46 HA THR 46 5.737 -18.352 9.802 343 HB THR 46 HB THR 46 7.968 -19.379 9.617 344 HG1 THR 46 HG1 THR 46 6.718 -19.600 12.149 345 1HG2 THR 46 1HG2 THR 46 9.740 -18.981 10.973 346 2HG2 THR 46 2HG2 THR 46 8.735 -18.451 12.322 347 3HG2 THR 46 3HG2 THR 46 9.026 -17.369 10.959 348 H ALA 47 H ALA 47 4.751 -16.169 10.607 349 HA ALA 47 HA ALA 47 4.943 -16.211 13.538 350 1HB ALA 47 1HB ALA 47 5.492 -13.953 11.754 351 2HB ALA 47 2HB ALA 47 5.980 -14.225 13.427 352 3HB ALA 47 3HB ALA 47 4.375 -13.589 13.068 353 H HIS 48 H HIS 48 3.048 -14.474 14.254 354 HA HIS 48 HA HIS 48 0.621 -15.752 13.277 355 1HB HIS 48 1HB HIS 48 1.483 -14.838 15.791 356 2HB HIS 48 2HB HIS 48 0.173 -13.760 15.324 357 HD1 HIS 48 HD1 HIS 48 -2.192 -14.748 15.215 358 HD2 HIS 48 HD2 HIS 48 0.734 -17.518 16.231 359 HE1 HIS 48 HE1 HIS 48 -3.439 -16.779 16.018 360 HE2 HIS 48 HE2 HIS 48 -1.649 -18.465 16.569 361 H GLY 49 H GLY 49 -1.092 -14.687 12.333 362 1HA GLY 49 1HA GLY 49 -0.516 -12.470 10.705 363 2HA GLY 49 2HA GLY 49 -2.122 -13.110 11.021 364 H CYS 50 H CYS 50 -1.545 -10.374 10.684 365 HA CYS 50 HA CYS 50 -2.454 -9.383 13.280 366 1HB CYS 50 1HB CYS 50 0.161 -9.016 12.510 367 2HB CYS 50 2HB CYS 50 -0.604 -7.531 11.952 368 HG CYS 50 HG CYS 50 -0.367 -8.403 14.914 369 H ASP 51 H ASP 51 -1.817 -8.575 9.876 370 HA ASP 51 HA ASP 51 -4.089 -6.717 9.938 371 1HB ASP 51 1HB ASP 51 -2.038 -7.041 7.742 372 2HB ASP 51 2HB ASP 51 -3.194 -5.727 7.936 373 H THR 52 H THR 52 -5.821 -6.928 8.576 374 HA THR 52 HA THR 52 -5.963 -9.425 7.016 375 HB THR 52 HB THR 52 -8.203 -8.038 8.504 376 HG1 THR 52 HG1 THR 52 -6.952 -10.529 9.015 377 1HG2 THR 52 1HG2 THR 52 -8.199 -10.594 6.922 378 2HG2 THR 52 2HG2 THR 52 -9.128 -9.132 6.590 379 3HG2 THR 52 3HG2 THR 52 -9.484 -10.098 8.022 380 H ILE 53 H ILE 53 -6.169 -9.093 4.900 381 HA ILE 53 HA ILE 53 -6.680 -6.471 3.861 382 HB ILE 53 HB ILE 53 -6.776 -8.888 2.107 383 1HG1 ILE 53 1HG1 ILE 53 -4.753 -8.891 3.827 384 2HG1 ILE 53 2HG1 ILE 53 -4.520 -9.318 2.138 385 1HG2 ILE 53 1HG2 ILE 53 -7.185 -6.825 1.027 386 2HG2 ILE 53 2HG2 ILE 53 -5.542 -7.300 0.597 387 3HG2 ILE 53 3HG2 ILE 53 -5.808 -6.060 1.821 388 1HD1 ILE 53 1HD1 ILE 53 -3.782 -6.991 1.713 389 2HD1 ILE 53 2HD1 ILE 53 -2.748 -7.877 2.833 390 3HD1 ILE 53 3HD1 ILE 53 -3.893 -6.682 3.446 391 H ALA 54 H ALA 54 -8.467 -5.678 2.865 392 HA ALA 54 HA ALA 54 -10.937 -7.177 3.288 393 1HB ALA 54 1HB ALA 54 -11.430 -4.577 2.233 394 2HB ALA 54 2HB ALA 54 -10.216 -4.449 3.506 395 3HB ALA 54 3HB ALA 54 -11.773 -5.201 3.846 396 H ARG 55 H ARG 55 -12.020 -8.113 1.683 397 HA ARG 55 HA ARG 55 -11.087 -7.738 -1.054 398 1HB ARG 55 1HB ARG 55 -11.925 -9.966 0.373 399 2HB ARG 55 2HB ARG 55 -13.281 -9.621 -0.689 400 1HG ARG 55 1HG ARG 55 -10.539 -9.662 -1.842 401 2HG ARG 55 2HG ARG 55 -11.333 -11.191 -1.458 402 1HD ARG 55 1HD ARG 55 -12.643 -9.039 -3.099 403 2HD ARG 55 2HD ARG 55 -11.652 -10.310 -3.815 404 HE ARG 55 HE ARG 55 -13.369 -11.778 -2.448 405 1HH1 ARG 55 1HH1 ARG 55 -13.972 -8.965 -4.433 406 2HH1 ARG 55 2HH1 ARG 55 -15.576 -9.458 -4.857 407 1HH2 ARG 55 1HH2 ARG 55 -15.477 -12.421 -3.010 408 2HH2 ARG 55 2HH2 ARG 55 -16.430 -11.417 -4.051 409 H CYS 56 H CYS 56 -12.541 -5.615 0.186 410 HA CYS 56 HA CYS 56 -15.152 -5.687 -1.135 411 1HB CYS 56 1HB CYS 56 -15.626 -3.642 0.170 412 2HB CYS 56 2HB CYS 56 -15.164 -4.993 1.199 413 H GLN 57 H GLN 57 -15.855 -3.767 -2.331 414 HA GLN 57 HA GLN 57 -13.610 -2.537 -3.790 415 1HB GLN 57 1HB GLN 57 -15.433 -4.156 -4.890 416 2HB GLN 57 2HB GLN 57 -16.316 -2.641 -5.014 417 1HG GLN 57 1HG GLN 57 -13.495 -2.738 -5.951 418 2HG GLN 57 2HG GLN 57 -14.755 -3.467 -6.946 419 1HE2 GLN 57 1HE2 GLN 57 -16.545 -2.101 -7.582 420 2HE2 GLN 57 2HE2 GLN 57 -16.282 -0.409 -7.811 421 H CYS 58 H CYS 58 -14.724 -1.474 -1.362 422 HA CYS 58 HA CYS 58 -16.629 0.531 -1.763 423 1HB CYS 58 1HB CYS 58 -14.297 0.559 0.166 424 2HB CYS 58 2HB CYS 58 -15.730 1.573 0.271 425 H THR 59 H THR 59 -16.584 2.413 -2.809 426 HA THR 59 HA THR 59 -14.299 3.218 -4.290 427 HB THR 59 HB THR 59 -16.583 5.074 -3.738 428 HG1 THR 59 HG1 THR 59 -17.768 3.934 -5.344 429 1HG2 THR 59 1HG2 THR 59 -14.720 4.565 -5.990 430 2HG2 THR 59 2HG2 THR 59 -15.266 6.090 -5.291 431 3HG2 THR 59 3HG2 THR 59 -16.338 5.167 -6.345 432 H THR 60 H THR 60 -15.314 3.807 -1.080 433 HA THR 60 HA THR 60 -13.246 5.878 -0.823 434 HB THR 60 HB THR 60 -15.240 7.116 -0.628 435 HG1 THR 60 HG1 THR 60 -14.850 7.953 1.267 436 1HG2 THR 60 1HG2 THR 60 -16.396 5.274 1.421 437 2HG2 THR 60 2HG2 THR 60 -16.686 5.025 -0.301 438 3HG2 THR 60 3HG2 THR 60 -17.191 6.528 0.470 439 H GLY 61 H GLY 61 -12.134 5.951 1.150 440 1HA GLY 61 1HA GLY 61 -12.639 3.911 3.153 441 2HA GLY 61 2HA GLY 61 -11.150 3.711 2.237 442 H VAL 62 H VAL 62 -9.799 4.060 4.024 443 HA VAL 62 HA VAL 62 -9.593 6.880 4.779 444 HB VAL 62 HB VAL 62 -10.833 5.864 6.605 445 1HG1 VAL 62 1HG1 VAL 62 -9.880 4.077 7.966 446 2HG1 VAL 62 2HG1 VAL 62 -8.500 3.971 6.872 447 3HG1 VAL 62 3HG1 VAL 62 -10.115 3.551 6.299 448 1HG2 VAL 62 1HG2 VAL 62 -9.740 7.151 8.045 449 2HG2 VAL 62 2HG2 VAL 62 -8.464 7.310 6.838 450 3HG2 VAL 62 3HG2 VAL 62 -8.359 6.053 8.070 451 H TYR 63 H TYR 63 -7.611 7.595 4.497 452 HA TYR 63 HA TYR 63 -5.433 5.675 4.187 453 1HB TYR 63 1HB TYR 63 -4.215 7.461 3.110 454 2HB TYR 63 2HB TYR 63 -5.836 7.399 2.432 455 HD1 TYR 63 HD1 TYR 63 -7.095 9.358 2.290 456 HD2 TYR 63 HD2 TYR 63 -3.839 9.180 5.029 457 HE1 TYR 63 HE1 TYR 63 -7.386 11.746 2.787 458 HE2 TYR 63 HE2 TYR 63 -4.126 11.569 5.531 459 HH TYR 63 HH TYR 63 -6.144 13.613 3.659 460 H PHE 64 H PHE 64 -3.226 6.547 4.968 461 HA PHE 64 HA PHE 64 -3.557 7.303 7.786 462 1HB PHE 64 1HB PHE 64 -2.032 5.296 6.524 463 2HB PHE 64 2HB PHE 64 -0.875 6.482 7.117 464 HD1 PHE 64 HD1 PHE 64 -3.057 3.780 7.974 465 HD2 PHE 64 HD2 PHE 64 -0.964 7.131 9.557 466 HE1 PHE 64 HE1 PHE 64 -3.256 2.832 10.237 467 HE2 PHE 64 HE2 PHE 64 -1.159 6.189 11.821 468 HZ PHE 64 HZ PHE 64 -2.306 4.037 12.163 469 H CYS 65 H CYS 65 -3.022 9.288 8.403 470 HA CYS 65 HA CYS 65 -1.612 11.034 6.565 471 1HB CYS 65 1HB CYS 65 -3.669 11.466 8.304 472 2HB CYS 65 2HB CYS 65 -2.302 12.072 9.235 473 HG CYS 65 HG CYS 65 -2.480 14.116 7.918 474 H ALA 66 H ALA 66 0.341 12.041 6.949 475 HA ALA 66 HA ALA 66 2.077 10.668 8.846 476 1HB ALA 66 1HB ALA 66 3.814 12.197 7.618 477 2HB ALA 66 2HB ALA 66 2.522 12.354 6.428 478 3HB ALA 66 3HB ALA 66 3.165 10.760 6.826 479 H SER 67 H SER 67 1.012 13.959 8.065 480 HA SER 67 HA SER 67 2.462 15.105 10.278 481 1HB SER 67 1HB SER 67 1.833 16.217 8.001 482 2HB SER 67 2HB SER 67 0.287 16.540 8.786 483 HG SER 67 HG SER 67 1.218 17.954 10.073 484 H LYS 68 H LYS 68 -0.970 14.631 9.462 485 HA LYS 68 HA LYS 68 -1.978 15.587 11.919 486 1HB LYS 68 1HB LYS 68 -3.212 13.676 9.929 487 2HB LYS 68 2HB LYS 68 -4.076 14.449 11.250 488 1HG LYS 68 1HG LYS 68 -2.628 16.291 9.487 489 2HG LYS 68 2HG LYS 68 -3.948 15.403 8.721 490 1HD LYS 68 1HD LYS 68 -5.515 16.560 9.834 491 2HD LYS 68 2HD LYS 68 -4.630 16.465 11.357 492 1HE LYS 68 1HE LYS 68 -3.354 18.212 9.406 493 2HE LYS 68 2HE LYS 68 -4.988 18.726 9.822 494 1HZ LYS 68 1HZ LYS 68 -4.205 18.383 12.225 495 2HZ LYS 68 2HZ LYS 68 -3.674 19.761 11.400 496 3HZ LYS 68 3HZ LYS 68 -2.641 18.436 11.583 497 H SER 69 H SER 69 -0.600 12.554 10.985 498 HA SER 69 HA SER 69 -0.236 10.598 12.092 499 1HB SER 69 1HB SER 69 -0.726 11.782 14.765 500 2HB SER 69 2HB SER 69 0.654 10.855 14.176 501 HG SER 69 HG SER 69 1.470 12.842 14.343 502 H LYS 70 H LYS 70 -3.003 11.429 11.419 503 HA LYS 70 HA LYS 70 -4.396 9.547 13.188 504 1HB LYS 70 1HB LYS 70 -5.631 12.102 12.155 505 2HB LYS 70 2HB LYS 70 -6.366 10.936 13.244 506 1HG LYS 70 1HG LYS 70 -5.397 11.833 15.041 507 2HG LYS 70 2HG LYS 70 -3.839 12.003 14.231 508 1HD LYS 70 1HD LYS 70 -4.460 14.205 14.625 509 2HD LYS 70 2HD LYS 70 -4.977 13.941 12.958 510 1HE LYS 70 1HE LYS 70 -7.218 13.844 13.530 511 2HE LYS 70 2HE LYS 70 -6.876 13.433 15.210 512 1HZ LYS 70 1HZ LYS 70 -6.456 16.079 13.929 513 2HZ LYS 70 2HZ LYS 70 -6.032 15.699 15.522 514 3HZ LYS 70 3HZ LYS 70 -7.658 15.689 15.055 515 H HIS 71 H HIS 71 -6.556 8.911 12.193 516 HA HIS 71 HA HIS 71 -6.036 8.050 9.475 517 1HB HIS 71 1HB HIS 71 -8.279 6.854 9.815 518 2HB HIS 71 2HB HIS 71 -6.938 6.340 10.831 519 HD1 HIS 71 HD1 HIS 71 -10.251 8.059 10.957 520 HD2 HIS 71 HD2 HIS 71 -7.225 6.910 13.564 521 HE1 HIS 71 HE1 HIS 71 -11.218 8.312 13.264 522 HE2 HIS 71 HE2 HIS 71 -9.402 7.521 14.820 523 H TYR 72 H TYR 72 -6.945 8.858 7.675 524 HA TYR 72 HA TYR 72 -9.064 10.880 8.002 525 1HB TYR 72 1HB TYR 72 -6.471 11.023 6.677 526 2HB TYR 72 2HB TYR 72 -7.793 11.481 5.611 527 HD1 TYR 72 HD1 TYR 72 -8.547 13.668 5.639 528 HD2 TYR 72 HD2 TYR 72 -6.494 12.156 9.047 529 HE1 TYR 72 HE1 TYR 72 -8.590 15.908 6.651 530 HE2 TYR 72 HE2 TYR 72 -6.531 14.394 10.071 531 HH TYR 72 HH TYR 72 -8.458 16.709 9.358 532 HA PRO 73 HA PRO 73 -11.092 7.958 5.228 533 1HB PRO 73 1HB PRO 73 -13.521 9.470 5.632 534 2HB PRO 73 2HB PRO 73 -13.118 7.857 6.221 535 1HG PRO 73 1HG PRO 73 -13.408 10.038 7.845 536 2HG PRO 73 2HG PRO 73 -12.404 8.632 8.243 537 1HD PRO 73 1HD PRO 73 -11.585 11.304 7.170 538 2HD PRO 73 2HD PRO 73 -10.794 10.286 8.392 539 H VAL 74 H VAL 74 -10.849 8.207 3.091 540 HA VAL 74 HA VAL 74 -11.896 10.648 1.839 541 HB VAL 74 HB VAL 74 -9.335 10.654 2.179 542 1HG1 VAL 74 1HG1 VAL 74 -8.046 9.546 0.427 543 2HG1 VAL 74 2HG1 VAL 74 -9.514 8.767 -0.165 544 3HG1 VAL 74 3HG1 VAL 74 -8.894 8.379 1.440 545 1HG2 VAL 74 1HG2 VAL 74 -10.501 11.109 -0.559 546 2HG2 VAL 74 2HG2 VAL 74 -8.987 11.782 0.044 547 3HG2 VAL 74 3HG2 VAL 74 -10.518 12.253 0.783 548 H SER 75 H SER 75 -12.361 10.451 -0.427 549 HA SER 75 HA SER 75 -13.128 7.722 -1.159 550 1HB SER 75 1HB SER 75 -14.533 8.844 -2.895 551 2HB SER 75 2HB SER 75 -14.936 9.343 -1.252 552 HG SER 75 HG SER 75 -14.699 11.061 -2.880 553 H PHE 76 H PHE 76 -11.951 6.627 -2.614 554 HA PHE 76 HA PHE 76 -10.294 8.193 -4.476 555 1HB PHE 76 1HB PHE 76 -9.043 5.680 -4.139 556 2HB PHE 76 2HB PHE 76 -8.445 7.260 -3.660 557 HD1 PHE 76 HD1 PHE 76 -7.673 7.372 -1.531 558 HD2 PHE 76 HD2 PHE 76 -10.961 4.810 -2.371 559 HE1 PHE 76 HE1 PHE 76 -7.738 6.703 0.830 560 HE2 PHE 76 HE2 PHE 76 -11.032 4.124 -0.009 561 HZ PHE 76 HZ PHE 76 -9.423 5.073 1.597 562 H GLU 77 H GLU 77 -9.606 7.009 -6.400 563 HA GLU 77 HA GLU 77 -11.738 5.225 -7.372 564 1HB GLU 77 1HB GLU 77 -10.965 7.649 -8.415 565 2HB GLU 77 2HB GLU 77 -10.024 6.521 -9.382 566 1HG GLU 77 1HG GLU 77 -11.823 6.337 -10.666 567 2HG GLU 77 2HG GLU 77 -12.526 5.383 -9.361 568 H GLY 78 H GLY 78 -11.028 3.551 -8.924 569 1HA GLY 78 1HA GLY 78 -8.357 2.578 -8.158 570 2HA GLY 78 2HA GLY 78 -9.686 1.569 -8.700 571 HA PRO 79 HA PRO 79 -7.997 3.614 -12.734 572 1HB PRO 79 1HB PRO 79 -5.678 5.029 -12.537 573 2HB PRO 79 2HB PRO 79 -7.277 5.770 -12.422 574 1HG PRO 79 1HG PRO 79 -5.391 4.985 -10.240 575 2HG PRO 79 2HG PRO 79 -6.385 6.444 -10.390 576 1HD PRO 79 1HD PRO 79 -7.093 4.362 -8.815 577 2HD PRO 79 2HD PRO 79 -8.286 5.383 -9.640 578 H GLY 80 H GLY 80 -6.970 2.226 -14.012 579 1HA GLY 80 1HA GLY 80 -5.432 0.114 -13.018 580 2HA GLY 80 2HA GLY 80 -5.584 0.546 -14.714 581 H LEU 81 H LEU 81 -4.055 1.997 -15.638 582 HA LEU 81 HA LEU 81 -1.478 1.867 -14.274 583 1HB LEU 81 1HB LEU 81 -2.112 1.253 -16.797 584 2HB LEU 81 2HB LEU 81 -1.652 2.931 -17.015 585 HG LEU 81 HG LEU 81 0.326 1.804 -17.404 586 1HD1 LEU 81 1HD1 LEU 81 1.762 2.095 -15.369 587 2HD1 LEU 81 2HD1 LEU 81 0.303 2.568 -14.511 588 3HD1 LEU 81 3HD1 LEU 81 0.861 3.520 -15.883 589 1HD2 LEU 81 1HD2 LEU 81 -0.729 -0.128 -15.454 590 2HD2 LEU 81 2HD2 LEU 81 1.026 0.043 -15.520 591 3HD2 LEU 81 3HD2 LEU 81 0.128 -0.397 -16.973 592 H VAL 82 H VAL 82 -0.709 3.535 -13.222 593 HA VAL 82 HA VAL 82 -1.388 6.246 -14.143 594 HB VAL 82 HB VAL 82 -1.042 5.329 -11.271 595 1HG1 VAL 82 1HG1 VAL 82 -1.579 7.700 -10.713 596 2HG1 VAL 82 2HG1 VAL 82 -1.384 8.098 -12.420 597 3HG1 VAL 82 3HG1 VAL 82 -0.013 7.485 -11.496 598 1HG2 VAL 82 1HG2 VAL 82 -3.410 6.403 -12.804 599 2HG2 VAL 82 2HG2 VAL 82 -3.373 6.192 -11.054 600 3HG2 VAL 82 3HG2 VAL 82 -3.229 4.791 -12.116 601 H GLU 83 H GLU 83 0.344 7.347 -14.788 602 HA GLU 83 HA GLU 83 2.959 6.256 -14.519 603 1HB GLU 83 1HB GLU 83 3.638 8.482 -15.579 604 2HB GLU 83 2HB GLU 83 2.584 7.430 -16.515 605 1HG GLU 83 1HG GLU 83 1.033 8.998 -16.648 606 2HG GLU 83 2HG GLU 83 1.021 9.211 -14.899 607 H VAL 84 H VAL 84 4.014 6.279 -12.670 608 HA VAL 84 HA VAL 84 3.579 8.235 -10.634 609 HB VAL 84 HB VAL 84 4.197 6.154 -9.762 610 1HG1 VAL 84 1HG1 VAL 84 6.394 6.106 -11.813 611 2HG1 VAL 84 2HG1 VAL 84 5.017 5.014 -11.667 612 3HG1 VAL 84 3HG1 VAL 84 6.308 4.972 -10.468 613 1HG2 VAL 84 1HG2 VAL 84 6.941 7.283 -9.656 614 2HG2 VAL 84 2HG2 VAL 84 5.919 6.665 -8.360 615 3HG2 VAL 84 3HG2 VAL 84 5.619 8.267 -9.031 616 H GLN 85 H GLN 85 4.312 10.232 -10.725 617 HA GLN 85 HA GLN 85 6.448 11.023 -12.459 618 1HB GLN 85 1HB GLN 85 6.059 13.271 -11.576 619 2HB GLN 85 2HB GLN 85 4.542 12.505 -12.029 620 1HG GLN 85 1HG GLN 85 4.708 11.813 -9.416 621 2HG GLN 85 2HG GLN 85 5.507 13.384 -9.404 622 1HE2 GLN 85 1HE2 GLN 85 2.571 11.720 -10.428 623 2HE2 GLN 85 2HE2 GLN 85 1.528 13.090 -10.284 624 H GLU 86 H GLU 86 8.480 11.897 -11.844 625 HA GLU 86 HA GLU 86 9.703 10.531 -9.687 626 1HB GLU 86 1HB GLU 86 10.688 11.562 -11.928 627 2HB GLU 86 2HB GLU 86 11.003 12.934 -10.875 628 1HG GLU 86 1HG GLU 86 11.838 10.260 -9.918 629 2HG GLU 86 2HG GLU 86 12.754 10.979 -11.242 630 H SER 87 H SER 87 8.996 11.010 -7.695 631 HA SER 87 HA SER 87 9.538 13.699 -6.701 632 1HB SER 87 1HB SER 87 6.884 12.717 -7.176 633 2HB SER 87 2HB SER 87 7.121 12.925 -5.441 634 HG SER 87 HG SER 87 6.608 14.792 -7.196 635 H GLU 88 H GLU 88 9.746 13.814 -4.395 636 HA GLU 88 HA GLU 88 10.657 13.078 -2.446 637 1HB GLU 88 1HB GLU 88 8.183 12.230 -2.492 638 2HB GLU 88 2HB GLU 88 8.919 10.642 -2.629 639 1HG GLU 88 1HG GLU 88 9.668 10.648 -0.501 640 2HG GLU 88 2HG GLU 88 9.970 12.385 -0.496 641 H TYR 89 H TYR 89 10.010 9.797 -3.619 642 HA TYR 89 HA TYR 89 12.841 9.371 -4.143 643 1HB TYR 89 1HB TYR 89 12.663 7.215 -2.726 644 2HB TYR 89 2HB TYR 89 12.903 8.746 -1.891 645 HD1 TYR 89 HD1 TYR 89 9.962 6.813 -3.177 646 HD2 TYR 89 HD2 TYR 89 11.719 8.928 0.070 647 HE1 TYR 89 HE1 TYR 89 7.960 6.378 -1.817 648 HE2 TYR 89 HE2 TYR 89 9.723 8.498 1.438 649 HH TYR 89 HH TYR 89 7.401 7.944 1.188 650 H TYR 90 H TYR 90 10.125 9.328 -5.535 651 HA TYR 90 HA TYR 90 10.217 6.573 -6.558 652 1HB TYR 90 1HB TYR 90 8.043 8.448 -6.016 653 2HB TYR 90 2HB TYR 90 7.951 7.756 -7.632 654 HD1 TYR 90 HD1 TYR 90 7.669 5.332 -7.930 655 HD2 TYR 90 HD2 TYR 90 7.677 7.099 -4.059 656 HE1 TYR 90 HE1 TYR 90 6.682 3.282 -6.999 657 HE2 TYR 90 HE2 TYR 90 6.691 5.053 -3.116 658 HH TYR 90 HH TYR 90 5.244 2.710 -4.920 659 HA PRO 91 HA PRO 91 11.779 8.311 -10.343 660 1HB PRO 91 1HB PRO 91 11.884 6.090 -11.807 661 2HB PRO 91 2HB PRO 91 12.907 6.282 -10.378 662 1HG PRO 91 1HG PRO 91 10.381 4.723 -10.705 663 2HG PRO 91 2HG PRO 91 11.851 4.301 -9.810 664 1HD PRO 91 1HD PRO 91 9.532 5.361 -8.693 665 2HD PRO 91 2HD PRO 91 11.135 5.372 -7.933 666 H LYS 92 H LYS 92 11.085 9.017 -12.344 667 HA LYS 92 HA LYS 92 8.305 9.199 -12.802 668 1HB LYS 92 1HB LYS 92 10.447 10.612 -13.645 669 2HB LYS 92 2HB LYS 92 10.126 9.664 -15.089 670 1HG LYS 92 1HG LYS 92 7.745 10.890 -13.916 671 2HG LYS 92 2HG LYS 92 8.957 12.043 -14.475 672 1HD LYS 92 1HD LYS 92 8.611 9.933 -16.403 673 2HD LYS 92 2HD LYS 92 7.057 10.675 -16.017 674 1HE LYS 92 1HE LYS 92 8.253 12.912 -16.360 675 2HE LYS 92 2HE LYS 92 9.533 11.967 -17.121 676 1HZ LYS 92 1HZ LYS 92 6.753 12.371 -18.015 677 2HZ LYS 92 2HZ LYS 92 7.625 11.016 -18.529 678 3HZ LYS 92 3HZ LYS 92 8.190 12.569 -18.885 679 H ARG 93 H ARG 93 7.972 6.781 -12.666 680 HA ARG 93 HA ARG 93 8.212 5.592 -15.353 681 1HB ARG 93 1HB ARG 93 8.698 4.412 -12.651 682 2HB ARG 93 2HB ARG 93 8.095 3.374 -13.936 683 1HG ARG 93 1HG ARG 93 10.081 4.420 -15.289 684 2HG ARG 93 2HG ARG 93 10.723 4.745 -13.678 685 1HD ARG 93 1HD ARG 93 11.600 2.650 -14.283 686 2HD ARG 93 2HD ARG 93 10.278 2.296 -13.172 687 HE ARG 93 HE ARG 93 9.084 2.149 -15.583 688 1HH1 ARG 93 1HH1 ARG 93 11.988 0.703 -14.297 689 2HH1 ARG 93 2HH1 ARG 93 11.873 -0.711 -15.287 690 1HH2 ARG 93 1HH2 ARG 93 8.929 0.287 -16.886 691 2HH2 ARG 93 2HH2 ARG 93 10.137 -0.948 -16.757 692 H TYR 94 H TYR 94 6.677 3.451 -15.237 693 HA TYR 94 HA TYR 94 3.996 4.541 -14.806 694 1HB TYR 94 1HB TYR 94 5.169 2.482 -16.612 695 2HB TYR 94 2HB TYR 94 3.482 2.300 -16.144 696 HD1 TYR 94 HD1 TYR 94 5.772 5.005 -17.319 697 HD2 TYR 94 HD2 TYR 94 1.919 3.225 -17.562 698 HE1 TYR 94 HE1 TYR 94 5.135 6.639 -19.032 699 HE2 TYR 94 HE2 TYR 94 1.267 4.853 -19.281 700 HH TYR 94 HH TYR 94 3.048 6.432 -21.093 701 H GLN 95 H GLN 95 2.603 3.734 -13.344 702 HA GLN 95 HA GLN 95 3.309 1.216 -11.993 703 1HB GLN 95 1HB GLN 95 2.751 3.892 -10.822 704 2HB GLN 95 2HB GLN 95 2.106 2.494 -9.974 705 1HG GLN 95 1HG GLN 95 4.653 1.694 -10.420 706 2HG GLN 95 2HG GLN 95 4.869 3.433 -10.241 707 1HE2 GLN 95 1HE2 GLN 95 4.453 4.401 -8.273 708 2HE2 GLN 95 2HE2 GLN 95 4.239 3.496 -6.817 709 H SER 96 H SER 96 1.708 -0.243 -11.969 710 HA SER 96 HA SER 96 -0.954 0.645 -12.815 711 1HB SER 96 1HB SER 96 -1.345 -1.545 -13.593 712 2HB SER 96 2HB SER 96 0.342 -1.226 -13.996 713 HG SER 96 HG SER 96 0.911 -2.369 -12.080 714 H HIS 97 H HIS 97 -2.849 -0.384 -11.892 715 HA HIS 97 HA HIS 97 -4.249 -0.788 -10.160 716 1HB HIS 97 1HB HIS 97 -2.141 -2.688 -10.000 717 2HB HIS 97 2HB HIS 97 -2.565 -2.226 -8.355 718 HD1 HIS 97 HD1 HIS 97 -3.826 -4.287 -7.664 719 HD2 HIS 97 HD2 HIS 97 -5.209 -2.684 -11.240 720 HE1 HIS 97 HE1 HIS 97 -5.928 -5.559 -8.202 721 HE2 HIS 97 HE2 HIS 97 -6.800 -4.502 -10.317 722 H VAL 98 H VAL 98 -3.617 1.683 -9.884 723 HA VAL 98 HA VAL 98 -2.833 1.982 -7.057 724 HB VAL 98 HB VAL 98 -1.136 2.877 -8.718 725 1HG1 VAL 98 1HG1 VAL 98 -3.418 4.705 -9.315 726 2HG1 VAL 98 2HG1 VAL 98 -2.279 3.930 -10.414 727 3HG1 VAL 98 3HG1 VAL 98 -1.759 5.291 -9.416 728 1HG2 VAL 98 1HG2 VAL 98 -0.810 3.642 -6.573 729 2HG2 VAL 98 2HG2 VAL 98 -2.356 4.492 -6.528 730 3HG2 VAL 98 3HG2 VAL 98 -1.017 5.145 -7.477 731 H LEU 99 H LEU 99 -4.042 3.353 -5.789 732 HA LEU 99 HA LEU 99 -6.542 4.314 -6.993 733 1HB LEU 99 1HB LEU 99 -5.843 3.204 -4.320 734 2HB LEU 99 2HB LEU 99 -7.118 4.406 -4.397 735 HG LEU 99 HG LEU 99 -8.342 2.979 -6.005 736 1HD1 LEU 99 1HD1 LEU 99 -7.520 0.536 -6.031 737 2HD1 LEU 99 2HD1 LEU 99 -5.952 1.224 -5.610 738 3HD1 LEU 99 3HD1 LEU 99 -6.751 1.702 -7.107 739 1HD2 LEU 99 1HD2 LEU 99 -7.903 1.081 -3.821 740 2HD2 LEU 99 2HD2 LEU 99 -9.371 1.921 -4.320 741 3HD2 LEU 99 3HD2 LEU 99 -8.194 2.739 -3.292 742 H LEU 100 H LEU 100 -7.200 6.441 -6.695 743 HA LEU 100 HA LEU 100 -5.311 8.161 -5.238 744 1HB LEU 100 1HB LEU 100 -6.134 8.269 -8.042 745 2HB LEU 100 2HB LEU 100 -6.247 9.807 -7.206 746 HG LEU 100 HG LEU 100 -3.758 8.102 -7.346 747 1HD1 LEU 100 1HD1 LEU 100 -4.627 9.245 -9.485 748 2HD1 LEU 100 2HD1 LEU 100 -2.944 9.485 -9.013 749 3HD1 LEU 100 3HD1 LEU 100 -4.138 10.743 -8.692 750 1HD2 LEU 100 1HD2 LEU 100 -4.391 9.927 -5.441 751 2HD2 LEU 100 2HD2 LEU 100 -3.595 10.945 -6.640 752 3HD2 LEU 100 3HD2 LEU 100 -2.748 9.554 -5.963 753 H ALA 101 H ALA 101 -6.119 9.720 -3.969 754 HA ALA 101 HA ALA 101 -8.956 10.423 -4.147 755 1HB ALA 101 1HB ALA 101 -9.075 10.234 -1.617 756 2HB ALA 101 2HB ALA 101 -7.611 9.260 -1.730 757 3HB ALA 101 3HB ALA 101 -9.090 8.724 -2.527 758 H THR 102 H THR 102 -9.419 12.488 -3.484 759 HA THR 102 HA THR 102 -7.098 14.181 -2.930 760 HB THR 102 HB THR 102 -8.332 14.974 -4.779 761 HG1 THR 102 HG1 THR 102 -7.835 16.668 -3.412 762 1HG2 THR 102 1HG2 THR 102 -10.638 14.018 -3.307 763 2HG2 THR 102 2HG2 THR 102 -10.432 14.304 -5.036 764 3HG2 THR 102 3HG2 THR 102 -10.880 15.636 -3.969 765 H GLY 103 H GLY 103 -6.696 14.863 -0.943 766 1HA GLY 103 1HA GLY 103 -8.950 15.315 0.895 767 2HA GLY 103 2HA GLY 103 -7.624 14.282 1.406 768 H PHE 104 H PHE 104 -5.997 15.209 2.459 769 HA PHE 104 HA PHE 104 -5.601 18.111 2.136 770 1HB PHE 104 1HB PHE 104 -6.258 16.604 4.527 771 2HB PHE 104 2HB PHE 104 -4.743 17.479 4.722 772 HD1 PHE 104 HD1 PHE 104 -5.062 19.411 5.907 773 HD2 PHE 104 HD2 PHE 104 -7.974 18.261 3.024 774 HE1 PHE 104 HE1 PHE 104 -6.316 21.482 6.352 775 HE2 PHE 104 HE2 PHE 104 -9.232 20.330 3.463 776 HZ PHE 104 HZ PHE 104 -8.403 21.943 5.128 777 H SER 105 H SER 105 -3.878 17.818 0.714 778 HA SER 105 HA SER 105 -1.548 16.352 1.725 779 1HB SER 105 1HB SER 105 -2.303 17.335 -1.027 780 2HB SER 105 2HB SER 105 -0.688 16.736 -0.649 781 HG SER 105 HG SER 105 -1.437 14.783 -0.748 782 H GLU 106 H GLU 106 -1.575 18.346 3.270 783 HA GLU 106 HA GLU 106 -0.554 20.800 2.224 784 1HB GLU 106 1HB GLU 106 -1.887 20.579 4.340 785 2HB GLU 106 2HB GLU 106 -0.474 19.853 5.089 786 1HG GLU 106 1HG GLU 106 0.067 21.915 5.703 787 2HG GLU 106 2HG GLU 106 0.542 22.160 4.022 788 HA PRO 107 HA PRO 107 3.636 19.230 3.970 789 1HB PRO 107 1HB PRO 107 3.909 16.647 4.660 790 2HB PRO 107 2HB PRO 107 3.257 17.848 5.782 791 1HG PRO 107 1HG PRO 107 1.804 15.847 4.097 792 2HG PRO 107 2HG PRO 107 1.519 16.304 5.785 793 1HD PRO 107 1HD PRO 107 0.054 17.265 3.691 794 2HD PRO 107 2HD PRO 107 0.300 18.156 5.205 795 H GLY 108 H GLY 108 5.324 17.350 3.278 796 1HA GLY 108 1HA GLY 108 4.637 16.519 0.533 797 2HA GLY 108 2HA GLY 108 6.135 17.377 0.859 798 H ASP 109 H ASP 109 4.628 14.859 2.826 799 HA ASP 109 HA ASP 109 6.950 13.137 2.253 800 1HB ASP 109 1HB ASP 109 5.614 13.826 4.839 801 2HB ASP 109 2HB ASP 109 6.347 12.235 4.655 802 H ALA 110 H ALA 110 6.374 10.791 3.143 803 HA ALA 110 HA ALA 110 3.624 10.057 2.526 804 1HB ALA 110 1HB ALA 110 4.373 9.845 0.348 805 2HB ALA 110 2HB ALA 110 4.599 8.214 0.980 806 3HB ALA 110 3HB ALA 110 5.978 9.305 0.843 807 H GLY 111 H GLY 111 3.456 7.529 2.674 808 1HA GLY 111 1HA GLY 111 4.687 5.611 3.762 809 2HA GLY 111 2HA GLY 111 4.976 6.736 5.080 810 H GLY 112 H GLY 112 3.380 4.112 4.637 811 1HA GLY 112 1HA GLY 112 1.732 3.714 6.496 812 2HA GLY 112 2HA GLY 112 0.858 5.085 5.829 813 H ILE 113 H ILE 113 -0.614 2.933 6.080 814 HA ILE 113 HA ILE 113 -0.782 1.839 3.352 815 HB ILE 113 HB ILE 113 -1.599 -0.270 4.211 816 1HG1 ILE 113 1HG1 ILE 113 -1.201 0.974 6.943 817 2HG1 ILE 113 2HG1 ILE 113 -2.733 0.485 6.224 818 1HG2 ILE 113 1HG2 ILE 113 0.470 -1.028 5.421 819 2HG2 ILE 113 2HG2 ILE 113 0.994 0.656 5.423 820 3HG2 ILE 113 3HG2 ILE 113 0.751 -0.189 3.894 821 1HD1 ILE 113 1HD1 ILE 113 -1.885 -1.860 6.217 822 2HD1 ILE 113 2HD1 ILE 113 -2.109 -1.159 7.819 823 3HD1 ILE 113 3HD1 ILE 113 -0.490 -1.294 7.134 824 H LEU 114 H LEU 114 -2.838 1.566 2.478 825 HA LEU 114 HA LEU 114 -4.886 3.241 3.681 826 1HB LEU 114 1HB LEU 114 -4.626 3.622 1.371 827 2HB LEU 114 2HB LEU 114 -4.560 1.909 1.007 828 HG LEU 114 HG LEU 114 -6.970 1.729 1.580 829 1HD1 LEU 114 1HD1 LEU 114 -6.827 3.863 3.026 830 2HD1 LEU 114 2HD1 LEU 114 -8.298 3.537 2.110 831 3HD1 LEU 114 3HD1 LEU 114 -7.125 4.710 1.507 832 1HD2 LEU 114 1HD2 LEU 114 -7.503 2.144 -0.553 833 2HD2 LEU 114 2HD2 LEU 114 -5.812 2.606 -0.736 834 3HD2 LEU 114 3HD2 LEU 114 -7.036 3.840 -0.440 835 H ARG 115 H ARG 115 -6.394 2.435 4.978 836 HA ARG 115 HA ARG 115 -7.092 -0.413 4.696 837 1HB ARG 115 1HB ARG 115 -6.556 1.269 7.082 838 2HB ARG 115 2HB ARG 115 -7.834 0.070 7.223 839 1HG ARG 115 1HG ARG 115 -6.386 -1.703 6.988 840 2HG ARG 115 2HG ARG 115 -5.174 -0.738 6.143 841 1HD ARG 115 1HD ARG 115 -4.336 -1.201 8.327 842 2HD ARG 115 2HD ARG 115 -4.790 0.501 8.279 843 HE ARG 115 HE ARG 115 -6.412 0.085 9.846 844 1HH1 ARG 115 1HH1 ARG 115 -5.256 -2.950 8.564 845 2HH1 ARG 115 2HH1 ARG 115 -6.097 -3.908 9.736 846 1HH2 ARG 115 1HH2 ARG 115 -7.520 -1.174 11.387 847 2HH2 ARG 115 2HH2 ARG 115 -7.383 -2.901 11.338 848 H CYS 116 H CYS 116 -9.228 -1.039 5.074 849 HA CYS 116 HA CYS 116 -11.222 1.114 4.824 850 1HB CYS 116 1HB CYS 116 -10.777 -0.521 2.829 851 2HB CYS 116 2HB CYS 116 -11.697 -1.668 3.794 852 H GLU 117 H GLU 117 -13.374 0.546 5.689 853 HA GLU 117 HA GLU 117 -13.266 -0.323 8.331 854 1HB GLU 117 1HB GLU 117 -15.758 -0.441 8.184 855 2HB GLU 117 2HB GLU 117 -15.077 1.072 7.600 856 1HG GLU 117 1HG GLU 117 -15.166 -0.311 5.299 857 2HG GLU 117 2HG GLU 117 -16.525 -1.042 6.153 858 H HIS 118 H HIS 118 -13.372 -2.152 5.438 859 HA HIS 118 HA HIS 118 -14.378 -4.541 6.762 860 1HB HIS 118 1HB HIS 118 -13.477 -4.227 3.896 861 2HB HIS 118 2HB HIS 118 -14.450 -5.531 4.571 862 HD2 HIS 118 HD2 HIS 118 -17.109 -5.157 4.223 863 HE1 HIS 118 HE1 HIS 118 -17.045 -0.961 3.590 864 HE2 HIS 118 HE2 HIS 118 -18.483 -3.028 3.706 865 H GLY 119 H GLY 119 -11.369 -3.233 5.467 866 1HA GLY 119 1HA GLY 119 -9.733 -4.842 7.064 867 2HA GLY 119 2HA GLY 119 -9.878 -5.640 5.506 868 H VAL 120 H VAL 120 -7.900 -5.385 4.698 869 HA VAL 120 HA VAL 120 -6.700 -2.709 4.645 870 HB VAL 120 HB VAL 120 -5.329 -5.248 3.791 871 1HG1 VAL 120 1HG1 VAL 120 -3.839 -3.093 5.095 872 2HG1 VAL 120 2HG1 VAL 120 -4.571 -2.660 3.550 873 3HG1 VAL 120 3HG1 VAL 120 -3.465 -4.030 3.648 874 1HG2 VAL 120 1HG2 VAL 120 -4.524 -4.430 6.412 875 2HG2 VAL 120 2HG2 VAL 120 -5.149 -5.987 5.872 876 3HG2 VAL 120 3HG2 VAL 120 -6.262 -4.724 6.394 877 H ILE 121 H ILE 121 -6.353 -1.621 2.778 878 HA ILE 121 HA ILE 121 -7.412 -2.827 0.324 879 HB ILE 121 HB ILE 121 -6.700 0.057 0.841 880 1HG1 ILE 121 1HG1 ILE 121 -8.874 -1.437 1.851 881 2HG1 ILE 121 2HG1 ILE 121 -8.652 0.305 1.911 882 1HG2 ILE 121 1HG2 ILE 121 -6.612 -0.312 -1.475 883 2HG2 ILE 121 2HG2 ILE 121 -8.201 0.390 -1.181 884 3HG2 ILE 121 3HG2 ILE 121 -8.040 -1.346 -1.452 885 1HD1 ILE 121 1HD1 ILE 121 -10.015 0.662 0.066 886 2HD1 ILE 121 2HD1 ILE 121 -10.831 -0.630 0.946 887 3HD1 ILE 121 3HD1 ILE 121 -9.875 -1.009 -0.485 888 H GLY 122 H GLY 122 -4.787 -0.512 1.055 889 1HA GLY 122 1HA GLY 122 -2.834 -2.181 -0.257 890 2HA GLY 122 2HA GLY 122 -3.278 -0.759 -1.188 891 H LEU 123 H LEU 123 -0.956 -0.290 -0.940 892 HA LEU 123 HA LEU 123 -0.386 0.989 1.653 893 1HB LEU 123 1HB LEU 123 2.058 0.749 0.820 894 2HB LEU 123 2HB LEU 123 1.243 -0.637 1.517 895 HG LEU 123 HG LEU 123 1.204 -0.251 -1.449 896 1HD1 LEU 123 1HD1 LEU 123 3.458 -1.528 0.091 897 2HD1 LEU 123 2HD1 LEU 123 3.550 0.005 -0.777 898 3HD1 LEU 123 3HD1 LEU 123 3.273 -1.495 -1.662 899 1HD2 LEU 123 1HD2 LEU 123 0.010 -2.063 0.123 900 2HD2 LEU 123 2HD2 LEU 123 1.555 -2.873 -0.137 901 3HD2 LEU 123 3HD2 LEU 123 0.555 -2.416 -1.516 902 H VAL 124 H VAL 124 1.113 2.884 1.493 903 HA VAL 124 HA VAL 124 0.064 4.785 -0.315 904 HB VAL 124 HB VAL 124 2.563 4.980 1.373 905 1HG1 VAL 124 1HG1 VAL 124 2.887 7.014 0.539 906 2HG1 VAL 124 2HG1 VAL 124 1.228 7.476 0.920 907 3HG1 VAL 124 3HG1 VAL 124 1.598 6.711 -0.626 908 1HG2 VAL 124 1HG2 VAL 124 1.298 5.491 3.159 909 2HG2 VAL 124 2HG2 VAL 124 0.029 4.635 2.285 910 3HG2 VAL 124 3HG2 VAL 124 0.126 6.394 2.199 911 H THR 125 H THR 125 0.624 5.279 -2.334 912 HA THR 125 HA THR 125 3.166 4.214 -3.361 913 HB THR 125 HB THR 125 0.485 4.618 -4.655 914 HG1 THR 125 HG1 THR 125 1.289 2.582 -3.711 915 1HG2 THR 125 1HG2 THR 125 3.073 4.936 -5.980 916 2HG2 THR 125 2HG2 THR 125 1.456 5.391 -6.515 917 3HG2 THR 125 3HG2 THR 125 2.016 3.730 -6.713 918 H MET 126 H MET 126 1.178 6.668 -4.980 919 HA MET 126 HA MET 126 3.309 8.621 -4.393 920 1HB MET 126 1HB MET 126 2.455 7.577 -6.967 921 2HB MET 126 2HB MET 126 2.361 9.332 -6.902 922 1HG MET 126 1HG MET 126 4.822 8.357 -5.749 923 2HG MET 126 2HG MET 126 4.606 7.793 -7.401 924 1HE MET 126 1HE MET 126 7.088 10.782 -6.800 925 2HE MET 126 2HE MET 126 6.455 9.624 -5.629 926 3HE MET 126 3HE MET 126 5.968 11.317 -5.546 927 H GLY 127 H GLY 127 2.627 10.476 -3.578 928 1HA GLY 127 1HA GLY 127 -0.244 11.107 -3.802 929 2HA GLY 127 2HA GLY 127 0.798 11.615 -2.482 930 H GLY 128 H GLY 128 -0.890 12.847 -4.884 931 1HA GLY 128 1HA GLY 128 1.081 14.575 -6.103 932 2HA GLY 128 2HA GLY 128 -0.657 14.632 -6.357 933 H GLU 129 H GLU 129 -0.320 16.961 -6.249 934 HA GLU 129 HA GLU 129 0.497 18.202 -3.818 935 1HB GLU 129 1HB GLU 129 -0.497 20.259 -4.871 936 2HB GLU 129 2HB GLU 129 0.726 19.448 -5.840 937 1HG GLU 129 1HG GLU 129 -1.590 18.264 -6.698 938 2HG GLU 129 2HG GLU 129 -2.092 19.926 -6.394 939 H GLY 130 H GLY 130 -2.446 16.796 -4.891 940 1HA GLY 130 1HA GLY 130 -3.727 17.640 -2.399 941 2HA GLY 130 2HA GLY 130 -4.552 18.021 -3.899 942 H VAL 131 H VAL 131 -3.146 15.203 -4.659 943 HA VAL 131 HA VAL 131 -5.408 13.632 -3.627 944 HB VAL 131 HB VAL 131 -3.972 12.804 -6.107 945 1HG1 VAL 131 1HG1 VAL 131 -6.107 11.851 -6.686 946 2HG1 VAL 131 2HG1 VAL 131 -6.870 12.641 -5.307 947 3HG1 VAL 131 3HG1 VAL 131 -5.680 11.367 -5.046 948 1HG2 VAL 131 1HG2 VAL 131 -4.460 15.194 -6.439 949 2HG2 VAL 131 2HG2 VAL 131 -6.158 14.879 -6.078 950 3HG2 VAL 131 3HG2 VAL 131 -5.412 14.161 -7.507 951 H VAL 132 H VAL 132 -5.011 11.346 -3.258 952 HA VAL 132 HA VAL 132 -2.216 10.824 -2.484 953 HB VAL 132 HB VAL 132 -3.012 9.435 -0.694 954 1HG1 VAL 132 1HG1 VAL 132 -4.738 11.233 0.337 955 2HG1 VAL 132 2HG1 VAL 132 -3.992 12.197 -0.939 956 3HG1 VAL 132 3HG1 VAL 132 -2.988 11.452 0.303 957 1HG2 VAL 132 1HG2 VAL 132 -4.895 8.323 -1.526 958 2HG2 VAL 132 2HG2 VAL 132 -5.705 9.828 -1.962 959 3HG2 VAL 132 3HG2 VAL 132 -5.546 9.373 -0.267 960 H GLY 133 H GLY 133 -1.222 9.318 -3.681 961 1HA GLY 133 1HA GLY 133 -2.863 7.384 -5.158 962 2HA GLY 133 2HA GLY 133 -1.183 7.764 -5.491 963 H PHE 134 H PHE 134 -3.166 5.425 -4.323 964 HA PHE 134 HA PHE 134 -1.036 4.294 -2.626 965 1HB PHE 134 1HB PHE 134 -3.990 3.705 -2.412 966 2HB PHE 134 2HB PHE 134 -2.719 3.152 -1.329 967 HD1 PHE 134 HD1 PHE 134 -5.337 4.794 -0.814 968 HD2 PHE 134 HD2 PHE 134 -1.227 5.822 -1.196 969 HE1 PHE 134 HE1 PHE 134 -5.700 6.759 0.616 970 HE2 PHE 134 HE2 PHE 134 -1.581 7.789 0.238 971 HZ PHE 134 HZ PHE 134 -3.821 8.259 1.147 972 H ALA 135 H ALA 135 -0.477 2.163 -2.886 973 HA ALA 135 HA ALA 135 -1.276 0.950 -5.413 974 1HB ALA 135 1HB ALA 135 0.545 -0.761 -4.537 975 2HB ALA 135 2HB ALA 135 0.998 0.613 -3.528 976 3HB ALA 135 3HB ALA 135 0.999 0.774 -5.283 977 H ASP 136 H ASP 136 -3.052 -0.268 -5.359 978 HA ASP 136 HA ASP 136 -4.129 -1.381 -2.995 979 1HB ASP 136 1HB ASP 136 -4.818 -1.351 -5.859 980 2HB ASP 136 2HB ASP 136 -5.403 -2.755 -4.970 981 H VAL 137 H VAL 137 -4.226 -3.448 -2.233 982 HA VAL 137 HA VAL 137 -2.080 -5.221 -3.087 983 HB VAL 137 HB VAL 137 -3.967 -5.408 -0.727 984 1HG1 VAL 137 1HG1 VAL 137 -3.333 -7.609 -1.027 985 2HG1 VAL 137 2HG1 VAL 137 -2.077 -7.014 0.058 986 3HG1 VAL 137 3HG1 VAL 137 -1.748 -7.175 -1.665 987 1HG2 VAL 137 1HG2 VAL 137 -1.143 -5.015 -0.170 988 2HG2 VAL 137 2HG2 VAL 137 -2.551 -4.144 0.441 989 3HG2 VAL 137 3HG2 VAL 137 -1.839 -3.691 -1.107 990 H ARG 138 H ARG 138 -4.969 -4.733 -4.307 991 HA ARG 138 HA ARG 138 -6.228 -7.276 -4.211 992 1HB ARG 138 1HB ARG 138 -6.559 -5.175 -6.350 993 2HB ARG 138 2HB ARG 138 -7.705 -6.428 -5.896 994 1HG ARG 138 1HG ARG 138 -7.074 -4.837 -3.602 995 2HG ARG 138 2HG ARG 138 -7.550 -3.790 -4.940 996 1HD ARG 138 1HD ARG 138 -9.237 -6.162 -4.625 997 2HD ARG 138 2HD ARG 138 -9.265 -5.077 -3.238 998 HE ARG 138 HE ARG 138 -10.212 -3.410 -4.574 999 1HH1 ARG 138 1HH1 ARG 138 -9.584 -6.312 -6.422 1000 2HH1 ARG 138 2HH1 ARG 138 -10.591 -5.832 -7.744 1001 1HH2 ARG 138 1HH2 ARG 138 -11.532 -2.787 -6.316 1002 2HH2 ARG 138 2HH2 ARG 138 -11.695 -3.835 -7.686 1003 H ASP 139 H ASP 139 -3.404 -6.298 -5.727 1004 HA ASP 139 HA ASP 139 -3.711 -8.023 -8.045 1005 1HB ASP 139 1HB ASP 139 -2.480 -5.729 -7.953 1006 2HB ASP 139 2HB ASP 139 -1.149 -6.662 -7.276 1007 H LEU 140 H LEU 140 -3.253 -8.750 -4.958 1008 HA LEU 140 HA LEU 140 -2.080 -11.253 -5.487 1009 1HB LEU 140 1HB LEU 140 0.016 -11.061 -4.273 1010 2HB LEU 140 2HB LEU 140 -0.010 -9.995 -5.659 1011 HG LEU 140 HG LEU 140 0.981 -8.647 -4.090 1012 1HD1 LEU 140 1HD1 LEU 140 -1.003 -7.491 -4.928 1013 2HD1 LEU 140 2HD1 LEU 140 -0.588 -6.991 -3.286 1014 3HD1 LEU 140 3HD1 LEU 140 -1.927 -8.105 -3.558 1015 1HD2 LEU 140 1HD2 LEU 140 0.283 -10.490 -2.285 1016 2HD2 LEU 140 2HD2 LEU 140 -0.808 -9.189 -1.810 1017 3HD2 LEU 140 3HD2 LEU 140 0.932 -8.908 -1.854 1018 H LEU 141 H LEU 141 -4.399 -10.419 -4.267 1019 HA LEU 141 HA LEU 141 -4.345 -10.216 -1.488 1020 1HB LEU 141 1HB LEU 141 -6.296 -10.411 -3.490 1021 2HB LEU 141 2HB LEU 141 -6.645 -11.700 -2.352 1022 HG LEU 141 HG LEU 141 -7.892 -9.894 -1.566 1023 1HD1 LEU 141 1HD1 LEU 141 -7.224 -9.883 0.558 1024 2HD1 LEU 141 2HD1 LEU 141 -5.650 -9.193 0.158 1025 3HD1 LEU 141 3HD1 LEU 141 -5.922 -10.926 -0.007 1026 1HD2 LEU 141 1HD2 LEU 141 -5.685 -8.316 -2.641 1027 2HD2 LEU 141 2HD2 LEU 141 -6.342 -7.699 -1.127 1028 3HD2 LEU 141 3HD2 LEU 141 -7.400 -7.929 -2.519 1029 H TRP 142 H TRP 142 -3.566 -12.913 -3.416 1030 HA TRP 142 HA TRP 142 -4.436 -15.037 -1.831 1031 1HB TRP 142 1HB TRP 142 -2.525 -16.313 -2.870 1032 2HB TRP 142 2HB TRP 142 -3.607 -15.526 -4.014 1033 HD1 TRP 142 HD1 TRP 142 -2.608 -13.094 -5.038 1034 HE1 TRP 142 HE1 TRP 142 -0.183 -12.524 -5.683 1035 HE3 TRP 142 HE3 TRP 142 -0.191 -16.758 -2.430 1036 HZ2 TRP 142 HZ2 TRP 142 2.407 -13.503 -5.156 1037 HZ3 TRP 142 HZ3 TRP 142 2.264 -16.875 -2.551 1038 HH2 TRP 142 HH2 TRP 142 3.537 -15.279 -3.887 1039 H LEU 143 H LEU 143 -4.134 -14.202 0.330 1040 HA LEU 143 HA LEU 143 -1.492 -14.896 1.386 1041 1HB LEU 143 1HB LEU 143 -3.036 -12.392 2.062 1042 2HB LEU 143 2HB LEU 143 -1.701 -12.996 3.024 1043 HG LEU 143 HG LEU 143 -0.515 -12.847 0.580 1044 1HD1 LEU 143 1HD1 LEU 143 -1.183 -10.587 -0.292 1045 2HD1 LEU 143 2HD1 LEU 143 -2.634 -10.725 0.702 1046 3HD1 LEU 143 3HD1 LEU 143 -2.328 -11.895 -0.582 1047 1HD2 LEU 143 1HD2 LEU 143 0.031 -11.834 2.924 1048 2HD2 LEU 143 2HD2 LEU 143 -0.673 -10.372 2.237 1049 3HD2 LEU 143 3HD2 LEU 143 0.724 -11.121 1.468 1050 H GLU 144 H GLU 144 -4.871 -14.137 2.145 1051 HA GLU 144 HA GLU 144 -5.164 -16.507 3.698 1052 1HB GLU 144 1HB GLU 144 -5.466 -15.591 5.874 1053 2HB GLU 144 2HB GLU 144 -3.932 -14.975 5.277 1054 1HG GLU 144 1HG GLU 144 -4.613 -12.924 5.709 1055 2HG GLU 144 2HG GLU 144 -5.897 -13.110 4.517 1056 H ASP 145 H ASP 145 -7.352 -15.692 5.288 1057 HA ASP 145 HA ASP 145 -9.449 -15.852 3.451 1058 1HB ASP 145 1HB ASP 145 -10.887 -15.162 5.442 1059 2HB ASP 145 2HB ASP 145 -9.886 -16.595 5.654 1060 H ASP 146 H ASP 146 -10.578 -14.407 2.326 1061 HA ASP 146 HA ASP 146 -9.933 -11.564 2.698 1062 1HB ASP 146 1HB ASP 146 -10.594 -11.251 0.386 1063 2HB ASP 146 2HB ASP 146 -9.434 -12.569 0.481 1064 H ALA 147 H ALA 147 -11.650 -9.984 2.547 1065 HA ALA 147 HA ALA 147 -13.944 -10.707 4.033 1066 1HB ALA 147 1HB ALA 147 -14.478 -8.475 4.052 1067 2HB ALA 147 2HB ALA 147 -13.899 -8.209 2.408 1068 3HB ALA 147 3HB ALA 147 -12.746 -8.399 3.729 1069 H MET 148 H MET 148 -16.158 -10.646 3.406 1070 HA MET 148 HA MET 148 -17.925 -11.260 2.112 1071 1HB MET 148 1HB MET 148 -16.768 -9.133 0.857 1072 2HB MET 148 2HB MET 148 -16.745 -10.335 -0.425 1073 1HG MET 148 1HG MET 148 -19.202 -9.572 1.131 1074 2HG MET 148 2HG MET 148 -18.748 -8.872 -0.421 1075 1HE MET 148 1HE MET 148 -20.237 -9.239 -1.920 1076 2HE MET 148 2HE MET 148 -21.028 -10.727 -2.440 1077 3HE MET 148 3HE MET 148 -19.362 -10.401 -2.918 1078 H GLU 149 H GLU 149 -17.032 -13.468 2.548 1079 HA GLU 149 HA GLU 149 -16.070 -14.764 0.088 1080 1HB GLU 149 1HB GLU 149 -15.370 -16.625 1.573 1081 2HB GLU 149 2HB GLU 149 -14.575 -15.103 1.953 1082 1HG GLU 149 1HG GLU 149 -16.905 -15.207 3.526 1083 2HG GLU 149 2HG GLU 149 -16.144 -16.794 3.635 1084 H GLN 150 H GLN 150 -16.783 -17.222 0.126 1085 HA GLN 150 HA GLN 150 -19.713 -17.179 0.292 1086 1HB GLN 150 1HB GLN 150 -18.124 -17.853 -1.806 1087 2HB GLN 150 2HB GLN 150 -18.383 -19.432 -1.077 1088 1HG GLN 150 1HG GLN 150 -20.597 -19.461 -1.583 1089 2HG GLN 150 2HG GLN 150 -20.757 -17.708 -1.486 1090 1HE2 GLN 150 1HE2 GLN 150 -21.156 -20.069 -3.545 1091 2HE2 GLN 150 2HE2 GLN 150 -20.635 -19.340 -5.022 Start of MODEL 5 1 1H GLY 1 1H GLY 1 -1.114 1.423 23.039 2 2H GLY 1 2H GLY 1 0.180 2.170 23.830 3 3H GLY 1 3H GLY 1 0.325 0.571 23.300 4 1HA GLY 1 1HA GLY 1 -0.307 1.818 21.009 5 2HA GLY 1 2HA GLY 1 0.641 3.045 21.838 6 HA PRO 2 HA PRO 2 3.505 -0.824 21.159 7 1HB PRO 2 1HB PRO 2 2.725 -2.506 19.175 8 2HB PRO 2 2HB PRO 2 2.275 -2.743 20.868 9 1HG PRO 2 1HG PRO 2 0.683 -1.540 18.636 10 2HG PRO 2 2HG PRO 2 0.166 -2.681 19.892 11 1HD PRO 2 1HD PRO 2 -0.356 -0.030 20.035 12 2HD PRO 2 2HD PRO 2 -0.072 -1.023 21.479 13 H TYR 3 H TYR 3 5.230 -0.135 20.075 14 HA TYR 3 HA TYR 3 4.836 1.127 17.452 15 1HB TYR 3 1HB TYR 3 6.301 1.907 19.736 16 2HB TYR 3 2HB TYR 3 7.490 1.492 18.505 17 HD1 TYR 3 HD1 TYR 3 7.700 2.809 16.486 18 HD2 TYR 3 HD2 TYR 3 4.749 3.759 19.399 19 HE1 TYR 3 HE1 TYR 3 7.354 4.994 15.413 20 HE2 TYR 3 HE2 TYR 3 4.393 5.945 18.334 21 HH TYR 3 HH TYR 3 4.719 7.039 16.218 22 H GLY 4 H GLY 4 5.282 -0.099 15.751 23 1HA GLY 4 1HA GLY 4 6.598 -2.573 15.845 24 2HA GLY 4 2HA GLY 4 6.288 -1.644 14.384 25 H HIS 5 H HIS 5 7.807 0.585 14.736 26 HA HIS 5 HA HIS 5 9.914 1.403 14.498 27 1HB HIS 5 1HB HIS 5 9.965 -0.001 16.859 28 2HB HIS 5 2HB HIS 5 11.303 -0.722 15.972 29 HD1 HIS 5 HD1 HIS 5 12.685 1.534 14.673 30 HD2 HIS 5 HD2 HIS 5 11.003 1.903 18.455 31 HE1 HIS 5 HE1 HIS 5 13.879 3.464 15.755 32 HE2 HIS 5 HE2 HIS 5 12.907 3.612 18.075 33 H GLN 6 H GLN 6 11.569 1.227 13.044 34 HA GLN 6 HA GLN 6 12.759 0.413 11.285 35 1HB GLN 6 1HB GLN 6 13.218 -1.324 13.322 36 2HB GLN 6 2HB GLN 6 12.557 -2.414 12.111 37 1HG GLN 6 1HG GLN 6 14.256 -1.765 10.533 38 2HG GLN 6 2HG GLN 6 14.874 -0.549 11.651 39 1HE2 GLN 6 1HE2 GLN 6 16.506 -1.116 12.898 40 2HE2 GLN 6 2HE2 GLN 6 17.002 -2.734 13.250 41 H SER 7 H SER 7 11.115 0.874 9.785 42 HA SER 7 HA SER 7 9.683 0.409 8.082 43 1HB SER 7 1HB SER 7 10.234 -2.525 8.355 44 2HB SER 7 2HB SER 7 10.022 -1.560 6.894 45 HG SER 7 HG SER 7 12.248 -2.285 7.545 46 H GLY 8 H GLY 8 7.797 -1.254 7.475 47 1HA GLY 8 1HA GLY 8 6.400 -2.324 9.762 48 2HA GLY 8 2HA GLY 8 5.686 -0.847 9.130 49 H ALA 9 H ALA 9 5.122 -0.853 6.800 50 HA ALA 9 HA ALA 9 3.962 -1.724 5.047 51 1HB ALA 9 1HB ALA 9 4.832 -3.602 3.992 52 2HB ALA 9 2HB ALA 9 5.287 -4.369 5.514 53 3HB ALA 9 3HB ALA 9 6.206 -2.989 4.912 54 H VAL 10 H VAL 10 2.868 -4.184 4.513 55 HA VAL 10 HA VAL 10 1.176 -4.728 6.862 56 HB VAL 10 HB VAL 10 -0.087 -3.361 5.277 57 1HG1 VAL 10 1HG1 VAL 10 1.310 -4.557 3.316 58 2HG1 VAL 10 2HG1 VAL 10 -0.213 -3.709 3.051 59 3HG1 VAL 10 3HG1 VAL 10 -0.198 -5.465 3.215 60 1HG2 VAL 10 1HG2 VAL 10 -1.989 -4.512 5.617 61 2HG2 VAL 10 2HG2 VAL 10 -0.941 -5.636 6.482 62 3HG2 VAL 10 3HG2 VAL 10 -1.383 -5.955 4.804 63 H TYR 11 H TYR 11 1.783 -6.712 7.491 64 HA TYR 11 HA TYR 11 2.238 -8.754 5.437 65 1HB TYR 11 1HB TYR 11 3.640 -9.886 6.909 66 2HB TYR 11 2HB TYR 11 3.967 -8.202 7.292 67 HD1 TYR 11 HD1 TYR 11 3.407 -11.326 8.677 68 HD2 TYR 11 HD2 TYR 11 2.326 -7.248 9.225 69 HE1 TYR 11 HE1 TYR 11 2.905 -11.783 11.039 70 HE2 TYR 11 HE2 TYR 11 1.819 -7.694 11.589 71 HH TYR 11 HH TYR 11 2.679 -9.554 13.336 72 H VAL 12 H VAL 12 0.844 -10.345 5.127 73 HA VAL 12 HA VAL 12 -1.255 -10.776 7.152 74 HB VAL 12 HB VAL 12 -1.520 -11.137 4.166 75 1HG1 VAL 12 1HG1 VAL 12 -2.975 -12.385 6.036 76 2HG1 VAL 12 2HG1 VAL 12 -3.634 -11.865 4.484 77 3HG1 VAL 12 3HG1 VAL 12 -3.878 -10.873 5.923 78 1HG2 VAL 12 1HG2 VAL 12 -1.900 -8.802 5.914 79 2HG2 VAL 12 2HG2 VAL 12 -3.203 -9.123 4.771 80 3HG2 VAL 12 3HG2 VAL 12 -1.556 -8.889 4.186 81 H GLY 13 H GLY 13 -1.588 -12.796 7.876 82 1HA GLY 13 1HA GLY 13 -1.170 -15.020 8.280 83 2HA GLY 13 2HA GLY 13 -1.311 -15.188 6.538 84 H ASN 14 H ASN 14 0.302 -16.445 5.882 85 HA ASN 14 HA ASN 14 2.921 -16.250 7.144 86 1HB ASN 14 1HB ASN 14 1.727 -18.178 5.155 87 2HB ASN 14 2HB ASN 14 3.433 -18.208 5.592 88 1HD2 ASN 14 1HD2 ASN 14 3.055 -20.346 6.360 89 2HD2 ASN 14 2HD2 ASN 14 2.353 -20.602 7.918 90 H TYR 15 H TYR 15 1.681 -14.240 5.197 91 HA TYR 15 HA TYR 15 4.013 -14.062 3.408 92 1HB TYR 15 1HB TYR 15 1.098 -13.626 2.764 93 2HB TYR 15 2HB TYR 15 2.374 -12.904 1.795 94 HD1 TYR 15 HD1 TYR 15 0.154 -15.024 1.129 95 HD2 TYR 15 HD2 TYR 15 4.318 -15.268 1.954 96 HE1 TYR 15 HE1 TYR 15 0.285 -17.096 -0.180 97 HE2 TYR 15 HE2 TYR 15 4.459 -17.336 0.645 98 HH TYR 15 HH TYR 15 1.751 -18.533 -1.226 99 H LYS 16 H LYS 16 4.831 -11.984 3.110 100 HA LYS 16 HA LYS 16 3.514 -9.834 4.628 101 1HB LYS 16 1HB LYS 16 5.458 -10.693 5.882 102 2HB LYS 16 2HB LYS 16 6.488 -10.361 4.496 103 1HG LYS 16 1HG LYS 16 5.051 -7.990 5.176 104 2HG LYS 16 2HG LYS 16 5.816 -8.644 6.625 105 1HD LYS 16 1HD LYS 16 7.749 -8.868 4.622 106 2HD LYS 16 2HD LYS 16 7.002 -7.290 4.363 107 1HE LYS 16 1HE LYS 16 8.896 -7.087 5.863 108 2HE LYS 16 2HE LYS 16 7.398 -6.730 6.720 109 1HZ LYS 16 1HZ LYS 16 8.307 -8.138 8.210 110 2HZ LYS 16 2HZ LYS 16 9.252 -8.948 7.063 111 3HZ LYS 16 3HZ LYS 16 7.608 -9.319 7.218 112 H VAL 17 H VAL 17 2.890 -8.291 3.232 113 HA VAL 17 HA VAL 17 4.514 -7.913 0.823 114 HB VAL 17 HB VAL 17 2.679 -7.425 -0.383 115 1HG1 VAL 17 1HG1 VAL 17 0.874 -8.772 0.121 116 2HG1 VAL 17 2HG1 VAL 17 0.972 -8.438 1.849 117 3HG1 VAL 17 3HG1 VAL 17 2.163 -9.493 1.086 118 1HG2 VAL 17 1HG2 VAL 17 0.739 -6.129 0.395 119 2HG2 VAL 17 2HG2 VAL 17 2.262 -5.275 0.650 120 3HG2 VAL 17 3HG2 VAL 17 1.452 -6.058 2.007 121 H VAL 18 H VAL 18 5.809 -6.250 0.677 122 HA VAL 18 HA VAL 18 5.146 -3.760 2.079 123 HB VAL 18 HB VAL 18 6.739 -4.910 3.518 124 1HG1 VAL 18 1HG1 VAL 18 8.795 -4.819 1.346 125 2HG1 VAL 18 2HG1 VAL 18 7.719 -6.207 1.517 126 3HG1 VAL 18 3HG1 VAL 18 8.791 -5.755 2.841 127 1HG2 VAL 18 1HG2 VAL 18 8.308 -3.168 3.788 128 2HG2 VAL 18 2HG2 VAL 18 6.867 -2.409 3.112 129 3HG2 VAL 18 3HG2 VAL 18 8.253 -2.751 2.076 130 H ASN 19 H ASN 19 6.353 -1.886 1.263 131 HA ASN 19 HA ASN 19 6.295 -1.706 -1.533 132 1HB ASN 19 1HB ASN 19 6.258 0.147 0.334 133 2HB ASN 19 2HB ASN 19 8.001 0.148 0.088 134 1HD2 ASN 19 1HD2 ASN 19 6.054 2.235 -0.451 135 2HD2 ASN 19 2HD2 ASN 19 6.194 2.604 -2.133 136 H ARG 20 H ARG 20 7.877 -1.785 -3.099 137 HA ARG 20 HA ARG 20 10.009 -3.538 -2.767 138 1HB ARG 20 1HB ARG 20 8.914 -2.801 -4.935 139 2HB ARG 20 2HB ARG 20 9.911 -1.356 -4.847 140 1HG ARG 20 1HG ARG 20 11.337 -3.922 -4.591 141 2HG ARG 20 2HG ARG 20 10.619 -3.581 -6.166 142 1HD ARG 20 1HD ARG 20 11.884 -1.625 -6.442 143 2HD ARG 20 2HD ARG 20 12.307 -1.555 -4.732 144 HE ARG 20 HE ARG 20 14.052 -2.978 -5.141 145 1HH1 ARG 20 1HH1 ARG 20 11.865 -3.068 -7.859 146 2HH1 ARG 20 2HH1 ARG 20 12.925 -4.024 -8.840 147 1HH2 ARG 20 1HH2 ARG 20 15.447 -4.234 -6.430 148 2HH2 ARG 20 2HH2 ARG 20 14.958 -4.686 -8.029 149 H HIS 21 H HIS 21 10.024 0.017 -2.819 150 HA HIS 21 HA HIS 21 12.824 0.251 -2.412 151 1HB HIS 21 1HB HIS 21 10.800 1.990 -3.073 152 2HB HIS 21 2HB HIS 21 11.200 2.488 -1.433 153 HD1 HIS 21 HD1 HIS 21 12.958 1.883 -4.747 154 HD2 HIS 21 HD2 HIS 21 13.357 4.131 -1.275 155 HE1 HIS 21 HE1 HIS 21 14.921 3.400 -5.152 156 HE2 HIS 21 HE2 HIS 21 15.203 4.683 -3.002 157 H LEU 22 H LEU 22 10.387 -0.765 -0.335 158 HA LEU 22 HA LEU 22 11.878 0.117 2.039 159 1HB LEU 22 1HB LEU 22 9.278 0.491 1.582 160 2HB LEU 22 2HB LEU 22 9.188 -1.113 2.283 161 HG LEU 22 HG LEU 22 10.666 -0.024 4.177 162 1HD1 LEU 22 1HD1 LEU 22 9.084 2.383 3.360 163 2HD1 LEU 22 2HD1 LEU 22 10.728 2.133 2.774 164 3HD1 LEU 22 3HD1 LEU 22 10.419 2.262 4.505 165 1HD2 LEU 22 1HD2 LEU 22 8.102 -0.817 3.989 166 2HD2 LEU 22 2HD2 LEU 22 7.870 0.894 4.343 167 3HD2 LEU 22 3HD2 LEU 22 8.803 -0.115 5.447 168 H ALA 23 H ALA 23 11.293 -2.612 0.099 169 HA ALA 23 HA ALA 23 11.298 -4.608 2.119 170 1HB ALA 23 1HB ALA 23 11.278 -4.504 -0.778 171 2HB ALA 23 2HB ALA 23 10.602 -5.710 0.315 172 3HB ALA 23 3HB ALA 23 12.296 -5.808 -0.166 173 H THR 24 H THR 24 12.984 -6.006 2.726 174 HA THR 24 HA THR 24 15.646 -4.786 2.498 175 HB THR 24 HB THR 24 16.192 -6.134 4.519 176 HG1 THR 24 HG1 THR 24 14.351 -7.048 5.623 177 1HG2 THR 24 1HG2 THR 24 15.545 -3.936 5.034 178 2HG2 THR 24 2HG2 THR 24 14.612 -4.975 6.112 179 3HG2 THR 24 3HG2 THR 24 13.848 -4.270 4.686 180 H HIS 25 H HIS 25 17.483 -6.437 2.614 181 HA HIS 25 HA HIS 25 17.462 -8.035 0.345 182 1HB HIS 25 1HB HIS 25 19.397 -7.213 2.018 183 2HB HIS 25 2HB HIS 25 19.243 -8.878 2.569 184 HD1 HIS 25 HD1 HIS 25 21.851 -8.146 1.311 185 HD2 HIS 25 HD2 HIS 25 18.613 -9.495 -0.915 186 HE1 HIS 25 HE1 HIS 25 22.831 -9.054 -0.820 187 HE2 HIS 25 HE2 HIS 25 20.861 -9.943 -2.112 188 H VAL 26 H VAL 26 16.470 -8.750 3.600 189 HA VAL 26 HA VAL 26 16.367 -11.594 3.257 190 HB VAL 26 HB VAL 26 16.668 -10.635 5.481 191 1HG1 VAL 26 1HG1 VAL 26 14.487 -9.696 6.544 192 2HG1 VAL 26 2HG1 VAL 26 14.051 -9.331 4.875 193 3HG1 VAL 26 3HG1 VAL 26 15.516 -8.642 5.574 194 1HG2 VAL 26 1HG2 VAL 26 13.977 -11.907 5.633 195 2HG2 VAL 26 2HG2 VAL 26 15.424 -12.207 6.598 196 3HG2 VAL 26 3HG2 VAL 26 15.319 -12.823 4.949 197 H ASP 27 H ASP 27 14.130 -8.931 2.784 198 HA ASP 27 HA ASP 27 11.756 -10.463 2.707 199 1HB ASP 27 1HB ASP 27 12.560 -7.717 1.838 200 2HB ASP 27 2HB ASP 27 11.087 -8.393 1.151 201 H TRP 28 H TRP 28 14.051 -9.366 0.269 202 HA TRP 28 HA TRP 28 12.657 -10.609 -1.866 203 1HB TRP 28 1HB TRP 28 15.387 -9.366 -1.659 204 2HB TRP 28 2HB TRP 28 14.819 -10.135 -3.140 205 HD1 TRP 28 HD1 TRP 28 12.368 -9.064 -4.086 206 HE1 TRP 28 HE1 TRP 28 11.661 -6.590 -4.160 207 HE3 TRP 28 HE3 TRP 28 15.662 -7.179 -0.668 208 HZ2 TRP 28 HZ2 TRP 28 12.396 -4.161 -2.917 209 HZ3 TRP 28 HZ3 TRP 28 15.595 -4.774 -0.170 210 HH2 TRP 28 HH2 TRP 28 14.001 -3.295 -1.275 211 H GLN 29 H GLN 29 15.146 -11.555 0.352 212 HA GLN 29 HA GLN 29 16.252 -13.738 -0.986 213 1HB GLN 29 1HB GLN 29 16.942 -12.661 1.250 214 2HB GLN 29 2HB GLN 29 15.741 -13.716 1.981 215 1HG GLN 29 1HG GLN 29 17.997 -14.643 2.108 216 2HG GLN 29 2HG GLN 29 16.908 -15.667 1.175 217 1HE2 GLN 29 1HE2 GLN 29 19.449 -13.245 0.908 218 2HE2 GLN 29 2HE2 GLN 29 20.035 -13.763 -0.634 219 H ASN 30 H ASN 30 13.396 -13.527 1.092 220 HA ASN 30 HA ASN 30 12.627 -16.230 0.202 221 1HB ASN 30 1HB ASN 30 12.128 -14.762 2.781 222 2HB ASN 30 2HB ASN 30 11.094 -16.098 2.284 223 1HD2 ASN 30 1HD2 ASN 30 14.488 -15.242 2.780 224 2HD2 ASN 30 2HD2 ASN 30 14.980 -16.799 3.342 225 H CYS 31 H CYS 31 12.199 -13.759 -1.246 226 HA CYS 31 HA CYS 31 9.440 -13.020 -0.917 227 1HB CYS 31 1HB CYS 31 10.903 -11.306 -1.684 228 2HB CYS 31 2HB CYS 31 11.540 -12.321 -2.969 229 HG CYS 31 HG CYS 31 9.922 -10.795 -4.164 230 H VAL 32 H VAL 32 7.724 -13.877 -1.862 231 HA VAL 32 HA VAL 32 8.088 -16.098 -3.708 232 HB VAL 32 HB VAL 32 5.597 -16.380 -3.419 233 1HG1 VAL 32 1HG1 VAL 32 6.887 -17.844 -2.151 234 2HG1 VAL 32 2HG1 VAL 32 5.842 -17.080 -0.953 235 3HG1 VAL 32 3HG1 VAL 32 7.518 -16.555 -1.126 236 1HG2 VAL 32 1HG2 VAL 32 5.170 -14.020 -2.749 237 2HG2 VAL 32 2HG2 VAL 32 5.952 -14.367 -1.208 238 3HG2 VAL 32 3HG2 VAL 32 4.470 -15.210 -1.654 239 H TRP 33 H TRP 33 6.551 -12.912 -3.554 240 HA TRP 33 HA TRP 33 6.463 -12.897 -6.483 241 1HB TRP 33 1HB TRP 33 4.228 -13.370 -6.237 242 2HB TRP 33 2HB TRP 33 4.142 -12.647 -4.636 243 HD1 TRP 33 HD1 TRP 33 3.485 -11.894 -8.269 244 HE1 TRP 33 HE1 TRP 33 2.550 -9.504 -8.490 245 HE3 TRP 33 HE3 TRP 33 4.345 -10.253 -3.518 246 HZ2 TRP 33 HZ2 TRP 33 2.226 -7.214 -6.845 247 HZ3 TRP 33 HZ3 TRP 33 3.705 -7.957 -2.920 248 HH2 TRP 33 HH2 TRP 33 2.670 -6.474 -4.557 249 H GLU 34 H GLU 34 6.483 -10.804 -7.434 250 HA GLU 34 HA GLU 34 6.678 -8.455 -5.790 251 1HB GLU 34 1HB GLU 34 8.923 -9.373 -5.472 252 2HB GLU 34 2HB GLU 34 9.146 -9.465 -7.214 253 1HG GLU 34 1HG GLU 34 8.407 -6.800 -6.395 254 2HG GLU 34 2HG GLU 34 9.840 -7.364 -5.537 255 H ASP 35 H ASP 35 5.623 -6.978 -6.928 256 HA ASP 35 HA ASP 35 5.762 -7.087 -9.863 257 1HB ASP 35 1HB ASP 35 3.631 -6.358 -7.937 258 2HB ASP 35 2HB ASP 35 3.706 -5.405 -9.415 259 H TYR 36 H TYR 36 7.008 -5.635 -10.814 260 HA TYR 36 HA TYR 36 8.186 -3.452 -9.458 261 1HB TYR 36 1HB TYR 36 8.990 -4.744 -11.569 262 2HB TYR 36 2HB TYR 36 7.991 -3.595 -12.452 263 HD1 TYR 36 HD1 TYR 36 8.707 -1.349 -12.790 264 HD2 TYR 36 HD2 TYR 36 10.917 -3.923 -10.222 265 HE1 TYR 36 HE1 TYR 36 10.541 0.289 -12.736 266 HE2 TYR 36 HE2 TYR 36 12.757 -2.291 -10.160 267 HH TYR 36 HH TYR 36 13.300 -0.053 -12.222 268 H ASN 37 H ASN 37 5.493 -3.682 -11.748 269 HA ASN 37 HA ASN 37 5.047 -0.899 -11.978 270 1HB ASN 37 1HB ASN 37 3.138 -3.210 -12.396 271 2HB ASN 37 2HB ASN 37 2.840 -1.548 -12.896 272 1HD2 ASN 37 1HD2 ASN 37 2.580 -2.724 -14.980 273 2HD2 ASN 37 2HD2 ASN 37 3.989 -2.935 -15.957 274 H ARG 38 H ARG 38 4.474 -3.065 -9.424 275 HA ARG 38 HA ARG 38 2.538 -1.200 -8.224 276 1HB ARG 38 1HB ARG 38 2.759 -4.153 -8.182 277 2HB ARG 38 2HB ARG 38 2.288 -3.388 -6.670 278 1HG ARG 38 1HG ARG 38 0.222 -3.062 -7.397 279 2HG ARG 38 2HG ARG 38 0.800 -2.280 -8.869 280 1HD ARG 38 1HD ARG 38 0.461 -5.240 -8.401 281 2HD ARG 38 2HD ARG 38 -0.519 -4.216 -9.448 282 HE ARG 38 HE ARG 38 2.278 -4.230 -10.116 283 1HH1 ARG 38 1HH1 ARG 38 -0.797 -5.809 -10.596 284 2HH1 ARG 38 2HH1 ARG 38 -0.340 -6.511 -12.111 285 1HH2 ARG 38 1HH2 ARG 38 2.881 -5.157 -12.108 286 2HH2 ARG 38 2HH2 ARG 38 1.747 -6.143 -12.970 287 H ASP 39 H ASP 39 5.725 -1.924 -8.182 288 HA ASP 39 HA ASP 39 7.422 -1.851 -6.644 289 1HB ASP 39 1HB ASP 39 7.401 0.181 -5.280 290 2HB ASP 39 2HB ASP 39 6.819 0.520 -6.907 291 H LEU 40 H LEU 40 5.537 -3.819 -5.997 292 HA LEU 40 HA LEU 40 5.821 -3.862 -3.077 293 1HB LEU 40 1HB LEU 40 3.523 -3.207 -3.571 294 2HB LEU 40 2HB LEU 40 3.333 -4.599 -4.617 295 HG LEU 40 HG LEU 40 3.797 -6.016 -2.533 296 1HD1 LEU 40 1HD1 LEU 40 3.895 -5.090 -0.483 297 2HD1 LEU 40 2HD1 LEU 40 2.750 -3.811 -0.889 298 3HD1 LEU 40 3HD1 LEU 40 4.440 -3.669 -1.374 299 1HD2 LEU 40 1HD2 LEU 40 1.559 -6.264 -2.258 300 2HD2 LEU 40 2HD2 LEU 40 1.525 -5.271 -3.716 301 3HD2 LEU 40 3HD2 LEU 40 1.267 -4.529 -2.134 302 H LEU 41 H LEU 41 5.953 -5.954 -2.154 303 HA LEU 41 HA LEU 41 6.051 -8.235 -3.933 304 1HB LEU 41 1HB LEU 41 8.280 -8.934 -3.354 305 2HB LEU 41 2HB LEU 41 8.318 -7.356 -4.096 306 HG LEU 41 HG LEU 41 9.610 -8.167 -1.760 307 1HD1 LEU 41 1HD1 LEU 41 9.284 -5.276 -2.192 308 2HD1 LEU 41 2HD1 LEU 41 9.849 -6.209 -3.577 309 3HD1 LEU 41 3HD1 LEU 41 10.746 -6.252 -2.057 310 1HD2 LEU 41 1HD2 LEU 41 7.264 -6.426 -1.088 311 2HD2 LEU 41 2HD2 LEU 41 8.752 -6.399 -0.151 312 3HD2 LEU 41 3HD2 LEU 41 7.822 -7.890 -0.283 313 H VAL 42 H VAL 42 6.131 -10.292 -2.823 314 HA VAL 42 HA VAL 42 5.255 -10.056 -0.023 315 HB VAL 42 HB VAL 42 4.213 -11.883 -2.188 316 1HG1 VAL 42 1HG1 VAL 42 4.643 -13.310 -0.267 317 2HG1 VAL 42 2HG1 VAL 42 2.911 -13.056 -0.448 318 3HG1 VAL 42 3HG1 VAL 42 3.807 -12.175 0.789 319 1HG2 VAL 42 1HG2 VAL 42 3.224 -9.564 -0.739 320 2HG2 VAL 42 2HG2 VAL 42 2.105 -10.931 -0.692 321 3HG2 VAL 42 3HG2 VAL 42 2.656 -10.290 -2.242 322 H SER 43 H SER 43 6.304 -11.179 1.427 323 HA SER 43 HA SER 43 8.115 -13.327 0.546 324 1HB SER 43 1HB SER 43 9.767 -12.628 2.060 325 2HB SER 43 2HB SER 43 9.155 -11.104 1.420 326 HG SER 43 HG SER 43 8.059 -10.750 3.282 327 H THR 44 H THR 44 8.433 -15.041 2.149 328 HA THR 44 HA THR 44 5.968 -15.453 3.662 329 HB THR 44 HB THR 44 6.414 -17.775 3.569 330 HG1 THR 44 HG1 THR 44 8.592 -17.821 4.075 331 1HG2 THR 44 1HG2 THR 44 6.042 -16.401 1.322 332 2HG2 THR 44 2HG2 THR 44 6.199 -18.161 1.370 333 3HG2 THR 44 3HG2 THR 44 7.590 -17.160 0.944 334 H THR 45 H THR 45 5.884 -15.263 5.763 335 HA THR 45 HA THR 45 8.394 -15.334 7.303 336 HB THR 45 HB THR 45 7.608 -13.144 7.515 337 HG1 THR 45 HG1 THR 45 6.292 -14.426 9.667 338 1HG2 THR 45 1HG2 THR 45 5.551 -12.900 6.590 339 2HG2 THR 45 2HG2 THR 45 5.106 -12.847 8.297 340 3HG2 THR 45 3HG2 THR 45 4.900 -14.338 7.377 341 H THR 46 H THR 46 8.097 -15.980 9.616 342 HA THR 46 HA THR 46 6.263 -18.270 9.745 343 HB THR 46 HB THR 46 7.862 -18.708 11.839 344 HG1 THR 46 HG1 THR 46 9.537 -17.301 10.040 345 1HG2 THR 46 1HG2 THR 46 7.801 -20.378 10.227 346 2HG2 THR 46 2HG2 THR 46 9.486 -19.857 10.234 347 3HG2 THR 46 3HG2 THR 46 8.399 -19.308 8.959 348 H ALA 47 H ALA 47 5.024 -15.888 10.143 349 HA ALA 47 HA ALA 47 4.167 -16.138 12.904 350 1HB ALA 47 1HB ALA 47 6.047 -14.455 12.865 351 2HB ALA 47 2HB ALA 47 4.519 -13.885 13.537 352 3HB ALA 47 3HB ALA 47 4.990 -13.423 11.901 353 H HIS 48 H HIS 48 2.069 -15.453 13.252 354 HA HIS 48 HA HIS 48 0.371 -15.368 10.985 355 1HB HIS 48 1HB HIS 48 -0.054 -15.005 13.936 356 2HB HIS 48 2HB HIS 48 -1.365 -14.694 12.802 357 HD1 HIS 48 HD1 HIS 48 -2.853 -16.656 13.258 358 HD2 HIS 48 HD2 HIS 48 1.093 -17.774 12.591 359 HE1 HIS 48 HE1 HIS 48 -2.878 -19.167 13.132 360 HE2 HIS 48 HE2 HIS 48 -0.488 -19.819 12.670 361 H GLY 49 H GLY 49 -0.907 -13.683 10.179 362 1HA GLY 49 1HA GLY 49 0.345 -11.082 10.357 363 2HA GLY 49 2HA GLY 49 -0.972 -11.534 9.289 364 H CYS 50 H CYS 50 -0.385 -9.300 11.351 365 HA CYS 50 HA CYS 50 -2.743 -9.594 13.053 366 1HB CYS 50 1HB CYS 50 -0.466 -8.775 13.904 367 2HB CYS 50 2HB CYS 50 -0.825 -7.271 13.064 368 HG CYS 50 HG CYS 50 -3.111 -7.773 14.848 369 H ASP 51 H ASP 51 -2.675 -8.980 10.052 370 HA ASP 51 HA ASP 51 -4.546 -6.724 10.197 371 1HB ASP 51 1HB ASP 51 -2.166 -7.012 8.386 372 2HB ASP 51 2HB ASP 51 -3.577 -6.100 7.858 373 H THR 52 H THR 52 -6.254 -6.796 8.744 374 HA THR 52 HA THR 52 -6.501 -9.303 7.211 375 HB THR 52 HB THR 52 -8.743 -7.754 8.522 376 HG1 THR 52 HG1 THR 52 -8.743 -9.403 10.043 377 1HG2 THR 52 1HG2 THR 52 -8.841 -9.698 6.515 378 2HG2 THR 52 2HG2 THR 52 -10.175 -9.075 7.485 379 3HG2 THR 52 3HG2 THR 52 -9.300 -10.512 8.012 380 H ILE 53 H ILE 53 -6.515 -8.963 5.096 381 HA ILE 53 HA ILE 53 -6.954 -6.341 4.008 382 HB ILE 53 HB ILE 53 -6.878 -8.764 2.266 383 1HG1 ILE 53 1HG1 ILE 53 -4.964 -8.484 4.235 384 2HG1 ILE 53 2HG1 ILE 53 -4.756 -9.358 2.726 385 1HG2 ILE 53 1HG2 ILE 53 -5.826 -5.954 2.031 386 2HG2 ILE 53 2HG2 ILE 53 -7.219 -6.649 1.201 387 3HG2 ILE 53 3HG2 ILE 53 -5.592 -7.212 0.816 388 1HD1 ILE 53 1HD1 ILE 53 -2.878 -7.935 3.044 389 2HD1 ILE 53 2HD1 ILE 53 -3.913 -6.537 3.334 390 3HD1 ILE 53 3HD1 ILE 53 -3.844 -7.266 1.730 391 H ALA 54 H ALA 54 -8.670 -5.583 2.874 392 HA ALA 54 HA ALA 54 -11.147 -7.093 3.149 393 1HB ALA 54 1HB ALA 54 -12.096 -5.115 3.486 394 2HB ALA 54 2HB ALA 54 -11.473 -4.490 1.958 395 3HB ALA 54 3HB ALA 54 -10.489 -4.394 3.419 396 H ARG 55 H ARG 55 -12.231 -7.975 1.497 397 HA ARG 55 HA ARG 55 -11.051 -7.818 -1.165 398 1HB ARG 55 1HB ARG 55 -12.147 -9.904 0.279 399 2HB ARG 55 2HB ARG 55 -13.425 -9.502 -0.858 400 1HG ARG 55 1HG ARG 55 -10.676 -9.761 -1.933 401 2HG ARG 55 2HG ARG 55 -11.506 -11.236 -1.431 402 1HD ARG 55 1HD ARG 55 -13.459 -9.982 -2.842 403 2HD ARG 55 2HD ARG 55 -12.019 -9.454 -3.711 404 HE ARG 55 HE ARG 55 -13.134 -12.106 -3.640 405 1HH1 ARG 55 1HH1 ARG 55 -10.248 -10.222 -4.196 406 2HH1 ARG 55 2HH1 ARG 55 -9.503 -11.427 -5.193 407 1HH2 ARG 55 1HH2 ARG 55 -12.155 -13.691 -4.950 408 2HH2 ARG 55 2HH2 ARG 55 -10.586 -13.396 -5.621 409 H CYS 56 H CYS 56 -12.552 -5.584 0.005 410 HA CYS 56 HA CYS 56 -14.954 -5.494 -1.662 411 1HB CYS 56 1HB CYS 56 -15.534 -3.490 -0.359 412 2HB CYS 56 2HB CYS 56 -15.226 -4.870 0.690 413 H GLN 57 H GLN 57 -15.409 -3.368 -2.737 414 HA GLN 57 HA GLN 57 -12.941 -2.167 -3.800 415 1HB GLN 57 1HB GLN 57 -14.968 -3.631 -5.204 416 2HB GLN 57 2HB GLN 57 -14.975 -1.966 -5.766 417 1HG GLN 57 1HG GLN 57 -12.301 -3.106 -5.529 418 2HG GLN 57 2HG GLN 57 -13.338 -3.952 -6.676 419 1HE2 GLN 57 1HE2 GLN 57 -13.813 -3.020 -8.591 420 2HE2 GLN 57 2HE2 GLN 57 -13.210 -1.483 -9.100 421 H CYS 58 H CYS 58 -14.554 -1.220 -1.623 422 HA CYS 58 HA CYS 58 -16.424 0.724 -2.280 423 1HB CYS 58 1HB CYS 58 -14.413 0.906 -0.029 424 2HB CYS 58 2HB CYS 58 -15.975 1.712 -0.116 425 H THR 59 H THR 59 -16.339 2.709 -3.141 426 HA THR 59 HA THR 59 -13.899 3.650 -4.290 427 HB THR 59 HB THR 59 -16.362 5.342 -4.018 428 HG1 THR 59 HG1 THR 59 -16.024 3.073 -5.671 429 1HG2 THR 59 1HG2 THR 59 -14.798 6.512 -5.239 430 2HG2 THR 59 2HG2 THR 59 -15.745 5.715 -6.495 431 3HG2 THR 59 3HG2 THR 59 -14.175 5.062 -6.026 432 H THR 60 H THR 60 -15.241 3.912 -1.215 433 HA THR 60 HA THR 60 -13.602 6.287 -0.629 434 HB THR 60 HB THR 60 -15.162 7.031 0.955 435 HG1 THR 60 HG1 THR 60 -16.214 4.411 0.849 436 1HG2 THR 60 1HG2 THR 60 -16.144 7.509 -1.131 437 2HG2 THR 60 2HG2 THR 60 -17.433 6.869 -0.112 438 3HG2 THR 60 3HG2 THR 60 -16.689 5.845 -1.341 439 H GLY 61 H GLY 61 -12.531 6.326 1.409 440 1HA GLY 61 1HA GLY 61 -12.531 4.101 3.185 441 2HA GLY 61 2HA GLY 61 -11.154 4.024 2.092 442 H VAL 62 H VAL 62 -9.933 4.211 4.152 443 HA VAL 62 HA VAL 62 -9.444 7.042 4.719 444 HB VAL 62 HB VAL 62 -10.892 6.258 6.533 445 1HG1 VAL 62 1HG1 VAL 62 -10.197 4.516 8.060 446 2HG1 VAL 62 2HG1 VAL 62 -8.712 4.266 7.142 447 3HG1 VAL 62 3HG1 VAL 62 -10.272 3.874 6.418 448 1HG2 VAL 62 1HG2 VAL 62 -9.669 7.848 7.531 449 2HG2 VAL 62 2HG2 VAL 62 -8.144 7.192 6.940 450 3HG2 VAL 62 3HG2 VAL 62 -8.906 6.499 8.372 451 H TYR 63 H TYR 63 -7.361 7.536 4.657 452 HA TYR 63 HA TYR 63 -5.422 5.346 4.566 453 1HB TYR 63 1HB TYR 63 -3.923 6.904 3.481 454 2HB TYR 63 2HB TYR 63 -5.481 6.933 2.663 455 HD1 TYR 63 HD1 TYR 63 -3.429 8.761 5.169 456 HD2 TYR 63 HD2 TYR 63 -6.614 8.977 2.346 457 HE1 TYR 63 HE1 TYR 63 -3.492 11.204 5.431 458 HE2 TYR 63 HE2 TYR 63 -6.683 11.418 2.607 459 HH TYR 63 HH TYR 63 -5.114 13.049 5.115 460 H PHE 64 H PHE 64 -3.869 5.081 6.060 461 HA PHE 64 HA PHE 64 -3.806 7.017 8.275 462 1HB PHE 64 1HB PHE 64 -4.550 4.729 8.861 463 2HB PHE 64 2HB PHE 64 -3.006 4.100 8.298 464 HD1 PHE 64 HD1 PHE 64 -1.168 4.005 9.725 465 HD2 PHE 64 HD2 PHE 64 -4.530 6.390 10.786 466 HE1 PHE 64 HE1 PHE 64 -0.203 4.363 11.959 467 HE2 PHE 64 HE2 PHE 64 -3.570 6.754 13.022 468 HZ PHE 64 HZ PHE 64 -1.404 5.741 13.612 469 H CYS 65 H CYS 65 -1.988 8.048 8.772 470 HA CYS 65 HA CYS 65 0.130 8.849 8.604 471 1HB CYS 65 1HB CYS 65 0.395 6.476 9.646 472 2HB CYS 65 2HB CYS 65 1.100 6.060 8.088 473 HG CYS 65 HG CYS 65 2.702 8.295 8.809 474 H ALA 66 H ALA 66 -1.458 8.388 6.072 475 HA ALA 66 HA ALA 66 0.428 7.723 4.034 476 1HB ALA 66 1HB ALA 66 -1.269 8.063 2.534 477 2HB ALA 66 2HB ALA 66 -1.945 9.419 3.435 478 3HB ALA 66 3HB ALA 66 -2.205 7.768 3.999 479 H SER 67 H SER 67 -0.856 10.757 5.332 480 HA SER 67 HA SER 67 1.576 12.142 4.688 481 1HB SER 67 1HB SER 67 -0.940 12.644 3.122 482 2HB SER 67 2HB SER 67 0.223 13.941 3.388 483 HG SER 67 HG SER 67 0.421 12.494 1.431 484 H LYS 68 H LYS 68 -0.403 11.525 6.934 485 HA LYS 68 HA LYS 68 -0.314 14.188 8.104 486 1HB LYS 68 1HB LYS 68 -2.814 12.717 7.435 487 2HB LYS 68 2HB LYS 68 -2.767 13.609 8.950 488 1HG LYS 68 1HG LYS 68 -1.877 15.012 6.493 489 2HG LYS 68 2HG LYS 68 -3.603 14.706 6.697 490 1HD LYS 68 1HD LYS 68 -3.779 16.111 8.486 491 2HD LYS 68 2HD LYS 68 -2.119 15.827 9.012 492 1HE LYS 68 1HE LYS 68 -1.436 17.101 6.895 493 2HE LYS 68 2HE LYS 68 -3.115 17.631 6.830 494 1HZ LYS 68 1HZ LYS 68 -2.539 18.196 9.353 495 2HZ LYS 68 2HZ LYS 68 -2.303 19.295 8.089 496 3HZ LYS 68 3HZ LYS 68 -1.001 18.389 8.676 497 H SER 69 H SER 69 0.470 11.072 8.433 498 HA SER 69 HA SER 69 0.906 9.654 10.165 499 1HB SER 69 1HB SER 69 2.017 12.017 10.787 500 2HB SER 69 2HB SER 69 0.900 11.872 12.144 501 HG SER 69 HG SER 69 1.841 9.829 12.588 502 H LYS 70 H LYS 70 -1.937 10.548 9.653 503 HA LYS 70 HA LYS 70 -3.089 9.362 12.051 504 1HB LYS 70 1HB LYS 70 -3.965 12.029 10.925 505 2HB LYS 70 2HB LYS 70 -4.872 11.108 12.114 506 1HG LYS 70 1HG LYS 70 -3.675 11.955 13.772 507 2HG LYS 70 2HG LYS 70 -2.166 11.468 13.001 508 1HD LYS 70 1HD LYS 70 -1.791 13.683 12.869 509 2HD LYS 70 2HD LYS 70 -2.864 13.594 11.470 510 1HE LYS 70 1HE LYS 70 -4.087 15.143 12.521 511 2HE LYS 70 2HE LYS 70 -4.626 13.823 13.559 512 1HZ LYS 70 1HZ LYS 70 -3.827 15.739 14.825 513 2HZ LYS 70 2HZ LYS 70 -2.299 15.584 14.115 514 3HZ LYS 70 3HZ LYS 70 -2.890 14.362 15.124 515 H HIS 71 H HIS 71 -5.521 8.996 11.674 516 HA HIS 71 HA HIS 71 -5.804 7.728 9.082 517 1HB HIS 71 1HB HIS 71 -7.017 7.461 11.713 518 2HB HIS 71 2HB HIS 71 -8.239 7.503 10.447 519 HD1 HIS 71 HD1 HIS 71 -6.511 5.123 12.287 520 HD2 HIS 71 HD2 HIS 71 -7.164 5.595 8.211 521 HE1 HIS 71 HE1 HIS 71 -6.170 2.843 11.284 522 HE2 HIS 71 HE2 HIS 71 -6.662 3.134 8.829 523 H TYR 72 H TYR 72 -6.610 8.761 7.387 524 HA TYR 72 HA TYR 72 -8.468 11.006 7.846 525 1HB TYR 72 1HB TYR 72 -5.962 10.866 6.422 526 2HB TYR 72 2HB TYR 72 -7.255 11.336 5.328 527 HD1 TYR 72 HD1 TYR 72 -5.428 12.263 8.392 528 HD2 TYR 72 HD2 TYR 72 -8.261 13.496 5.466 529 HE1 TYR 72 HE1 TYR 72 -5.251 14.577 9.206 530 HE2 TYR 72 HE2 TYR 72 -8.098 15.812 6.275 531 HH TYR 72 HH TYR 72 -5.657 16.829 8.458 532 HA PRO 73 HA PRO 73 -11.087 8.322 5.304 533 1HB PRO 73 1HB PRO 73 -13.094 10.429 5.685 534 2HB PRO 73 2HB PRO 73 -13.148 8.736 6.185 535 1HG PRO 73 1HG PRO 73 -12.901 10.746 7.965 536 2HG PRO 73 2HG PRO 73 -12.142 9.162 8.212 537 1HD PRO 73 1HD PRO 73 -10.914 11.722 7.245 538 2HD PRO 73 2HD PRO 73 -10.272 10.528 8.395 539 H VAL 74 H VAL 74 -10.797 8.416 3.152 540 HA VAL 74 HA VAL 74 -11.399 10.922 1.763 541 HB VAL 74 HB VAL 74 -8.875 10.596 2.282 542 1HG1 VAL 74 1HG1 VAL 74 -7.635 9.291 0.673 543 2HG1 VAL 74 2HG1 VAL 74 -9.132 8.786 -0.112 544 3HG1 VAL 74 3HG1 VAL 74 -8.774 8.254 1.531 545 1HG2 VAL 74 1HG2 VAL 74 -8.258 11.609 0.129 546 2HG2 VAL 74 2HG2 VAL 74 -9.698 12.341 0.837 547 3HG2 VAL 74 3HG2 VAL 74 -9.854 11.202 -0.500 548 H SER 75 H SER 75 -11.869 10.698 -0.467 549 HA SER 75 HA SER 75 -12.843 8.027 -1.166 550 1HB SER 75 1HB SER 75 -13.389 10.589 -2.671 551 2HB SER 75 2HB SER 75 -14.307 9.084 -2.716 552 HG SER 75 HG SER 75 -14.685 9.529 -0.391 553 H PHE 76 H PHE 76 -11.791 6.813 -2.617 554 HA PHE 76 HA PHE 76 -10.003 8.168 -4.513 555 1HB PHE 76 1HB PHE 76 -8.805 5.682 -4.041 556 2HB PHE 76 2HB PHE 76 -8.206 7.259 -3.554 557 HD1 PHE 76 HD1 PHE 76 -10.960 5.075 -2.272 558 HD2 PHE 76 HD2 PHE 76 -7.332 7.138 -1.457 559 HE1 PHE 76 HE1 PHE 76 -11.115 4.414 0.092 560 HE2 PHE 76 HE2 PHE 76 -7.482 6.497 0.904 561 HZ PHE 76 HZ PHE 76 -9.379 5.128 1.687 562 H GLU 77 H GLU 77 -9.394 6.886 -6.356 563 HA GLU 77 HA GLU 77 -11.543 5.060 -7.199 564 1HB GLU 77 1HB GLU 77 -10.078 7.243 -8.577 565 2HB GLU 77 2HB GLU 77 -10.400 5.802 -9.533 566 1HG GLU 77 1HG GLU 77 -12.511 7.337 -8.039 567 2HG GLU 77 2HG GLU 77 -12.113 7.594 -9.738 568 H GLY 78 H GLY 78 -10.837 3.298 -8.675 569 1HA GLY 78 1HA GLY 78 -8.131 2.412 -7.906 570 2HA GLY 78 2HA GLY 78 -9.465 1.341 -8.284 571 HA PRO 79 HA PRO 79 -8.024 3.009 -12.586 572 1HB PRO 79 1HB PRO 79 -5.523 4.439 -12.068 573 2HB PRO 79 2HB PRO 79 -6.930 4.950 -13.000 574 1HG PRO 79 1HG PRO 79 -6.274 6.037 -10.610 575 2HG PRO 79 2HG PRO 79 -7.943 5.914 -11.191 576 1HD PRO 79 1HD PRO 79 -6.516 4.255 -9.168 577 2HD PRO 79 2HD PRO 79 -8.200 4.784 -9.221 578 H GLY 80 H GLY 80 -6.923 1.673 -13.882 579 1HA GLY 80 1HA GLY 80 -5.350 -0.396 -12.810 580 2HA GLY 80 2HA GLY 80 -5.554 -0.046 -14.520 581 H LEU 81 H LEU 81 -4.318 2.162 -15.097 582 HA LEU 81 HA LEU 81 -1.620 1.880 -13.947 583 1HB LEU 81 1HB LEU 81 -2.273 1.278 -16.495 584 2HB LEU 81 2HB LEU 81 -1.826 2.964 -16.669 585 HG LEU 81 HG LEU 81 0.175 1.897 -17.068 586 1HD1 LEU 81 1HD1 LEU 81 0.597 3.539 -15.391 587 2HD1 LEU 81 2HD1 LEU 81 1.605 2.129 -15.066 588 3HD1 LEU 81 3HD1 LEU 81 0.155 2.409 -14.113 589 1HD2 LEU 81 1HD2 LEU 81 -0.547 -0.058 -14.904 590 2HD2 LEU 81 2HD2 LEU 81 0.996 -0.040 -15.758 591 3HD2 LEU 81 3HD2 LEU 81 -0.496 -0.359 -16.641 592 H VAL 82 H VAL 82 -0.874 3.603 -12.951 593 HA VAL 82 HA VAL 82 -1.763 6.263 -13.842 594 HB VAL 82 HB VAL 82 -1.262 5.554 -10.946 595 1HG1 VAL 82 1HG1 VAL 82 -2.863 7.770 -11.033 596 2HG1 VAL 82 2HG1 VAL 82 -1.815 8.012 -12.431 597 3HG1 VAL 82 3HG1 VAL 82 -1.111 7.784 -10.829 598 1HG2 VAL 82 1HG2 VAL 82 -3.227 4.338 -11.828 599 2HG2 VAL 82 2HG2 VAL 82 -3.926 5.878 -12.329 600 3HG2 VAL 82 3HG2 VAL 82 -3.659 5.547 -10.618 601 H GLU 83 H GLU 83 -0.102 7.498 -14.429 602 HA GLU 83 HA GLU 83 2.591 6.653 -14.017 603 1HB GLU 83 1HB GLU 83 1.205 8.572 -15.643 604 2HB GLU 83 2HB GLU 83 2.570 9.356 -14.860 605 1HG GLU 83 1HG GLU 83 3.321 6.781 -15.918 606 2HG GLU 83 2HG GLU 83 2.610 7.804 -17.164 607 H VAL 84 H VAL 84 3.476 6.774 -12.057 608 HA VAL 84 HA VAL 84 2.722 8.786 -10.156 609 HB VAL 84 HB VAL 84 4.423 7.779 -8.696 610 1HG1 VAL 84 1HG1 VAL 84 2.208 6.828 -8.697 611 2HG1 VAL 84 2HG1 VAL 84 3.395 5.534 -8.532 612 3HG1 VAL 84 3HG1 VAL 84 2.606 5.815 -10.084 613 1HG2 VAL 84 1HG2 VAL 84 5.094 5.448 -10.171 614 2HG2 VAL 84 2HG2 VAL 84 6.169 6.691 -9.530 615 3HG2 VAL 84 3HG2 VAL 84 5.504 6.852 -11.154 616 H GLN 85 H GLN 85 3.523 10.737 -9.989 617 HA GLN 85 HA GLN 85 5.631 11.689 -11.633 618 1HB GLN 85 1HB GLN 85 4.592 13.152 -9.222 619 2HB GLN 85 2HB GLN 85 5.182 13.815 -10.739 620 1HG GLN 85 1HG GLN 85 2.957 12.175 -11.337 621 2HG GLN 85 2HG GLN 85 2.517 13.199 -9.971 622 1HE2 GLN 85 1HE2 GLN 85 3.301 15.547 -10.282 623 2HE2 GLN 85 2HE2 GLN 85 2.953 16.243 -11.824 624 H GLU 86 H GLU 86 7.668 12.516 -11.028 625 HA GLU 86 HA GLU 86 9.060 10.936 -9.138 626 1HB GLU 86 1HB GLU 86 10.111 11.882 -11.167 627 2HB GLU 86 2HB GLU 86 9.936 13.494 -10.490 628 1HG GLU 86 1HG GLU 86 11.267 12.164 -8.503 629 2HG GLU 86 2HG GLU 86 11.940 11.448 -9.967 630 H SER 87 H SER 87 8.525 11.151 -7.035 631 HA SER 87 HA SER 87 9.018 13.754 -5.800 632 1HB SER 87 1HB SER 87 6.910 13.250 -4.335 633 2HB SER 87 2HB SER 87 6.708 13.990 -5.923 634 HG SER 87 HG SER 87 6.252 11.906 -6.747 635 H GLU 88 H GLU 88 9.238 13.640 -3.455 636 HA GLU 88 HA GLU 88 10.248 12.814 -1.603 637 1HB GLU 88 1HB GLU 88 8.015 11.410 -1.898 638 2HB GLU 88 2HB GLU 88 9.150 10.088 -2.102 639 1HG GLU 88 1HG GLU 88 9.041 9.923 0.116 640 2HG GLU 88 2HG GLU 88 10.144 11.299 0.114 641 H TYR 89 H TYR 89 10.305 9.716 -3.334 642 HA TYR 89 HA TYR 89 13.126 9.984 -3.922 643 1HB TYR 89 1HB TYR 89 13.541 7.743 -2.688 644 2HB TYR 89 2HB TYR 89 13.486 9.226 -1.742 645 HD1 TYR 89 HD1 TYR 89 12.503 8.895 0.311 646 HD2 TYR 89 HD2 TYR 89 10.895 6.865 -3.066 647 HE1 TYR 89 HE1 TYR 89 10.746 7.929 1.735 648 HE2 TYR 89 HE2 TYR 89 9.134 5.895 -1.651 649 HH TYR 89 HH TYR 89 8.005 6.369 0.469 650 H TYR 90 H TYR 90 10.445 9.405 -5.231 651 HA TYR 90 HA TYR 90 11.243 6.907 -6.568 652 1HB TYR 90 1HB TYR 90 8.949 7.204 -5.185 653 2HB TYR 90 2HB TYR 90 8.418 7.788 -6.759 654 HD1 TYR 90 HD1 TYR 90 9.355 4.888 -4.799 655 HD2 TYR 90 HD2 TYR 90 8.522 6.281 -8.733 656 HE1 TYR 90 HE1 TYR 90 9.058 2.565 -5.552 657 HE2 TYR 90 HE2 TYR 90 8.222 3.963 -9.496 658 HH TYR 90 HH TYR 90 8.995 1.672 -8.774 659 HA PRO 91 HA PRO 91 11.550 9.526 -10.160 660 1HB PRO 91 1HB PRO 91 12.076 7.634 -11.992 661 2HB PRO 91 2HB PRO 91 13.258 8.086 -10.758 662 1HG PRO 91 1HG PRO 91 11.399 5.742 -10.828 663 2HG PRO 91 2HG PRO 91 13.108 5.798 -10.364 664 1HD PRO 91 1HD PRO 91 11.053 5.789 -8.562 665 2HD PRO 91 2HD PRO 91 12.634 6.529 -8.243 666 H LYS 92 H LYS 92 10.307 10.162 -11.903 667 HA LYS 92 HA LYS 92 7.593 9.581 -11.922 668 1HB LYS 92 1HB LYS 92 8.580 11.609 -12.914 669 2HB LYS 92 2HB LYS 92 9.261 10.637 -14.210 670 1HG LYS 92 1HG LYS 92 7.380 10.751 -15.371 671 2HG LYS 92 2HG LYS 92 6.438 10.162 -14.001 672 1HD LYS 92 1HD LYS 92 5.601 12.192 -13.647 673 2HD LYS 92 2HD LYS 92 7.221 12.879 -13.528 674 1HE LYS 92 1HE LYS 92 7.261 13.516 -15.728 675 2HE LYS 92 2HE LYS 92 6.144 12.247 -16.228 676 1HZ LYS 92 1HZ LYS 92 5.460 14.807 -15.984 677 2HZ LYS 92 2HZ LYS 92 5.048 14.252 -14.440 678 3HZ LYS 92 3HZ LYS 92 4.364 13.530 -15.808 679 H ARG 93 H ARG 93 7.265 7.338 -11.946 680 HA ARG 93 HA ARG 93 7.793 6.063 -14.553 681 1HB ARG 93 1HB ARG 93 8.804 5.289 -12.072 682 2HB ARG 93 2HB ARG 93 7.496 4.156 -12.389 683 1HG ARG 93 1HG ARG 93 9.488 3.199 -13.244 684 2HG ARG 93 2HG ARG 93 8.528 3.726 -14.628 685 1HD ARG 93 1HD ARG 93 10.553 4.563 -15.246 686 2HD ARG 93 2HD ARG 93 9.954 5.932 -14.311 687 HE ARG 93 HE ARG 93 11.624 5.570 -12.801 688 1HH1 ARG 93 1HH1 ARG 93 11.198 2.666 -14.690 689 2HH1 ARG 93 2HH1 ARG 93 12.575 1.870 -14.005 690 1HH2 ARG 93 1HH2 ARG 93 13.434 4.523 -11.899 691 2HH2 ARG 93 2HH2 ARG 93 13.844 2.923 -12.420 692 H TYR 94 H TYR 94 6.434 3.832 -14.479 693 HA TYR 94 HA TYR 94 3.642 4.691 -14.258 694 1HB TYR 94 1HB TYR 94 5.101 2.708 -15.953 695 2HB TYR 94 2HB TYR 94 3.392 2.439 -15.623 696 HD1 TYR 94 HD1 TYR 94 5.729 5.071 -16.844 697 HD2 TYR 94 HD2 TYR 94 1.803 3.445 -16.981 698 HE1 TYR 94 HE1 TYR 94 5.144 6.650 -18.630 699 HE2 TYR 94 HE2 TYR 94 1.204 5.017 -18.766 700 HH TYR 94 HH TYR 94 2.315 6.354 -20.495 701 H GLN 95 H GLN 95 2.245 3.752 -12.865 702 HA GLN 95 HA GLN 95 3.149 1.335 -11.449 703 1HB GLN 95 1HB GLN 95 2.863 3.876 -10.330 704 2HB GLN 95 2HB GLN 95 1.428 3.001 -9.817 705 1HG GLN 95 1HG GLN 95 3.230 2.811 -8.193 706 2HG GLN 95 2HG GLN 95 2.809 1.242 -8.878 707 1HE2 GLN 95 1HE2 GLN 95 5.151 3.848 -8.925 708 2HE2 GLN 95 2HE2 GLN 95 6.463 2.915 -9.552 709 H SER 96 H SER 96 1.774 -0.310 -11.568 710 HA SER 96 HA SER 96 -0.889 0.153 -12.635 711 1HB SER 96 1HB SER 96 0.397 -1.628 -13.647 712 2HB SER 96 2HB SER 96 0.633 -2.399 -12.078 713 HG SER 96 HG SER 96 -1.561 -2.846 -12.002 714 H HIS 97 H HIS 97 -2.747 -1.017 -11.740 715 HA HIS 97 HA HIS 97 -4.278 -1.132 -10.052 716 1HB HIS 97 1HB HIS 97 -2.132 -3.045 -9.583 717 2HB HIS 97 2HB HIS 97 -2.996 -2.640 -8.106 718 HD1 HIS 97 HD1 HIS 97 -4.328 -4.754 -7.817 719 HD2 HIS 97 HD2 HIS 97 -4.754 -3.090 -11.602 720 HE1 HIS 97 HE1 HIS 97 -6.167 -6.064 -8.926 721 HE2 HIS 97 HE2 HIS 97 -6.469 -4.979 -11.179 722 H VAL 98 H VAL 98 -3.422 1.320 -9.809 723 HA VAL 98 HA VAL 98 -2.860 1.611 -6.927 724 HB VAL 98 HB VAL 98 -0.912 2.308 -8.321 725 1HG1 VAL 98 1HG1 VAL 98 -1.155 3.587 -10.110 726 2HG1 VAL 98 2HG1 VAL 98 -1.848 4.872 -9.121 727 3HG1 VAL 98 3HG1 VAL 98 -2.895 3.640 -9.829 728 1HG2 VAL 98 1HG2 VAL 98 -2.301 3.937 -6.328 729 2HG2 VAL 98 2HG2 VAL 98 -1.116 4.821 -7.293 730 3HG2 VAL 98 3HG2 VAL 98 -0.626 3.390 -6.383 731 H LEU 99 H LEU 99 -4.130 2.966 -5.778 732 HA LEU 99 HA LEU 99 -6.376 4.190 -7.214 733 1HB LEU 99 1HB LEU 99 -6.146 3.757 -4.241 734 2HB LEU 99 2HB LEU 99 -7.594 4.130 -5.156 735 HG LEU 99 HG LEU 99 -7.081 1.840 -6.336 736 1HD1 LEU 99 1HD1 LEU 99 -5.043 1.923 -4.382 737 2HD1 LEU 99 2HD1 LEU 99 -5.457 0.602 -5.476 738 3HD1 LEU 99 3HD1 LEU 99 -6.199 0.690 -3.878 739 1HD2 LEU 99 1HD2 LEU 99 -8.090 1.554 -3.546 740 2HD2 LEU 99 2HD2 LEU 99 -8.746 0.921 -5.056 741 3HD2 LEU 99 3HD2 LEU 99 -8.948 2.626 -4.653 742 H LEU 100 H LEU 100 -7.003 6.363 -6.776 743 HA LEU 100 HA LEU 100 -4.953 7.913 -5.355 744 1HB LEU 100 1HB LEU 100 -5.913 8.213 -8.117 745 2HB LEU 100 2HB LEU 100 -5.739 9.703 -7.204 746 HG LEU 100 HG LEU 100 -3.526 7.670 -7.430 747 1HD1 LEU 100 1HD1 LEU 100 -3.746 10.181 -9.056 748 2HD1 LEU 100 2HD1 LEU 100 -4.285 8.611 -9.652 749 3HD1 LEU 100 3HD1 LEU 100 -2.591 8.859 -9.222 750 1HD2 LEU 100 1HD2 LEU 100 -3.829 9.782 -5.724 751 2HD2 LEU 100 2HD2 LEU 100 -2.911 10.502 -7.046 752 3HD2 LEU 100 3HD2 LEU 100 -2.289 9.079 -6.211 753 H ALA 101 H ALA 101 -5.610 9.372 -3.944 754 HA ALA 101 HA ALA 101 -8.461 10.116 -3.905 755 1HB ALA 101 1HB ALA 101 -7.984 10.193 -1.318 756 2HB ALA 101 2HB ALA 101 -6.754 9.000 -1.743 757 3HB ALA 101 3HB ALA 101 -8.453 8.697 -2.124 758 H THR 102 H THR 102 -8.873 12.223 -3.685 759 HA THR 102 HA THR 102 -6.609 14.033 -3.388 760 HB THR 102 HB THR 102 -7.957 14.548 -5.257 761 HG1 THR 102 HG1 THR 102 -8.828 16.601 -4.662 762 1HG2 THR 102 1HG2 THR 102 -10.054 13.834 -5.327 763 2HG2 THR 102 2HG2 THR 102 -10.481 15.246 -4.359 764 3HG2 THR 102 3HG2 THR 102 -10.144 13.703 -3.570 765 H GLY 103 H GLY 103 -6.110 14.752 -1.434 766 1HA GLY 103 1HA GLY 103 -8.220 14.901 0.614 767 2HA GLY 103 2HA GLY 103 -6.493 14.829 0.928 768 H PHE 104 H PHE 104 -5.494 16.665 1.419 769 HA PHE 104 HA PHE 104 -6.746 19.202 0.606 770 1HB PHE 104 1HB PHE 104 -6.828 18.321 3.161 771 2HB PHE 104 2HB PHE 104 -5.289 19.175 3.184 772 HD1 PHE 104 HD1 PHE 104 -8.714 19.502 3.704 773 HD2 PHE 104 HD2 PHE 104 -5.390 21.575 2.041 774 HE1 PHE 104 HE1 PHE 104 -9.909 21.635 3.983 775 HE2 PHE 104 HE2 PHE 104 -6.579 23.712 2.319 776 HZ PHE 104 HZ PHE 104 -8.842 23.743 3.290 777 H SER 105 H SER 105 -3.768 17.796 1.970 778 HA SER 105 HA SER 105 -2.136 18.892 -0.085 779 1HB SER 105 1HB SER 105 -2.187 20.275 2.594 780 2HB SER 105 2HB SER 105 -0.772 20.338 1.543 781 HG SER 105 HG SER 105 -3.319 21.446 1.181 782 H GLU 106 H GLU 106 0.304 18.764 0.729 783 HA GLU 106 HA GLU 106 0.586 16.330 2.358 784 1HB GLU 106 1HB GLU 106 1.508 16.868 -0.401 785 2HB GLU 106 2HB GLU 106 2.671 16.078 0.654 786 1HG GLU 106 1HG GLU 106 1.340 14.198 0.928 787 2HG GLU 106 2HG GLU 106 -0.123 15.041 0.421 788 HA PRO 107 HA PRO 107 3.332 19.237 4.453 789 1HB PRO 107 1HB PRO 107 3.928 17.591 6.537 790 2HB PRO 107 2HB PRO 107 2.432 18.526 6.443 791 1HG PRO 107 1HG PRO 107 2.912 15.646 5.782 792 2HG PRO 107 2HG PRO 107 1.560 16.382 6.663 793 1HD PRO 107 1HD PRO 107 1.369 15.660 4.067 794 2HD PRO 107 2HD PRO 107 0.506 17.066 4.725 795 H GLY 108 H GLY 108 4.135 15.769 4.190 796 1HA GLY 108 1HA GLY 108 6.331 15.858 2.626 797 2HA GLY 108 2HA GLY 108 6.973 16.342 4.188 798 H ASP 109 H ASP 109 5.560 14.728 5.907 799 HA ASP 109 HA ASP 109 6.971 12.286 5.679 800 1HB ASP 109 1HB ASP 109 6.009 13.541 7.782 801 2HB ASP 109 2HB ASP 109 4.584 12.554 7.466 802 H ALA 110 H ALA 110 6.442 10.409 4.754 803 HA ALA 110 HA ALA 110 3.642 9.812 4.170 804 1HB ALA 110 1HB ALA 110 3.973 10.595 2.073 805 2HB ALA 110 2HB ALA 110 4.679 8.997 1.836 806 3HB ALA 110 3HB ALA 110 5.722 10.385 2.151 807 H GLY 111 H GLY 111 3.284 7.864 4.996 808 1HA GLY 111 1HA GLY 111 4.610 5.538 4.213 809 2HA GLY 111 2HA GLY 111 5.331 6.058 5.729 810 H GLY 112 H GLY 112 2.851 4.293 4.312 811 1HA GLY 112 1HA GLY 112 1.881 3.230 6.684 812 2HA GLY 112 2HA GLY 112 0.820 4.571 6.280 813 H ILE 113 H ILE 113 -0.682 2.617 6.293 814 HA ILE 113 HA ILE 113 -0.807 1.526 3.559 815 HB ILE 113 HB ILE 113 -1.839 -0.514 4.451 816 1HG1 ILE 113 1HG1 ILE 113 -1.169 0.679 7.151 817 2HG1 ILE 113 2HG1 ILE 113 -2.786 0.401 6.512 818 1HG2 ILE 113 1HG2 ILE 113 0.225 -1.415 5.600 819 2HG2 ILE 113 2HG2 ILE 113 0.886 0.217 5.492 820 3HG2 ILE 113 3HG2 ILE 113 0.478 -0.669 4.022 821 1HD1 ILE 113 1HD1 ILE 113 -0.749 -1.670 7.279 822 2HD1 ILE 113 2HD1 ILE 113 -2.264 -2.032 6.452 823 3HD1 ILE 113 3HD1 ILE 113 -2.288 -1.327 8.069 824 H LEU 114 H LEU 114 -2.837 1.354 2.613 825 HA LEU 114 HA LEU 114 -4.850 3.128 3.730 826 1HB LEU 114 1HB LEU 114 -4.449 3.478 1.432 827 2HB LEU 114 2HB LEU 114 -4.488 1.763 1.077 828 HG LEU 114 HG LEU 114 -6.920 1.744 1.518 829 1HD1 LEU 114 1HD1 LEU 114 -6.763 3.781 3.047 830 2HD1 LEU 114 2HD1 LEU 114 -8.156 3.661 1.972 831 3HD1 LEU 114 3HD1 LEU 114 -6.816 4.735 1.564 832 1HD2 LEU 114 1HD2 LEU 114 -7.576 2.966 -0.505 833 2HD2 LEU 114 2HD2 LEU 114 -6.108 2.022 -0.756 834 3HD2 LEU 114 3HD2 LEU 114 -6.004 3.767 -0.523 835 H ARG 115 H ARG 115 -6.486 2.412 4.935 836 HA ARG 115 HA ARG 115 -7.284 -0.411 4.647 837 1HB ARG 115 1HB ARG 115 -7.303 1.322 7.121 838 2HB ARG 115 2HB ARG 115 -7.957 -0.308 7.036 839 1HG ARG 115 1HG ARG 115 -5.522 -0.854 6.166 840 2HG ARG 115 2HG ARG 115 -5.138 0.609 7.076 841 1HD ARG 115 1HD ARG 115 -6.566 -0.544 8.942 842 2HD ARG 115 2HD ARG 115 -6.190 -2.012 8.042 843 HE ARG 115 HE ARG 115 -4.044 -1.895 8.823 844 1HH1 ARG 115 1HH1 ARG 115 -5.579 1.203 9.296 845 2HH1 ARG 115 2HH1 ARG 115 -4.267 1.853 10.219 846 1HH2 ARG 115 1HH2 ARG 115 -2.317 -1.042 10.038 847 2HH2 ARG 115 2HH2 ARG 115 -2.415 0.579 10.641 848 H CYS 116 H CYS 116 -9.463 -0.953 4.922 849 HA CYS 116 HA CYS 116 -11.361 1.266 4.529 850 1HB CYS 116 1HB CYS 116 -10.902 -0.383 2.579 851 2HB CYS 116 2HB CYS 116 -11.839 -1.532 3.525 852 H GLU 117 H GLU 117 -13.612 0.709 5.231 853 HA GLU 117 HA GLU 117 -13.665 -0.053 7.919 854 1HB GLU 117 1HB GLU 117 -15.944 -0.002 5.934 855 2HB GLU 117 2HB GLU 117 -16.119 -0.061 7.682 856 1HG GLU 117 1HG GLU 117 -14.459 2.142 6.699 857 2HG GLU 117 2HG GLU 117 -16.144 2.201 6.186 858 H HIS 118 H HIS 118 -13.616 -1.977 5.092 859 HA HIS 118 HA HIS 118 -14.760 -4.299 6.432 860 1HB HIS 118 1HB HIS 118 -13.707 -4.083 3.609 861 2HB HIS 118 2HB HIS 118 -14.719 -5.365 4.269 862 HD2 HIS 118 HD2 HIS 118 -17.353 -4.987 3.763 863 HE1 HIS 118 HE1 HIS 118 -17.227 -0.807 3.044 864 HE2 HIS 118 HE2 HIS 118 -18.689 -2.856 3.156 865 H GLY 119 H GLY 119 -11.669 -3.049 5.346 866 1HA GLY 119 1HA GLY 119 -10.150 -4.653 7.043 867 2HA GLY 119 2HA GLY 119 -10.215 -5.482 5.495 868 H VAL 120 H VAL 120 -8.234 -5.245 4.710 869 HA VAL 120 HA VAL 120 -7.012 -2.572 4.689 870 HB VAL 120 HB VAL 120 -5.602 -5.138 3.985 871 1HG1 VAL 120 1HG1 VAL 120 -4.141 -3.548 3.363 872 2HG1 VAL 120 2HG1 VAL 120 -3.750 -3.554 5.083 873 3HG1 VAL 120 3HG1 VAL 120 -4.839 -2.329 4.430 874 1HG2 VAL 120 1HG2 VAL 120 -4.928 -4.231 6.616 875 2HG2 VAL 120 2HG2 VAL 120 -5.528 -5.806 6.100 876 3HG2 VAL 120 3HG2 VAL 120 -6.664 -4.525 6.519 877 H ILE 121 H ILE 121 -6.597 -1.530 2.807 878 HA ILE 121 HA ILE 121 -7.602 -2.753 0.351 879 HB ILE 121 HB ILE 121 -6.652 0.073 0.785 880 1HG1 ILE 121 1HG1 ILE 121 -8.925 -1.124 1.870 881 2HG1 ILE 121 2HG1 ILE 121 -8.617 0.598 1.722 882 1HG2 ILE 121 1HG2 ILE 121 -7.997 -1.321 -1.499 883 2HG2 ILE 121 2HG2 ILE 121 -6.543 -0.324 -1.501 884 3HG2 ILE 121 3HG2 ILE 121 -8.123 0.427 -1.287 885 1HD1 ILE 121 1HD1 ILE 121 -10.802 -0.636 0.765 886 2HD1 ILE 121 2HD1 ILE 121 -9.774 -0.683 -0.661 887 3HD1 ILE 121 3HD1 ILE 121 -10.148 0.863 0.106 888 H GLY 122 H GLY 122 -4.829 -0.621 1.072 889 1HA GLY 122 1HA GLY 122 -2.987 -2.485 -0.152 890 2HA GLY 122 2HA GLY 122 -3.285 -1.036 -1.098 891 H LEU 123 H LEU 123 -1.278 -0.130 -0.940 892 HA LEU 123 HA LEU 123 -0.548 0.867 1.721 893 1HB LEU 123 1HB LEU 123 1.869 0.489 1.092 894 2HB LEU 123 2HB LEU 123 0.937 -0.943 1.483 895 HG LEU 123 HG LEU 123 1.132 -0.164 -1.383 896 1HD1 LEU 123 1HD1 LEU 123 3.310 -1.877 -0.383 897 2HD1 LEU 123 2HD1 LEU 123 3.444 -0.159 -0.010 898 3HD1 LEU 123 3HD1 LEU 123 3.302 -0.688 -1.685 899 1HD2 LEU 123 1HD2 LEU 123 1.045 -2.543 -1.715 900 2HD2 LEU 123 2HD2 LEU 123 -0.225 -2.081 -0.581 901 3HD2 LEU 123 3HD2 LEU 123 1.256 -2.833 0.012 902 H VAL 124 H VAL 124 1.036 2.677 1.607 903 HA VAL 124 HA VAL 124 0.137 4.655 -0.216 904 HB VAL 124 HB VAL 124 2.591 4.765 1.538 905 1HG1 VAL 124 1HG1 VAL 124 0.862 7.013 0.517 906 2HG1 VAL 124 2HG1 VAL 124 2.372 6.503 -0.240 907 3HG1 VAL 124 3HG1 VAL 124 2.381 7.144 1.402 908 1HG2 VAL 124 1HG2 VAL 124 0.163 6.094 2.482 909 2HG2 VAL 124 2HG2 VAL 124 1.325 5.097 3.355 910 3HG2 VAL 124 3HG2 VAL 124 0.038 4.336 2.421 911 H THR 125 H THR 125 0.632 4.600 -2.319 912 HA THR 125 HA THR 125 3.247 3.627 -3.164 913 HB THR 125 HB THR 125 0.676 4.213 -4.606 914 HG1 THR 125 HG1 THR 125 1.023 2.039 -5.261 915 1HG2 THR 125 1HG2 THR 125 1.800 4.858 -6.421 916 2HG2 THR 125 2HG2 THR 125 2.272 3.163 -6.544 917 3HG2 THR 125 3HG2 THR 125 3.348 4.324 -5.768 918 H MET 126 H MET 126 1.494 6.166 -4.895 919 HA MET 126 HA MET 126 3.540 8.102 -4.077 920 1HB MET 126 1HB MET 126 2.896 7.328 -6.919 921 2HB MET 126 2HB MET 126 3.736 8.815 -6.498 922 1HG MET 126 1HG MET 126 4.670 6.012 -5.924 923 2HG MET 126 2HG MET 126 5.311 7.102 -7.151 924 1HE MET 126 1HE MET 126 5.511 9.839 -5.912 925 2HE MET 126 2HE MET 126 6.948 9.129 -6.645 926 3HE MET 126 3HE MET 126 7.048 9.864 -5.046 927 H GLY 127 H GLY 127 2.687 10.001 -3.564 928 1HA GLY 127 1HA GLY 127 -0.046 10.581 -4.515 929 2HA GLY 127 2HA GLY 127 0.621 11.144 -2.991 930 H GLY 128 H GLY 128 -0.438 12.326 -5.713 931 1HA GLY 128 1HA GLY 128 1.715 13.909 -6.696 932 2HA GLY 128 2HA GLY 128 0.008 14.169 -7.019 933 H GLU 129 H GLU 129 0.067 16.389 -6.768 934 HA GLU 129 HA GLU 129 1.106 17.523 -4.308 935 1HB GLU 129 1HB GLU 129 -0.339 18.900 -6.578 936 2HB GLU 129 2HB GLU 129 0.576 19.678 -5.294 937 1HG GLU 129 1HG GLU 129 2.630 18.751 -6.119 938 2HG GLU 129 2HG GLU 129 1.761 17.798 -7.321 939 H GLY 130 H GLY 130 -1.898 16.397 -5.527 940 1HA GLY 130 1HA GLY 130 -3.213 17.401 -3.100 941 2HA GLY 130 2HA GLY 130 -3.971 17.688 -4.657 942 H VAL 131 H VAL 131 -2.663 14.812 -5.222 943 HA VAL 131 HA VAL 131 -4.963 13.363 -4.099 944 HB VAL 131 HB VAL 131 -3.604 12.282 -6.506 945 1HG1 VAL 131 1HG1 VAL 131 -5.955 11.669 -7.053 946 2HG1 VAL 131 2HG1 VAL 131 -6.445 12.396 -5.524 947 3HG1 VAL 131 3HG1 VAL 131 -5.369 11.000 -5.530 948 1HG2 VAL 131 1HG2 VAL 131 -5.574 14.559 -6.662 949 2HG2 VAL 131 2HG2 VAL 131 -4.907 13.658 -8.023 950 3HG2 VAL 131 3HG2 VAL 131 -3.855 14.673 -7.036 951 H VAL 132 H VAL 132 -4.649 11.090 -3.635 952 HA VAL 132 HA VAL 132 -1.892 10.516 -2.748 953 HB VAL 132 HB VAL 132 -4.439 9.372 -1.608 954 1HG1 VAL 132 1HG1 VAL 132 -2.641 7.971 -1.075 955 2HG1 VAL 132 2HG1 VAL 132 -2.905 8.966 0.357 956 3HG1 VAL 132 3HG1 VAL 132 -1.570 9.331 -0.737 957 1HG2 VAL 132 1HG2 VAL 132 -2.846 11.532 -0.278 958 2HG2 VAL 132 2HG2 VAL 132 -4.489 10.985 0.064 959 3HG2 VAL 132 3HG2 VAL 132 -4.155 11.916 -1.397 960 H GLY 133 H GLY 133 -0.906 8.917 -3.866 961 1HA GLY 133 1HA GLY 133 -2.523 6.997 -5.358 962 2HA GLY 133 2HA GLY 133 -0.782 7.189 -5.463 963 H PHE 134 H PHE 134 -2.990 5.007 -4.641 964 HA PHE 134 HA PHE 134 -1.321 3.871 -2.495 965 1HB PHE 134 1HB PHE 134 -4.322 3.882 -2.777 966 2HB PHE 134 2HB PHE 134 -3.486 2.730 -1.742 967 HD1 PHE 134 HD1 PHE 134 -1.602 3.989 -0.229 968 HD2 PHE 134 HD2 PHE 134 -5.221 5.679 -1.690 969 HE1 PHE 134 HE1 PHE 134 -1.548 5.655 1.581 970 HE2 PHE 134 HE2 PHE 134 -5.175 7.348 0.116 971 HZ PHE 134 HZ PHE 134 -3.334 7.340 1.750 972 H ALA 135 H ALA 135 -0.621 1.838 -2.762 973 HA ALA 135 HA ALA 135 -1.287 0.466 -5.244 974 1HB ALA 135 1HB ALA 135 0.965 0.504 -3.405 975 2HB ALA 135 2HB ALA 135 0.908 0.059 -5.109 976 3HB ALA 135 3HB ALA 135 0.504 -1.133 -3.873 977 H ASP 136 H ASP 136 -3.158 -0.638 -5.132 978 HA ASP 136 HA ASP 136 -4.222 -1.713 -2.744 979 1HB ASP 136 1HB ASP 136 -5.804 -2.914 -4.329 980 2HB ASP 136 2HB ASP 136 -5.770 -1.159 -4.443 981 H VAL 137 H VAL 137 -4.451 -3.795 -2.024 982 HA VAL 137 HA VAL 137 -2.334 -5.632 -2.815 983 HB VAL 137 HB VAL 137 -4.338 -5.818 -0.552 984 1HG1 VAL 137 1HG1 VAL 137 -2.500 -7.432 0.317 985 2HG1 VAL 137 2HG1 VAL 137 -2.055 -7.559 -1.383 986 3HG1 VAL 137 3HG1 VAL 137 -3.676 -8.012 -0.862 987 1HG2 VAL 137 1HG2 VAL 137 -2.118 -4.138 -0.820 988 2HG2 VAL 137 2HG2 VAL 137 -1.597 -5.442 0.247 989 3HG2 VAL 137 3HG2 VAL 137 -3.025 -4.489 0.651 990 H ARG 138 H ARG 138 -5.143 -5.005 -4.138 991 HA ARG 138 HA ARG 138 -6.518 -7.491 -4.156 992 1HB ARG 138 1HB ARG 138 -6.685 -5.294 -6.215 993 2HB ARG 138 2HB ARG 138 -7.896 -6.519 -5.864 994 1HG ARG 138 1HG ARG 138 -7.018 -4.448 -3.866 995 2HG ARG 138 2HG ARG 138 -8.376 -4.226 -4.969 996 1HD ARG 138 1HD ARG 138 -8.409 -6.748 -3.467 997 2HD ARG 138 2HD ARG 138 -8.555 -5.299 -2.476 998 HE ARG 138 HE ARG 138 -10.597 -4.822 -3.490 999 1HH1 ARG 138 1HH1 ARG 138 -9.145 -7.673 -4.902 1000 2HH1 ARG 138 2HH1 ARG 138 -10.604 -8.175 -5.684 1001 1HH2 ARG 138 1HH2 ARG 138 -12.510 -5.489 -4.521 1002 2HH2 ARG 138 2HH2 ARG 138 -12.511 -6.937 -5.470 1003 H ASP 139 H ASP 139 -3.601 -6.614 -5.538 1004 HA ASP 139 HA ASP 139 -3.939 -8.378 -7.851 1005 1HB ASP 139 1HB ASP 139 -2.931 -6.125 -8.191 1006 2HB ASP 139 2HB ASP 139 -1.593 -6.603 -7.151 1007 H LEU 140 H LEU 140 -3.391 -8.971 -4.793 1008 HA LEU 140 HA LEU 140 -2.048 -11.396 -5.217 1009 1HB LEU 140 1HB LEU 140 0.065 -11.007 -4.105 1010 2HB LEU 140 2HB LEU 140 -0.082 -9.969 -5.505 1011 HG LEU 140 HG LEU 140 0.794 -8.463 -4.049 1012 1HD1 LEU 140 1HD1 LEU 140 -1.341 -7.509 -4.637 1013 2HD1 LEU 140 2HD1 LEU 140 -0.924 -7.075 -2.977 1014 3HD1 LEU 140 3HD1 LEU 140 -2.114 -8.342 -3.287 1015 1HD2 LEU 140 1HD2 LEU 140 -0.620 -9.157 -1.582 1016 2HD2 LEU 140 2HD2 LEU 140 1.086 -8.808 -1.860 1017 3HD2 LEU 140 3HD2 LEU 140 0.448 -10.416 -2.201 1018 H LEU 141 H LEU 141 -4.385 -10.581 -3.965 1019 HA LEU 141 HA LEU 141 -4.264 -10.228 -1.208 1020 1HB LEU 141 1HB LEU 141 -6.256 -10.623 -3.129 1021 2HB LEU 141 2HB LEU 141 -6.499 -11.889 -1.941 1022 HG LEU 141 HG LEU 141 -7.830 -10.146 -1.169 1023 1HD1 LEU 141 1HD1 LEU 141 -5.636 -10.904 0.327 1024 2HD1 LEU 141 2HD1 LEU 141 -7.094 -10.113 0.919 1025 3HD1 LEU 141 3HD1 LEU 141 -5.683 -9.150 0.481 1026 1HD2 LEU 141 1HD2 LEU 141 -5.994 -7.933 -1.029 1027 2HD2 LEU 141 2HD2 LEU 141 -7.583 -8.028 -1.787 1028 3HD2 LEU 141 3HD2 LEU 141 -6.149 -8.528 -2.681 1029 H TRP 142 H TRP 142 -3.735 -13.096 -3.089 1030 HA TRP 142 HA TRP 142 -4.346 -15.136 -1.380 1031 1HB TRP 142 1HB TRP 142 -2.418 -16.385 -2.394 1032 2HB TRP 142 2HB TRP 142 -3.514 -15.651 -3.558 1033 HD1 TRP 142 HD1 TRP 142 -2.569 -13.161 -4.556 1034 HE1 TRP 142 HE1 TRP 142 -0.165 -12.581 -5.265 1035 HE3 TRP 142 HE3 TRP 142 -0.071 -16.851 -2.054 1036 HZ2 TRP 142 HZ2 TRP 142 2.442 -13.560 -4.824 1037 HZ3 TRP 142 HZ3 TRP 142 2.379 -16.961 -2.254 1038 HH2 TRP 142 HH2 TRP 142 3.609 -15.349 -3.608 1039 H LEU 143 H LEU 143 -4.096 -14.533 0.761 1040 HA LEU 143 HA LEU 143 -1.485 -15.084 1.879 1041 1HB LEU 143 1HB LEU 143 -2.893 -12.460 2.376 1042 2HB LEU 143 2HB LEU 143 -1.573 -13.063 3.355 1043 HG LEU 143 HG LEU 143 -0.390 -13.123 0.924 1044 1HD1 LEU 143 1HD1 LEU 143 -2.665 -11.235 0.763 1045 2HD1 LEU 143 2HD1 LEU 143 -1.891 -12.198 -0.496 1046 3HD1 LEU 143 3HD1 LEU 143 -1.121 -10.720 0.079 1047 1HD2 LEU 143 1HD2 LEU 143 0.087 -11.876 3.206 1048 2HD2 LEU 143 2HD2 LEU 143 -0.475 -10.483 2.283 1049 3HD2 LEU 143 3HD2 LEU 143 0.905 -11.419 1.713 1050 H GLU 144 H GLU 144 -4.801 -14.012 2.532 1051 HA GLU 144 HA GLU 144 -5.225 -16.214 4.335 1052 1HB GLU 144 1HB GLU 144 -4.571 -13.550 5.343 1053 2HB GLU 144 2HB GLU 144 -6.094 -14.161 5.971 1054 1HG GLU 144 1HG GLU 144 -4.143 -16.237 6.089 1055 2HG GLU 144 2HG GLU 144 -3.479 -14.775 6.816 1056 H ASP 145 H ASP 145 -7.508 -15.437 5.595 1057 HA ASP 145 HA ASP 145 -9.458 -15.700 3.614 1058 1HB ASP 145 1HB ASP 145 -9.646 -16.237 6.101 1059 2HB ASP 145 2HB ASP 145 -9.972 -14.523 6.344 1060 H ASP 146 H ASP 146 -10.601 -14.314 2.414 1061 HA ASP 146 HA ASP 146 -10.050 -11.445 2.739 1062 1HB ASP 146 1HB ASP 146 -10.701 -11.218 0.386 1063 2HB ASP 146 2HB ASP 146 -9.417 -12.409 0.567 1064 H ALA 147 H ALA 147 -11.804 -9.921 2.471 1065 HA ALA 147 HA ALA 147 -14.129 -10.649 3.892 1066 1HB ALA 147 1HB ALA 147 -14.206 -8.254 2.144 1067 2HB ALA 147 2HB ALA 147 -12.977 -8.307 3.407 1068 3HB ALA 147 3HB ALA 147 -14.684 -8.443 3.830 1069 H MET 148 H MET 148 -16.219 -11.048 3.247 1070 HA MET 148 HA MET 148 -16.514 -12.032 0.526 1071 1HB MET 148 1HB MET 148 -18.033 -12.350 3.077 1072 2HB MET 148 2HB MET 148 -18.872 -12.631 1.558 1073 1HG MET 148 1HG MET 148 -17.991 -14.647 1.387 1074 2HG MET 148 2HG MET 148 -16.361 -13.988 1.511 1075 1HE MET 148 1HE MET 148 -15.423 -13.150 3.555 1076 2HE MET 148 2HE MET 148 -15.161 -14.337 4.834 1077 3HE MET 148 3HE MET 148 -16.358 -13.060 5.048 1078 H GLU 149 H GLU 149 -18.061 -11.325 -0.937 1079 HA GLU 149 HA GLU 149 -19.657 -8.981 -0.241 1080 1HB GLU 149 1HB GLU 149 -17.254 -8.600 -1.454 1081 2HB GLU 149 2HB GLU 149 -18.303 -8.770 -2.854 1082 1HG GLU 149 1HG GLU 149 -19.016 -6.693 -2.616 1083 2HG GLU 149 2HG GLU 149 -19.553 -7.035 -0.971 1084 H GLN 150 H GLN 150 -18.771 -11.276 -2.805 1085 HA GLN 150 HA GLN 150 -21.356 -11.008 -4.073 1086 1HB GLN 150 1HB GLN 150 -18.767 -12.173 -4.744 1087 2HB GLN 150 2HB GLN 150 -20.110 -13.208 -5.212 1088 1HG GLN 150 1HG GLN 150 -19.861 -10.306 -5.964 1089 2HG GLN 150 2HG GLN 150 -19.357 -11.652 -6.985 1090 1HE2 GLN 150 1HE2 GLN 150 -20.834 -10.961 -8.575 1091 2HE2 GLN 150 2HE2 GLN 150 -22.527 -11.274 -8.423 Start of MODEL 6 1 1H GLY 1 1H GLY 1 19.090 -0.062 14.871 2 2H GLY 1 2H GLY 1 17.835 0.070 13.744 3 3H GLY 1 3H GLY 1 19.111 1.179 13.721 4 1HA GLY 1 1HA GLY 1 19.604 -0.248 11.968 5 2HA GLY 1 2HA GLY 1 20.630 -0.782 13.291 6 HA PRO 2 HA PRO 2 18.984 -4.847 12.904 7 1HB PRO 2 1HB PRO 2 18.913 -5.722 15.473 8 2HB PRO 2 2HB PRO 2 20.418 -5.516 14.570 9 1HG PRO 2 1HG PRO 2 19.145 -3.692 16.575 10 2HG PRO 2 2HG PRO 2 20.850 -4.148 16.402 11 1HD PRO 2 1HD PRO 2 19.874 -1.794 15.490 12 2HD PRO 2 2HD PRO 2 21.208 -2.648 14.688 13 H TYR 3 H TYR 3 17.398 -2.690 15.171 14 HA TYR 3 HA TYR 3 14.942 -4.287 15.021 15 1HB TYR 3 1HB TYR 3 16.057 -3.282 17.217 16 2HB TYR 3 2HB TYR 3 15.139 -1.858 16.741 17 HD1 TYR 3 HD1 TYR 3 12.719 -1.849 16.829 18 HD2 TYR 3 HD2 TYR 3 14.919 -5.328 17.904 19 HE1 TYR 3 HE1 TYR 3 10.699 -2.801 17.858 20 HE2 TYR 3 HE2 TYR 3 12.905 -6.290 18.936 21 HH TYR 3 HH TYR 3 10.078 -4.452 19.512 22 H GLY 4 H GLY 4 13.459 -3.730 13.579 23 1HA GLY 4 1HA GLY 4 13.046 -0.879 12.998 24 2HA GLY 4 2HA GLY 4 13.326 -1.982 11.660 25 H HIS 5 H HIS 5 11.023 -0.443 11.844 26 HA HIS 5 HA HIS 5 9.022 -2.377 11.473 27 1HB HIS 5 1HB HIS 5 9.248 -2.378 14.016 28 2HB HIS 5 2HB HIS 5 8.567 -0.754 13.974 29 HD1 HIS 5 HD1 HIS 5 7.135 -3.039 11.481 30 HD2 HIS 5 HD2 HIS 5 6.360 -1.936 15.412 31 HE1 HIS 5 HE1 HIS 5 4.800 -3.840 11.957 32 HE2 HIS 5 HE2 HIS 5 4.385 -3.238 14.367 33 H GLN 6 H GLN 6 9.714 0.969 12.368 34 HA GLN 6 HA GLN 6 7.344 2.030 11.179 35 1HB GLN 6 1HB GLN 6 8.376 4.214 11.554 36 2HB GLN 6 2HB GLN 6 8.512 3.203 12.986 37 1HG GLN 6 1HG GLN 6 10.828 2.752 11.452 38 2HG GLN 6 2HG GLN 6 10.565 4.495 11.486 39 1HE2 GLN 6 1HE2 GLN 6 10.753 5.599 13.403 40 2HE2 GLN 6 2HE2 GLN 6 11.399 4.889 14.840 41 H SER 7 H SER 7 7.853 0.635 9.171 42 HA SER 7 HA SER 7 9.436 2.240 7.272 43 1HB SER 7 1HB SER 7 9.936 0.257 6.044 44 2HB SER 7 2HB SER 7 10.229 -0.128 7.740 45 HG SER 7 HG SER 7 8.818 -1.545 6.204 46 H GLY 8 H GLY 8 6.443 0.452 7.785 47 1HA GLY 8 1HA GLY 8 4.355 1.191 6.932 48 2HA GLY 8 2HA GLY 8 5.209 2.049 5.659 49 H ALA 9 H ALA 9 4.146 -1.114 6.767 50 HA ALA 9 HA ALA 9 3.860 -1.966 4.009 51 1HB ALA 9 1HB ALA 9 5.026 -4.223 4.972 52 2HB ALA 9 2HB ALA 9 5.977 -2.973 5.775 53 3HB ALA 9 3HB ALA 9 5.857 -2.995 4.016 54 H VAL 10 H VAL 10 2.634 -3.970 3.807 55 HA VAL 10 HA VAL 10 0.766 -4.288 6.052 56 HB VAL 10 HB VAL 10 0.409 -5.125 3.169 57 1HG1 VAL 10 1HG1 VAL 10 -1.553 -6.046 3.725 58 2HG1 VAL 10 2HG1 VAL 10 -1.958 -4.739 4.839 59 3HG1 VAL 10 3HG1 VAL 10 -0.919 -6.061 5.371 60 1HG2 VAL 10 1HG2 VAL 10 -0.505 -3.126 2.678 61 2HG2 VAL 10 2HG2 VAL 10 0.486 -2.566 4.025 62 3HG2 VAL 10 3HG2 VAL 10 -1.219 -2.939 4.280 63 H TYR 11 H TYR 11 1.096 -6.017 7.310 64 HA TYR 11 HA TYR 11 2.387 -8.389 6.143 65 1HB TYR 11 1HB TYR 11 3.530 -7.434 8.075 66 2HB TYR 11 2HB TYR 11 2.052 -7.521 9.024 67 HD1 TYR 11 HD1 TYR 11 5.092 -9.113 8.296 68 HD2 TYR 11 HD2 TYR 11 1.034 -9.955 9.260 69 HE1 TYR 11 HE1 TYR 11 5.748 -11.346 9.092 70 HE2 TYR 11 HE2 TYR 11 1.680 -12.190 10.052 71 HH TYR 11 HH TYR 11 3.803 -13.817 9.450 72 H VAL 12 H VAL 12 1.054 -9.976 5.561 73 HA VAL 12 HA VAL 12 -1.355 -10.439 7.189 74 HB VAL 12 HB VAL 12 -1.090 -10.864 4.209 75 1HG1 VAL 12 1HG1 VAL 12 -2.526 -12.539 5.279 76 2HG1 VAL 12 2HG1 VAL 12 -3.456 -11.433 4.268 77 3HG1 VAL 12 3HG1 VAL 12 -3.469 -11.248 6.022 78 1HG2 VAL 12 1HG2 VAL 12 -1.452 -8.643 4.227 79 2HG2 VAL 12 2HG2 VAL 12 -2.076 -8.650 5.876 80 3HG2 VAL 12 3HG2 VAL 12 -3.120 -9.125 4.538 81 H GLY 13 H GLY 13 -1.123 -12.229 8.347 82 1HA GLY 13 1HA GLY 13 -0.503 -14.349 8.980 83 2HA GLY 13 2HA GLY 13 -0.928 -14.777 7.332 84 H ASN 14 H ASN 14 0.611 -15.985 6.464 85 HA ASN 14 HA ASN 14 3.380 -15.655 7.298 86 1HB ASN 14 1HB ASN 14 1.869 -17.756 5.788 87 2HB ASN 14 2HB ASN 14 3.624 -17.691 5.674 88 1HD2 ASN 14 1HD2 ASN 14 3.990 -19.592 6.734 89 2HD2 ASN 14 2HD2 ASN 14 3.677 -19.814 8.419 90 H TYR 15 H TYR 15 1.825 -13.811 5.400 91 HA TYR 15 HA TYR 15 3.906 -13.710 3.313 92 1HB TYR 15 1HB TYR 15 0.920 -13.506 3.027 93 2HB TYR 15 2HB TYR 15 1.969 -12.645 1.911 94 HD1 TYR 15 HD1 TYR 15 3.987 -15.268 2.368 95 HD2 TYR 15 HD2 TYR 15 0.076 -14.518 0.879 96 HE1 TYR 15 HE1 TYR 15 4.126 -17.285 0.979 97 HE2 TYR 15 HE2 TYR 15 0.206 -16.535 -0.503 98 HH TYR 15 HH TYR 15 1.607 -18.808 -0.322 99 H LYS 16 H LYS 16 4.904 -11.763 3.254 100 HA LYS 16 HA LYS 16 3.514 -9.479 4.502 101 1HB LYS 16 1HB LYS 16 5.547 -10.447 5.725 102 2HB LYS 16 2HB LYS 16 6.508 -9.795 4.405 103 1HG LYS 16 1HG LYS 16 4.627 -7.928 5.702 104 2HG LYS 16 2HG LYS 16 6.010 -8.457 6.663 105 1HD LYS 16 1HD LYS 16 7.461 -7.822 4.695 106 2HD LYS 16 2HD LYS 16 6.034 -7.054 3.998 107 1HE LYS 16 1HE LYS 16 6.742 -5.234 5.104 108 2HE LYS 16 2HE LYS 16 6.027 -6.019 6.511 109 1HZ LYS 16 1HZ LYS 16 8.833 -5.672 5.803 110 2HZ LYS 16 2HZ LYS 16 8.417 -7.131 6.553 111 3HZ LYS 16 3HZ LYS 16 8.089 -5.661 7.324 112 H VAL 17 H VAL 17 2.936 -8.024 3.006 113 HA VAL 17 HA VAL 17 4.583 -7.805 0.596 114 HB VAL 17 HB VAL 17 2.764 -7.270 -0.616 115 1HG1 VAL 17 1HG1 VAL 17 1.156 -8.178 1.756 116 2HG1 VAL 17 2HG1 VAL 17 2.116 -9.274 0.760 117 3HG1 VAL 17 3HG1 VAL 17 0.779 -8.371 0.044 118 1HG2 VAL 17 1HG2 VAL 17 1.616 -5.744 1.718 119 2HG2 VAL 17 2HG2 VAL 17 0.914 -5.829 0.101 120 3HG2 VAL 17 3HG2 VAL 17 2.481 -5.059 0.342 121 H VAL 18 H VAL 18 5.963 -6.205 0.385 122 HA VAL 18 HA VAL 18 5.429 -3.649 1.728 123 HB VAL 18 HB VAL 18 6.986 -4.889 3.159 124 1HG1 VAL 18 1HG1 VAL 18 9.058 -5.710 2.455 125 2HG1 VAL 18 2HG1 VAL 18 8.997 -4.815 0.937 126 3HG1 VAL 18 3HG1 VAL 18 7.937 -6.205 1.185 127 1HG2 VAL 18 1HG2 VAL 18 7.163 -2.356 2.674 128 2HG2 VAL 18 2HG2 VAL 18 8.631 -2.794 1.799 129 3HG2 VAL 18 3HG2 VAL 18 8.489 -3.156 3.518 130 H ASN 19 H ASN 19 6.696 -1.848 0.859 131 HA ASN 19 HA ASN 19 6.647 -1.736 -1.942 132 1HB ASN 19 1HB ASN 19 8.126 0.034 0.019 133 2HB ASN 19 2HB ASN 19 7.849 0.417 -1.677 134 1HD2 ASN 19 1HD2 ASN 19 6.381 0.034 1.454 135 2HD2 ASN 19 2HD2 ASN 19 4.901 0.843 1.080 136 H ARG 20 H ARG 20 8.242 -1.910 -3.502 137 HA ARG 20 HA ARG 20 10.299 -3.739 -3.102 138 1HB ARG 20 1HB ARG 20 9.215 -2.847 -5.296 139 2HB ARG 20 2HB ARG 20 10.485 -1.633 -5.231 140 1HG ARG 20 1HG ARG 20 12.153 -3.480 -5.147 141 2HG ARG 20 2HG ARG 20 10.828 -4.616 -5.410 142 1HD ARG 20 1HD ARG 20 10.301 -3.539 -7.527 143 2HD ARG 20 2HD ARG 20 11.575 -2.350 -7.256 144 HE ARG 20 HE ARG 20 11.889 -5.050 -8.192 145 1HH1 ARG 20 1HH1 ARG 20 13.463 -2.372 -6.600 146 2HH1 ARG 20 2HH1 ARG 20 15.057 -2.884 -7.043 147 1HH2 ARG 20 1HH2 ARG 20 13.985 -5.724 -8.774 148 2HH2 ARG 20 2HH2 ARG 20 15.354 -4.786 -8.278 149 H HIS 21 H HIS 21 10.461 -0.188 -3.236 150 HA HIS 21 HA HIS 21 13.262 -0.073 -2.762 151 1HB HIS 21 1HB HIS 21 11.343 1.744 -3.525 152 2HB HIS 21 2HB HIS 21 11.718 2.262 -1.885 153 HD1 HIS 21 HD1 HIS 21 14.822 1.209 -2.388 154 HD2 HIS 21 HD2 HIS 21 12.658 4.092 -4.454 155 HE1 HIS 21 HE1 HIS 21 16.541 2.695 -3.466 156 HE2 HIS 21 HE2 HIS 21 15.209 4.469 -4.660 157 H LEU 22 H LEU 22 10.728 -0.940 -0.751 158 HA LEU 22 HA LEU 22 12.173 -0.083 1.660 159 1HB LEU 22 1HB LEU 22 9.752 0.621 1.283 160 2HB LEU 22 2HB LEU 22 9.332 -1.060 1.547 161 HG LEU 22 HG LEU 22 10.257 -0.961 3.806 162 1HD1 LEU 22 1HD1 LEU 22 11.225 1.656 2.846 163 2HD1 LEU 22 2HD1 LEU 22 11.945 0.527 3.994 164 3HD1 LEU 22 3HD1 LEU 22 10.640 1.596 4.510 165 1HD2 LEU 22 1HD2 LEU 22 8.433 0.044 4.738 166 2HD2 LEU 22 2HD2 LEU 22 7.880 -0.077 3.067 167 3HD2 LEU 22 3HD2 LEU 22 8.524 1.449 3.675 168 H ALA 23 H ALA 23 11.469 -2.816 -0.250 169 HA ALA 23 HA ALA 23 11.268 -4.780 1.771 170 1HB ALA 23 1HB ALA 23 11.384 -4.702 -1.097 171 2HB ALA 23 2HB ALA 23 10.713 -5.939 -0.036 172 3HB ALA 23 3HB ALA 23 12.420 -5.987 -0.476 173 H THR 24 H THR 24 12.828 -6.258 2.514 174 HA THR 24 HA THR 24 15.561 -5.177 2.479 175 HB THR 24 HB THR 24 14.910 -5.264 4.712 176 HG1 THR 24 HG1 THR 24 16.552 -6.408 5.271 177 1HG2 THR 24 1HG2 THR 24 13.865 -7.339 5.722 178 2HG2 THR 24 2HG2 THR 24 13.503 -7.828 4.066 179 3HG2 THR 24 3HG2 THR 24 12.830 -6.331 4.710 180 H HIS 25 H HIS 25 17.285 -6.942 2.783 181 HA HIS 25 HA HIS 25 17.377 -8.544 0.520 182 1HB HIS 25 1HB HIS 25 19.317 -9.627 1.539 183 2HB HIS 25 2HB HIS 25 19.367 -7.889 1.816 184 HD1 HIS 25 HD1 HIS 25 18.675 -7.101 4.278 185 HD2 HIS 25 HD2 HIS 25 19.390 -11.166 3.801 186 HE1 HIS 25 HE1 HIS 25 18.988 -8.006 6.603 187 HE2 HIS 25 HE2 HIS 25 19.304 -10.486 6.294 188 H VAL 26 H VAL 26 16.050 -9.194 3.670 189 HA VAL 26 HA VAL 26 15.832 -12.025 3.317 190 HB VAL 26 HB VAL 26 15.970 -11.060 5.557 191 1HG1 VAL 26 1HG1 VAL 26 13.437 -9.697 4.732 192 2HG1 VAL 26 2HG1 VAL 26 14.878 -9.017 5.487 193 3HG1 VAL 26 3HG1 VAL 26 13.776 -10.019 6.432 194 1HG2 VAL 26 1HG2 VAL 26 13.990 -12.256 6.557 195 2HG2 VAL 26 2HG2 VAL 26 14.975 -13.213 5.451 196 3HG2 VAL 26 3HG2 VAL 26 13.434 -12.548 4.909 197 H ASP 27 H ASP 27 13.772 -9.263 2.637 198 HA ASP 27 HA ASP 27 11.357 -10.705 2.331 199 1HB ASP 27 1HB ASP 27 11.977 -8.052 2.395 200 2HB ASP 27 2HB ASP 27 11.736 -8.279 0.666 201 H TRP 28 H TRP 28 13.897 -9.661 0.119 202 HA TRP 28 HA TRP 28 12.649 -10.836 -2.142 203 1HB TRP 28 1HB TRP 28 15.369 -9.647 -1.694 204 2HB TRP 28 2HB TRP 28 14.927 -10.407 -3.224 205 HD1 TRP 28 HD1 TRP 28 12.499 -9.331 -4.300 206 HE1 TRP 28 HE1 TRP 28 11.848 -6.846 -4.457 207 HE3 TRP 28 HE3 TRP 28 15.683 -7.441 -0.783 208 HZ2 TRP 28 HZ2 TRP 28 12.581 -4.409 -3.236 209 HZ3 TRP 28 HZ3 TRP 28 15.647 -5.025 -0.342 210 HH2 TRP 28 HH2 TRP 28 14.135 -3.539 -1.545 211 H GLN 29 H GLN 29 14.939 -11.886 0.243 212 HA GLN 29 HA GLN 29 16.065 -14.080 -1.070 213 1HB GLN 29 1HB GLN 29 15.758 -13.187 1.717 214 2HB GLN 29 2HB GLN 29 15.929 -14.927 1.527 215 1HG GLN 29 1HG GLN 29 17.899 -13.965 -0.106 216 2HG GLN 29 2HG GLN 29 17.896 -12.800 1.218 217 1HE2 GLN 29 1HE2 GLN 29 19.493 -15.337 0.219 218 2HE2 GLN 29 2HE2 GLN 29 19.867 -16.127 1.710 219 H ASN 30 H ASN 30 13.098 -13.805 0.839 220 HA ASN 30 HA ASN 30 12.294 -16.457 -0.166 221 1HB ASN 30 1HB ASN 30 12.214 -15.296 2.521 222 2HB ASN 30 2HB ASN 30 10.668 -15.969 2.017 223 1HD2 ASN 30 1HD2 ASN 30 10.976 -18.169 0.844 224 2HD2 ASN 30 2HD2 ASN 30 11.982 -19.297 1.681 225 H CYS 31 H CYS 31 11.920 -14.107 -1.653 226 HA CYS 31 HA CYS 31 9.240 -13.142 -1.254 227 1HB CYS 31 1HB CYS 31 9.611 -11.846 -3.288 228 2HB CYS 31 2HB CYS 31 10.979 -11.684 -2.195 229 HG CYS 31 HG CYS 31 11.324 -13.750 -4.441 230 H VAL 32 H VAL 32 7.435 -13.966 -2.027 231 HA VAL 32 HA VAL 32 7.548 -16.278 -3.778 232 HB VAL 32 HB VAL 32 5.071 -16.373 -3.379 233 1HG1 VAL 32 1HG1 VAL 32 7.175 -16.660 -1.342 234 2HG1 VAL 32 2HG1 VAL 32 5.991 -17.830 -1.928 235 3HG1 VAL 32 3HG1 VAL 32 5.523 -16.628 -0.724 236 1HG2 VAL 32 1HG2 VAL 32 4.060 -14.978 -1.716 237 2HG2 VAL 32 2HG2 VAL 32 4.819 -13.935 -2.918 238 3HG2 VAL 32 3HG2 VAL 32 5.602 -14.202 -1.360 239 H TRP 33 H TRP 33 6.307 -12.965 -3.775 240 HA TRP 33 HA TRP 33 6.112 -13.110 -6.693 241 1HB TRP 33 1HB TRP 33 3.856 -13.332 -6.392 242 2HB TRP 33 2HB TRP 33 3.887 -12.584 -4.800 243 HD1 TRP 33 HD1 TRP 33 3.281 -11.794 -8.452 244 HE1 TRP 33 HE1 TRP 33 2.518 -9.343 -8.670 245 HE3 TRP 33 HE3 TRP 33 4.204 -10.237 -3.685 246 HZ2 TRP 33 HZ2 TRP 33 2.337 -7.043 -7.017 247 HZ3 TRP 33 HZ3 TRP 33 3.718 -7.903 -3.080 248 HH2 TRP 33 HH2 TRP 33 2.807 -6.346 -4.722 249 H GLU 34 H GLU 34 6.354 -11.121 -7.774 250 HA GLU 34 HA GLU 34 6.906 -8.730 -6.219 251 1HB GLU 34 1HB GLU 34 9.013 -9.714 -8.134 252 2HB GLU 34 2HB GLU 34 9.130 -8.403 -6.969 253 1HG GLU 34 1HG GLU 34 10.365 -10.093 -5.996 254 2HG GLU 34 2HG GLU 34 8.800 -10.229 -5.194 255 H ASP 35 H ASP 35 5.637 -7.299 -7.218 256 HA ASP 35 HA ASP 35 5.468 -7.370 -10.154 257 1HB ASP 35 1HB ASP 35 3.363 -7.571 -8.702 258 2HB ASP 35 2HB ASP 35 3.596 -5.865 -8.333 259 H TYR 36 H TYR 36 6.770 -5.972 -11.124 260 HA TYR 36 HA TYR 36 7.938 -3.737 -9.836 261 1HB TYR 36 1HB TYR 36 8.678 -3.135 -12.188 262 2HB TYR 36 2HB TYR 36 9.170 -4.723 -11.609 263 HD1 TYR 36 HD1 TYR 36 8.359 -6.727 -12.650 264 HD2 TYR 36 HD2 TYR 36 6.901 -2.926 -13.882 265 HE1 TYR 36 HE1 TYR 36 7.343 -7.768 -14.633 266 HE2 TYR 36 HE2 TYR 36 5.878 -3.955 -15.868 267 HH TYR 36 HH TYR 36 6.638 -6.590 -17.173 268 H ASN 37 H ASN 37 5.129 -4.123 -11.914 269 HA ASN 37 HA ASN 37 4.686 -1.400 -12.472 270 1HB ASN 37 1HB ASN 37 3.322 -3.907 -12.899 271 2HB ASN 37 2HB ASN 37 2.175 -2.675 -12.382 272 1HD2 ASN 37 1HD2 ASN 37 5.124 -2.219 -14.251 273 2HD2 ASN 37 2HD2 ASN 37 4.346 -1.643 -15.681 274 H ARG 38 H ARG 38 4.236 -3.262 -9.621 275 HA ARG 38 HA ARG 38 2.625 -1.093 -8.447 276 1HB ARG 38 1HB ARG 38 2.666 -4.047 -7.956 277 2HB ARG 38 2HB ARG 38 2.151 -2.956 -6.677 278 1HG ARG 38 1HG ARG 38 0.178 -3.603 -7.739 279 2HG ARG 38 2HG ARG 38 0.520 -1.994 -8.381 280 1HD ARG 38 1HD ARG 38 0.927 -2.767 -10.466 281 2HD ARG 38 2HD ARG 38 1.676 -4.252 -9.883 282 HE ARG 38 HE ARG 38 -1.056 -4.389 -9.331 283 1HH1 ARG 38 1HH1 ARG 38 1.067 -4.318 -12.099 284 2HH1 ARG 38 2HH1 ARG 38 -0.009 -5.227 -13.105 285 1HH2 ARG 38 1HH2 ARG 38 -2.474 -5.585 -10.652 286 2HH2 ARG 38 2HH2 ARG 38 -2.019 -5.946 -12.285 287 H ASP 39 H ASP 39 5.721 -2.146 -8.604 288 HA ASP 39 HA ASP 39 7.560 -2.059 -7.244 289 1HB ASP 39 1HB ASP 39 6.027 0.400 -6.938 290 2HB ASP 39 2HB ASP 39 7.021 0.067 -5.525 291 H LEU 40 H LEU 40 5.509 -3.824 -6.379 292 HA LEU 40 HA LEU 40 6.029 -3.825 -3.485 293 1HB LEU 40 1HB LEU 40 3.749 -3.083 -3.844 294 2HB LEU 40 2HB LEU 40 3.433 -4.455 -4.887 295 HG LEU 40 HG LEU 40 3.890 -5.921 -2.850 296 1HD1 LEU 40 1HD1 LEU 40 4.143 -5.042 -0.785 297 2HD1 LEU 40 2HD1 LEU 40 3.139 -3.636 -1.140 298 3HD1 LEU 40 3HD1 LEU 40 4.812 -3.686 -1.695 299 1HD2 LEU 40 1HD2 LEU 40 1.637 -5.191 -3.880 300 2HD2 LEU 40 2HD2 LEU 40 1.514 -4.138 -2.468 301 3HD2 LEU 40 3HD2 LEU 40 1.643 -5.885 -2.257 302 H LEU 41 H LEU 41 6.082 -5.907 -2.502 303 HA LEU 41 HA LEU 41 6.037 -8.224 -4.244 304 1HB LEU 41 1HB LEU 41 8.238 -9.013 -3.682 305 2HB LEU 41 2HB LEU 41 8.339 -7.448 -4.445 306 HG LEU 41 HG LEU 41 9.609 -8.292 -2.099 307 1HD1 LEU 41 1HD1 LEU 41 9.992 -6.426 -3.960 308 2HD1 LEU 41 2HD1 LEU 41 10.842 -6.432 -2.412 309 3HD1 LEU 41 3HD1 LEU 41 9.431 -5.399 -2.641 310 1HD2 LEU 41 1HD2 LEU 41 7.359 -6.419 -1.464 311 2HD2 LEU 41 2HD2 LEU 41 8.855 -6.421 -0.541 312 3HD2 LEU 41 3HD2 LEU 41 7.864 -7.875 -0.612 313 H VAL 42 H VAL 42 6.043 -10.264 -3.108 314 HA VAL 42 HA VAL 42 5.203 -9.965 -0.301 315 HB VAL 42 HB VAL 42 4.076 -11.767 -2.446 316 1HG1 VAL 42 1HG1 VAL 42 4.561 -12.984 -0.217 317 2HG1 VAL 42 2HG1 VAL 42 2.944 -13.108 -0.902 318 3HG1 VAL 42 3HG1 VAL 42 3.255 -11.997 0.432 319 1HG2 VAL 42 1HG2 VAL 42 2.441 -10.271 -2.488 320 2HG2 VAL 42 2HG2 VAL 42 3.264 -9.322 -1.250 321 3HG2 VAL 42 3HG2 VAL 42 2.113 -10.575 -0.782 322 H SER 43 H SER 43 6.290 -11.068 1.142 323 HA SER 43 HA SER 43 7.975 -13.309 0.251 324 1HB SER 43 1HB SER 43 9.758 -12.596 1.566 325 2HB SER 43 2HB SER 43 9.113 -11.064 0.978 326 HG SER 43 HG SER 43 8.616 -10.543 2.951 327 H THR 44 H THR 44 8.364 -14.954 1.899 328 HA THR 44 HA THR 44 6.004 -15.242 3.592 329 HB THR 44 HB THR 44 6.456 -17.590 3.619 330 HG1 THR 44 HG1 THR 44 8.347 -18.416 2.648 331 1HG2 THR 44 1HG2 THR 44 5.779 -16.304 1.381 332 2HG2 THR 44 2HG2 THR 44 5.925 -18.063 1.494 333 3HG2 THR 44 3HG2 THR 44 7.253 -17.108 0.831 334 H THR 45 H THR 45 6.074 -15.696 5.750 335 HA THR 45 HA THR 45 8.672 -15.539 7.099 336 HB THR 45 HB THR 45 8.028 -13.318 7.343 337 HG1 THR 45 HG1 THR 45 8.352 -13.949 9.401 338 1HG2 THR 45 1HG2 THR 45 5.407 -13.227 8.299 339 2HG2 THR 45 2HG2 THR 45 5.368 -14.283 6.890 340 3HG2 THR 45 3HG2 THR 45 6.008 -12.646 6.748 341 H THR 46 H THR 46 8.350 -15.975 9.533 342 HA THR 46 HA THR 46 6.336 -18.101 9.865 343 HB THR 46 HB THR 46 8.557 -19.077 9.686 344 HG1 THR 46 HG1 THR 46 7.267 -20.120 11.153 345 1HG2 THR 46 1HG2 THR 46 10.348 -17.999 10.397 346 2HG2 THR 46 2HG2 THR 46 9.839 -18.346 12.051 347 3HG2 THR 46 3HG2 THR 46 9.360 -16.834 11.279 348 H ALA 47 H ALA 47 5.991 -15.332 10.533 349 HA ALA 47 HA ALA 47 5.949 -15.466 13.477 350 1HB ALA 47 1HB ALA 47 6.161 -13.111 11.622 351 2HB ALA 47 2HB ALA 47 7.301 -13.635 12.860 352 3HB ALA 47 3HB ALA 47 5.747 -12.945 13.329 353 H HIS 48 H HIS 48 4.139 -13.932 14.358 354 HA HIS 48 HA HIS 48 1.650 -14.980 13.331 355 1HB HIS 48 1HB HIS 48 2.314 -13.241 15.709 356 2HB HIS 48 2HB HIS 48 0.672 -13.721 15.296 357 HD1 HIS 48 HD1 HIS 48 3.922 -15.695 15.593 358 HD2 HIS 48 HD2 HIS 48 -0.010 -15.748 16.934 359 HE1 HIS 48 HE1 HIS 48 3.721 -17.768 17.002 360 HE2 HIS 48 HE2 HIS 48 1.360 -17.725 17.882 361 H GLY 49 H GLY 49 -0.107 -13.760 12.589 362 1HA GLY 49 1HA GLY 49 0.680 -11.187 11.410 363 2HA GLY 49 2HA GLY 49 -0.644 -12.203 10.860 364 H CYS 50 H CYS 50 -1.562 -9.890 10.958 365 HA CYS 50 HA CYS 50 -3.348 -9.793 13.183 366 1HB CYS 50 1HB CYS 50 -1.064 -8.650 13.871 367 2HB CYS 50 2HB CYS 50 -1.719 -7.297 12.955 368 HG CYS 50 HG CYS 50 -2.340 -7.634 15.708 369 H ASP 51 H ASP 51 -1.929 -8.005 10.472 370 HA ASP 51 HA ASP 51 -4.274 -6.440 9.998 371 1HB ASP 51 1HB ASP 51 -2.011 -6.989 8.069 372 2HB ASP 51 2HB ASP 51 -3.135 -5.632 8.035 373 H THR 52 H THR 52 -5.938 -6.780 8.623 374 HA THR 52 HA THR 52 -5.930 -9.289 7.077 375 HB THR 52 HB THR 52 -8.278 -8.022 8.504 376 HG1 THR 52 HG1 THR 52 -8.125 -9.784 9.873 377 1HG2 THR 52 1HG2 THR 52 -9.130 -9.143 6.596 378 2HG2 THR 52 2HG2 THR 52 -9.406 -10.186 7.991 379 3HG2 THR 52 3HG2 THR 52 -8.087 -10.537 6.874 380 H ILE 53 H ILE 53 -6.183 -9.003 4.959 381 HA ILE 53 HA ILE 53 -6.714 -6.400 3.886 382 HB ILE 53 HB ILE 53 -6.859 -8.818 2.149 383 1HG1 ILE 53 1HG1 ILE 53 -4.845 -8.973 3.804 384 2HG1 ILE 53 2HG1 ILE 53 -4.583 -9.247 2.090 385 1HG2 ILE 53 1HG2 ILE 53 -5.613 -7.273 0.620 386 2HG2 ILE 53 2HG2 ILE 53 -5.798 -6.026 1.851 387 3HG2 ILE 53 3HG2 ILE 53 -7.224 -6.731 1.088 388 1HD1 ILE 53 1HD1 ILE 53 -2.804 -7.904 2.882 389 2HD1 ILE 53 2HD1 ILE 53 -3.914 -6.785 3.677 390 3HD1 ILE 53 3HD1 ILE 53 -3.849 -6.862 1.916 391 H ALA 54 H ALA 54 -8.528 -5.628 2.905 392 HA ALA 54 HA ALA 54 -10.976 -7.152 3.374 393 1HB ALA 54 1HB ALA 54 -10.295 -4.418 3.577 394 2HB ALA 54 2HB ALA 54 -11.844 -5.187 3.919 395 3HB ALA 54 3HB ALA 54 -11.506 -4.564 2.306 396 H ARG 55 H ARG 55 -12.092 -8.087 1.788 397 HA ARG 55 HA ARG 55 -11.186 -7.710 -0.963 398 1HB ARG 55 1HB ARG 55 -11.478 -10.003 0.126 399 2HB ARG 55 2HB ARG 55 -13.210 -9.723 0.006 400 1HG ARG 55 1HG ARG 55 -12.583 -11.032 -1.861 401 2HG ARG 55 2HG ARG 55 -12.893 -9.401 -2.459 402 1HD ARG 55 1HD ARG 55 -10.403 -8.997 -2.250 403 2HD ARG 55 2HD ARG 55 -10.235 -10.732 -1.985 404 HE ARG 55 HE ARG 55 -10.763 -9.401 -4.475 405 1HH1 ARG 55 1HH1 ARG 55 -11.087 -12.396 -2.713 406 2HH1 ARG 55 2HH1 ARG 55 -11.179 -13.370 -4.141 407 1HH2 ARG 55 1HH2 ARG 55 -10.885 -10.681 -6.354 408 2HH2 ARG 55 2HH2 ARG 55 -11.064 -12.398 -6.209 409 H CYS 56 H CYS 56 -12.671 -5.613 0.253 410 HA CYS 56 HA CYS 56 -15.307 -5.784 -1.008 411 1HB CYS 56 1HB CYS 56 -15.771 -3.686 0.260 412 2HB CYS 56 2HB CYS 56 -15.361 -5.056 1.285 413 H GLN 57 H GLN 57 -16.083 -3.721 -2.068 414 HA GLN 57 HA GLN 57 -13.906 -2.575 -3.690 415 1HB GLN 57 1HB GLN 57 -16.566 -3.656 -4.417 416 2HB GLN 57 2HB GLN 57 -16.062 -2.201 -5.264 417 1HG GLN 57 1HG GLN 57 -14.043 -3.307 -6.019 418 2HG GLN 57 2HG GLN 57 -14.480 -4.757 -5.117 419 1HE2 GLN 57 1HE2 GLN 57 -15.212 -6.294 -6.380 420 2HE2 GLN 57 2HE2 GLN 57 -16.186 -6.086 -7.792 421 H CYS 58 H CYS 58 -15.024 -1.534 -1.156 422 HA CYS 58 HA CYS 58 -16.777 0.615 -1.639 423 1HB CYS 58 1HB CYS 58 -14.642 0.598 0.492 424 2HB CYS 58 2HB CYS 58 -16.192 1.429 0.524 425 H THR 59 H THR 59 -16.463 2.406 -2.779 426 HA THR 59 HA THR 59 -13.919 3.113 -3.828 427 HB THR 59 HB THR 59 -15.772 3.689 -5.168 428 HG1 THR 59 HG1 THR 59 -14.212 5.333 -5.133 429 1HG2 THR 59 1HG2 THR 59 -17.005 4.513 -2.661 430 2HG2 THR 59 2HG2 THR 59 -17.741 3.948 -4.162 431 3HG2 THR 59 3HG2 THR 59 -17.270 5.640 -3.992 432 H THR 60 H THR 60 -15.387 3.715 -0.831 433 HA THR 60 HA THR 60 -13.554 5.966 -0.355 434 HB THR 60 HB THR 60 -15.567 6.987 0.016 435 HG1 THR 60 HG1 THR 60 -15.306 5.711 2.526 436 1HG2 THR 60 1HG2 THR 60 -16.592 4.285 0.639 437 2HG2 THR 60 2HG2 THR 60 -17.276 5.562 -0.368 438 3HG2 THR 60 3HG2 THR 60 -17.396 5.665 1.389 439 H GLY 61 H GLY 61 -12.010 5.698 1.056 440 1HA GLY 61 1HA GLY 61 -12.299 3.667 3.167 441 2HA GLY 61 2HA GLY 61 -10.863 3.676 2.150 442 H VAL 62 H VAL 62 -9.533 4.056 4.015 443 HA VAL 62 HA VAL 62 -9.501 6.889 4.744 444 HB VAL 62 HB VAL 62 -10.681 5.780 6.578 445 1HG1 VAL 62 1HG1 VAL 62 -8.653 4.351 7.886 446 2HG1 VAL 62 2HG1 VAL 62 -8.645 3.789 6.216 447 3HG1 VAL 62 3HG1 VAL 62 -10.129 3.711 7.163 448 1HG2 VAL 62 1HG2 VAL 62 -9.751 7.374 7.801 449 2HG2 VAL 62 2HG2 VAL 62 -8.298 7.346 6.801 450 3HG2 VAL 62 3HG2 VAL 62 -8.433 6.270 8.192 451 H TYR 63 H TYR 63 -7.552 7.767 4.726 452 HA TYR 63 HA TYR 63 -5.233 5.974 4.487 453 1HB TYR 63 1HB TYR 63 -4.149 7.696 3.188 454 2HB TYR 63 2HB TYR 63 -5.747 7.407 2.510 455 HD1 TYR 63 HD1 TYR 63 -3.897 9.694 4.790 456 HD2 TYR 63 HD2 TYR 63 -7.222 9.199 2.177 457 HE1 TYR 63 HE1 TYR 63 -4.393 12.093 4.973 458 HE2 TYR 63 HE2 TYR 63 -7.725 11.597 2.356 459 HH TYR 63 HH TYR 63 -6.899 13.493 4.561 460 H PHE 64 H PHE 64 -3.288 6.525 5.558 461 HA PHE 64 HA PHE 64 -3.686 7.676 8.143 462 1HB PHE 64 1HB PHE 64 -1.943 5.833 7.113 463 2HB PHE 64 2HB PHE 64 -0.907 7.247 7.282 464 HD1 PHE 64 HD1 PHE 64 -2.629 4.586 8.988 465 HD2 PHE 64 HD2 PHE 64 -0.655 8.318 9.519 466 HE1 PHE 64 HE1 PHE 64 -2.376 4.106 11.388 467 HE2 PHE 64 HE2 PHE 64 -0.397 7.845 11.920 468 HZ PHE 64 HZ PHE 64 -1.258 5.737 12.857 469 H CYS 65 H CYS 65 -3.432 9.719 8.758 470 HA CYS 65 HA CYS 65 -2.385 11.653 6.855 471 1HB CYS 65 1HB CYS 65 -4.262 11.699 9.056 472 2HB CYS 65 2HB CYS 65 -3.076 12.986 9.227 473 HG CYS 65 HG CYS 65 -3.925 14.074 7.109 474 H ALA 66 H ALA 66 -0.556 12.854 7.114 475 HA ALA 66 HA ALA 66 1.333 11.898 9.118 476 1HB ALA 66 1HB ALA 66 3.004 12.545 7.718 477 2HB ALA 66 2HB ALA 66 2.120 13.953 7.131 478 3HB ALA 66 3HB ALA 66 1.719 12.346 6.528 479 H SER 67 H SER 67 -0.231 14.898 8.098 480 HA SER 67 HA SER 67 1.082 16.425 10.180 481 1HB SER 67 1HB SER 67 0.297 17.192 7.766 482 2HB SER 67 2HB SER 67 -1.212 17.526 8.617 483 HG SER 67 HG SER 67 0.094 18.771 10.115 484 H LYS 68 H LYS 68 -1.969 14.839 9.636 485 HA LYS 68 HA LYS 68 -3.177 16.093 11.973 486 1HB LYS 68 1HB LYS 68 -4.144 14.617 9.631 487 2HB LYS 68 2HB LYS 68 -4.957 14.180 11.127 488 1HG LYS 68 1HG LYS 68 -4.632 17.035 10.259 489 2HG LYS 68 2HG LYS 68 -5.994 16.035 9.745 490 1HD LYS 68 1HD LYS 68 -6.865 15.893 11.883 491 2HD LYS 68 2HD LYS 68 -5.314 16.241 12.648 492 1HE LYS 68 1HE LYS 68 -5.721 18.530 11.263 493 2HE LYS 68 2HE LYS 68 -7.383 18.071 11.633 494 1HZ LYS 68 1HZ LYS 68 -6.522 17.779 14.004 495 2HZ LYS 68 2HZ LYS 68 -6.732 19.357 13.435 496 3HZ LYS 68 3HZ LYS 68 -5.182 18.683 13.503 497 H SER 69 H SER 69 -1.592 13.146 11.067 498 HA SER 69 HA SER 69 -1.079 11.240 12.206 499 1HB SER 69 1HB SER 69 -0.472 13.298 13.864 500 2HB SER 69 2HB SER 69 -1.628 12.422 14.865 501 HG SER 69 HG SER 69 -0.314 10.703 14.915 502 H LYS 70 H LYS 70 -3.858 11.788 11.487 503 HA LYS 70 HA LYS 70 -5.149 9.918 13.343 504 1HB LYS 70 1HB LYS 70 -6.507 12.338 12.148 505 2HB LYS 70 2HB LYS 70 -7.230 11.162 13.237 506 1HG LYS 70 1HG LYS 70 -6.369 12.133 15.058 507 2HG LYS 70 2HG LYS 70 -4.814 12.444 14.281 508 1HD LYS 70 1HD LYS 70 -5.652 14.582 14.621 509 2HD LYS 70 2HD LYS 70 -6.112 14.242 12.951 510 1HE LYS 70 1HE LYS 70 -8.019 15.187 13.980 511 2HE LYS 70 2HE LYS 70 -8.335 13.458 13.852 512 1HZ LYS 70 1HZ LYS 70 -7.767 15.070 16.242 513 2HZ LYS 70 2HZ LYS 70 -7.344 13.432 16.238 514 3HZ LYS 70 3HZ LYS 70 -8.955 13.889 16.000 515 H HIS 71 H HIS 71 -7.243 9.070 12.340 516 HA HIS 71 HA HIS 71 -6.587 8.081 9.697 517 1HB HIS 71 1HB HIS 71 -8.804 7.458 11.652 518 2HB HIS 71 2HB HIS 71 -8.730 6.745 10.045 519 HD1 HIS 71 HD1 HIS 71 -7.839 6.006 13.389 520 HD2 HIS 71 HD2 HIS 71 -6.003 5.421 9.707 521 HE1 HIS 71 HE1 HIS 71 -6.139 4.193 13.766 522 HE2 HIS 71 HE2 HIS 71 -4.985 3.912 11.544 523 H TYR 72 H TYR 72 -7.178 9.130 7.927 524 HA TYR 72 HA TYR 72 -9.557 10.858 8.030 525 1HB TYR 72 1HB TYR 72 -6.884 11.229 6.981 526 2HB TYR 72 2HB TYR 72 -8.093 11.497 5.730 527 HD1 TYR 72 HD1 TYR 72 -7.270 12.470 9.236 528 HD2 TYR 72 HD2 TYR 72 -9.135 13.563 5.572 529 HE1 TYR 72 HE1 TYR 72 -7.672 14.729 10.123 530 HE2 TYR 72 HE2 TYR 72 -9.544 15.824 6.445 531 HH TYR 72 HH TYR 72 -9.803 16.807 8.959 532 HA PRO 73 HA PRO 73 -11.122 7.800 5.115 533 1HB PRO 73 1HB PRO 73 -13.708 9.049 5.364 534 2HB PRO 73 2HB PRO 73 -13.174 7.493 6.000 535 1HG PRO 73 1HG PRO 73 -13.789 9.657 7.566 536 2HG PRO 73 2HG PRO 73 -12.690 8.355 8.053 537 1HD PRO 73 1HD PRO 73 -12.049 11.081 6.992 538 2HD PRO 73 2HD PRO 73 -11.255 10.154 8.284 539 H VAL 74 H VAL 74 -10.935 8.019 2.966 540 HA VAL 74 HA VAL 74 -12.019 10.432 1.690 541 HB VAL 74 HB VAL 74 -9.448 10.469 2.067 542 1HG1 VAL 74 1HG1 VAL 74 -8.146 9.430 0.277 543 2HG1 VAL 74 2HG1 VAL 74 -9.603 8.636 -0.321 544 3HG1 VAL 74 3HG1 VAL 74 -8.965 8.225 1.271 545 1HG2 VAL 74 1HG2 VAL 74 -10.488 12.148 0.763 546 2HG2 VAL 74 2HG2 VAL 74 -10.764 11.030 -0.574 547 3HG2 VAL 74 3HG2 VAL 74 -9.123 11.540 -0.175 548 H SER 75 H SER 75 -12.564 10.207 -0.527 549 HA SER 75 HA SER 75 -13.162 7.446 -1.284 550 1HB SER 75 1HB SER 75 -14.300 9.079 -3.215 551 2HB SER 75 2HB SER 75 -15.133 8.410 -1.812 552 HG SER 75 HG SER 75 -15.241 10.339 -1.000 553 H PHE 76 H PHE 76 -12.185 6.454 -2.985 554 HA PHE 76 HA PHE 76 -10.515 8.104 -4.742 555 1HB PHE 76 1HB PHE 76 -9.117 5.672 -4.411 556 2HB PHE 76 2HB PHE 76 -8.621 7.279 -3.907 557 HD1 PHE 76 HD1 PHE 76 -11.129 4.819 -2.621 558 HD2 PHE 76 HD2 PHE 76 -7.738 7.257 -1.818 559 HE1 PHE 76 HE1 PHE 76 -11.183 4.115 -0.266 560 HE2 PHE 76 HE2 PHE 76 -7.787 6.574 0.539 561 HZ PHE 76 HZ PHE 76 -9.515 4.994 1.320 562 H GLU 77 H GLU 77 -9.699 6.892 -6.625 563 HA GLU 77 HA GLU 77 -11.751 5.050 -7.652 564 1HB GLU 77 1HB GLU 77 -9.983 7.023 -9.114 565 2HB GLU 77 2HB GLU 77 -11.010 5.843 -9.914 566 1HG GLU 77 1HG GLU 77 -12.688 7.273 -9.841 567 2HG GLU 77 2HG GLU 77 -12.635 7.232 -8.079 568 H GLY 78 H GLY 78 -10.928 3.381 -9.178 569 1HA GLY 78 1HA GLY 78 -8.244 2.525 -8.309 570 2HA GLY 78 2HA GLY 78 -9.526 1.441 -8.812 571 HA PRO 79 HA PRO 79 -7.926 3.310 -12.964 572 1HB PRO 79 1HB PRO 79 -5.550 4.878 -12.259 573 2HB PRO 79 2HB PRO 79 -6.924 5.325 -13.271 574 1HG PRO 79 1HG PRO 79 -6.502 6.402 -10.830 575 2HG PRO 79 2HG PRO 79 -8.122 6.162 -11.507 576 1HD PRO 79 1HD PRO 79 -6.674 4.560 -9.447 577 2HD PRO 79 2HD PRO 79 -8.387 4.982 -9.560 578 H GLY 80 H GLY 80 -6.623 2.096 -14.229 579 1HA GLY 80 1HA GLY 80 -5.020 0.096 -13.058 580 2HA GLY 80 2HA GLY 80 -5.129 0.449 -14.775 581 H LEU 81 H LEU 81 -3.626 1.852 -15.727 582 HA LEU 81 HA LEU 81 -1.092 1.918 -14.341 583 1HB LEU 81 1HB LEU 81 -1.738 1.485 -16.917 584 2HB LEU 81 2HB LEU 81 -1.308 3.184 -16.984 585 HG LEU 81 HG LEU 81 0.706 2.164 -17.449 586 1HD1 LEU 81 1HD1 LEU 81 0.882 3.708 -15.514 587 2HD1 LEU 81 2HD1 LEU 81 2.160 2.498 -15.601 588 3HD1 LEU 81 3HD1 LEU 81 0.838 2.296 -14.457 589 1HD2 LEU 81 1HD2 LEU 81 1.302 0.199 -15.627 590 2HD2 LEU 81 2HD2 LEU 81 0.718 -0.058 -17.271 591 3HD2 LEU 81 3HD2 LEU 81 -0.419 -0.039 -15.925 592 H VAL 82 H VAL 82 -0.151 3.579 -13.420 593 HA VAL 82 HA VAL 82 -0.974 6.304 -14.083 594 HB VAL 82 HB VAL 82 -0.811 5.250 -11.243 595 1HG1 VAL 82 1HG1 VAL 82 0.002 7.358 -10.928 596 2HG1 VAL 82 2HG1 VAL 82 -1.723 7.722 -10.913 597 3HG1 VAL 82 3HG1 VAL 82 -0.777 7.997 -12.375 598 1HG2 VAL 82 1HG2 VAL 82 -3.097 6.272 -12.924 599 2HG2 VAL 82 2HG2 VAL 82 -3.187 6.064 -11.176 600 3HG2 VAL 82 3HG2 VAL 82 -2.913 4.667 -12.217 601 H GLU 83 H GLU 83 0.760 7.535 -14.443 602 HA GLU 83 HA GLU 83 3.376 6.461 -14.137 603 1HB GLU 83 1HB GLU 83 2.231 9.021 -15.155 604 2HB GLU 83 2HB GLU 83 3.949 8.957 -14.789 605 1HG GLU 83 1HG GLU 83 4.305 7.223 -16.375 606 2HG GLU 83 2HG GLU 83 2.571 6.999 -16.606 607 H VAL 84 H VAL 84 4.281 6.266 -12.205 608 HA VAL 84 HA VAL 84 3.733 8.030 -10.020 609 HB VAL 84 HB VAL 84 4.256 5.728 -9.544 610 1HG1 VAL 84 1HG1 VAL 84 5.602 4.749 -11.045 611 2HG1 VAL 84 2HG1 VAL 84 6.882 5.229 -9.931 612 3HG1 VAL 84 3HG1 VAL 84 6.521 6.222 -11.339 613 1HG2 VAL 84 1HG2 VAL 84 6.542 6.205 -8.207 614 2HG2 VAL 84 2HG2 VAL 84 4.955 6.743 -7.664 615 3HG2 VAL 84 3HG2 VAL 84 6.017 7.857 -8.523 616 H GLN 85 H GLN 85 4.495 10.016 -9.904 617 HA GLN 85 HA GLN 85 6.684 10.947 -11.472 618 1HB GLN 85 1HB GLN 85 6.333 13.074 -10.141 619 2HB GLN 85 2HB GLN 85 4.946 12.500 -11.056 620 1HG GLN 85 1HG GLN 85 3.749 11.992 -9.196 621 2HG GLN 85 2HG GLN 85 5.182 11.617 -8.239 622 1HE2 GLN 85 1HE2 GLN 85 2.697 13.603 -8.296 623 2HE2 GLN 85 2HE2 GLN 85 3.397 15.044 -7.649 624 H GLU 86 H GLU 86 8.687 11.758 -10.788 625 HA GLU 86 HA GLU 86 9.947 10.236 -8.753 626 1HB GLU 86 1HB GLU 86 10.941 11.320 -10.908 627 2HB GLU 86 2HB GLU 86 11.146 12.737 -9.889 628 1HG GLU 86 1HG GLU 86 12.344 10.012 -9.470 629 2HG GLU 86 2HG GLU 86 13.188 11.489 -9.929 630 H SER 87 H SER 87 9.283 10.581 -6.702 631 HA SER 87 HA SER 87 9.833 13.214 -5.571 632 1HB SER 87 1HB SER 87 7.641 13.739 -5.550 633 2HB SER 87 2HB SER 87 7.149 12.083 -5.888 634 HG SER 87 HG SER 87 7.352 11.618 -3.693 635 H GLU 88 H GLU 88 10.166 13.215 -3.300 636 HA GLU 88 HA GLU 88 11.123 12.396 -1.411 637 1HB GLU 88 1HB GLU 88 8.654 11.478 -1.446 638 2HB GLU 88 2HB GLU 88 9.452 9.924 -1.616 639 1HG GLU 88 1HG GLU 88 9.993 9.864 0.532 640 2HG GLU 88 2HG GLU 88 10.653 11.498 0.486 641 H TYR 89 H TYR 89 10.486 9.178 -2.763 642 HA TYR 89 HA TYR 89 13.308 8.831 -3.381 643 1HB TYR 89 1HB TYR 89 13.185 6.586 -2.080 644 2HB TYR 89 2HB TYR 89 13.473 8.073 -1.184 645 HD1 TYR 89 HD1 TYR 89 12.407 8.103 0.853 646 HD2 TYR 89 HD2 TYR 89 10.436 6.282 -2.449 647 HE1 TYR 89 HE1 TYR 89 10.468 7.618 2.285 648 HE2 TYR 89 HE2 TYR 89 8.492 5.791 -1.025 649 HH TYR 89 HH TYR 89 7.952 5.518 1.326 650 H TYR 90 H TYR 90 10.531 8.791 -4.677 651 HA TYR 90 HA TYR 90 10.663 6.104 -5.858 652 1HB TYR 90 1HB TYR 90 8.464 7.878 -5.139 653 2HB TYR 90 2HB TYR 90 8.341 7.310 -6.801 654 HD1 TYR 90 HD1 TYR 90 8.407 6.283 -3.269 655 HD2 TYR 90 HD2 TYR 90 7.874 5.004 -7.292 656 HE1 TYR 90 HE1 TYR 90 7.488 4.150 -2.463 657 HE2 TYR 90 HE2 TYR 90 6.954 2.867 -6.497 658 HH TYR 90 HH TYR 90 7.370 1.603 -3.721 659 HA PRO 91 HA PRO 91 12.144 8.117 -9.544 660 1HB PRO 91 1HB PRO 91 12.336 5.982 -11.129 661 2HB PRO 91 2HB PRO 91 13.382 6.166 -9.716 662 1HG PRO 91 1HG PRO 91 10.933 4.486 -10.058 663 2HG PRO 91 2HG PRO 91 12.453 4.098 -9.233 664 1HD PRO 91 1HD PRO 91 10.133 4.947 -7.975 665 2HD PRO 91 2HD PRO 91 11.764 5.057 -7.284 666 H LYS 92 H LYS 92 11.397 8.901 -11.494 667 HA LYS 92 HA LYS 92 8.606 8.955 -11.925 668 1HB LYS 92 1HB LYS 92 10.145 10.771 -12.604 669 2HB LYS 92 2HB LYS 92 10.819 9.717 -13.838 670 1HG LYS 92 1HG LYS 92 9.338 10.757 -15.162 671 2HG LYS 92 2HG LYS 92 8.207 9.587 -14.478 672 1HD LYS 92 1HD LYS 92 7.052 11.181 -13.420 673 2HD LYS 92 2HD LYS 92 8.521 11.932 -12.791 674 1HE LYS 92 1HE LYS 92 8.113 12.328 -15.662 675 2HE LYS 92 2HE LYS 92 6.850 13.035 -14.654 676 1HZ LYS 92 1HZ LYS 92 9.702 13.699 -14.798 677 2HZ LYS 92 2HZ LYS 92 8.899 13.917 -13.326 678 3HZ LYS 92 3HZ LYS 92 8.360 14.726 -14.710 679 H ARG 93 H ARG 93 8.194 6.630 -11.972 680 HA ARG 93 HA ARG 93 8.659 5.490 -14.652 681 1HB ARG 93 1HB ARG 93 9.069 4.334 -11.970 682 2HB ARG 93 2HB ARG 93 8.278 3.277 -13.131 683 1HG ARG 93 1HG ARG 93 10.132 3.514 -14.665 684 2HG ARG 93 2HG ARG 93 10.912 4.666 -13.580 685 1HD ARG 93 1HD ARG 93 11.192 2.971 -11.897 686 2HD ARG 93 2HD ARG 93 10.255 1.817 -12.845 687 HE ARG 93 HE ARG 93 12.548 2.800 -14.247 688 1HH1 ARG 93 1HH1 ARG 93 11.460 0.461 -11.896 689 2HH1 ARG 93 2HH1 ARG 93 12.761 -0.639 -12.204 690 1HH2 ARG 93 1HH2 ARG 93 14.259 1.354 -14.653 691 2HH2 ARG 93 2HH2 ARG 93 14.351 -0.132 -13.769 692 H TYR 94 H TYR 94 7.100 3.367 -14.717 693 HA TYR 94 HA TYR 94 4.400 4.477 -14.500 694 1HB TYR 94 1HB TYR 94 5.695 2.425 -16.242 695 2HB TYR 94 2HB TYR 94 3.963 2.308 -15.952 696 HD1 TYR 94 HD1 TYR 94 6.604 4.618 -17.166 697 HD2 TYR 94 HD2 TYR 94 2.467 3.645 -17.155 698 HE1 TYR 94 HE1 TYR 94 6.206 6.315 -18.892 699 HE2 TYR 94 HE2 TYR 94 2.051 5.335 -18.877 700 HH TYR 94 HH TYR 94 3.045 7.329 -19.784 701 H GLN 95 H GLN 95 2.891 3.647 -13.167 702 HA GLN 95 HA GLN 95 3.449 1.065 -11.876 703 1HB GLN 95 1HB GLN 95 3.321 3.666 -10.631 704 2HB GLN 95 2HB GLN 95 2.065 2.618 -9.985 705 1HG GLN 95 1HG GLN 95 3.573 1.698 -8.662 706 2HG GLN 95 2HG GLN 95 4.396 1.064 -10.087 707 1HE2 GLN 95 1HE2 GLN 95 4.295 3.640 -7.740 708 2HE2 GLN 95 2HE2 GLN 95 5.886 4.243 -8.039 709 H SER 96 H SER 96 1.796 -0.330 -11.984 710 HA SER 96 HA SER 96 -0.814 0.710 -12.836 711 1HB SER 96 1HB SER 96 0.182 -0.996 -14.282 712 2HB SER 96 2HB SER 96 0.278 -2.111 -12.919 713 HG SER 96 HG SER 96 -2.152 -0.975 -13.831 714 H HIS 97 H HIS 97 -2.764 -0.240 -11.968 715 HA HIS 97 HA HIS 97 -4.172 -0.833 -10.292 716 1HB HIS 97 1HB HIS 97 -2.090 -2.714 -10.218 717 2HB HIS 97 2HB HIS 97 -2.360 -2.253 -8.542 718 HD1 HIS 97 HD1 HIS 97 -3.458 -4.453 -7.871 719 HD2 HIS 97 HD2 HIS 97 -5.357 -2.562 -11.046 720 HE1 HIS 97 HE1 HIS 97 -5.625 -5.689 -8.190 721 HE2 HIS 97 HE2 HIS 97 -6.800 -4.465 -10.052 722 H VAL 98 H VAL 98 -3.488 1.664 -9.988 723 HA VAL 98 HA VAL 98 -2.845 1.918 -7.119 724 HB VAL 98 HB VAL 98 -1.046 2.806 -8.654 725 1HG1 VAL 98 1HG1 VAL 98 -1.602 5.204 -9.443 726 2HG1 VAL 98 2HG1 VAL 98 -3.273 4.642 -9.424 727 3HG1 VAL 98 3HG1 VAL 98 -2.082 3.830 -10.441 728 1HG2 VAL 98 1HG2 VAL 98 -1.007 5.096 -7.447 729 2HG2 VAL 98 2HG2 VAL 98 -0.866 3.609 -6.504 730 3HG2 VAL 98 3HG2 VAL 98 -2.409 4.464 -6.581 731 H LEU 99 H LEU 99 -4.113 3.278 -5.899 732 HA LEU 99 HA LEU 99 -6.539 4.263 -7.227 733 1HB LEU 99 1HB LEU 99 -5.955 3.319 -4.444 734 2HB LEU 99 2HB LEU 99 -7.311 4.392 -4.734 735 HG LEU 99 HG LEU 99 -8.245 2.739 -6.325 736 1HD1 LEU 99 1HD1 LEU 99 -6.245 1.627 -7.045 737 2HD1 LEU 99 2HD1 LEU 99 -7.305 0.443 -6.281 738 3HD1 LEU 99 3HD1 LEU 99 -5.910 1.072 -5.406 739 1HD2 LEU 99 1HD2 LEU 99 -9.216 2.586 -4.227 740 2HD2 LEU 99 2HD2 LEU 99 -7.728 2.024 -3.465 741 3HD2 LEU 99 3HD2 LEU 99 -8.652 0.940 -4.506 742 H LEU 100 H LEU 100 -7.307 6.377 -6.802 743 HA LEU 100 HA LEU 100 -5.416 8.129 -5.400 744 1HB LEU 100 1HB LEU 100 -6.213 8.211 -8.219 745 2HB LEU 100 2HB LEU 100 -6.310 9.756 -7.392 746 HG LEU 100 HG LEU 100 -3.841 8.017 -7.498 747 1HD1 LEU 100 1HD1 LEU 100 -4.195 10.640 -8.894 748 2HD1 LEU 100 2HD1 LEU 100 -4.675 9.127 -9.665 749 3HD1 LEU 100 3HD1 LEU 100 -2.998 9.377 -9.177 750 1HD2 LEU 100 1HD2 LEU 100 -4.460 9.870 -5.623 751 2HD2 LEU 100 2HD2 LEU 100 -3.666 10.875 -6.835 752 3HD2 LEU 100 3HD2 LEU 100 -2.818 9.494 -6.145 753 H ALA 101 H ALA 101 -6.277 9.558 -4.057 754 HA ALA 101 HA ALA 101 -9.119 10.262 -4.311 755 1HB ALA 101 1HB ALA 101 -7.747 9.142 -1.894 756 2HB ALA 101 2HB ALA 101 -9.264 8.636 -2.641 757 3HB ALA 101 3HB ALA 101 -9.183 10.154 -1.748 758 H THR 102 H THR 102 -9.669 12.298 -3.517 759 HA THR 102 HA THR 102 -7.369 14.061 -3.036 760 HB THR 102 HB THR 102 -8.544 14.786 -4.949 761 HG1 THR 102 HG1 THR 102 -8.188 16.584 -3.781 762 1HG2 THR 102 1HG2 THR 102 -10.888 13.823 -3.533 763 2HG2 THR 102 2HG2 THR 102 -10.611 14.037 -5.264 764 3HG2 THR 102 3HG2 THR 102 -11.135 15.404 -4.280 765 H GLY 103 H GLY 103 -7.181 15.202 -1.188 766 1HA GLY 103 1HA GLY 103 -9.265 14.768 0.847 767 2HA GLY 103 2HA GLY 103 -7.583 15.150 1.180 768 H PHE 104 H PHE 104 -6.843 17.335 0.506 769 HA PHE 104 HA PHE 104 -8.949 19.339 0.307 770 1HB PHE 104 1HB PHE 104 -8.309 18.801 2.782 771 2HB PHE 104 2HB PHE 104 -6.856 19.728 2.422 772 HD1 PHE 104 HD1 PHE 104 -9.951 19.967 3.857 773 HD2 PHE 104 HD2 PHE 104 -7.488 22.008 1.052 774 HE1 PHE 104 HE1 PHE 104 -11.177 22.053 4.306 775 HE2 PHE 104 HE2 PHE 104 -8.707 24.099 1.496 776 HZ PHE 104 HZ PHE 104 -10.555 24.122 3.125 777 H SER 105 H SER 105 -5.447 19.110 0.960 778 HA SER 105 HA SER 105 -4.633 20.070 -1.544 779 1HB SER 105 1HB SER 105 -5.771 22.129 -0.272 780 2HB SER 105 2HB SER 105 -4.158 22.248 0.431 781 HG SER 105 HG SER 105 -4.873 23.218 -1.837 782 H GLU 106 H GLU 106 -3.386 18.150 -0.826 783 HA GLU 106 HA GLU 106 -1.433 17.183 -0.176 784 1HB GLU 106 1HB GLU 106 -0.662 19.450 -1.282 785 2HB GLU 106 2HB GLU 106 -0.209 19.854 0.367 786 1HG GLU 106 1HG GLU 106 0.921 17.443 0.202 787 2HG GLU 106 2HG GLU 106 0.969 17.897 -1.502 788 HA PRO 107 HA PRO 107 -2.514 17.759 4.274 789 1HB PRO 107 1HB PRO 107 -2.557 15.099 4.841 790 2HB PRO 107 2HB PRO 107 -3.950 15.969 4.189 791 1HG PRO 107 1HG PRO 107 -1.948 14.260 2.762 792 2HG PRO 107 2HG PRO 107 -3.711 14.315 2.571 793 1HD PRO 107 1HD PRO 107 -2.030 15.553 0.854 794 2HD PRO 107 2HD PRO 107 -3.635 16.203 1.247 795 H GLY 108 H GLY 108 -0.048 15.860 2.651 796 1HA GLY 108 1HA GLY 108 2.030 16.785 4.305 797 2HA GLY 108 2HA GLY 108 1.539 15.193 4.867 798 H ASP 109 H ASP 109 3.688 14.493 4.316 799 HA ASP 109 HA ASP 109 3.843 13.649 1.526 800 1HB ASP 109 1HB ASP 109 5.370 15.792 2.460 801 2HB ASP 109 2HB ASP 109 6.478 14.423 2.478 802 H ALA 110 H ALA 110 3.236 12.291 4.010 803 HA ALA 110 HA ALA 110 4.976 10.046 3.702 804 1HB ALA 110 1HB ALA 110 6.410 11.420 5.116 805 2HB ALA 110 2HB ALA 110 5.855 9.989 5.983 806 3HB ALA 110 3HB ALA 110 5.117 11.558 6.309 807 H GLY 111 H GLY 111 3.139 8.841 3.369 808 1HA GLY 111 1HA GLY 111 1.195 8.738 5.585 809 2HA GLY 111 2HA GLY 111 0.854 8.270 3.926 810 H GLY 112 H GLY 112 0.000 6.353 5.175 811 1HA GLY 112 1HA GLY 112 2.189 4.404 5.559 812 2HA GLY 112 2HA GLY 112 0.753 4.421 6.571 813 H ILE 113 H ILE 113 -0.919 3.184 5.998 814 HA ILE 113 HA ILE 113 -0.990 2.140 3.244 815 HB ILE 113 HB ILE 113 -1.751 -0.014 4.065 816 1HG1 ILE 113 1HG1 ILE 113 -1.396 1.206 6.813 817 2HG1 ILE 113 2HG1 ILE 113 -2.908 0.667 6.087 818 1HG2 ILE 113 1HG2 ILE 113 0.322 -0.805 5.055 819 2HG2 ILE 113 2HG2 ILE 113 0.774 0.850 5.469 820 3HG2 ILE 113 3HG2 ILE 113 0.654 0.365 3.776 821 1HD1 ILE 113 1HD1 ILE 113 -1.067 -1.501 6.075 822 2HD1 ILE 113 2HD1 ILE 113 -2.604 -1.351 6.926 823 3HD1 ILE 113 3HD1 ILE 113 -1.114 -0.797 7.689 824 H LEU 114 H LEU 114 -3.020 1.788 2.332 825 HA LEU 114 HA LEU 114 -5.158 3.359 3.516 826 1HB LEU 114 1HB LEU 114 -4.861 3.762 1.210 827 2HB LEU 114 2HB LEU 114 -4.742 2.052 0.841 828 HG LEU 114 HG LEU 114 -7.123 1.761 1.252 829 1HD1 LEU 114 1HD1 LEU 114 -8.561 3.407 1.990 830 2HD1 LEU 114 2HD1 LEU 114 -7.449 4.711 1.572 831 3HD1 LEU 114 3HD1 LEU 114 -7.122 3.687 2.969 832 1HD2 LEU 114 1HD2 LEU 114 -7.784 2.552 -0.770 833 2HD2 LEU 114 2HD2 LEU 114 -6.049 2.824 -0.938 834 3HD2 LEU 114 3HD2 LEU 114 -7.112 4.157 -0.486 835 H ARG 115 H ARG 115 -6.541 2.443 4.880 836 HA ARG 115 HA ARG 115 -7.216 -0.399 4.479 837 1HB ARG 115 1HB ARG 115 -7.057 1.180 7.048 838 2HB ARG 115 2HB ARG 115 -7.678 -0.459 6.931 839 1HG ARG 115 1HG ARG 115 -5.055 -0.205 5.727 840 2HG ARG 115 2HG ARG 115 -5.063 0.287 7.421 841 1HD ARG 115 1HD ARG 115 -6.582 -2.027 7.394 842 2HD ARG 115 2HD ARG 115 -5.287 -2.361 6.245 843 HE ARG 115 HE ARG 115 -3.865 -2.543 8.011 844 1HH1 ARG 115 1HH1 ARG 115 -6.597 -0.619 9.015 845 2HH1 ARG 115 2HH1 ARG 115 -6.065 -0.495 10.659 846 1HH2 ARG 115 1HH2 ARG 115 -3.163 -2.381 10.172 847 2HH2 ARG 115 2HH2 ARG 115 -4.116 -1.495 11.316 848 H CYS 116 H CYS 116 -9.342 -1.067 4.872 849 HA CYS 116 HA CYS 116 -11.339 1.099 4.762 850 1HB CYS 116 1HB CYS 116 -11.020 -0.495 2.742 851 2HB CYS 116 2HB CYS 116 -11.824 -1.694 3.749 852 H GLU 117 H GLU 117 -13.473 0.521 5.692 853 HA GLU 117 HA GLU 117 -13.266 -0.291 8.346 854 1HB GLU 117 1HB GLU 117 -15.280 0.720 6.671 855 2HB GLU 117 2HB GLU 117 -15.925 -0.778 7.327 856 1HG GLU 117 1HG GLU 117 -15.622 -0.014 9.565 857 2HG GLU 117 2HG GLU 117 -14.732 1.405 9.015 858 H HIS 118 H HIS 118 -13.467 -2.181 5.494 859 HA HIS 118 HA HIS 118 -14.400 -4.553 6.895 860 1HB HIS 118 1HB HIS 118 -13.568 -4.264 4.003 861 2HB HIS 118 2HB HIS 118 -14.465 -5.602 4.719 862 HD2 HIS 118 HD2 HIS 118 -17.147 -5.351 4.439 863 HE1 HIS 118 HE1 HIS 118 -17.279 -1.169 3.731 864 HE2 HIS 118 HE2 HIS 118 -18.628 -3.284 3.967 865 H GLY 119 H GLY 119 -11.439 -3.244 5.490 866 1HA GLY 119 1HA GLY 119 -9.754 -4.804 7.101 867 2HA GLY 119 2HA GLY 119 -9.910 -5.618 5.552 868 H VAL 120 H VAL 120 -7.925 -5.347 4.756 869 HA VAL 120 HA VAL 120 -6.776 -2.650 4.635 870 HB VAL 120 HB VAL 120 -5.356 -5.172 3.816 871 1HG1 VAL 120 1HG1 VAL 120 -4.658 -2.360 4.210 872 2HG1 VAL 120 2HG1 VAL 120 -3.899 -3.597 3.209 873 3HG1 VAL 120 3HG1 VAL 120 -3.527 -3.507 4.930 874 1HG2 VAL 120 1HG2 VAL 120 -6.303 -4.644 6.419 875 2HG2 VAL 120 2HG2 VAL 120 -4.568 -4.334 6.433 876 3HG2 VAL 120 3HG2 VAL 120 -5.179 -5.900 5.902 877 H ILE 121 H ILE 121 -6.458 -1.597 2.743 878 HA ILE 121 HA ILE 121 -7.506 -2.866 0.317 879 HB ILE 121 HB ILE 121 -6.806 0.031 0.772 880 1HG1 ILE 121 1HG1 ILE 121 -8.943 -1.403 1.863 881 2HG1 ILE 121 2HG1 ILE 121 -8.791 0.345 1.762 882 1HG2 ILE 121 1HG2 ILE 121 -8.322 0.303 -1.260 883 2HG2 ILE 121 2HG2 ILE 121 -8.110 -1.431 -1.501 884 3HG2 ILE 121 3HG2 ILE 121 -6.710 -0.359 -1.532 885 1HD1 ILE 121 1HD1 ILE 121 -10.924 -0.817 0.879 886 2HD1 ILE 121 2HD1 ILE 121 -9.935 -1.188 -0.531 887 3HD1 ILE 121 3HD1 ILE 121 -10.198 0.492 -0.056 888 H GLY 122 H GLY 122 -4.908 -0.513 0.993 889 1HA GLY 122 1HA GLY 122 -2.939 -2.189 -0.294 890 2HA GLY 122 2HA GLY 122 -3.386 -0.771 -1.228 891 H LEU 123 H LEU 123 -1.036 -0.352 -0.945 892 HA LEU 123 HA LEU 123 -0.511 0.984 1.631 893 1HB LEU 123 1HB LEU 123 1.938 0.678 0.946 894 2HB LEU 123 2HB LEU 123 1.064 -0.730 1.519 895 HG LEU 123 HG LEU 123 1.163 -0.230 -1.419 896 1HD1 LEU 123 1HD1 LEU 123 3.478 0.099 -0.630 897 2HD1 LEU 123 2HD1 LEU 123 3.292 -1.346 -1.625 898 3HD1 LEU 123 3HD1 LEU 123 3.421 -1.493 0.128 899 1HD2 LEU 123 1HD2 LEU 123 -0.051 -2.119 -0.030 900 2HD2 LEU 123 2HD2 LEU 123 1.548 -2.863 -0.094 901 3HD2 LEU 123 3HD2 LEU 123 0.702 -2.460 -1.588 902 H VAL 124 H VAL 124 1.014 2.851 1.461 903 HA VAL 124 HA VAL 124 0.035 4.731 -0.402 904 HB VAL 124 HB VAL 124 1.939 6.175 0.429 905 1HG1 VAL 124 1HG1 VAL 124 0.963 5.950 2.912 906 2HG1 VAL 124 2HG1 VAL 124 -0.253 5.019 2.037 907 3HG1 VAL 124 3HG1 VAL 124 0.067 6.695 1.588 908 1HG2 VAL 124 1HG2 VAL 124 2.595 4.755 2.764 909 2HG2 VAL 124 2HG2 VAL 124 3.661 5.188 1.428 910 3HG2 VAL 124 3HG2 VAL 124 2.828 3.635 1.421 911 H THR 125 H THR 125 0.668 5.255 -2.395 912 HA THR 125 HA THR 125 3.186 4.098 -3.385 913 HB THR 125 HB THR 125 0.534 4.563 -4.710 914 HG1 THR 125 HG1 THR 125 1.303 2.509 -3.772 915 1HG2 THR 125 1HG2 THR 125 3.149 4.807 -6.017 916 2HG2 THR 125 2HG2 THR 125 1.557 5.359 -6.540 917 3HG2 THR 125 3HG2 THR 125 2.028 3.675 -6.775 918 H MET 126 H MET 126 1.272 6.601 -5.007 919 HA MET 126 HA MET 126 3.420 8.523 -4.399 920 1HB MET 126 1HB MET 126 3.099 7.322 -6.857 921 2HB MET 126 2HB MET 126 2.247 8.845 -7.058 922 1HG MET 126 1HG MET 126 4.592 8.952 -7.757 923 2HG MET 126 2HG MET 126 4.207 10.082 -6.462 924 1HE MET 126 1HE MET 126 5.726 10.665 -5.211 925 2HE MET 126 2HE MET 126 7.261 10.099 -5.869 926 3HE MET 126 3HE MET 126 6.836 9.744 -4.193 927 H GLY 127 H GLY 127 2.715 10.394 -3.628 928 1HA GLY 127 1HA GLY 127 -0.135 11.057 -4.018 929 2HA GLY 127 2HA GLY 127 0.811 11.520 -2.612 930 H GLY 128 H GLY 128 -0.757 13.202 -4.413 931 1HA GLY 128 1HA GLY 128 1.395 14.836 -5.600 932 2HA GLY 128 2HA GLY 128 -0.280 14.855 -6.129 933 H GLU 129 H GLU 129 -0.353 17.118 -5.892 934 HA GLU 129 HA GLU 129 -0.040 18.201 -3.201 935 1HB GLU 129 1HB GLU 129 -0.822 19.762 -5.652 936 2HB GLU 129 2HB GLU 129 -0.059 20.350 -4.182 937 1HG GLU 129 1HG GLU 129 1.307 18.414 -6.019 938 2HG GLU 129 2HG GLU 129 1.389 20.158 -6.258 939 H GLY 130 H GLY 130 -2.348 16.450 -4.274 940 1HA GLY 130 1HA GLY 130 -4.398 17.762 -2.778 941 2HA GLY 130 2HA GLY 130 -4.710 17.847 -4.504 942 H VAL 131 H VAL 131 -3.429 15.180 -4.935 943 HA VAL 131 HA VAL 131 -5.629 13.541 -3.868 944 HB VAL 131 HB VAL 131 -4.163 12.714 -6.330 945 1HG1 VAL 131 1HG1 VAL 131 -6.273 11.693 -6.898 946 2HG1 VAL 131 2HG1 VAL 131 -7.057 12.481 -5.528 947 3HG1 VAL 131 3HG1 VAL 131 -5.830 11.246 -5.251 948 1HG2 VAL 131 1HG2 VAL 131 -4.708 15.073 -6.728 949 2HG2 VAL 131 2HG2 VAL 131 -6.394 14.743 -6.332 950 3HG2 VAL 131 3HG2 VAL 131 -5.660 13.999 -7.753 951 H VAL 132 H VAL 132 -5.150 11.273 -3.466 952 HA VAL 132 HA VAL 132 -2.339 10.862 -2.680 953 HB VAL 132 HB VAL 132 -3.077 9.486 -0.865 954 1HG1 VAL 132 1HG1 VAL 132 -4.882 11.193 0.148 955 2HG1 VAL 132 2HG1 VAL 132 -4.240 12.178 -1.167 956 3HG1 VAL 132 3HG1 VAL 132 -3.154 11.539 0.068 957 1HG2 VAL 132 1HG2 VAL 132 -5.598 9.286 -0.438 958 2HG2 VAL 132 2HG2 VAL 132 -4.895 8.260 -1.689 959 3HG2 VAL 132 3HG2 VAL 132 -5.786 9.713 -2.140 960 H GLY 133 H GLY 133 -1.285 9.374 -3.848 961 1HA GLY 133 1HA GLY 133 -2.841 7.379 -5.330 962 2HA GLY 133 2HA GLY 133 -1.157 7.783 -5.611 963 H PHE 134 H PHE 134 -3.155 5.438 -4.466 964 HA PHE 134 HA PHE 134 -1.044 4.327 -2.733 965 1HB PHE 134 1HB PHE 134 -4.013 3.812 -2.494 966 2HB PHE 134 2HB PHE 134 -2.754 3.209 -1.424 967 HD1 PHE 134 HD1 PHE 134 -1.181 5.868 -1.358 968 HD2 PHE 134 HD2 PHE 134 -5.288 4.898 -0.814 969 HE1 PHE 134 HE1 PHE 134 -1.452 7.841 0.085 970 HE2 PHE 134 HE2 PHE 134 -5.568 6.869 0.626 971 HZ PHE 134 HZ PHE 134 -3.648 8.344 1.079 972 H ALA 135 H ALA 135 -0.516 2.179 -2.953 973 HA ALA 135 HA ALA 135 -1.311 0.940 -5.466 974 1HB ALA 135 1HB ALA 135 0.450 -0.803 -4.523 975 2HB ALA 135 2HB ALA 135 0.920 0.581 -3.534 976 3HB ALA 135 3HB ALA 135 0.953 0.703 -5.294 977 H ASP 136 H ASP 136 -3.110 -0.245 -5.436 978 HA ASP 136 HA ASP 136 -4.251 -1.314 -3.076 979 1HB ASP 136 1HB ASP 136 -5.179 -0.770 -5.586 980 2HB ASP 136 2HB ASP 136 -5.111 -2.530 -5.613 981 H VAL 137 H VAL 137 -4.491 -3.423 -2.378 982 HA VAL 137 HA VAL 137 -2.317 -5.218 -3.131 983 HB VAL 137 HB VAL 137 -4.323 -5.366 -0.867 984 1HG1 VAL 137 1HG1 VAL 137 -3.781 -7.593 -1.163 985 2HG1 VAL 137 2HG1 VAL 137 -2.557 -7.067 -0.007 986 3HG1 VAL 137 3HG1 VAL 137 -2.146 -7.230 -1.712 987 1HG2 VAL 137 1HG2 VAL 137 -1.527 -5.121 -0.153 988 2HG2 VAL 137 2HG2 VAL 137 -2.913 -4.158 0.360 989 3HG2 VAL 137 3HG2 VAL 137 -2.077 -3.768 -1.142 990 H ARG 138 H ARG 138 -5.092 -4.647 -4.516 991 HA ARG 138 HA ARG 138 -6.458 -7.132 -4.532 992 1HB ARG 138 1HB ARG 138 -6.535 -4.932 -6.596 993 2HB ARG 138 2HB ARG 138 -7.732 -6.201 -6.377 994 1HG ARG 138 1HG ARG 138 -7.110 -4.350 -4.118 995 2HG ARG 138 2HG ARG 138 -8.165 -3.821 -5.429 996 1HD ARG 138 1HD ARG 138 -8.566 -6.311 -3.776 997 2HD ARG 138 2HD ARG 138 -9.407 -4.782 -3.523 998 HE ARG 138 HE ARG 138 -9.687 -5.803 -6.190 999 1HH1 ARG 138 1HH1 ARG 138 -10.947 -5.949 -2.939 1000 2HH1 ARG 138 2HH1 ARG 138 -12.518 -6.478 -3.437 1001 1HH2 ARG 138 1HH2 ARG 138 -11.754 -6.498 -6.849 1002 2HH2 ARG 138 2HH2 ARG 138 -12.977 -6.789 -5.657 1003 H ASP 139 H ASP 139 -3.487 -6.305 -5.837 1004 HA ASP 139 HA ASP 139 -3.763 -8.101 -8.128 1005 1HB ASP 139 1HB ASP 139 -1.416 -7.292 -8.652 1006 2HB ASP 139 2HB ASP 139 -2.687 -6.076 -8.727 1007 H LEU 140 H LEU 140 -3.354 -8.697 -5.039 1008 HA LEU 140 HA LEU 140 -2.065 -11.158 -5.418 1009 1HB LEU 140 1HB LEU 140 0.024 -10.838 -4.244 1010 2HB LEU 140 2HB LEU 140 -0.045 -9.797 -5.646 1011 HG LEU 140 HG LEU 140 0.876 -8.364 -4.125 1012 1HD1 LEU 140 1HD1 LEU 140 -0.804 -6.827 -3.224 1013 2HD1 LEU 140 2HD1 LEU 140 -2.062 -8.009 -3.587 1014 3HD1 LEU 140 3HD1 LEU 140 -1.138 -7.278 -4.898 1015 1HD2 LEU 140 1HD2 LEU 140 -0.774 -8.909 -1.769 1016 2HD2 LEU 140 2HD2 LEU 140 0.968 -8.680 -1.914 1017 3HD2 LEU 140 3HD2 LEU 140 0.249 -10.249 -2.283 1018 H LEU 141 H LEU 141 -4.402 -10.223 -4.255 1019 HA LEU 141 HA LEU 141 -4.389 -9.887 -1.502 1020 1HB LEU 141 1HB LEU 141 -6.298 -10.171 -3.506 1021 2HB LEU 141 2HB LEU 141 -6.649 -11.456 -2.364 1022 HG LEU 141 HG LEU 141 -7.940 -9.621 -1.663 1023 1HD1 LEU 141 1HD1 LEU 141 -7.340 -9.500 0.507 1024 2HD1 LEU 141 2HD1 LEU 141 -5.652 -9.138 0.135 1025 3HD1 LEU 141 3HD1 LEU 141 -6.251 -10.791 0.001 1026 1HD2 LEU 141 1HD2 LEU 141 -5.773 -7.685 -1.301 1027 2HD2 LEU 141 2HD2 LEU 141 -7.413 -7.453 -1.908 1028 3HD2 LEU 141 3HD2 LEU 141 -6.154 -8.063 -2.980 1029 H TRP 142 H TRP 142 -3.743 -12.739 -3.318 1030 HA TRP 142 HA TRP 142 -4.549 -14.735 -1.571 1031 1HB TRP 142 1HB TRP 142 -2.697 -16.105 -2.579 1032 2HB TRP 142 2HB TRP 142 -3.782 -15.356 -3.746 1033 HD1 TRP 142 HD1 TRP 142 -2.736 -12.963 -4.869 1034 HE1 TRP 142 HE1 TRP 142 -0.316 -12.514 -5.612 1035 HE3 TRP 142 HE3 TRP 142 -0.382 -16.645 -2.228 1036 HZ2 TRP 142 HZ2 TRP 142 2.247 -13.583 -5.142 1037 HZ3 TRP 142 HZ3 TRP 142 2.060 -16.866 -2.428 1038 HH2 TRP 142 HH2 TRP 142 3.349 -15.363 -3.857 1039 H LEU 143 H LEU 143 -4.216 -14.007 0.553 1040 HA LEU 143 HA LEU 143 -1.568 -14.624 1.597 1041 1HB LEU 143 1HB LEU 143 -2.994 -12.013 2.091 1042 2HB LEU 143 2HB LEU 143 -1.716 -12.610 3.127 1043 HG LEU 143 HG LEU 143 -0.483 -12.701 0.698 1044 1HD1 LEU 143 1HD1 LEU 143 -0.991 -10.503 -0.356 1045 2HD1 LEU 143 2HD1 LEU 143 -2.423 -10.408 0.668 1046 3HD1 LEU 143 3HD1 LEU 143 -2.268 -11.707 -0.514 1047 1HD2 LEU 143 1HD2 LEU 143 0.189 -11.644 2.934 1048 2HD2 LEU 143 2HD2 LEU 143 -0.555 -10.173 2.310 1049 3HD2 LEU 143 3HD2 LEU 143 0.803 -10.902 1.456 1050 H GLU 144 H GLU 144 -4.870 -13.601 2.388 1051 HA GLU 144 HA GLU 144 -5.111 -15.806 4.258 1052 1HB GLU 144 1HB GLU 144 -4.884 -12.973 5.081 1053 2HB GLU 144 2HB GLU 144 -6.178 -13.887 5.842 1054 1HG GLU 144 1HG GLU 144 -4.533 -15.571 6.558 1055 2HG GLU 144 2HG GLU 144 -3.252 -14.588 5.851 1056 H ASP 145 H ASP 145 -7.465 -15.299 5.438 1057 HA ASP 145 HA ASP 145 -9.353 -15.791 3.437 1058 1HB ASP 145 1HB ASP 145 -9.351 -16.046 6.129 1059 2HB ASP 145 2HB ASP 145 -10.357 -14.610 5.961 1060 H ASP 146 H ASP 146 -10.713 -14.540 2.278 1061 HA ASP 146 HA ASP 146 -10.194 -11.698 2.214 1062 1HB ASP 146 1HB ASP 146 -11.758 -13.612 0.517 1063 2HB ASP 146 2HB ASP 146 -12.039 -11.881 0.362 1064 H ALA 147 H ALA 147 -11.834 -10.071 2.373 1065 HA ALA 147 HA ALA 147 -13.710 -10.614 4.500 1066 1HB ALA 147 1HB ALA 147 -13.885 -8.335 4.772 1067 2HB ALA 147 2HB ALA 147 -13.606 -8.002 3.063 1068 3HB ALA 147 3HB ALA 147 -12.262 -8.480 4.099 1069 H MET 148 H MET 148 -15.940 -10.467 4.401 1070 HA MET 148 HA MET 148 -18.016 -10.714 3.507 1071 1HB MET 148 1HB MET 148 -17.553 -8.444 2.636 1072 2HB MET 148 2HB MET 148 -16.864 -9.158 1.184 1073 1HG MET 148 1HG MET 148 -19.451 -10.258 1.559 1074 2HG MET 148 2HG MET 148 -19.567 -8.509 1.739 1075 1HE MET 148 1HE MET 148 -17.615 -7.450 -1.535 1076 2HE MET 148 2HE MET 148 -17.507 -7.342 0.222 1077 3HE MET 148 3HE MET 148 -18.946 -6.753 -0.612 1078 H GLU 149 H GLU 149 -17.135 -13.012 3.372 1079 HA GLU 149 HA GLU 149 -16.471 -14.053 0.796 1080 1HB GLU 149 1HB GLU 149 -15.793 -15.070 2.996 1081 2HB GLU 149 2HB GLU 149 -17.461 -15.588 3.202 1082 1HG GLU 149 1HG GLU 149 -16.863 -17.462 2.179 1083 2HG GLU 149 2HG GLU 149 -16.820 -16.515 0.692 1084 H GLN 150 H GLN 150 -19.294 -14.702 2.882 1085 HA GLN 150 HA GLN 150 -20.843 -15.347 0.481 1086 1HB GLN 150 1HB GLN 150 -20.918 -16.187 3.304 1087 2HB GLN 150 2HB GLN 150 -22.496 -15.931 2.571 1088 1HG GLN 150 1HG GLN 150 -20.434 -17.596 1.190 1089 2HG GLN 150 2HG GLN 150 -21.422 -18.273 2.484 1090 1HE2 GLN 150 1HE2 GLN 150 -21.187 -18.036 -0.740 1091 2HE2 GLN 150 2HE2 GLN 150 -22.851 -18.177 -1.184 Start of MODEL 7 1 1H GLY 1 1H GLY 1 -0.930 -9.730 23.518 2 2H GLY 1 2H GLY 1 -1.159 -8.244 24.291 3 3H GLY 1 3H GLY 1 0.387 -8.925 24.210 4 1HA GLY 1 1HA GLY 1 -0.807 -8.595 21.624 5 2HA GLY 1 2HA GLY 1 -0.635 -7.077 22.491 6 HA PRO 2 HA PRO 2 3.418 -8.904 20.428 7 1HB PRO 2 1HB PRO 2 2.842 -6.653 18.560 8 2HB PRO 2 2HB PRO 2 3.554 -8.237 18.229 9 1HG PRO 2 1HG PRO 2 1.033 -7.720 17.556 10 2HG PRO 2 2HG PRO 2 1.496 -9.305 18.202 11 1HD PRO 2 1HD PRO 2 0.061 -7.057 19.540 12 2HD PRO 2 2HD PRO 2 -0.156 -8.808 19.730 13 H TYR 3 H TYR 3 5.307 -7.278 19.794 14 HA TYR 3 HA TYR 3 5.216 -4.780 21.249 15 1HB TYR 3 1HB TYR 3 5.985 -7.024 22.665 16 2HB TYR 3 2HB TYR 3 7.523 -6.341 22.147 17 HD1 TYR 3 HD1 TYR 3 4.293 -4.863 23.329 18 HD2 TYR 3 HD2 TYR 3 8.508 -5.136 23.843 19 HE1 TYR 3 HE1 TYR 3 4.171 -3.222 25.157 20 HE2 TYR 3 HE2 TYR 3 8.397 -3.497 25.673 21 HH TYR 3 HH TYR 3 5.441 -2.522 27.091 22 H GLY 4 H GLY 4 6.748 -3.326 20.569 23 1HA GLY 4 1HA GLY 4 8.534 -2.485 19.367 24 2HA GLY 4 2HA GLY 4 9.064 -4.135 19.075 25 H HIS 5 H HIS 5 6.441 -1.915 18.133 26 HA HIS 5 HA HIS 5 6.934 -2.564 15.340 27 1HB HIS 5 1HB HIS 5 4.534 -3.026 14.913 28 2HB HIS 5 2HB HIS 5 5.283 -4.233 15.952 29 HD1 HIS 5 HD1 HIS 5 2.188 -2.858 15.685 30 HD2 HIS 5 HD2 HIS 5 4.865 -2.954 18.860 31 HE1 HIS 5 HE1 HIS 5 0.795 -2.514 17.750 32 HE2 HIS 5 HE2 HIS 5 2.423 -2.667 19.664 33 H GLN 6 H GLN 6 6.858 -0.773 14.157 34 HA GLN 6 HA GLN 6 5.137 1.440 15.037 35 1HB GLN 6 1HB GLN 6 7.945 1.424 15.192 36 2HB GLN 6 2HB GLN 6 7.555 2.433 13.807 37 1HG GLN 6 1HG GLN 6 7.683 3.867 15.669 38 2HG GLN 6 2HG GLN 6 5.968 3.684 15.300 39 1HE2 GLN 6 1HE2 GLN 6 8.333 1.760 17.120 40 2HE2 GLN 6 2HE2 GLN 6 7.397 1.666 18.569 41 H SER 7 H SER 7 4.503 -0.419 13.059 42 HA SER 7 HA SER 7 3.698 -0.536 10.936 43 1HB SER 7 1HB SER 7 3.921 2.404 11.393 44 2HB SER 7 2HB SER 7 3.620 1.843 9.749 45 HG SER 7 HG SER 7 1.681 2.222 10.921 46 H GLY 8 H GLY 8 4.279 -0.026 8.573 47 1HA GLY 8 1HA GLY 8 6.603 0.929 7.585 48 2HA GLY 8 2HA GLY 8 7.095 -0.614 8.266 49 H ALA 9 H ALA 9 4.460 -1.823 7.632 50 HA ALA 9 HA ALA 9 4.037 -1.697 4.830 51 1HB ALA 9 1HB ALA 9 5.168 -4.350 5.436 52 2HB ALA 9 2HB ALA 9 6.325 -3.021 5.353 53 3HB ALA 9 3HB ALA 9 5.283 -3.372 3.973 54 H VAL 10 H VAL 10 2.971 -4.051 4.202 55 HA VAL 10 HA VAL 10 0.867 -4.408 6.228 56 HB VAL 10 HB VAL 10 0.742 -5.094 3.289 57 1HG1 VAL 10 1HG1 VAL 10 -1.520 -5.570 3.588 58 2HG1 VAL 10 2HG1 VAL 10 -1.584 -4.751 5.149 59 3HG1 VAL 10 3HG1 VAL 10 -0.752 -6.299 4.998 60 1HG2 VAL 10 1HG2 VAL 10 -0.266 -3.069 2.840 61 2HG2 VAL 10 2HG2 VAL 10 0.950 -2.602 4.029 62 3HG2 VAL 10 3HG2 VAL 10 -0.731 -2.807 4.521 63 H TYR 11 H TYR 11 1.284 -6.141 7.467 64 HA TYR 11 HA TYR 11 2.513 -8.510 6.255 65 1HB TYR 11 1HB TYR 11 3.559 -7.685 8.293 66 2HB TYR 11 2HB TYR 11 2.022 -7.751 9.145 67 HD1 TYR 11 HD1 TYR 11 5.036 -9.452 8.492 68 HD2 TYR 11 HD2 TYR 11 0.908 -10.129 9.270 69 HE1 TYR 11 HE1 TYR 11 5.556 -11.735 9.237 70 HE2 TYR 11 HE2 TYR 11 1.418 -12.416 10.014 71 HH TYR 11 HH TYR 11 3.127 -14.094 9.775 72 H VAL 12 H VAL 12 1.200 -10.051 5.529 73 HA VAL 12 HA VAL 12 -1.341 -10.506 6.949 74 HB VAL 12 HB VAL 12 -0.855 -10.946 3.998 75 1HG1 VAL 12 1HG1 VAL 12 -3.323 -11.200 5.710 76 2HG1 VAL 12 2HG1 VAL 12 -2.492 -12.485 4.833 77 3HG1 VAL 12 3HG1 VAL 12 -3.330 -11.212 3.945 78 1HG2 VAL 12 1HG2 VAL 12 -1.571 -8.576 5.490 79 2HG2 VAL 12 2HG2 VAL 12 -2.834 -9.024 4.344 80 3HG2 VAL 12 3HG2 VAL 12 -1.185 -8.757 3.779 81 H GLY 13 H GLY 13 -1.124 -12.297 8.128 82 1HA GLY 13 1HA GLY 13 -0.593 -14.444 8.746 83 2HA GLY 13 2HA GLY 13 -0.969 -14.840 7.078 84 H ASN 14 H ASN 14 0.570 -16.103 6.292 85 HA ASN 14 HA ASN 14 3.311 -15.847 7.218 86 1HB ASN 14 1HB ASN 14 1.697 -17.918 5.902 87 2HB ASN 14 2HB ASN 14 3.354 -17.820 5.316 88 1HD2 ASN 14 1HD2 ASN 14 1.983 -17.272 8.533 89 2HD2 ASN 14 2HD2 ASN 14 2.932 -18.474 9.332 90 H TYR 15 H TYR 15 1.809 -13.985 5.222 91 HA TYR 15 HA TYR 15 4.030 -13.840 3.289 92 1HB TYR 15 1HB TYR 15 1.067 -13.647 2.780 93 2HB TYR 15 2HB TYR 15 2.215 -12.851 1.716 94 HD1 TYR 15 HD1 TYR 15 0.209 -15.007 1.004 95 HD2 TYR 15 HD2 TYR 15 4.318 -15.205 2.066 96 HE1 TYR 15 HE1 TYR 15 0.425 -17.097 -0.262 97 HE2 TYR 15 HE2 TYR 15 4.545 -17.291 0.798 98 HH TYR 15 HH TYR 15 1.842 -19.032 -0.395 99 H LYS 16 H LYS 16 4.983 -11.865 3.282 100 HA LYS 16 HA LYS 16 3.475 -9.626 4.474 101 1HB LYS 16 1HB LYS 16 5.373 -10.364 5.865 102 2HB LYS 16 2HB LYS 16 6.464 -10.085 4.515 103 1HG LYS 16 1HG LYS 16 4.818 -7.772 5.220 104 2HG LYS 16 2HG LYS 16 5.922 -8.297 6.492 105 1HD LYS 16 1HD LYS 16 7.650 -8.381 4.517 106 2HD LYS 16 2HD LYS 16 6.521 -7.253 3.763 107 1HE LYS 16 1HE LYS 16 7.736 -5.704 4.854 108 2HE LYS 16 2HE LYS 16 6.727 -6.166 6.224 109 1HZ LYS 16 1HZ LYS 16 8.412 -7.466 7.123 110 2HZ LYS 16 2HZ LYS 16 9.240 -6.106 6.555 111 3HZ LYS 16 3HZ LYS 16 9.278 -7.547 5.671 112 H VAL 17 H VAL 17 2.883 -8.185 2.977 113 HA VAL 17 HA VAL 17 4.563 -7.884 0.599 114 HB VAL 17 HB VAL 17 2.747 -7.428 -0.637 115 1HG1 VAL 17 1HG1 VAL 17 2.122 -9.375 0.948 116 2HG1 VAL 17 2HG1 VAL 17 0.877 -8.654 -0.072 117 3HG1 VAL 17 3HG1 VAL 17 0.977 -8.222 1.635 118 1HG2 VAL 17 1HG2 VAL 17 2.425 -5.201 0.261 119 2HG2 VAL 17 2HG2 VAL 17 1.558 -5.861 1.648 120 3HG2 VAL 17 3HG2 VAL 17 0.868 -5.996 0.029 121 H VAL 18 H VAL 18 5.880 -6.233 0.409 122 HA VAL 18 HA VAL 18 5.280 -3.725 1.820 123 HB VAL 18 HB VAL 18 6.905 -4.994 3.171 124 1HG1 VAL 18 1HG1 VAL 18 8.974 -4.666 1.050 125 2HG1 VAL 18 2HG1 VAL 18 7.885 -6.053 0.983 126 3HG1 VAL 18 3HG1 VAL 18 8.911 -5.804 2.396 127 1HG2 VAL 18 1HG2 VAL 18 8.323 -3.210 3.612 128 2HG2 VAL 18 2HG2 VAL 18 6.946 -2.433 2.830 129 3HG2 VAL 18 3HG2 VAL 18 8.423 -2.741 1.914 130 H ASN 19 H ASN 19 6.530 -1.871 0.988 131 HA ASN 19 HA ASN 19 6.424 -1.692 -1.813 132 1HB ASN 19 1HB ASN 19 6.772 0.089 0.313 133 2HB ASN 19 2HB ASN 19 8.251 0.238 -0.632 134 1HD2 ASN 19 1HD2 ASN 19 7.850 2.235 -1.449 135 2HD2 ASN 19 2HD2 ASN 19 6.572 2.577 -2.560 136 H ARG 20 H ARG 20 8.006 -1.806 -3.394 137 HA ARG 20 HA ARG 20 10.091 -3.611 -3.054 138 1HB ARG 20 1HB ARG 20 8.952 -2.563 -5.211 139 2HB ARG 20 2HB ARG 20 10.354 -1.504 -5.148 140 1HG ARG 20 1HG ARG 20 10.972 -4.353 -4.859 141 2HG ARG 20 2HG ARG 20 10.270 -3.901 -6.414 142 1HD ARG 20 1HD ARG 20 12.091 -1.914 -6.050 143 2HD ARG 20 2HD ARG 20 12.901 -3.273 -5.269 144 HE ARG 20 HE ARG 20 11.852 -3.929 -7.853 145 1HH1 ARG 20 1HH1 ARG 20 14.555 -2.499 -6.171 146 2HH1 ARG 20 2HH1 ARG 20 15.681 -2.823 -7.446 147 1HH2 ARG 20 1HH2 ARG 20 13.332 -4.357 -9.530 148 2HH2 ARG 20 2HH2 ARG 20 14.987 -3.877 -9.353 149 H HIS 21 H HIS 21 10.200 -0.060 -3.108 150 HA HIS 21 HA HIS 21 13.009 0.075 -2.655 151 1HB HIS 21 1HB HIS 21 11.026 1.880 -3.370 152 2HB HIS 21 2HB HIS 21 11.513 2.415 -1.765 153 HD1 HIS 21 HD1 HIS 21 13.368 4.039 -1.801 154 HD2 HIS 21 HD2 HIS 21 13.506 1.476 -5.069 155 HE1 HIS 21 HE1 HIS 21 15.332 4.803 -3.172 156 HE2 HIS 21 HE2 HIS 21 15.457 3.174 -5.089 157 H LEU 22 H LEU 22 10.512 -0.851 -0.636 158 HA LEU 22 HA LEU 22 11.963 0.035 1.764 159 1HB LEU 22 1HB LEU 22 9.088 -0.851 1.550 160 2HB LEU 22 2HB LEU 22 9.882 -0.235 2.988 161 HG LEU 22 HG LEU 22 9.461 1.376 0.470 162 1HD1 LEU 22 1HD1 LEU 22 7.466 2.084 1.218 163 2HD1 LEU 22 2HD1 LEU 22 7.975 2.066 2.906 164 3HD1 LEU 22 3HD1 LEU 22 7.471 0.570 2.121 165 1HD2 LEU 22 1HD2 LEU 22 11.348 1.866 2.221 166 2HD2 LEU 22 2HD2 LEU 22 10.009 2.513 3.170 167 3HD2 LEU 22 3HD2 LEU 22 10.359 3.176 1.574 168 H ALA 23 H ALA 23 11.550 -2.663 -0.155 169 HA ALA 23 HA ALA 23 11.270 -4.623 1.917 170 1HB ALA 23 1HB ALA 23 11.217 -4.590 -0.929 171 2HB ALA 23 2HB ALA 23 10.720 -5.872 0.174 172 3HB ALA 23 3HB ALA 23 12.385 -5.800 -0.399 173 H THR 24 H THR 24 12.867 -6.090 2.624 174 HA THR 24 HA THR 24 15.580 -4.972 2.526 175 HB THR 24 HB THR 24 14.895 -5.149 4.774 176 HG1 THR 24 HG1 THR 24 16.310 -6.636 5.593 177 1HG2 THR 24 1HG2 THR 24 12.920 -6.496 4.576 178 2HG2 THR 24 2HG2 THR 24 13.997 -7.207 5.777 179 3HG2 THR 24 3HG2 THR 24 13.885 -7.914 4.166 180 H HIS 25 H HIS 25 17.368 -6.653 2.627 181 HA HIS 25 HA HIS 25 17.345 -8.236 0.349 182 1HB HIS 25 1HB HIS 25 19.340 -7.464 1.801 183 2HB HIS 25 2HB HIS 25 19.038 -8.920 2.744 184 HD1 HIS 25 HD1 HIS 25 19.234 -8.310 -1.016 185 HD2 HIS 25 HD2 HIS 25 20.816 -10.776 1.931 186 HE1 HIS 25 HE1 HIS 25 20.748 -9.916 -2.224 187 HE2 HIS 25 HE2 HIS 25 21.752 -11.349 -0.411 188 H VAL 26 H VAL 26 16.270 -8.927 3.577 189 HA VAL 26 HA VAL 26 16.104 -11.757 3.296 190 HB VAL 26 HB VAL 26 14.531 -10.029 5.206 191 1HG1 VAL 26 1HG1 VAL 26 15.471 -12.872 5.519 192 2HG1 VAL 26 2HG1 VAL 26 13.869 -12.429 4.930 193 3HG1 VAL 26 3HG1 VAL 26 14.364 -11.982 6.563 194 1HG2 VAL 26 1HG2 VAL 26 17.393 -10.741 5.141 195 2HG2 VAL 26 2HG2 VAL 26 16.579 -10.936 6.694 196 3HG2 VAL 26 3HG2 VAL 26 16.581 -9.367 5.889 197 H ASP 27 H ASP 27 13.969 -9.075 2.558 198 HA ASP 27 HA ASP 27 11.585 -10.577 2.307 199 1HB ASP 27 1HB ASP 27 12.490 -7.837 1.614 200 2HB ASP 27 2HB ASP 27 11.173 -8.473 0.632 201 H TRP 28 H TRP 28 14.083 -9.527 0.042 202 HA TRP 28 HA TRP 28 12.837 -10.761 -2.187 203 1HB TRP 28 1HB TRP 28 15.593 -9.613 -1.789 204 2HB TRP 28 2HB TRP 28 15.083 -10.345 -3.309 205 HD1 TRP 28 HD1 TRP 28 12.873 -9.131 -4.503 206 HE1 TRP 28 HE1 TRP 28 12.227 -6.640 -4.544 207 HE3 TRP 28 HE3 TRP 28 15.738 -7.490 -0.611 208 HZ2 TRP 28 HZ2 TRP 28 12.823 -4.297 -3.085 209 HZ3 TRP 28 HZ3 TRP 28 15.650 -5.113 -0.002 210 HH2 TRP 28 HH2 TRP 28 14.230 -3.546 -1.220 211 H GLN 29 H GLN 29 15.286 -11.710 0.125 212 HA GLN 29 HA GLN 29 16.318 -13.962 -1.153 213 1HB GLN 29 1HB GLN 29 16.187 -12.950 1.602 214 2HB GLN 29 2HB GLN 29 16.305 -14.701 1.492 215 1HG GLN 29 1HG GLN 29 18.170 -13.516 -0.316 216 2HG GLN 29 2HG GLN 29 18.365 -12.800 1.283 217 1HE2 GLN 29 1HE2 GLN 29 19.822 -14.880 -0.479 218 2HE2 GLN 29 2HE2 GLN 29 20.187 -16.145 0.639 219 H ASN 30 H ASN 30 13.397 -13.549 0.767 220 HA ASN 30 HA ASN 30 12.584 -16.278 0.002 221 1HB ASN 30 1HB ASN 30 12.103 -14.730 2.538 222 2HB ASN 30 2HB ASN 30 11.042 -16.053 2.067 223 1HD2 ASN 30 1HD2 ASN 30 12.026 -18.153 1.736 224 2HD2 ASN 30 2HD2 ASN 30 13.414 -18.590 2.667 225 H CYS 31 H CYS 31 12.222 -13.718 -1.436 226 HA CYS 31 HA CYS 31 9.489 -12.933 -1.152 227 1HB CYS 31 1HB CYS 31 10.951 -11.286 -2.036 228 2HB CYS 31 2HB CYS 31 11.598 -12.391 -3.241 229 HG CYS 31 HG CYS 31 8.872 -12.135 -4.084 230 H VAL 32 H VAL 32 7.758 -13.941 -1.883 231 HA VAL 32 HA VAL 32 8.036 -16.197 -3.684 232 HB VAL 32 HB VAL 32 5.554 -16.449 -3.310 233 1HG1 VAL 32 1HG1 VAL 32 6.876 -17.857 -2.010 234 2HG1 VAL 32 2HG1 VAL 32 5.853 -17.039 -0.827 235 3HG1 VAL 32 3HG1 VAL 32 7.526 -16.523 -1.054 236 1HG2 VAL 32 1HG2 VAL 32 4.465 -15.187 -1.602 237 2HG2 VAL 32 2HG2 VAL 32 5.185 -14.042 -2.732 238 3HG2 VAL 32 3HG2 VAL 32 5.964 -14.362 -1.182 239 H TRP 33 H TRP 33 6.541 -12.990 -3.625 240 HA TRP 33 HA TRP 33 6.368 -13.101 -6.547 241 1HB TRP 33 1HB TRP 33 4.143 -13.544 -6.223 242 2HB TRP 33 2HB TRP 33 4.104 -12.755 -4.652 243 HD1 TRP 33 HD1 TRP 33 3.309 -12.164 -8.279 244 HE1 TRP 33 HE1 TRP 33 2.386 -9.777 -8.576 245 HE3 TRP 33 HE3 TRP 33 4.400 -10.303 -3.662 246 HZ2 TRP 33 HZ2 TRP 33 2.159 -7.404 -7.030 247 HZ3 TRP 33 HZ3 TRP 33 3.810 -7.974 -3.146 248 HH2 TRP 33 HH2 TRP 33 2.715 -6.560 -4.805 249 H GLU 34 H GLU 34 6.350 -11.050 -7.591 250 HA GLU 34 HA GLU 34 6.670 -8.643 -6.034 251 1HB GLU 34 1HB GLU 34 8.929 -9.580 -5.903 252 2HB GLU 34 2HB GLU 34 8.988 -9.714 -7.655 253 1HG GLU 34 1HG GLU 34 8.346 -7.037 -7.070 254 2HG GLU 34 2HG GLU 34 9.659 -7.497 -5.988 255 H ASP 35 H ASP 35 5.629 -7.109 -7.124 256 HA ASP 35 HA ASP 35 5.403 -7.369 -10.045 257 1HB ASP 35 1HB ASP 35 3.575 -6.378 -7.927 258 2HB ASP 35 2HB ASP 35 3.526 -5.537 -9.473 259 H TYR 36 H TYR 36 6.653 -6.075 -11.195 260 HA TYR 36 HA TYR 36 8.070 -3.883 -10.098 261 1HB TYR 36 1HB TYR 36 8.590 -3.410 -12.565 262 2HB TYR 36 2HB TYR 36 9.122 -4.954 -11.909 263 HD1 TYR 36 HD1 TYR 36 6.448 -3.356 -13.929 264 HD2 TYR 36 HD2 TYR 36 8.423 -6.975 -12.883 265 HE1 TYR 36 HE1 TYR 36 5.246 -4.525 -15.728 266 HE2 TYR 36 HE2 TYR 36 7.228 -8.154 -14.680 267 HH TYR 36 HH TYR 36 4.747 -7.544 -15.948 268 H ASN 37 H ASN 37 5.109 -4.139 -11.990 269 HA ASN 37 HA ASN 37 4.835 -1.341 -12.444 270 1HB ASN 37 1HB ASN 37 3.311 -3.772 -13.019 271 2HB ASN 37 2HB ASN 37 2.286 -2.391 -12.640 272 1HD2 ASN 37 1HD2 ASN 37 3.310 -3.993 -15.135 273 2HD2 ASN 37 2HD2 ASN 37 3.584 -2.734 -16.285 274 H ARG 38 H ARG 38 4.368 -3.304 -9.713 275 HA ARG 38 HA ARG 38 2.638 -1.254 -8.494 276 1HB ARG 38 1HB ARG 38 2.732 -4.214 -8.219 277 2HB ARG 38 2HB ARG 38 2.338 -3.280 -6.783 278 1HG ARG 38 1HG ARG 38 0.395 -2.401 -7.746 279 2HG ARG 38 2HG ARG 38 0.892 -2.865 -9.376 280 1HD ARG 38 1HD ARG 38 0.867 -5.277 -8.163 281 2HD ARG 38 2HD ARG 38 -0.403 -4.454 -7.259 282 HE ARG 38 HE ARG 38 -1.739 -4.704 -9.080 283 1HH1 ARG 38 1HH1 ARG 38 1.578 -4.749 -10.164 284 2HH1 ARG 38 2HH1 ARG 38 1.164 -5.050 -11.819 285 1HH2 ARG 38 1HH2 ARG 38 -2.285 -5.099 -11.256 286 2HH2 ARG 38 2HH2 ARG 38 -1.028 -5.247 -12.439 287 H ASP 39 H ASP 39 5.777 -2.320 -8.598 288 HA ASP 39 HA ASP 39 7.580 -2.214 -7.193 289 1HB ASP 39 1HB ASP 39 5.955 0.232 -6.617 290 2HB ASP 39 2HB ASP 39 7.362 -0.103 -5.611 291 H LEU 40 H LEU 40 5.710 -4.055 -6.366 292 HA LEU 40 HA LEU 40 6.034 -3.949 -3.449 293 1HB LEU 40 1HB LEU 40 3.741 -3.300 -3.979 294 2HB LEU 40 2HB LEU 40 3.536 -4.747 -4.946 295 HG LEU 40 HG LEU 40 3.949 -6.064 -2.807 296 1HD1 LEU 40 1HD1 LEU 40 4.183 -5.055 -0.822 297 2HD1 LEU 40 2HD1 LEU 40 3.011 -3.796 -1.209 298 3HD1 LEU 40 3HD1 LEU 40 4.675 -3.656 -1.775 299 1HD2 LEU 40 1HD2 LEU 40 1.707 -6.208 -2.502 300 2HD2 LEU 40 2HD2 LEU 40 1.689 -5.248 -3.983 301 3HD2 LEU 40 3HD2 LEU 40 1.495 -4.458 -2.417 302 H LEU 41 H LEU 41 6.155 -6.007 -2.421 303 HA LEU 41 HA LEU 41 6.229 -8.358 -4.111 304 1HB LEU 41 1HB LEU 41 8.464 -9.065 -3.314 305 2HB LEU 41 2HB LEU 41 8.487 -7.688 -4.387 306 HG LEU 41 HG LEU 41 9.609 -7.974 -1.735 307 1HD1 LEU 41 1HD1 LEU 41 9.859 -5.524 -3.389 308 2HD1 LEU 41 2HD1 LEU 41 10.466 -7.050 -4.028 309 3HD1 LEU 41 3HD1 LEU 41 11.084 -6.427 -2.498 310 1HD2 LEU 41 1HD2 LEU 41 7.991 -5.467 -2.129 311 2HD2 LEU 41 2HD2 LEU 41 8.991 -5.896 -0.745 312 3HD2 LEU 41 3HD2 LEU 41 7.508 -6.783 -1.067 313 H VAL 42 H VAL 42 6.137 -10.340 -2.989 314 HA VAL 42 HA VAL 42 5.299 -10.035 -0.182 315 HB VAL 42 HB VAL 42 4.278 -11.908 -2.318 316 1HG1 VAL 42 1HG1 VAL 42 3.013 -13.127 -0.664 317 2HG1 VAL 42 2HG1 VAL 42 3.651 -12.111 0.628 318 3HG1 VAL 42 3HG1 VAL 42 4.721 -13.209 -0.237 319 1HG2 VAL 42 1HG2 VAL 42 3.320 -9.505 -1.056 320 2HG2 VAL 42 2HG2 VAL 42 2.191 -10.837 -0.797 321 3HG2 VAL 42 3HG2 VAL 42 2.666 -10.387 -2.435 322 H SER 43 H SER 43 6.420 -11.050 1.289 323 HA SER 43 HA SER 43 8.208 -13.241 0.472 324 1HB SER 43 1HB SER 43 9.874 -12.478 1.917 325 2HB SER 43 2HB SER 43 9.216 -10.968 1.290 326 HG SER 43 HG SER 43 7.812 -11.059 3.235 327 H THR 44 H THR 44 8.560 -14.894 2.124 328 HA THR 44 HA THR 44 6.110 -15.295 3.659 329 HB THR 44 HB THR 44 6.615 -17.619 3.655 330 HG1 THR 44 HG1 THR 44 8.603 -18.394 2.894 331 1HG2 THR 44 1HG2 THR 44 6.119 -16.307 1.390 332 2HG2 THR 44 2HG2 THR 44 6.308 -18.062 1.479 333 3HG2 THR 44 3HG2 THR 44 7.662 -17.055 0.966 334 H THR 45 H THR 45 6.029 -15.636 5.805 335 HA THR 45 HA THR 45 8.529 -15.499 7.334 336 HB THR 45 HB THR 45 7.862 -13.275 7.511 337 HG1 THR 45 HG1 THR 45 6.420 -14.435 9.650 338 1HG2 THR 45 1HG2 THR 45 5.474 -13.909 6.522 339 2HG2 THR 45 2HG2 THR 45 5.786 -12.394 7.365 340 3HG2 THR 45 3HG2 THR 45 5.030 -13.737 8.219 341 H THR 46 H THR 46 8.100 -15.991 9.708 342 HA THR 46 HA THR 46 6.011 -18.058 9.931 343 HB THR 46 HB THR 46 7.594 -19.216 11.522 344 HG1 THR 46 HG1 THR 46 8.940 -17.279 11.751 345 1HG2 THR 46 1HG2 THR 46 9.069 -20.158 9.805 346 2HG2 THR 46 2HG2 THR 46 8.544 -18.898 8.687 347 3HG2 THR 46 3HG2 THR 46 7.384 -20.085 9.284 348 H ALA 47 H ALA 47 4.992 -15.859 10.665 349 HA ALA 47 HA ALA 47 5.022 -15.909 13.583 350 1HB ALA 47 1HB ALA 47 5.561 -13.455 11.931 351 2HB ALA 47 2HB ALA 47 6.545 -14.141 13.225 352 3HB ALA 47 3HB ALA 47 5.000 -13.378 13.601 353 H HIS 48 H HIS 48 3.204 -14.487 14.459 354 HA HIS 48 HA HIS 48 0.801 -15.138 12.972 355 1HB HIS 48 1HB HIS 48 1.445 -14.382 15.770 356 2HB HIS 48 2HB HIS 48 -0.153 -13.938 15.178 357 HD1 HIS 48 HD1 HIS 48 -1.023 -15.689 16.995 358 HD2 HIS 48 HD2 HIS 48 1.086 -17.293 13.795 359 HE1 HIS 48 HE1 HIS 48 -1.539 -18.150 17.015 360 HE2 HIS 48 HE2 HIS 48 -0.319 -19.086 15.019 361 H GLY 49 H GLY 49 -0.375 -13.749 11.813 362 1HA GLY 49 1HA GLY 49 0.522 -10.989 11.628 363 2HA GLY 49 2HA GLY 49 -0.647 -11.779 10.580 364 H CYS 50 H CYS 50 -1.450 -9.417 11.140 365 HA CYS 50 HA CYS 50 -3.581 -9.797 13.099 366 1HB CYS 50 1HB CYS 50 -1.732 -7.403 13.093 367 2HB CYS 50 2HB CYS 50 -3.209 -7.533 14.043 368 HG CYS 50 HG CYS 50 -1.166 -8.169 15.536 369 H ASP 51 H ASP 51 -2.182 -7.632 10.656 370 HA ASP 51 HA ASP 51 -4.557 -6.224 10.092 371 1HB ASP 51 1HB ASP 51 -2.204 -6.729 8.258 372 2HB ASP 51 2HB ASP 51 -3.417 -5.466 8.067 373 H THR 52 H THR 52 -6.183 -6.555 8.658 374 HA THR 52 HA THR 52 -6.142 -9.081 7.139 375 HB THR 52 HB THR 52 -8.521 -7.794 8.498 376 HG1 THR 52 HG1 THR 52 -8.319 -9.325 10.004 377 1HG2 THR 52 1HG2 THR 52 -8.336 -10.416 7.037 378 2HG2 THR 52 2HG2 THR 52 -9.202 -8.980 6.491 379 3HG2 THR 52 3HG2 THR 52 -9.729 -9.828 7.944 380 H ILE 53 H ILE 53 -6.259 -8.779 5.016 381 HA ILE 53 HA ILE 53 -6.816 -6.200 3.912 382 HB ILE 53 HB ILE 53 -6.782 -8.616 2.177 383 1HG1 ILE 53 1HG1 ILE 53 -4.703 -8.030 4.086 384 2HG1 ILE 53 2HG1 ILE 53 -4.812 -9.355 2.934 385 1HG2 ILE 53 1HG2 ILE 53 -5.612 -5.853 1.915 386 2HG2 ILE 53 2HG2 ILE 53 -7.117 -6.426 1.198 387 3HG2 ILE 53 3HG2 ILE 53 -5.579 -7.105 0.673 388 1HD1 ILE 53 1HD1 ILE 53 -3.875 -7.779 1.213 389 2HD1 ILE 53 2HD1 ILE 53 -2.780 -8.239 2.514 390 3HD1 ILE 53 3HD1 ILE 53 -3.558 -6.657 2.536 391 H ALA 54 H ALA 54 -8.571 -5.472 2.831 392 HA ALA 54 HA ALA 54 -11.014 -7.046 3.136 393 1HB ALA 54 1HB ALA 54 -11.926 -5.099 3.673 394 2HB ALA 54 2HB ALA 54 -11.550 -4.466 2.071 395 3HB ALA 54 3HB ALA 54 -10.387 -4.290 3.383 396 H ARG 55 H ARG 55 -11.885 -8.089 1.475 397 HA ARG 55 HA ARG 55 -10.860 -7.610 -1.210 398 1HB ARG 55 1HB ARG 55 -11.495 -9.911 0.127 399 2HB ARG 55 2HB ARG 55 -12.932 -9.668 -0.855 400 1HG ARG 55 1HG ARG 55 -10.419 -9.317 -2.310 401 2HG ARG 55 2HG ARG 55 -10.669 -10.941 -1.666 402 1HD ARG 55 1HD ARG 55 -13.007 -10.787 -2.697 403 2HD ARG 55 2HD ARG 55 -12.386 -9.398 -3.589 404 HE ARG 55 HE ARG 55 -10.676 -11.649 -3.870 405 1HH1 ARG 55 1HH1 ARG 55 -13.707 -10.322 -4.980 406 2HH1 ARG 55 2HH1 ARG 55 -13.662 -11.158 -6.494 407 1HH2 ARG 55 1HH2 ARG 55 -10.616 -12.750 -5.864 408 2HH2 ARG 55 2HH2 ARG 55 -11.909 -12.537 -6.997 409 H CYS 56 H CYS 56 -12.483 -5.574 -0.110 410 HA CYS 56 HA CYS 56 -15.037 -5.841 -1.513 411 1HB CYS 56 1HB CYS 56 -15.658 -3.769 -0.290 412 2HB CYS 56 2HB CYS 56 -15.217 -5.093 0.782 413 H GLN 57 H GLN 57 -15.818 -3.818 -2.637 414 HA GLN 57 HA GLN 57 -13.589 -2.584 -4.119 415 1HB GLN 57 1HB GLN 57 -15.280 -2.396 -6.013 416 2HB GLN 57 2HB GLN 57 -14.672 -4.007 -5.654 417 1HG GLN 57 1HG GLN 57 -16.724 -4.423 -4.322 418 2HG GLN 57 2HG GLN 57 -17.335 -2.858 -4.859 419 1HE2 GLN 57 1HE2 GLN 57 -16.911 -2.668 -7.404 420 2HE2 GLN 57 2HE2 GLN 57 -17.594 -3.977 -8.302 421 H CYS 58 H CYS 58 -14.811 -1.533 -1.715 422 HA CYS 58 HA CYS 58 -16.724 0.457 -2.275 423 1HB CYS 58 1HB CYS 58 -14.606 0.566 -0.120 424 2HB CYS 58 2HB CYS 58 -16.145 1.418 -0.136 425 H THR 59 H THR 59 -16.545 2.603 -2.822 426 HA THR 59 HA THR 59 -14.089 3.358 -4.164 427 HB THR 59 HB THR 59 -16.426 5.202 -3.900 428 HG1 THR 59 HG1 THR 59 -16.354 2.840 -5.455 429 1HG2 THR 59 1HG2 THR 59 -14.337 4.649 -5.945 430 2HG2 THR 59 2HG2 THR 59 -14.871 6.185 -5.263 431 3HG2 THR 59 3HG2 THR 59 -15.882 5.342 -6.437 432 H THR 60 H THR 60 -14.956 3.441 -1.042 433 HA THR 60 HA THR 60 -13.493 5.946 -0.555 434 HB THR 60 HB THR 60 -14.868 6.407 1.360 435 HG1 THR 60 HG1 THR 60 -15.710 4.770 2.336 436 1HG2 THR 60 1HG2 THR 60 -17.210 6.388 0.347 437 2HG2 THR 60 2HG2 THR 60 -16.438 5.725 -1.094 438 3HG2 THR 60 3HG2 THR 60 -15.959 7.309 -0.483 439 H GLY 61 H GLY 61 -12.563 6.015 1.694 440 1HA GLY 61 1HA GLY 61 -12.073 3.692 3.199 441 2HA GLY 61 2HA GLY 61 -10.755 3.900 2.050 442 H VAL 62 H VAL 62 -9.668 4.043 4.305 443 HA VAL 62 HA VAL 62 -9.374 6.897 4.883 444 HB VAL 62 HB VAL 62 -10.893 6.059 6.606 445 1HG1 VAL 62 1HG1 VAL 62 -8.707 4.251 7.588 446 2HG1 VAL 62 2HG1 VAL 62 -9.943 3.690 6.461 447 3HG1 VAL 62 3HG1 VAL 62 -10.408 4.285 8.055 448 1HG2 VAL 62 1HG2 VAL 62 -8.898 6.352 8.516 449 2HG2 VAL 62 2HG2 VAL 62 -9.872 7.635 7.797 450 3HG2 VAL 62 3HG2 VAL 62 -8.297 7.232 7.111 451 H TYR 63 H TYR 63 -7.313 7.489 4.879 452 HA TYR 63 HA TYR 63 -5.266 5.400 5.191 453 1HB TYR 63 1HB TYR 63 -3.826 6.671 3.773 454 2HB TYR 63 2HB TYR 63 -5.395 6.612 2.981 455 HD1 TYR 63 HD1 TYR 63 -3.323 8.787 5.189 456 HD2 TYR 63 HD2 TYR 63 -6.384 8.593 2.237 457 HE1 TYR 63 HE1 TYR 63 -3.310 11.240 5.023 458 HE2 TYR 63 HE2 TYR 63 -6.376 11.046 2.065 459 HH TYR 63 HH TYR 63 -5.155 13.042 4.262 460 H PHE 64 H PHE 64 -3.657 5.623 6.670 461 HA PHE 64 HA PHE 64 -4.080 7.424 8.833 462 1HB PHE 64 1HB PHE 64 -2.650 5.041 8.419 463 2HB PHE 64 2HB PHE 64 -1.440 6.243 8.854 464 HD1 PHE 64 HD1 PHE 64 -4.141 4.165 10.022 465 HD2 PHE 64 HD2 PHE 64 -1.662 7.481 11.004 466 HE1 PHE 64 HE1 PHE 64 -4.750 3.915 12.392 467 HE2 PHE 64 HE2 PHE 64 -2.266 7.237 13.377 468 HZ PHE 64 HZ PHE 64 -3.813 5.451 14.072 469 H CYS 65 H CYS 65 -2.850 9.167 9.522 470 HA CYS 65 HA CYS 65 -1.095 10.340 7.466 471 1HB CYS 65 1HB CYS 65 -3.372 11.448 8.276 472 2HB CYS 65 2HB CYS 65 -2.343 12.037 9.577 473 HG CYS 65 HG CYS 65 -1.346 13.677 8.050 474 H ALA 66 H ALA 66 0.782 11.454 8.145 475 HA ALA 66 HA ALA 66 1.905 10.386 10.614 476 1HB ALA 66 1HB ALA 66 3.383 12.057 8.606 477 2HB ALA 66 2HB ALA 66 3.080 10.339 8.344 478 3HB ALA 66 3HB ALA 66 4.022 10.865 9.738 479 H SER 67 H SER 67 1.370 13.528 9.048 480 HA SER 67 HA SER 67 2.413 15.056 11.211 481 1HB SER 67 1HB SER 67 0.991 15.617 8.671 482 2HB SER 67 2HB SER 67 0.829 16.835 9.936 483 HG SER 67 HG SER 67 3.095 16.956 10.024 484 H LYS 68 H LYS 68 -0.837 14.060 10.246 485 HA LYS 68 HA LYS 68 -2.044 15.427 12.500 486 1HB LYS 68 1HB LYS 68 -2.954 14.273 10.006 487 2HB LYS 68 2HB LYS 68 -3.957 13.755 11.352 488 1HG LYS 68 1HG LYS 68 -5.041 15.665 10.750 489 2HG LYS 68 2HG LYS 68 -3.919 16.312 11.948 490 1HD LYS 68 1HD LYS 68 -2.615 16.273 9.424 491 2HD LYS 68 2HD LYS 68 -4.204 17.009 9.216 492 1HE LYS 68 1HE LYS 68 -2.830 18.811 9.767 493 2HE LYS 68 2HE LYS 68 -3.613 18.397 11.291 494 1HZ LYS 68 1HZ LYS 68 -1.368 16.871 11.298 495 2HZ LYS 68 2HZ LYS 68 -1.558 18.341 12.111 496 3HZ LYS 68 3HZ LYS 68 -0.835 18.309 10.583 497 H SER 69 H SER 69 -0.993 12.225 11.634 498 HA SER 69 HA SER 69 -0.889 10.265 12.781 499 1HB SER 69 1HB SER 69 -0.335 10.380 15.051 500 2HB SER 69 2HB SER 69 0.126 11.975 14.456 501 HG SER 69 HG SER 69 -1.773 12.808 15.309 502 H LYS 70 H LYS 70 -3.423 11.027 11.760 503 HA LYS 70 HA LYS 70 -5.128 9.461 13.550 504 1HB LYS 70 1HB LYS 70 -7.023 11.003 13.175 505 2HB LYS 70 2HB LYS 70 -5.705 11.768 14.047 506 1HG LYS 70 1HG LYS 70 -5.118 12.356 11.455 507 2HG LYS 70 2HG LYS 70 -6.882 12.403 11.477 508 1HD LYS 70 1HD LYS 70 -5.211 13.806 13.543 509 2HD LYS 70 2HD LYS 70 -5.673 14.574 12.025 510 1HE LYS 70 1HE LYS 70 -7.890 14.688 12.594 511 2HE LYS 70 2HE LYS 70 -7.796 13.292 13.667 512 1HZ LYS 70 1HZ LYS 70 -7.876 15.861 14.474 513 2HZ LYS 70 2HZ LYS 70 -6.216 15.541 14.531 514 3HZ LYS 70 3HZ LYS 70 -7.293 14.575 15.406 515 H HIS 71 H HIS 71 -7.224 8.873 12.407 516 HA HIS 71 HA HIS 71 -6.526 7.800 9.806 517 1HB HIS 71 1HB HIS 71 -8.437 7.174 11.916 518 2HB HIS 71 2HB HIS 71 -9.177 7.120 10.319 519 HD1 HIS 71 HD1 HIS 71 -8.495 4.642 12.250 520 HD2 HIS 71 HD2 HIS 71 -6.409 5.823 8.857 521 HE1 HIS 71 HE1 HIS 71 -7.281 2.586 11.458 522 HE2 HIS 71 HE2 HIS 71 -6.096 3.304 9.354 523 H TYR 72 H TYR 72 -6.948 8.834 7.972 524 HA TYR 72 HA TYR 72 -9.032 10.909 7.984 525 1HB TYR 72 1HB TYR 72 -6.382 10.662 6.712 526 2HB TYR 72 2HB TYR 72 -7.637 11.355 5.693 527 HD1 TYR 72 HD1 TYR 72 -7.448 13.638 5.596 528 HD2 TYR 72 HD2 TYR 72 -6.768 11.693 9.318 529 HE1 TYR 72 HE1 TYR 72 -7.115 15.825 6.665 530 HE2 TYR 72 HE2 TYR 72 -6.434 13.873 10.406 531 HH TYR 72 HH TYR 72 -6.088 16.787 8.612 532 HA PRO 73 HA PRO 73 -11.134 8.020 5.214 533 1HB PRO 73 1HB PRO 73 -13.425 9.792 5.407 534 2HB PRO 73 2HB PRO 73 -13.239 8.158 6.047 535 1HG PRO 73 1HG PRO 73 -13.410 10.363 7.632 536 2HG PRO 73 2HG PRO 73 -12.523 8.897 8.092 537 1HD PRO 73 1HD PRO 73 -11.469 11.476 6.977 538 2HD PRO 73 2HD PRO 73 -10.826 10.469 8.295 539 H VAL 74 H VAL 74 -10.722 8.165 3.095 540 HA VAL 74 HA VAL 74 -11.409 10.659 1.700 541 HB VAL 74 HB VAL 74 -8.824 9.119 1.469 542 1HG1 VAL 74 1HG1 VAL 74 -8.240 10.739 -0.327 543 2HG1 VAL 74 2HG1 VAL 74 -9.939 11.217 -0.371 544 3HG1 VAL 74 3HG1 VAL 74 -9.476 9.560 -0.772 545 1HG2 VAL 74 1HG2 VAL 74 -9.648 11.685 2.626 546 2HG2 VAL 74 2HG2 VAL 74 -8.188 11.747 1.638 547 3HG2 VAL 74 3HG2 VAL 74 -8.274 10.649 3.016 548 H SER 75 H SER 75 -12.223 10.448 -0.333 549 HA SER 75 HA SER 75 -12.977 7.750 -1.156 550 1HB SER 75 1HB SER 75 -13.814 10.401 -2.361 551 2HB SER 75 2HB SER 75 -14.546 8.825 -2.663 552 HG SER 75 HG SER 75 -15.034 10.581 -0.673 553 H PHE 76 H PHE 76 -11.810 6.701 -2.644 554 HA PHE 76 HA PHE 76 -10.263 8.316 -4.559 555 1HB PHE 76 1HB PHE 76 -8.916 5.838 -4.141 556 2HB PHE 76 2HB PHE 76 -8.337 7.466 -3.820 557 HD1 PHE 76 HD1 PHE 76 -10.678 5.008 -2.254 558 HD2 PHE 76 HD2 PHE 76 -7.553 7.845 -1.713 559 HE1 PHE 76 HE1 PHE 76 -10.656 4.519 0.157 560 HE2 PHE 76 HE2 PHE 76 -7.526 7.363 0.698 561 HZ PHE 76 HZ PHE 76 -9.081 5.699 1.637 562 H GLU 77 H GLU 77 -9.526 7.098 -6.449 563 HA GLU 77 HA GLU 77 -11.578 5.189 -7.350 564 1HB GLU 77 1HB GLU 77 -9.966 7.248 -8.863 565 2HB GLU 77 2HB GLU 77 -10.834 5.950 -9.672 566 1HG GLU 77 1HG GLU 77 -12.829 6.910 -8.196 567 2HG GLU 77 2HG GLU 77 -11.860 8.376 -8.331 568 H GLY 78 H GLY 78 -10.776 3.495 -8.849 569 1HA GLY 78 1HA GLY 78 -8.006 2.776 -8.133 570 2HA GLY 78 2HA GLY 78 -9.284 1.613 -8.424 571 HA PRO 79 HA PRO 79 -8.055 3.274 -12.799 572 1HB PRO 79 1HB PRO 79 -5.542 4.721 -12.349 573 2HB PRO 79 2HB PRO 79 -6.969 5.217 -13.261 574 1HG PRO 79 1HG PRO 79 -6.294 6.348 -10.908 575 2HG PRO 79 2HG PRO 79 -7.979 6.159 -11.426 576 1HD PRO 79 1HD PRO 79 -6.405 4.542 -9.467 577 2HD PRO 79 2HD PRO 79 -8.097 5.058 -9.407 578 H GLY 80 H GLY 80 -6.950 1.935 -14.124 579 1HA GLY 80 1HA GLY 80 -5.436 -0.167 -13.091 580 2HA GLY 80 2HA GLY 80 -5.526 0.268 -14.791 581 H LEU 81 H LEU 81 -3.918 1.564 -15.703 582 HA LEU 81 HA LEU 81 -1.429 1.555 -14.186 583 1HB LEU 81 1HB LEU 81 -1.915 0.800 -16.710 584 2HB LEU 81 2HB LEU 81 -1.444 2.468 -16.985 585 HG LEU 81 HG LEU 81 0.564 1.361 -17.187 586 1HD1 LEU 81 1HD1 LEU 81 1.890 1.775 -15.154 587 2HD1 LEU 81 2HD1 LEU 81 0.395 2.087 -14.278 588 3HD1 LEU 81 3HD1 LEU 81 0.872 3.140 -15.609 589 1HD2 LEU 81 1HD2 LEU 81 -0.545 -0.495 -15.151 590 2HD2 LEU 81 2HD2 LEU 81 1.204 -0.384 -15.343 591 3HD2 LEU 81 3HD2 LEU 81 0.193 -0.845 -16.713 592 H VAL 82 H VAL 82 -0.734 3.292 -13.186 593 HA VAL 82 HA VAL 82 -1.439 5.938 -14.275 594 HB VAL 82 HB VAL 82 -1.102 5.247 -11.341 595 1HG1 VAL 82 1HG1 VAL 82 -1.868 7.551 -10.956 596 2HG1 VAL 82 2HG1 VAL 82 -1.857 7.837 -12.695 597 3HG1 VAL 82 3HG1 VAL 82 -0.348 7.501 -11.848 598 1HG2 VAL 82 1HG2 VAL 82 -3.187 4.357 -12.174 599 2HG2 VAL 82 2HG2 VAL 82 -3.570 5.889 -12.957 600 3HG2 VAL 82 3HG2 VAL 82 -3.519 5.788 -11.197 601 H GLU 83 H GLU 83 0.284 7.067 -14.902 602 HA GLU 83 HA GLU 83 2.924 6.107 -14.425 603 1HB GLU 83 1HB GLU 83 1.685 7.867 -16.240 604 2HB GLU 83 2HB GLU 83 2.884 8.827 -15.386 605 1HG GLU 83 1HG GLU 83 4.630 7.303 -16.015 606 2HG GLU 83 2HG GLU 83 3.459 6.204 -16.743 607 H VAL 84 H VAL 84 3.803 6.266 -12.471 608 HA VAL 84 HA VAL 84 3.155 8.380 -10.647 609 HB VAL 84 HB VAL 84 5.147 6.118 -10.556 610 1HG1 VAL 84 1HG1 VAL 84 5.176 6.965 -8.017 611 2HG1 VAL 84 2HG1 VAL 84 4.984 8.517 -8.834 612 3HG1 VAL 84 3HG1 VAL 84 6.361 7.485 -9.217 613 1HG2 VAL 84 1HG2 VAL 84 2.659 5.748 -10.227 614 2HG2 VAL 84 2HG2 VAL 84 2.825 6.663 -8.728 615 3HG2 VAL 84 3HG2 VAL 84 3.719 5.159 -8.945 616 H GLN 85 H GLN 85 3.932 10.362 -10.845 617 HA GLN 85 HA GLN 85 6.240 11.005 -12.400 618 1HB GLN 85 1HB GLN 85 4.272 12.517 -12.111 619 2HB GLN 85 2HB GLN 85 4.743 12.752 -10.434 620 1HG GLN 85 1HG GLN 85 6.221 14.306 -10.984 621 2HG GLN 85 2HG GLN 85 6.955 13.270 -12.207 622 1HE2 GLN 85 1HE2 GLN 85 7.053 14.315 -14.055 623 2HE2 GLN 85 2HE2 GLN 85 5.805 15.293 -14.742 624 H GLU 86 H GLU 86 8.243 11.864 -11.646 625 HA GLU 86 HA GLU 86 9.241 10.554 -9.343 626 1HB GLU 86 1HB GLU 86 11.322 11.768 -9.779 627 2HB GLU 86 2HB GLU 86 10.671 11.087 -11.264 628 1HG GLU 86 1HG GLU 86 10.968 13.101 -12.144 629 2HG GLU 86 2HG GLU 86 9.560 13.596 -11.204 630 H SER 87 H SER 87 8.366 11.108 -7.447 631 HA SER 87 HA SER 87 8.847 13.821 -6.482 632 1HB SER 87 1HB SER 87 6.358 13.257 -7.374 633 2HB SER 87 2HB SER 87 6.214 12.705 -5.705 634 HG SER 87 HG SER 87 7.076 15.276 -6.551 635 H GLU 88 H GLU 88 8.153 13.889 -4.048 636 HA GLU 88 HA GLU 88 8.882 13.252 -1.976 637 1HB GLU 88 1HB GLU 88 6.634 12.062 -2.505 638 2HB GLU 88 2HB GLU 88 7.602 10.600 -2.569 639 1HG GLU 88 1HG GLU 88 6.700 10.755 -0.388 640 2HG GLU 88 2HG GLU 88 8.419 11.133 -0.270 641 H TYR 89 H TYR 89 9.007 9.943 -3.205 642 HA TYR 89 HA TYR 89 11.904 9.956 -3.283 643 1HB TYR 89 1HB TYR 89 11.862 7.868 -1.739 644 2HB TYR 89 2HB TYR 89 11.789 9.466 -1.003 645 HD1 TYR 89 HD1 TYR 89 10.424 9.490 0.849 646 HD2 TYR 89 HD2 TYR 89 9.251 7.159 -2.513 647 HE1 TYR 89 HE1 TYR 89 8.350 8.864 2.012 648 HE2 TYR 89 HE2 TYR 89 7.174 6.530 -1.360 649 HH TYR 89 HH TYR 89 6.300 6.373 0.907 650 H TYR 90 H TYR 90 9.516 9.444 -5.037 651 HA TYR 90 HA TYR 90 10.200 6.702 -5.865 652 1HB TYR 90 1HB TYR 90 7.655 7.921 -5.351 653 2HB TYR 90 2HB TYR 90 7.745 7.484 -7.054 654 HD1 TYR 90 HD1 TYR 90 9.123 5.802 -4.019 655 HD2 TYR 90 HD2 TYR 90 6.469 5.574 -7.336 656 HE1 TYR 90 HE1 TYR 90 8.608 3.467 -3.440 657 HE2 TYR 90 HE2 TYR 90 5.946 3.242 -6.766 658 HH TYR 90 HH TYR 90 7.753 1.467 -4.443 659 HA PRO 91 HA PRO 91 11.616 8.622 -9.622 660 1HB PRO 91 1HB PRO 91 12.074 6.415 -11.074 661 2HB PRO 91 2HB PRO 91 13.072 6.822 -9.674 662 1HG PRO 91 1HG PRO 91 10.823 4.861 -9.889 663 2HG PRO 91 2HG PRO 91 12.384 4.687 -9.066 664 1HD PRO 91 1HD PRO 91 10.040 5.322 -7.789 665 2HD PRO 91 2HD PRO 91 11.649 5.770 -7.189 666 H LYS 92 H LYS 92 10.847 9.191 -11.647 667 HA LYS 92 HA LYS 92 8.094 9.000 -12.111 668 1HB LYS 92 1HB LYS 92 9.246 10.859 -13.029 669 2HB LYS 92 2HB LYS 92 10.393 9.829 -13.868 670 1HG LYS 92 1HG LYS 92 8.612 10.984 -15.262 671 2HG LYS 92 2HG LYS 92 8.849 9.258 -15.528 672 1HD LYS 92 1HD LYS 92 6.703 8.886 -15.080 673 2HD LYS 92 2HD LYS 92 6.896 9.600 -13.482 674 1HE LYS 92 1HE LYS 92 5.282 10.970 -14.356 675 2HE LYS 92 2HE LYS 92 6.738 11.854 -14.814 676 1HZ LYS 92 1HZ LYS 92 6.448 11.385 -16.989 677 2HZ LYS 92 2HZ LYS 92 4.826 11.255 -16.532 678 3HZ LYS 92 3HZ LYS 92 5.768 9.862 -16.705 679 H ARG 93 H ARG 93 7.721 6.699 -11.937 680 HA ARG 93 HA ARG 93 8.295 5.275 -14.453 681 1HB ARG 93 1HB ARG 93 9.217 4.562 -11.957 682 2HB ARG 93 2HB ARG 93 7.784 3.562 -12.136 683 1HG ARG 93 1HG ARG 93 8.709 2.839 -14.366 684 2HG ARG 93 2HG ARG 93 10.209 3.645 -13.905 685 1HD ARG 93 1HD ARG 93 10.697 1.573 -13.122 686 2HD ARG 93 2HD ARG 93 9.843 2.187 -11.707 687 HE ARG 93 HE ARG 93 8.136 0.712 -12.129 688 1HH1 ARG 93 1HH1 ARG 93 10.232 0.866 -14.917 689 2HH1 ARG 93 2HH1 ARG 93 9.482 -0.478 -15.710 690 1HH2 ARG 93 1HH2 ARG 93 7.150 -1.057 -13.172 691 2HH2 ARG 93 2HH2 ARG 93 7.733 -1.569 -14.720 692 H TYR 94 H TYR 94 6.773 3.242 -14.558 693 HA TYR 94 HA TYR 94 4.053 4.278 -14.463 694 1HB TYR 94 1HB TYR 94 5.462 2.117 -15.949 695 2HB TYR 94 2HB TYR 94 3.737 1.914 -15.664 696 HD1 TYR 94 HD1 TYR 94 6.193 4.383 -16.988 697 HD2 TYR 94 HD2 TYR 94 2.217 2.885 -17.128 698 HE1 TYR 94 HE1 TYR 94 5.714 5.852 -18.895 699 HE2 TYR 94 HE2 TYR 94 1.722 4.348 -19.034 700 HH TYR 94 HH TYR 94 2.897 6.763 -19.856 701 H GLN 95 H GLN 95 2.498 3.561 -13.103 702 HA GLN 95 HA GLN 95 3.127 1.212 -11.441 703 1HB GLN 95 1HB GLN 95 3.231 3.613 -10.387 704 2HB GLN 95 2HB GLN 95 1.480 3.456 -10.355 705 1HG GLN 95 1HG GLN 95 1.668 2.375 -8.440 706 2HG GLN 95 2HG GLN 95 2.459 1.060 -9.309 707 1HE2 GLN 95 1HE2 GLN 95 4.600 0.722 -9.037 708 2HE2 GLN 95 2HE2 GLN 95 5.602 1.644 -7.974 709 H SER 96 H SER 96 1.724 -0.387 -11.796 710 HA SER 96 HA SER 96 -0.917 0.224 -12.870 711 1HB SER 96 1HB SER 96 0.696 -1.636 -13.714 712 2HB SER 96 2HB SER 96 0.090 -2.554 -12.336 713 HG SER 96 HG SER 96 -1.026 -2.527 -14.594 714 H HIS 97 H HIS 97 -2.851 -0.673 -11.990 715 HA HIS 97 HA HIS 97 -4.353 -0.944 -10.306 716 1HB HIS 97 1HB HIS 97 -2.182 -2.868 -9.793 717 2HB HIS 97 2HB HIS 97 -3.208 -2.530 -8.404 718 HD1 HIS 97 HD1 HIS 97 -5.161 -4.025 -8.237 719 HD2 HIS 97 HD2 HIS 97 -3.925 -3.543 -12.175 720 HE1 HIS 97 HE1 HIS 97 -6.678 -5.493 -9.603 721 HE2 HIS 97 HE2 HIS 97 -5.861 -5.246 -11.973 722 H VAL 98 H VAL 98 -3.623 1.458 -9.976 723 HA VAL 98 HA VAL 98 -2.834 1.721 -7.145 724 HB VAL 98 HB VAL 98 -1.118 2.551 -8.828 725 1HG1 VAL 98 1HG1 VAL 98 -2.000 3.749 -10.502 726 2HG1 VAL 98 2HG1 VAL 98 -1.849 5.089 -9.362 727 3HG1 VAL 98 3HG1 VAL 98 -3.394 4.260 -9.554 728 1HG2 VAL 98 1HG2 VAL 98 -2.247 4.291 -6.668 729 2HG2 VAL 98 2HG2 VAL 98 -0.812 4.755 -7.584 730 3HG2 VAL 98 3HG2 VAL 98 -0.810 3.267 -6.634 731 H LEU 99 H LEU 99 -3.825 3.425 -5.955 732 HA LEU 99 HA LEU 99 -6.347 4.377 -7.137 733 1HB LEU 99 1HB LEU 99 -5.705 3.619 -4.289 734 2HB LEU 99 2HB LEU 99 -7.168 4.465 -4.753 735 HG LEU 99 HG LEU 99 -7.391 2.384 -6.402 736 1HD1 LEU 99 1HD1 LEU 99 -5.390 1.591 -4.397 737 2HD1 LEU 99 2HD1 LEU 99 -5.697 0.955 -6.013 738 3HD1 LEU 99 3HD1 LEU 99 -6.705 0.446 -4.658 739 1HD2 LEU 99 1HD2 LEU 99 -9.034 1.576 -4.978 740 2HD2 LEU 99 2HD2 LEU 99 -8.861 3.252 -4.455 741 3HD2 LEU 99 3HD2 LEU 99 -8.106 1.955 -3.527 742 H LEU 100 H LEU 100 -6.874 6.540 -6.918 743 HA LEU 100 HA LEU 100 -4.972 8.187 -5.407 744 1HB LEU 100 1HB LEU 100 -5.436 8.197 -8.280 745 2HB LEU 100 2HB LEU 100 -5.603 9.787 -7.556 746 HG LEU 100 HG LEU 100 -3.180 7.996 -7.327 747 1HD1 LEU 100 1HD1 LEU 100 -3.169 10.656 -8.656 748 2HD1 LEU 100 2HD1 LEU 100 -3.797 9.263 -9.540 749 3HD1 LEU 100 3HD1 LEU 100 -2.144 9.247 -8.927 750 1HD2 LEU 100 1HD2 LEU 100 -2.349 9.363 -5.769 751 2HD2 LEU 100 2HD2 LEU 100 -4.008 9.913 -5.544 752 3HD2 LEU 100 3HD2 LEU 100 -2.919 10.807 -6.602 753 H ALA 101 H ALA 101 -5.727 9.988 -4.436 754 HA ALA 101 HA ALA 101 -8.427 10.939 -4.906 755 1HB ALA 101 1HB ALA 101 -7.609 9.783 -2.239 756 2HB ALA 101 2HB ALA 101 -8.872 9.180 -3.315 757 3HB ALA 101 3HB ALA 101 -9.062 10.741 -2.526 758 H THR 102 H THR 102 -8.867 12.942 -3.668 759 HA THR 102 HA THR 102 -6.361 14.321 -2.957 760 HB THR 102 HB THR 102 -7.056 15.336 -4.954 761 HG1 THR 102 HG1 THR 102 -8.309 16.924 -2.971 762 1HG2 THR 102 1HG2 THR 102 -9.342 16.167 -5.352 763 2HG2 THR 102 2HG2 THR 102 -9.864 15.354 -3.877 764 3HG2 THR 102 3HG2 THR 102 -9.251 14.410 -5.235 765 H GLY 103 H GLY 103 -6.237 15.204 -0.993 766 1HA GLY 103 1HA GLY 103 -8.333 14.803 0.900 767 2HA GLY 103 2HA GLY 103 -6.829 15.664 1.190 768 H PHE 104 H PHE 104 -7.604 17.431 2.235 769 HA PHE 104 HA PHE 104 -8.944 19.412 0.616 770 1HB PHE 104 1HB PHE 104 -10.594 17.808 2.078 771 2HB PHE 104 2HB PHE 104 -10.286 19.107 3.225 772 HD1 PHE 104 HD1 PHE 104 -11.670 20.937 3.181 773 HD2 PHE 104 HD2 PHE 104 -11.188 18.632 -0.363 774 HE1 PHE 104 HE1 PHE 104 -13.350 22.334 2.049 775 HE2 PHE 104 HE2 PHE 104 -12.865 20.025 -1.502 776 HZ PHE 104 HZ PHE 104 -13.949 21.879 -0.297 777 H SER 105 H SER 105 -7.826 18.542 3.871 778 HA SER 105 HA SER 105 -6.609 21.215 4.067 779 1HB SER 105 1HB SER 105 -6.990 20.658 6.669 780 2HB SER 105 2HB SER 105 -8.180 21.521 5.698 781 HG SER 105 HG SER 105 -8.176 18.706 6.008 782 H GLU 106 H GLU 106 -4.495 20.858 3.809 783 HA GLU 106 HA GLU 106 -2.386 20.089 4.159 784 1HB GLU 106 1HB GLU 106 -3.492 20.275 6.642 785 2HB GLU 106 2HB GLU 106 -3.015 18.584 6.611 786 1HG GLU 106 1HG GLU 106 -1.033 19.323 7.301 787 2HG GLU 106 2HG GLU 106 -0.791 19.810 5.625 788 HA PRO 107 HA PRO 107 -3.004 16.017 2.325 789 1HB PRO 107 1HB PRO 107 -0.504 15.789 1.285 790 2HB PRO 107 2HB PRO 107 -1.780 16.748 0.525 791 1HG PRO 107 1HG PRO 107 0.484 17.648 2.266 792 2HG PRO 107 2HG PRO 107 -0.138 18.376 0.773 793 1HD PRO 107 1HD PRO 107 -0.768 19.333 3.221 794 2HD PRO 107 2HD PRO 107 -1.900 19.398 1.856 795 H GLY 108 H GLY 108 -0.154 16.923 4.238 796 1HA GLY 108 1HA GLY 108 0.406 15.719 6.239 797 2HA GLY 108 2HA GLY 108 -0.285 14.274 5.517 798 H ASP 109 H ASP 109 2.243 14.328 6.710 799 HA ASP 109 HA ASP 109 4.294 14.630 4.743 800 1HB ASP 109 1HB ASP 109 4.183 14.251 7.532 801 2HB ASP 109 2HB ASP 109 5.061 12.866 6.892 802 H ALA 110 H ALA 110 3.292 11.686 6.489 803 HA ALA 110 HA ALA 110 4.034 10.120 4.118 804 1HB ALA 110 1HB ALA 110 4.793 9.743 6.670 805 2HB ALA 110 2HB ALA 110 4.672 8.441 5.486 806 3HB ALA 110 3HB ALA 110 3.355 8.723 6.626 807 H GLY 111 H GLY 111 2.622 7.843 4.429 808 1HA GLY 111 1HA GLY 111 -0.209 8.648 4.512 809 2HA GLY 111 2HA GLY 111 0.420 7.822 3.095 810 H GLY 112 H GLY 112 2.050 5.914 4.244 811 1HA GLY 112 1HA GLY 112 2.056 3.974 5.535 812 2HA GLY 112 2HA GLY 112 0.535 4.478 6.256 813 H ILE 113 H ILE 113 -1.023 3.069 5.857 814 HA ILE 113 HA ILE 113 -1.176 1.875 3.166 815 HB ILE 113 HB ILE 113 -2.091 -0.174 4.176 816 1HG1 ILE 113 1HG1 ILE 113 -1.336 1.136 6.797 817 2HG1 ILE 113 2HG1 ILE 113 -2.974 0.800 6.245 818 1HG2 ILE 113 1HG2 ILE 113 0.026 -1.019 5.129 819 2HG2 ILE 113 2HG2 ILE 113 0.629 0.637 5.191 820 3HG2 ILE 113 3HG2 ILE 113 0.261 -0.108 3.637 821 1HD1 ILE 113 1HD1 ILE 113 -2.342 -1.631 6.212 822 2HD1 ILE 113 2HD1 ILE 113 -2.414 -0.878 7.804 823 3HD1 ILE 113 3HD1 ILE 113 -0.852 -1.170 7.036 824 H LEU 114 H LEU 114 -3.208 1.646 2.269 825 HA LEU 114 HA LEU 114 -5.282 3.301 3.456 826 1HB LEU 114 1HB LEU 114 -4.917 3.680 1.138 827 2HB LEU 114 2HB LEU 114 -4.971 1.967 0.774 828 HG LEU 114 HG LEU 114 -7.339 1.886 1.087 829 1HD1 LEU 114 1HD1 LEU 114 -7.352 3.448 3.046 830 2HD1 LEU 114 2HD1 LEU 114 -8.672 3.670 1.897 831 3HD1 LEU 114 3HD1 LEU 114 -7.302 4.782 1.893 832 1HD2 LEU 114 1HD2 LEU 114 -6.174 3.191 -0.949 833 2HD2 LEU 114 2HD2 LEU 114 -7.226 4.466 -0.335 834 3HD2 LEU 114 3HD2 LEU 114 -7.913 2.920 -0.834 835 H ARG 115 H ARG 115 -6.660 2.416 4.844 836 HA ARG 115 HA ARG 115 -7.425 -0.400 4.448 837 1HB ARG 115 1HB ARG 115 -7.341 1.223 6.995 838 2HB ARG 115 2HB ARG 115 -7.932 -0.428 6.877 839 1HG ARG 115 1HG ARG 115 -5.385 -0.454 5.720 840 2HG ARG 115 2HG ARG 115 -5.245 0.533 7.175 841 1HD ARG 115 1HD ARG 115 -6.818 -1.884 7.587 842 2HD ARG 115 2HD ARG 115 -5.169 -2.220 7.060 843 HE ARG 115 HE ARG 115 -5.245 -0.298 9.163 844 1HH1 ARG 115 1HH1 ARG 115 -5.426 -3.717 8.493 845 2HH1 ARG 115 2HH1 ARG 115 -4.851 -4.182 10.059 846 1HH2 ARG 115 1HH2 ARG 115 -4.487 -0.905 11.224 847 2HH2 ARG 115 2HH2 ARG 115 -4.317 -2.585 11.611 848 H CYS 116 H CYS 116 -9.541 -0.999 4.531 849 HA CYS 116 HA CYS 116 -11.511 1.183 4.404 850 1HB CYS 116 1HB CYS 116 -11.128 -0.427 2.420 851 2HB CYS 116 2HB CYS 116 -11.954 -1.626 3.406 852 H GLU 117 H GLU 117 -13.716 0.591 5.216 853 HA GLU 117 HA GLU 117 -13.649 -0.156 7.897 854 1HB GLU 117 1HB GLU 117 -15.855 0.084 5.879 855 2HB GLU 117 2HB GLU 117 -16.200 -0.543 7.485 856 1HG GLU 117 1HG GLU 117 -16.160 1.484 8.387 857 2HG GLU 117 2HG GLU 117 -14.642 1.893 7.591 858 H HIS 118 H HIS 118 -13.684 -2.100 5.068 859 HA HIS 118 HA HIS 118 -14.660 -4.466 6.438 860 1HB HIS 118 1HB HIS 118 -13.602 -4.175 3.619 861 2HB HIS 118 2HB HIS 118 -14.480 -5.556 4.271 862 HD2 HIS 118 HD2 HIS 118 -17.147 -5.442 3.803 863 HE1 HIS 118 HE1 HIS 118 -17.431 -1.283 3.007 864 HE2 HIS 118 HE2 HIS 118 -18.644 -3.492 2.998 865 H GLY 119 H GLY 119 -11.619 -3.146 5.222 866 1HA GLY 119 1HA GLY 119 -10.022 -4.589 7.015 867 2HA GLY 119 2HA GLY 119 -10.055 -5.484 5.503 868 H VAL 120 H VAL 120 -8.081 -5.192 4.712 869 HA VAL 120 HA VAL 120 -6.961 -2.480 4.596 870 HB VAL 120 HB VAL 120 -5.466 -4.985 3.862 871 1HG1 VAL 120 1HG1 VAL 120 -3.685 -3.309 4.984 872 2HG1 VAL 120 2HG1 VAL 120 -4.831 -2.152 4.304 873 3HG1 VAL 120 3HG1 VAL 120 -4.060 -3.348 3.261 874 1HG2 VAL 120 1HG2 VAL 120 -4.787 -4.099 6.495 875 2HG2 VAL 120 2HG2 VAL 120 -5.342 -5.686 5.963 876 3HG2 VAL 120 3HG2 VAL 120 -6.513 -4.451 6.424 877 H ILE 121 H ILE 121 -6.607 -1.455 2.688 878 HA ILE 121 HA ILE 121 -7.638 -2.757 0.284 879 HB ILE 121 HB ILE 121 -6.835 0.119 0.699 880 1HG1 ILE 121 1HG1 ILE 121 -9.071 -1.243 1.697 881 2HG1 ILE 121 2HG1 ILE 121 -8.846 0.499 1.611 882 1HG2 ILE 121 1HG2 ILE 121 -8.083 -1.328 -1.616 883 2HG2 ILE 121 2HG2 ILE 121 -6.649 -0.304 -1.596 884 3HG2 ILE 121 3HG2 ILE 121 -8.246 0.416 -1.405 885 1HD1 ILE 121 1HD1 ILE 121 -10.971 -0.638 0.609 886 2HD1 ILE 121 2HD1 ILE 121 -9.919 -0.930 -0.771 887 3HD1 ILE 121 3HD1 ILE 121 -10.205 0.721 -0.213 888 H GLY 122 H GLY 122 -4.944 -0.464 0.817 889 1HA GLY 122 1HA GLY 122 -3.125 -2.308 -0.528 890 2HA GLY 122 2HA GLY 122 -3.442 -0.786 -1.341 891 H LEU 123 H LEU 123 -1.144 -0.440 -1.161 892 HA LEU 123 HA LEU 123 -0.358 0.545 1.503 893 1HB LEU 123 1HB LEU 123 1.997 0.063 0.791 894 2HB LEU 123 2HB LEU 123 0.993 -1.350 1.056 895 HG LEU 123 HG LEU 123 1.204 -0.295 -1.720 896 1HD1 LEU 123 1HD1 LEU 123 3.263 -1.472 -2.129 897 2HD1 LEU 123 2HD1 LEU 123 3.343 -1.993 -0.445 898 3HD1 LEU 123 3HD1 LEU 123 3.520 -0.285 -0.851 899 1HD2 LEU 123 1HD2 LEU 123 1.221 -3.116 -0.670 900 2HD2 LEU 123 2HD2 LEU 123 0.881 -2.570 -2.313 901 3HD2 LEU 123 3HD2 LEU 123 -0.257 -2.217 -1.013 902 H VAL 124 H VAL 124 1.327 2.279 1.412 903 HA VAL 124 HA VAL 124 0.430 4.434 -0.147 904 HB VAL 124 HB VAL 124 1.570 4.750 1.994 905 1HG1 VAL 124 1HG1 VAL 124 4.267 4.409 0.867 906 2HG1 VAL 124 2HG1 VAL 124 3.366 2.920 1.148 907 3HG1 VAL 124 3HG1 VAL 124 3.653 4.041 2.479 908 1HG2 VAL 124 1HG2 VAL 124 1.522 6.537 0.228 909 2HG2 VAL 124 2HG2 VAL 124 3.171 6.069 -0.188 910 3HG2 VAL 124 3HG2 VAL 124 2.813 6.695 1.420 911 H THR 125 H THR 125 0.774 4.914 -2.211 912 HA THR 125 HA THR 125 3.174 3.827 -3.526 913 HB THR 125 HB THR 125 0.386 4.302 -4.547 914 HG1 THR 125 HG1 THR 125 0.883 2.177 -5.437 915 1HG2 THR 125 1HG2 THR 125 2.833 4.655 -6.092 916 2HG2 THR 125 2HG2 THR 125 1.168 5.089 -6.480 917 3HG2 THR 125 3HG2 THR 125 1.737 3.443 -6.757 918 H MET 126 H MET 126 1.063 6.310 -4.895 919 HA MET 126 HA MET 126 3.376 8.090 -5.001 920 1HB MET 126 1HB MET 126 1.144 7.584 -6.706 921 2HB MET 126 2HB MET 126 1.095 9.274 -6.224 922 1HG MET 126 1HG MET 126 3.580 7.986 -7.296 923 2HG MET 126 2HG MET 126 2.361 8.708 -8.344 924 1HE MET 126 1HE MET 126 5.196 8.827 -6.319 925 2HE MET 126 2HE MET 126 5.312 10.387 -5.499 926 3HE MET 126 3HE MET 126 5.925 10.206 -7.145 927 H GLY 127 H GLY 127 3.097 10.399 -4.510 928 1HA GLY 127 1HA GLY 127 0.941 11.046 -2.653 929 2HA GLY 127 2HA GLY 127 2.573 11.069 -2.003 930 H GLY 128 H GLY 128 0.330 12.604 -4.207 931 1HA GLY 128 1HA GLY 128 2.188 14.624 -5.065 932 2HA GLY 128 2HA GLY 128 0.457 14.608 -5.359 933 H GLU 129 H GLU 129 1.129 16.987 -4.903 934 HA GLU 129 HA GLU 129 1.503 17.745 -2.182 935 1HB GLU 129 1HB GLU 129 0.908 20.039 -3.050 936 2HB GLU 129 2HB GLU 129 2.262 19.258 -3.855 937 1HG GLU 129 1HG GLU 129 1.257 19.662 -5.781 938 2HG GLU 129 2HG GLU 129 0.020 18.495 -5.318 939 H GLY 130 H GLY 130 -1.240 16.853 -4.044 940 1HA GLY 130 1HA GLY 130 -2.961 17.541 -1.768 941 2HA GLY 130 2HA GLY 130 -3.427 18.090 -3.369 942 H VAL 131 H VAL 131 -2.014 15.239 -4.031 943 HA VAL 131 HA VAL 131 -4.531 13.765 -3.657 944 HB VAL 131 HB VAL 131 -2.943 12.569 -5.723 945 1HG1 VAL 131 1HG1 VAL 131 -5.130 12.050 -5.929 946 2HG1 VAL 131 2HG1 VAL 131 -5.117 13.452 -6.998 947 3HG1 VAL 131 3HG1 VAL 131 -5.674 13.619 -5.333 948 1HG2 VAL 131 1HG2 VAL 131 -3.653 15.443 -6.289 949 2HG2 VAL 131 2HG2 VAL 131 -2.895 14.292 -7.389 950 3HG2 VAL 131 3HG2 VAL 131 -2.016 14.866 -5.972 951 H VAL 132 H VAL 132 -4.373 11.446 -3.416 952 HA VAL 132 HA VAL 132 -1.835 10.612 -2.167 953 HB VAL 132 HB VAL 132 -3.064 9.268 -0.595 954 1HG1 VAL 132 1HG1 VAL 132 -4.734 11.658 -0.336 955 2HG1 VAL 132 2HG1 VAL 132 -3.015 11.988 -0.560 956 3HG1 VAL 132 3HG1 VAL 132 -3.551 10.970 0.777 957 1HG2 VAL 132 1HG2 VAL 132 -5.684 9.717 -0.653 958 2HG2 VAL 132 2HG2 VAL 132 -4.942 8.383 -1.536 959 3HG2 VAL 132 3HG2 VAL 132 -5.357 9.876 -2.377 960 H GLY 133 H GLY 133 -0.834 9.045 -3.264 961 1HA GLY 133 1HA GLY 133 -2.423 7.316 -5.039 962 2HA GLY 133 2HA GLY 133 -0.688 7.580 -5.154 963 H PHE 134 H PHE 134 -2.938 5.333 -4.353 964 HA PHE 134 HA PHE 134 -1.089 3.988 -2.491 965 1HB PHE 134 1HB PHE 134 -4.107 3.790 -2.487 966 2HB PHE 134 2HB PHE 134 -3.012 2.979 -1.374 967 HD1 PHE 134 HD1 PHE 134 -1.123 5.251 -0.854 968 HD2 PHE 134 HD2 PHE 134 -5.372 5.107 -1.021 969 HE1 PHE 134 HE1 PHE 134 -1.244 7.168 0.681 970 HE2 PHE 134 HE2 PHE 134 -5.501 7.024 0.512 971 HZ PHE 134 HZ PHE 134 -3.436 8.057 1.366 972 H ALA 135 H ALA 135 -0.555 1.909 -2.905 973 HA ALA 135 HA ALA 135 -1.434 0.765 -5.435 974 1HB ALA 135 1HB ALA 135 0.728 0.204 -5.461 975 2HB ALA 135 2HB ALA 135 0.325 -1.033 -4.269 976 3HB ALA 135 3HB ALA 135 0.913 0.545 -3.740 977 H ASP 136 H ASP 136 -3.199 -0.470 -5.448 978 HA ASP 136 HA ASP 136 -4.367 -1.543 -3.105 979 1HB ASP 136 1HB ASP 136 -5.271 -1.007 -5.615 980 2HB ASP 136 2HB ASP 136 -5.163 -2.764 -5.665 981 H VAL 137 H VAL 137 -4.443 -3.576 -2.277 982 HA VAL 137 HA VAL 137 -2.319 -5.396 -3.092 983 HB VAL 137 HB VAL 137 -4.217 -5.515 -0.735 984 1HG1 VAL 137 1HG1 VAL 137 -2.338 -7.129 0.079 985 2HG1 VAL 137 2HG1 VAL 137 -2.031 -7.333 -1.643 986 3HG1 VAL 137 3HG1 VAL 137 -3.615 -7.727 -0.978 987 1HG2 VAL 137 1HG2 VAL 137 -2.802 -4.223 0.399 988 2HG2 VAL 137 2HG2 VAL 137 -2.034 -3.853 -1.145 989 3HG2 VAL 137 3HG2 VAL 137 -1.406 -5.160 -0.138 990 H ARG 138 H ARG 138 -5.200 -4.895 -4.323 991 HA ARG 138 HA ARG 138 -6.493 -7.420 -4.186 992 1HB ARG 138 1HB ARG 138 -6.795 -5.306 -6.321 993 2HB ARG 138 2HB ARG 138 -7.944 -6.573 -5.915 994 1HG ARG 138 1HG ARG 138 -7.305 -4.949 -3.608 995 2HG ARG 138 2HG ARG 138 -7.909 -3.973 -4.948 996 1HD ARG 138 1HD ARG 138 -9.398 -6.458 -4.464 997 2HD ARG 138 2HD ARG 138 -9.474 -5.284 -3.153 998 HE ARG 138 HE ARG 138 -10.553 -3.772 -4.587 999 1HH1 ARG 138 1HH1 ARG 138 -9.865 -6.808 -6.182 1000 2HH1 ARG 138 2HH1 ARG 138 -10.963 -6.509 -7.484 1001 1HH2 ARG 138 1HH2 ARG 138 -11.992 -3.389 -6.303 1002 2HH2 ARG 138 2HH2 ARG 138 -12.168 -4.572 -7.555 1003 H ASP 139 H ASP 139 -3.645 -6.535 -5.705 1004 HA ASP 139 HA ASP 139 -4.016 -8.348 -7.967 1005 1HB ASP 139 1HB ASP 139 -2.817 -5.983 -7.962 1006 2HB ASP 139 2HB ASP 139 -1.431 -6.947 -7.459 1007 H LEU 140 H LEU 140 -3.484 -8.921 -4.905 1008 HA LEU 140 HA LEU 140 -2.258 -11.401 -5.268 1009 1HB LEU 140 1HB LEU 140 -0.092 -11.066 -4.199 1010 2HB LEU 140 2HB LEU 140 -0.217 -10.155 -5.686 1011 HG LEU 140 HG LEU 140 0.741 -8.531 -4.446 1012 1HD1 LEU 140 1HD1 LEU 140 -2.085 -8.297 -3.447 1013 2HD1 LEU 140 2HD1 LEU 140 -1.404 -7.546 -4.890 1014 3HD1 LEU 140 3HD1 LEU 140 -0.852 -7.047 -3.289 1015 1HD2 LEU 140 1HD2 LEU 140 0.511 -10.347 -2.433 1016 2HD2 LEU 140 2HD2 LEU 140 -0.430 -8.989 -1.813 1017 3HD2 LEU 140 3HD2 LEU 140 1.251 -8.752 -2.289 1018 H LEU 141 H LEU 141 -4.470 -10.986 -4.033 1019 HA LEU 141 HA LEU 141 -4.231 -10.361 -1.258 1020 1HB LEU 141 1HB LEU 141 -6.323 -10.706 -3.095 1021 2HB LEU 141 2HB LEU 141 -6.575 -11.913 -1.847 1022 HG LEU 141 HG LEU 141 -7.779 -10.090 -1.073 1023 1HD1 LEU 141 1HD1 LEU 141 -6.923 -10.088 0.959 1024 2HD1 LEU 141 2HD1 LEU 141 -5.593 -9.050 0.443 1025 3HD1 LEU 141 3HD1 LEU 141 -5.451 -10.800 0.306 1026 1HD2 LEU 141 1HD2 LEU 141 -6.011 -8.596 -2.701 1027 2HD2 LEU 141 2HD2 LEU 141 -5.979 -7.894 -1.084 1028 3HD2 LEU 141 3HD2 LEU 141 -7.511 -8.068 -1.940 1029 H TRP 142 H TRP 142 -3.569 -13.159 -3.066 1030 HA TRP 142 HA TRP 142 -4.300 -15.217 -1.355 1031 1HB TRP 142 1HB TRP 142 -2.401 -16.496 -2.390 1032 2HB TRP 142 2HB TRP 142 -3.505 -15.759 -3.546 1033 HD1 TRP 142 HD1 TRP 142 -2.543 -13.311 -4.614 1034 HE1 TRP 142 HE1 TRP 142 -0.138 -12.754 -5.333 1035 HE3 TRP 142 HE3 TRP 142 -0.054 -16.954 -2.032 1036 HZ2 TRP 142 HZ2 TRP 142 2.462 -13.731 -4.873 1037 HZ3 TRP 142 HZ3 TRP 142 2.397 -17.073 -2.229 1038 HH2 TRP 142 HH2 TRP 142 3.629 -15.493 -3.619 1039 H LEU 143 H LEU 143 -3.985 -14.401 0.766 1040 HA LEU 143 HA LEU 143 -1.369 -15.052 1.838 1041 1HB LEU 143 1HB LEU 143 -2.655 -12.373 2.370 1042 2HB LEU 143 2HB LEU 143 -1.222 -12.987 3.167 1043 HG LEU 143 HG LEU 143 -0.322 -13.104 0.659 1044 1HD1 LEU 143 1HD1 LEU 143 -1.301 -10.711 -0.162 1045 2HD1 LEU 143 2HD1 LEU 143 -2.738 -11.451 0.544 1046 3HD1 LEU 143 3HD1 LEU 143 -1.860 -12.279 -0.743 1047 1HD2 LEU 143 1HD2 LEU 143 0.431 -11.740 2.728 1048 2HD2 LEU 143 2HD2 LEU 143 -0.427 -10.409 1.953 1049 3HD2 LEU 143 3HD2 LEU 143 0.911 -11.198 1.120 1050 H GLU 144 H GLU 144 -4.642 -13.880 2.530 1051 HA GLU 144 HA GLU 144 -4.980 -15.956 4.513 1052 1HB GLU 144 1HB GLU 144 -4.304 -13.263 5.282 1053 2HB GLU 144 2HB GLU 144 -5.916 -13.659 5.856 1054 1HG GLU 144 1HG GLU 144 -4.111 -15.837 6.353 1055 2HG GLU 144 2HG GLU 144 -3.474 -14.336 7.022 1056 H ASP 145 H ASP 145 -7.286 -15.067 5.726 1057 HA ASP 145 HA ASP 145 -9.245 -15.656 3.823 1058 1HB ASP 145 1HB ASP 145 -9.173 -15.412 6.570 1059 2HB ASP 145 2HB ASP 145 -10.222 -14.080 6.092 1060 H ASP 146 H ASP 146 -10.647 -14.440 2.627 1061 HA ASP 146 HA ASP 146 -9.896 -11.643 2.242 1062 1HB ASP 146 1HB ASP 146 -11.401 -11.852 0.209 1063 2HB ASP 146 2HB ASP 146 -9.962 -12.867 0.203 1064 H ALA 147 H ALA 147 -11.499 -9.968 2.112 1065 HA ALA 147 HA ALA 147 -13.729 -10.453 3.948 1066 1HB ALA 147 1HB ALA 147 -11.933 -8.514 4.081 1067 2HB ALA 147 2HB ALA 147 -13.604 -8.269 4.586 1068 3HB ALA 147 3HB ALA 147 -13.073 -7.717 2.998 1069 H MET 148 H MET 148 -15.757 -10.567 3.259 1070 HA MET 148 HA MET 148 -16.457 -9.344 0.679 1071 1HB MET 148 1HB MET 148 -17.924 -11.332 0.237 1072 2HB MET 148 2HB MET 148 -16.198 -11.668 0.180 1073 1HG MET 148 1HG MET 148 -16.743 -12.219 2.774 1074 2HG MET 148 2HG MET 148 -18.263 -12.671 2.004 1075 1HE MET 148 1HE MET 148 -17.354 -14.609 3.456 1076 2HE MET 148 2HE MET 148 -16.272 -15.869 2.862 1077 3HE MET 148 3HE MET 148 -17.910 -15.739 2.220 1078 H GLU 149 H GLU 149 -19.029 -9.636 0.462 1079 HA GLU 149 HA GLU 149 -20.269 -8.978 3.039 1080 1HB GLU 149 1HB GLU 149 -21.576 -7.177 1.780 1081 2HB GLU 149 2HB GLU 149 -19.899 -6.821 2.174 1082 1HG GLU 149 1HG GLU 149 -19.266 -6.756 0.021 1083 2HG GLU 149 2HG GLU 149 -20.339 -8.075 -0.447 1084 H GLN 150 H GLN 150 -22.724 -8.861 2.787 1085 HA GLN 150 HA GLN 150 -23.709 -10.698 0.727 1086 1HB GLN 150 1HB GLN 150 -24.335 -11.000 3.669 1087 2HB GLN 150 2HB GLN 150 -24.959 -11.999 2.365 1088 1HG GLN 150 1HG GLN 150 -22.902 -13.029 2.004 1089 2HG GLN 150 2HG GLN 150 -22.019 -11.774 2.871 1090 1HE2 GLN 150 1HE2 GLN 150 -21.134 -12.672 4.590 1091 2HE2 GLN 150 2HE2 GLN 150 -21.928 -13.722 5.710 Start of MODEL 8 1 1H GLY 1 1H GLY 1 0.889 -5.037 15.758 2 2H GLY 1 2H GLY 1 1.123 -3.390 16.065 3 3H GLY 1 3H GLY 1 2.383 -4.488 16.333 4 1HA GLY 1 1HA GLY 1 1.762 -4.927 13.730 5 2HA GLY 1 2HA GLY 1 1.563 -3.190 13.903 6 HA PRO 2 HA PRO 2 5.859 -2.525 13.213 7 1HB PRO 2 1HB PRO 2 5.755 -0.700 15.566 8 2HB PRO 2 2HB PRO 2 6.335 -0.391 13.925 9 1HG PRO 2 1HG PRO 2 3.987 0.565 14.738 10 2HG PRO 2 2HG PRO 2 4.197 -0.057 13.090 11 1HD PRO 2 1HD PRO 2 2.848 -1.315 15.437 12 2HD PRO 2 2HD PRO 2 2.421 -1.388 13.714 13 H TYR 3 H TYR 3 5.307 -2.256 16.729 14 HA TYR 3 HA TYR 3 6.213 -3.350 18.507 15 1HB TYR 3 1HB TYR 3 5.622 -5.385 17.065 16 2HB TYR 3 2HB TYR 3 7.321 -5.414 16.609 17 HD1 TYR 3 HD1 TYR 3 5.173 -5.326 19.665 18 HD2 TYR 3 HD2 TYR 3 8.782 -6.689 17.871 19 HE1 TYR 3 HE1 TYR 3 5.688 -6.618 21.694 20 HE2 TYR 3 HE2 TYR 3 9.306 -7.983 19.894 21 HH TYR 3 HH TYR 3 7.836 -7.516 22.810 22 H GLY 4 H GLY 4 8.550 -4.029 15.892 23 1HA GLY 4 1HA GLY 4 10.455 -2.182 17.071 24 2HA GLY 4 2HA GLY 4 10.901 -3.878 17.170 25 H HIS 5 H HIS 5 9.980 -4.799 14.720 26 HA HIS 5 HA HIS 5 11.791 -3.381 12.884 27 1HB HIS 5 1HB HIS 5 11.947 -5.538 11.672 28 2HB HIS 5 2HB HIS 5 12.496 -5.660 13.340 29 HD1 HIS 5 HD1 HIS 5 10.189 -7.150 10.947 30 HD2 HIS 5 HD2 HIS 5 10.525 -6.930 15.083 31 HE1 HIS 5 HE1 HIS 5 8.696 -8.966 11.840 32 HE2 HIS 5 HE2 HIS 5 8.985 -8.873 14.341 33 H GLN 6 H GLN 6 11.148 -2.896 10.800 34 HA GLN 6 HA GLN 6 9.724 -2.285 9.136 35 1HB GLN 6 1HB GLN 6 8.490 -4.829 10.122 36 2HB GLN 6 2HB GLN 6 7.633 -3.860 8.930 37 1HG GLN 6 1HG GLN 6 8.781 -5.033 7.428 38 2HG GLN 6 2HG GLN 6 10.132 -3.983 7.854 39 1HE2 GLN 6 1HE2 GLN 6 11.624 -4.748 9.474 40 2HE2 GLN 6 2HE2 GLN 6 11.889 -6.444 9.659 41 H SER 7 H SER 7 8.749 -0.393 9.418 42 HA SER 7 HA SER 7 6.377 -0.293 11.159 43 1HB SER 7 1HB SER 7 8.705 1.599 11.013 44 2HB SER 7 2HB SER 7 7.114 2.190 11.492 45 HG SER 7 HG SER 7 8.770 0.307 12.775 46 H GLY 8 H GLY 8 6.572 -0.730 8.289 47 1HA GLY 8 1HA GLY 8 4.589 1.136 7.450 48 2HA GLY 8 2HA GLY 8 6.142 1.496 6.709 49 H ALA 9 H ALA 9 4.167 -1.403 7.369 50 HA ALA 9 HA ALA 9 4.040 -2.021 4.554 51 1HB ALA 9 1HB ALA 9 6.116 -3.160 6.161 52 2HB ALA 9 2HB ALA 9 5.783 -3.392 4.446 53 3HB ALA 9 3HB ALA 9 5.010 -4.432 5.642 54 H VAL 10 H VAL 10 2.883 -4.192 4.237 55 HA VAL 10 HA VAL 10 0.744 -4.371 6.251 56 HB VAL 10 HB VAL 10 0.661 -5.236 3.356 57 1HG1 VAL 10 1HG1 VAL 10 -1.868 -4.737 4.696 58 2HG1 VAL 10 2HG1 VAL 10 -0.944 -6.030 5.460 59 3HG1 VAL 10 3HG1 VAL 10 -1.346 -6.128 3.745 60 1HG2 VAL 10 1HG2 VAL 10 -0.896 -2.921 4.390 61 2HG2 VAL 10 2HG2 VAL 10 -0.279 -3.235 2.768 62 3HG2 VAL 10 3HG2 VAL 10 0.818 -2.693 4.038 63 H TYR 11 H TYR 11 0.860 -6.087 7.550 64 HA TYR 11 HA TYR 11 2.269 -8.490 6.633 65 1HB TYR 11 1HB TYR 11 2.281 -7.105 9.037 66 2HB TYR 11 2HB TYR 11 1.261 -8.496 9.380 67 HD1 TYR 11 HD1 TYR 11 4.608 -7.540 8.074 68 HD2 TYR 11 HD2 TYR 11 2.215 -10.578 9.847 69 HE1 TYR 11 HE1 TYR 11 6.619 -8.913 8.423 70 HE2 TYR 11 HE2 TYR 11 4.218 -11.960 10.198 71 HH TYR 11 HH TYR 11 6.666 -11.628 10.426 72 H VAL 12 H VAL 12 1.060 -10.050 5.747 73 HA VAL 12 HA VAL 12 -1.635 -10.502 6.845 74 HB VAL 12 HB VAL 12 -0.853 -11.049 3.981 75 1HG1 VAL 12 1HG1 VAL 12 -2.658 -12.425 4.538 76 2HG1 VAL 12 2HG1 VAL 12 -3.403 -11.018 3.781 77 3HG1 VAL 12 3HG1 VAL 12 -3.413 -11.182 5.536 78 1HG2 VAL 12 1HG2 VAL 12 -2.763 -8.923 4.338 79 2HG2 VAL 12 2HG2 VAL 12 -1.247 -8.930 3.437 80 3HG2 VAL 12 3HG2 VAL 12 -1.249 -8.547 5.157 81 H GLY 13 H GLY 13 -1.549 -12.278 8.065 82 1HA GLY 13 1HA GLY 13 -1.012 -14.398 8.789 83 2HA GLY 13 2HA GLY 13 -1.277 -14.833 7.109 84 H ASN 14 H ASN 14 0.327 -16.039 6.365 85 HA ASN 14 HA ASN 14 3.006 -15.752 7.482 86 1HB ASN 14 1HB ASN 14 2.036 -17.782 5.466 87 2HB ASN 14 2HB ASN 14 3.508 -17.857 6.429 88 1HD2 ASN 14 1HD2 ASN 14 3.366 -19.289 7.981 89 2HD2 ASN 14 2HD2 ASN 14 1.960 -19.653 8.914 90 H TYR 15 H TYR 15 1.655 -13.902 5.439 91 HA TYR 15 HA TYR 15 3.922 -13.828 3.555 92 1HB TYR 15 1HB TYR 15 0.976 -13.569 2.998 93 2HB TYR 15 2HB TYR 15 2.147 -12.765 1.965 94 HD1 TYR 15 HD1 TYR 15 0.166 -14.807 1.070 95 HD2 TYR 15 HD2 TYR 15 4.180 -15.232 2.407 96 HE1 TYR 15 HE1 TYR 15 0.374 -16.869 -0.237 97 HE2 TYR 15 HE2 TYR 15 4.396 -17.295 1.096 98 HH TYR 15 HH TYR 15 3.292 -18.306 -0.953 99 H LYS 16 H LYS 16 4.684 -11.745 3.085 100 HA LYS 16 HA LYS 16 3.307 -9.512 4.408 101 1HB LYS 16 1HB LYS 16 5.176 -10.279 5.847 102 2HB LYS 16 2HB LYS 16 6.291 -9.978 4.519 103 1HG LYS 16 1HG LYS 16 5.449 -7.580 4.560 104 2HG LYS 16 2HG LYS 16 4.707 -7.987 6.108 105 1HD LYS 16 1HD LYS 16 6.679 -7.327 6.960 106 2HD LYS 16 2HD LYS 16 7.218 -8.936 6.475 107 1HE LYS 16 1HE LYS 16 7.950 -7.987 4.307 108 2HE LYS 16 2HE LYS 16 7.506 -6.384 4.894 109 1HZ LYS 16 1HZ LYS 16 9.657 -6.356 5.507 110 2HZ LYS 16 2HZ LYS 16 9.794 -8.040 5.575 111 3HZ LYS 16 3HZ LYS 16 9.091 -7.197 6.862 112 H VAL 17 H VAL 17 2.845 -8.005 2.952 113 HA VAL 17 HA VAL 17 4.572 -7.790 0.587 114 HB VAL 17 HB VAL 17 2.793 -7.314 -0.713 115 1HG1 VAL 17 1HG1 VAL 17 0.899 -8.179 1.402 116 2HG1 VAL 17 2HG1 VAL 17 2.190 -9.286 0.937 117 3HG1 VAL 17 3HG1 VAL 17 1.047 -8.707 -0.274 118 1HG2 VAL 17 1HG2 VAL 17 1.487 -5.844 1.577 119 2HG2 VAL 17 2HG2 VAL 17 0.838 -5.968 -0.061 120 3HG2 VAL 17 3HG2 VAL 17 2.360 -5.123 0.224 121 H VAL 18 H VAL 18 5.897 -6.148 0.436 122 HA VAL 18 HA VAL 18 5.230 -3.604 1.745 123 HB VAL 18 HB VAL 18 6.788 -4.863 3.207 124 1HG1 VAL 18 1HG1 VAL 18 7.929 -6.025 1.267 125 2HG1 VAL 18 2HG1 VAL 18 8.983 -5.433 2.551 126 3HG1 VAL 18 3HG1 VAL 18 8.846 -4.536 1.038 127 1HG2 VAL 18 1HG2 VAL 18 8.097 -3.029 3.741 128 2HG2 VAL 18 2HG2 VAL 18 6.770 -2.297 2.839 129 3HG2 VAL 18 3HG2 VAL 18 8.325 -2.570 2.053 130 H ASN 19 H ASN 19 6.555 -1.769 0.914 131 HA ASN 19 HA ASN 19 6.548 -1.677 -1.886 132 1HB ASN 19 1HB ASN 19 7.193 0.110 0.281 133 2HB ASN 19 2HB ASN 19 8.407 0.257 -0.986 134 1HD2 ASN 19 1HD2 ASN 19 5.268 1.041 0.008 135 2HD2 ASN 19 2HD2 ASN 19 4.745 1.825 -1.440 136 H ARG 20 H ARG 20 8.158 -1.941 -3.427 137 HA ARG 20 HA ARG 20 10.135 -3.838 -2.957 138 1HB ARG 20 1HB ARG 20 9.582 -1.897 -5.150 139 2HB ARG 20 2HB ARG 20 11.144 -2.702 -5.138 140 1HG ARG 20 1HG ARG 20 9.760 -4.870 -4.896 141 2HG ARG 20 2HG ARG 20 8.420 -3.879 -5.470 142 1HD ARG 20 1HD ARG 20 10.982 -4.560 -6.882 143 2HD ARG 20 2HD ARG 20 9.329 -4.889 -7.392 144 HE ARG 20 HE ARG 20 9.115 -2.673 -8.089 145 1HH1 ARG 20 1HH1 ARG 20 12.258 -3.246 -6.671 146 2HH1 ARG 20 2HH1 ARG 20 12.944 -1.792 -7.310 147 1HH2 ARG 20 1HH2 ARG 20 10.024 -0.765 -8.926 148 2HH2 ARG 20 2HH2 ARG 20 11.679 -0.385 -8.587 149 H HIS 21 H HIS 21 10.470 -0.302 -3.186 150 HA HIS 21 HA HIS 21 13.267 -0.318 -2.689 151 1HB HIS 21 1HB HIS 21 11.175 1.675 -3.094 152 2HB HIS 21 2HB HIS 21 12.376 2.187 -1.912 153 HD1 HIS 21 HD1 HIS 21 14.899 0.982 -3.217 154 HD2 HIS 21 HD2 HIS 21 11.974 3.096 -5.279 155 HE1 HIS 21 HE1 HIS 21 16.035 1.861 -5.281 156 HE2 HIS 21 HE2 HIS 21 14.221 3.053 -6.561 157 H LEU 22 H LEU 22 10.700 -0.998 -0.644 158 HA LEU 22 HA LEU 22 12.241 -0.139 1.707 159 1HB LEU 22 1HB LEU 22 9.724 0.595 1.119 160 2HB LEU 22 2HB LEU 22 9.397 -0.869 2.029 161 HG LEU 22 HG LEU 22 10.979 0.182 3.812 162 1HD1 LEU 22 1HD1 LEU 22 11.892 2.081 2.975 163 2HD1 LEU 22 2HD1 LEU 22 10.418 2.780 3.643 164 3HD1 LEU 22 3HD1 LEU 22 10.516 2.412 1.922 165 1HD2 LEU 22 1HD2 LEU 22 8.934 1.644 4.552 166 2HD2 LEU 22 2HD2 LEU 22 8.817 -0.115 4.517 167 3HD2 LEU 22 3HD2 LEU 22 8.138 0.840 3.199 168 H ALA 23 H ALA 23 11.840 -2.880 -0.028 169 HA ALA 23 HA ALA 23 11.263 -4.618 2.238 170 1HB ALA 23 1HB ALA 23 11.290 -4.917 -0.662 171 2HB ALA 23 2HB ALA 23 10.348 -5.766 0.564 172 3HB ALA 23 3HB ALA 23 11.987 -6.290 0.198 173 H THR 24 H THR 24 12.718 -5.688 3.416 174 HA THR 24 HA THR 24 15.494 -5.046 3.138 175 HB THR 24 HB THR 24 15.812 -6.386 5.138 176 HG1 THR 24 HG1 THR 24 13.175 -7.274 4.625 177 1HG2 THR 24 1HG2 THR 24 14.993 -4.321 5.798 178 2HG2 THR 24 2HG2 THR 24 13.931 -5.470 6.610 179 3HG2 THR 24 3HG2 THR 24 13.385 -4.643 5.151 180 H HIS 25 H HIS 25 17.203 -6.734 3.100 181 HA HIS 25 HA HIS 25 17.092 -8.262 0.795 182 1HB HIS 25 1HB HIS 25 19.092 -7.574 2.401 183 2HB HIS 25 2HB HIS 25 18.843 -9.203 3.021 184 HD1 HIS 25 HD1 HIS 25 21.231 -9.781 2.061 185 HD2 HIS 25 HD2 HIS 25 18.362 -8.820 -0.787 186 HE1 HIS 25 HE1 HIS 25 22.178 -10.559 -0.135 187 HE2 HIS 25 HE2 HIS 25 20.390 -10.039 -1.832 188 H VAL 26 H VAL 26 16.081 -9.060 4.031 189 HA VAL 26 HA VAL 26 15.912 -11.874 3.666 190 HB VAL 26 HB VAL 26 14.322 -10.181 5.599 191 1HG1 VAL 26 1HG1 VAL 26 15.191 -13.042 5.917 192 2HG1 VAL 26 2HG1 VAL 26 13.649 -12.593 5.187 193 3HG1 VAL 26 3HG1 VAL 26 13.997 -12.148 6.858 194 1HG2 VAL 26 1HG2 VAL 26 16.077 -10.179 7.086 195 2HG2 VAL 26 2HG2 VAL 26 16.938 -10.018 5.557 196 3HG2 VAL 26 3HG2 VAL 26 16.842 -11.588 6.353 197 H ASP 27 H ASP 27 13.755 -9.189 2.987 198 HA ASP 27 HA ASP 27 11.400 -10.720 2.617 199 1HB ASP 27 1HB ASP 27 12.280 -7.950 1.889 200 2HB ASP 27 2HB ASP 27 10.847 -8.613 1.109 201 H TRP 28 H TRP 28 13.936 -9.517 0.493 202 HA TRP 28 HA TRP 28 12.814 -10.662 -1.848 203 1HB TRP 28 1HB TRP 28 15.642 -9.709 -1.391 204 2HB TRP 28 2HB TRP 28 14.897 -10.029 -2.955 205 HD1 TRP 28 HD1 TRP 28 14.357 -7.675 0.062 206 HE1 TRP 28 HE1 TRP 28 13.454 -5.441 -0.806 207 HE3 TRP 28 HE3 TRP 28 13.930 -8.853 -4.888 208 HZ2 TRP 28 HZ2 TRP 28 12.629 -4.334 -3.232 209 HZ3 TRP 28 HZ3 TRP 28 13.068 -7.134 -6.427 210 HH2 TRP 28 HH2 TRP 28 12.437 -4.917 -5.616 211 H GLN 29 H GLN 29 15.012 -11.721 0.620 212 HA GLN 29 HA GLN 29 16.255 -13.861 -0.679 213 1HB GLN 29 1HB GLN 29 16.416 -12.797 1.809 214 2HB GLN 29 2HB GLN 29 15.528 -14.272 2.158 215 1HG GLN 29 1HG GLN 29 17.863 -14.675 2.459 216 2HG GLN 29 2HG GLN 29 17.308 -15.564 1.040 217 1HE2 GLN 29 1HE2 GLN 29 19.978 -15.020 1.487 218 2HE2 GLN 29 2HE2 GLN 29 20.540 -13.907 0.290 219 H ASN 30 H ASN 30 13.202 -13.703 1.105 220 HA ASN 30 HA ASN 30 12.513 -16.349 0.004 221 1HB ASN 30 1HB ASN 30 12.381 -15.325 2.710 222 2HB ASN 30 2HB ASN 30 10.792 -15.847 2.161 223 1HD2 ASN 30 1HD2 ASN 30 12.861 -16.931 4.088 224 2HD2 ASN 30 2HD2 ASN 30 13.020 -18.591 3.638 225 H CYS 31 H CYS 31 12.130 -13.724 -1.242 226 HA CYS 31 HA CYS 31 9.414 -12.937 -0.987 227 1HB CYS 31 1HB CYS 31 9.793 -11.621 -3.015 228 2HB CYS 31 2HB CYS 31 11.123 -11.418 -1.884 229 HG CYS 31 HG CYS 31 11.794 -11.873 -4.505 230 H VAL 32 H VAL 32 7.663 -13.897 -1.723 231 HA VAL 32 HA VAL 32 7.894 -16.142 -3.542 232 HB VAL 32 HB VAL 32 5.432 -16.385 -3.153 233 1HG1 VAL 32 1HG1 VAL 32 7.457 -16.451 -0.969 234 2HG1 VAL 32 2HG1 VAL 32 6.608 -17.778 -1.762 235 3HG1 VAL 32 3HG1 VAL 32 5.770 -16.779 -0.573 236 1HG2 VAL 32 1HG2 VAL 32 5.020 -13.979 -2.672 237 2HG2 VAL 32 2HG2 VAL 32 5.829 -14.200 -1.120 238 3HG2 VAL 32 3HG2 VAL 32 4.337 -15.073 -1.468 239 H TRP 33 H TRP 33 6.477 -12.899 -3.470 240 HA TRP 33 HA TRP 33 6.329 -12.986 -6.395 241 1HB TRP 33 1HB TRP 33 4.087 -13.364 -6.119 242 2HB TRP 33 2HB TRP 33 4.043 -12.607 -4.532 243 HD1 TRP 33 HD1 TRP 33 3.521 -11.856 -8.217 244 HE1 TRP 33 HE1 TRP 33 2.593 -9.465 -8.460 245 HE3 TRP 33 HE3 TRP 33 4.126 -10.269 -3.411 246 HZ2 TRP 33 HZ2 TRP 33 2.177 -7.192 -6.802 247 HZ3 TRP 33 HZ3 TRP 33 3.447 -7.983 -2.817 248 HH2 TRP 33 HH2 TRP 33 2.494 -6.489 -4.491 249 H GLU 34 H GLU 34 6.371 -10.920 -7.422 250 HA GLU 34 HA GLU 34 6.695 -8.525 -5.869 251 1HB GLU 34 1HB GLU 34 8.914 -9.501 -5.565 252 2HB GLU 34 2HB GLU 34 9.090 -9.686 -7.305 253 1HG GLU 34 1HG GLU 34 8.471 -6.958 -6.621 254 2HG GLU 34 2HG GLU 34 9.889 -7.527 -5.741 255 H ASP 35 H ASP 35 5.621 -7.081 -7.044 256 HA ASP 35 HA ASP 35 5.736 -7.276 -9.978 257 1HB ASP 35 1HB ASP 35 3.611 -6.556 -8.068 258 2HB ASP 35 2HB ASP 35 3.707 -5.521 -9.489 259 H TYR 36 H TYR 36 7.006 -5.875 -10.969 260 HA TYR 36 HA TYR 36 8.270 -3.705 -9.712 261 1HB TYR 36 1HB TYR 36 8.941 -5.012 -11.845 262 2HB TYR 36 2HB TYR 36 7.903 -3.869 -12.691 263 HD1 TYR 36 HD1 TYR 36 8.383 -1.324 -12.090 264 HD2 TYR 36 HD2 TYR 36 11.180 -4.497 -11.638 265 HE1 TYR 36 HE1 TYR 36 10.228 0.301 -12.165 266 HE2 TYR 36 HE2 TYR 36 13.033 -2.882 -11.711 267 HH TYR 36 HH TYR 36 12.713 0.238 -12.786 268 H ASN 37 H ASN 37 5.565 -3.760 -12.033 269 HA ASN 37 HA ASN 37 5.188 -0.995 -12.188 270 1HB ASN 37 1HB ASN 37 3.571 -3.400 -12.814 271 2HB ASN 37 2HB ASN 37 2.685 -1.891 -12.619 272 1HD2 ASN 37 1HD2 ASN 37 2.183 -2.264 -14.893 273 2HD2 ASN 37 2HD2 ASN 37 3.296 -1.709 -16.091 274 H ARG 38 H ARG 38 4.509 -3.182 -9.636 275 HA ARG 38 HA ARG 38 2.738 -1.214 -8.357 276 1HB ARG 38 1HB ARG 38 2.860 -4.151 -8.340 277 2HB ARG 38 2HB ARG 38 2.615 -3.428 -6.756 278 1HG ARG 38 1HG ARG 38 0.461 -3.777 -7.522 279 2HG ARG 38 2HG ARG 38 0.748 -2.076 -7.896 280 1HD ARG 38 1HD ARG 38 -0.256 -3.001 -9.820 281 2HD ARG 38 2HD ARG 38 1.458 -2.839 -10.200 282 HE ARG 38 HE ARG 38 1.332 -5.361 -9.318 283 1HH1 ARG 38 1HH1 ARG 38 -0.641 -3.628 -11.619 284 2HH1 ARG 38 2HH1 ARG 38 -1.012 -5.038 -12.551 285 1HH2 ARG 38 1HH2 ARG 38 0.843 -7.216 -10.544 286 2HH2 ARG 38 2HH2 ARG 38 -0.171 -7.075 -11.942 287 H ASP 39 H ASP 39 5.919 -2.275 -8.363 288 HA ASP 39 HA ASP 39 7.668 -2.118 -6.902 289 1HB ASP 39 1HB ASP 39 6.729 0.313 -7.200 290 2HB ASP 39 2HB ASP 39 6.222 0.121 -5.525 291 H LEU 40 H LEU 40 5.853 -4.040 -6.169 292 HA LEU 40 HA LEU 40 6.067 -3.971 -3.242 293 1HB LEU 40 1HB LEU 40 3.752 -3.387 -4.062 294 2HB LEU 40 2HB LEU 40 3.656 -5.005 -4.724 295 HG LEU 40 HG LEU 40 4.019 -5.876 -2.381 296 1HD1 LEU 40 1HD1 LEU 40 4.807 -3.404 -1.753 297 2HD1 LEU 40 2HD1 LEU 40 4.109 -4.513 -0.573 298 3HD1 LEU 40 3HD1 LEU 40 3.104 -3.272 -1.318 299 1HD2 LEU 40 1HD2 LEU 40 1.717 -5.000 -3.691 300 2HD2 LEU 40 2HD2 LEU 40 1.560 -4.398 -2.039 301 3HD2 LEU 40 3HD2 LEU 40 1.807 -6.120 -2.331 302 H LEU 41 H LEU 41 6.160 -6.061 -2.240 303 HA LEU 41 HA LEU 41 6.333 -8.395 -3.923 304 1HB LEU 41 1HB LEU 41 8.596 -9.043 -3.187 305 2HB LEU 41 2HB LEU 41 8.576 -7.634 -4.219 306 HG LEU 41 HG LEU 41 9.533 -7.927 -1.434 307 1HD1 LEU 41 1HD1 LEU 41 11.229 -7.497 -2.869 308 2HD1 LEU 41 2HD1 LEU 41 10.820 -5.851 -2.382 309 3HD1 LEU 41 3HD1 LEU 41 10.242 -6.487 -3.923 310 1HD2 LEU 41 1HD2 LEU 41 8.118 -5.414 -2.326 311 2HD2 LEU 41 2HD2 LEU 41 9.154 -5.552 -0.911 312 3HD2 LEU 41 3HD2 LEU 41 7.648 -6.458 -0.988 313 H VAL 42 H VAL 42 5.860 -10.246 -2.892 314 HA VAL 42 HA VAL 42 5.183 -10.002 -0.051 315 HB VAL 42 HB VAL 42 4.209 -11.898 -2.190 316 1HG1 VAL 42 1HG1 VAL 42 3.454 -12.092 0.721 317 2HG1 VAL 42 2HG1 VAL 42 4.669 -13.125 -0.024 318 3HG1 VAL 42 3HG1 VAL 42 3.001 -13.182 -0.589 319 1HG2 VAL 42 1HG2 VAL 42 2.169 -10.741 -0.558 320 2HG2 VAL 42 2HG2 VAL 42 2.455 -10.547 -2.286 321 3HG2 VAL 42 3HG2 VAL 42 3.246 -9.467 -1.139 322 H SER 43 H SER 43 6.208 -11.089 1.450 323 HA SER 43 HA SER 43 8.044 -13.247 0.658 324 1HB SER 43 1HB SER 43 9.723 -12.452 2.062 325 2HB SER 43 2HB SER 43 9.044 -10.948 1.442 326 HG SER 43 HG SER 43 7.742 -10.901 3.377 327 H THR 44 H THR 44 8.397 -14.868 2.348 328 HA THR 44 HA THR 44 5.944 -15.236 3.889 329 HB THR 44 HB THR 44 6.467 -17.559 3.953 330 HG1 THR 44 HG1 THR 44 8.431 -18.360 3.547 331 1HG2 THR 44 1HG2 THR 44 7.521 -17.087 1.255 332 2HG2 THR 44 2HG2 THR 44 5.984 -16.305 1.643 333 3HG2 THR 44 3HG2 THR 44 6.151 -18.059 1.796 334 H THR 45 H THR 45 5.842 -15.297 6.022 335 HA THR 45 HA THR 45 8.293 -14.694 7.512 336 HB THR 45 HB THR 45 7.044 -13.418 8.938 337 HG1 THR 45 HG1 THR 45 5.279 -14.118 9.854 338 1HG2 THR 45 1HG2 THR 45 5.034 -12.403 7.846 339 2HG2 THR 45 2HG2 THR 45 5.269 -13.528 6.512 340 3HG2 THR 45 3HG2 THR 45 6.516 -12.340 6.896 341 H THR 46 H THR 46 5.698 -17.002 7.233 342 HA THR 46 HA THR 46 5.407 -19.083 8.106 343 HB THR 46 HB THR 46 8.110 -18.928 9.410 344 HG1 THR 46 HG1 THR 46 7.530 -19.171 6.656 345 1HG2 THR 46 1HG2 THR 46 7.809 -21.093 9.696 346 2HG2 THR 46 2HG2 THR 46 7.724 -21.299 7.947 347 3HG2 THR 46 3HG2 THR 46 6.251 -21.013 8.873 348 H ALA 47 H ALA 47 4.678 -16.683 9.568 349 HA ALA 47 HA ALA 47 4.399 -17.899 12.212 350 1HB ALA 47 1HB ALA 47 5.130 -14.995 11.983 351 2HB ALA 47 2HB ALA 47 6.351 -16.255 12.159 352 3HB ALA 47 3HB ALA 47 5.134 -16.024 13.415 353 H HIS 48 H HIS 48 3.074 -15.871 13.495 354 HA HIS 48 HA HIS 48 0.493 -16.021 12.267 355 1HB HIS 48 1HB HIS 48 1.498 -15.568 14.865 356 2HB HIS 48 2HB HIS 48 0.576 -14.129 14.437 357 HD1 HIS 48 HD1 HIS 48 -1.927 -14.823 13.367 358 HD2 HIS 48 HD2 HIS 48 -0.055 -17.484 15.952 359 HE1 HIS 48 HE1 HIS 48 -3.752 -16.329 14.219 360 HE2 HIS 48 HE2 HIS 48 -2.582 -17.982 15.717 361 H GLY 49 H GLY 49 -0.764 -14.368 11.423 362 1HA GLY 49 1HA GLY 49 0.668 -12.289 10.082 363 2HA GLY 49 2HA GLY 49 -1.074 -12.529 10.067 364 H CYS 50 H CYS 50 -1.757 -10.474 10.442 365 HA CYS 50 HA CYS 50 -1.734 -9.514 13.100 366 1HB CYS 50 1HB CYS 50 0.367 -8.528 11.299 367 2HB CYS 50 2HB CYS 50 -0.568 -7.254 12.074 368 HG CYS 50 HG CYS 50 0.159 -8.829 14.330 369 H ASP 51 H ASP 51 -2.032 -8.564 9.693 370 HA ASP 51 HA ASP 51 -4.488 -7.099 10.410 371 1HB ASP 51 1HB ASP 51 -2.632 -6.587 8.074 372 2HB ASP 51 2HB ASP 51 -4.094 -5.679 8.448 373 H THR 52 H THR 52 -6.132 -7.013 8.671 374 HA THR 52 HA THR 52 -6.143 -9.471 7.047 375 HB THR 52 HB THR 52 -8.496 -8.251 8.504 376 HG1 THR 52 HG1 THR 52 -8.314 -9.926 9.890 377 1HG2 THR 52 1HG2 THR 52 -9.153 -10.829 7.812 378 2HG2 THR 52 2HG2 THR 52 -8.357 -10.203 6.369 379 3HG2 THR 52 3HG2 THR 52 -9.748 -9.357 7.047 380 H ILE 53 H ILE 53 -6.336 -9.084 4.943 381 HA ILE 53 HA ILE 53 -6.889 -6.442 3.972 382 HB ILE 53 HB ILE 53 -6.924 -8.769 2.123 383 1HG1 ILE 53 1HG1 ILE 53 -4.797 -8.340 4.013 384 2HG1 ILE 53 2HG1 ILE 53 -4.951 -9.586 2.781 385 1HG2 ILE 53 1HG2 ILE 53 -5.693 -6.026 1.967 386 2HG2 ILE 53 2HG2 ILE 53 -7.239 -6.517 1.277 387 3HG2 ILE 53 3HG2 ILE 53 -5.742 -7.212 0.662 388 1HD1 ILE 53 1HD1 ILE 53 -3.605 -6.916 2.586 389 2HD1 ILE 53 2HD1 ILE 53 -4.033 -7.856 1.157 390 3HD1 ILE 53 3HD1 ILE 53 -2.920 -8.523 2.345 391 H ALA 54 H ALA 54 -8.683 -5.665 2.967 392 HA ALA 54 HA ALA 54 -11.112 -7.249 3.284 393 1HB ALA 54 1HB ALA 54 -11.680 -4.648 2.294 394 2HB ALA 54 2HB ALA 54 -10.483 -4.500 3.579 395 3HB ALA 54 3HB ALA 54 -12.014 -5.316 3.890 396 H ARG 55 H ARG 55 -12.161 -8.145 1.630 397 HA ARG 55 HA ARG 55 -11.151 -7.703 -1.071 398 1HB ARG 55 1HB ARG 55 -12.471 -9.677 -1.672 399 2HB ARG 55 2HB ARG 55 -11.410 -10.011 -0.309 400 1HG ARG 55 1HG ARG 55 -13.119 -10.508 1.032 401 2HG ARG 55 2HG ARG 55 -14.040 -9.093 0.521 402 1HD ARG 55 1HD ARG 55 -13.860 -11.154 -1.535 403 2HD ARG 55 2HD ARG 55 -14.646 -11.713 -0.058 404 HE ARG 55 HE ARG 55 -15.603 -9.176 -1.045 405 1HH1 ARG 55 1HH1 ARG 55 -15.993 -12.645 -1.140 406 2HH1 ARG 55 2HH1 ARG 55 -17.645 -12.569 -1.651 407 1HH2 ARG 55 1HH2 ARG 55 -17.775 -9.078 -1.717 408 2HH2 ARG 55 2HH2 ARG 55 -18.657 -10.545 -1.980 409 H CYS 56 H CYS 56 -12.684 -5.630 0.194 410 HA CYS 56 HA CYS 56 -15.237 -5.697 -1.237 411 1HB CYS 56 1HB CYS 56 -15.804 -3.713 0.114 412 2HB CYS 56 2HB CYS 56 -15.350 -5.085 1.119 413 H GLN 57 H GLN 57 -15.923 -3.583 -2.244 414 HA GLN 57 HA GLN 57 -13.635 -2.321 -3.607 415 1HB GLN 57 1HB GLN 57 -16.181 -3.429 -4.682 416 2HB GLN 57 2HB GLN 57 -15.529 -1.986 -5.446 417 1HG GLN 57 1HG GLN 57 -13.718 -3.076 -6.291 418 2HG GLN 57 2HG GLN 57 -13.693 -4.272 -4.994 419 1HE2 GLN 57 1HE2 GLN 57 -14.165 -3.934 -8.175 420 2HE2 GLN 57 2HE2 GLN 57 -15.249 -5.245 -8.473 421 H CYS 58 H CYS 58 -14.940 -1.389 -1.199 422 HA CYS 58 HA CYS 58 -16.835 0.620 -1.690 423 1HB CYS 58 1HB CYS 58 -14.723 0.663 0.472 424 2HB CYS 58 2HB CYS 58 -16.275 1.492 0.489 425 H THR 59 H THR 59 -16.691 2.568 -2.603 426 HA THR 59 HA THR 59 -14.217 3.457 -3.724 427 HB THR 59 HB THR 59 -16.581 5.268 -3.552 428 HG1 THR 59 HG1 THR 59 -17.562 4.078 -5.248 429 1HG2 THR 59 1HG2 THR 59 -15.903 6.091 -5.548 430 2HG2 THR 59 2HG2 THR 59 -15.249 4.546 -6.092 431 3HG2 THR 59 3HG2 THR 59 -14.345 5.529 -4.941 432 H THR 60 H THR 60 -15.551 3.757 -0.661 433 HA THR 60 HA THR 60 -13.978 6.189 -0.127 434 HB THR 60 HB THR 60 -15.511 6.839 1.538 435 HG1 THR 60 HG1 THR 60 -16.484 4.192 1.371 436 1HG2 THR 60 1HG2 THR 60 -17.799 6.619 0.497 437 2HG2 THR 60 2HG2 THR 60 -17.021 5.688 -0.784 438 3HG2 THR 60 3HG2 THR 60 -16.549 7.364 -0.500 439 H GLY 61 H GLY 61 -12.264 5.938 1.119 440 1HA GLY 61 1HA GLY 61 -12.264 3.858 3.192 441 2HA GLY 61 2HA GLY 61 -10.964 3.858 2.005 442 H VAL 62 H VAL 62 -10.003 4.064 4.417 443 HA VAL 62 HA VAL 62 -9.560 6.947 4.830 444 HB VAL 62 HB VAL 62 -10.763 6.000 6.727 445 1HG1 VAL 62 1HG1 VAL 62 -8.777 4.399 7.960 446 2HG1 VAL 62 2HG1 VAL 62 -9.002 3.795 6.319 447 3HG1 VAL 62 3HG1 VAL 62 -10.383 3.922 7.409 448 1HG2 VAL 62 1HG2 VAL 62 -8.505 6.309 8.321 449 2HG2 VAL 62 2HG2 VAL 62 -9.634 7.568 7.818 450 3HG2 VAL 62 3HG2 VAL 62 -8.172 7.268 6.880 451 H TYR 63 H TYR 63 -7.590 7.657 4.511 452 HA TYR 63 HA TYR 63 -5.392 5.720 4.333 453 1HB TYR 63 1HB TYR 63 -4.330 7.184 2.800 454 2HB TYR 63 2HB TYR 63 -6.026 7.158 2.336 455 HD1 TYR 63 HD1 TYR 63 -3.346 9.178 3.815 456 HD2 TYR 63 HD2 TYR 63 -7.410 9.148 2.554 457 HE1 TYR 63 HE1 TYR 63 -3.402 11.634 3.943 458 HE2 TYR 63 HE2 TYR 63 -7.472 11.600 2.683 459 HH TYR 63 HH TYR 63 -5.954 13.484 2.635 460 H PHE 64 H PHE 64 -3.195 7.194 4.585 461 HA PHE 64 HA PHE 64 -1.754 8.177 6.034 462 1HB PHE 64 1HB PHE 64 -4.259 9.623 6.463 463 2HB PHE 64 2HB PHE 64 -3.225 9.619 7.884 464 HD1 PHE 64 HD1 PHE 64 -3.084 12.066 7.648 465 HD2 PHE 64 HD2 PHE 64 -1.585 9.441 4.649 466 HE1 PHE 64 HE1 PHE 64 -1.759 13.909 6.699 467 HE2 PHE 64 HE2 PHE 64 -0.259 11.279 3.699 468 HZ PHE 64 HZ PHE 64 -0.344 13.516 4.722 469 H CYS 65 H CYS 65 -4.265 8.130 8.509 470 HA CYS 65 HA CYS 65 -4.526 6.889 10.399 471 1HB CYS 65 1HB CYS 65 -4.037 5.003 8.540 472 2HB CYS 65 2HB CYS 65 -2.639 4.753 9.581 473 HG CYS 65 HG CYS 65 -4.988 4.735 11.354 474 H ALA 66 H ALA 66 -1.168 6.199 9.388 475 HA ALA 66 HA ALA 66 -0.251 6.855 12.075 476 1HB ALA 66 1HB ALA 66 0.722 4.877 11.336 477 2HB ALA 66 2HB ALA 66 1.987 6.077 11.071 478 3HB ALA 66 3HB ALA 66 1.011 5.510 9.716 479 H SER 67 H SER 67 0.163 7.979 8.746 480 HA SER 67 HA SER 67 2.212 9.766 8.972 481 1HB SER 67 1HB SER 67 0.926 9.270 6.886 482 2HB SER 67 2HB SER 67 -0.353 10.330 7.476 483 HG SER 67 HG SER 67 1.165 12.036 7.479 484 H LYS 68 H LYS 68 -1.184 10.834 9.227 485 HA LYS 68 HA LYS 68 -0.341 13.169 10.726 486 1HB LYS 68 1HB LYS 68 -2.095 13.208 8.901 487 2HB LYS 68 2HB LYS 68 -3.159 12.363 10.016 488 1HG LYS 68 1HG LYS 68 -3.630 14.734 10.022 489 2HG LYS 68 2HG LYS 68 -2.990 14.235 11.587 490 1HD LYS 68 1HD LYS 68 -1.989 16.332 10.909 491 2HD LYS 68 2HD LYS 68 -0.769 15.059 10.919 492 1HE LYS 68 1HE LYS 68 -0.390 15.262 8.724 493 2HE LYS 68 2HE LYS 68 -2.111 15.325 8.348 494 1HZ LYS 68 1HZ LYS 68 -1.780 17.720 9.429 495 2HZ LYS 68 2HZ LYS 68 -1.576 17.425 7.776 496 3HZ LYS 68 3HZ LYS 68 -0.228 17.496 8.793 497 H SER 69 H SER 69 -0.640 10.145 11.680 498 HA SER 69 HA SER 69 -0.974 9.122 13.679 499 1HB SER 69 1HB SER 69 -0.133 11.636 14.359 500 2HB SER 69 2HB SER 69 -1.675 11.538 15.208 501 HG SER 69 HG SER 69 -0.942 9.638 16.203 502 H LYS 70 H LYS 70 -3.261 10.267 11.867 503 HA LYS 70 HA LYS 70 -5.398 9.318 13.616 504 1HB LYS 70 1HB LYS 70 -5.645 11.859 11.998 505 2HB LYS 70 2HB LYS 70 -6.879 11.148 13.026 506 1HG LYS 70 1HG LYS 70 -6.145 12.371 14.712 507 2HG LYS 70 2HG LYS 70 -4.601 11.523 14.639 508 1HD LYS 70 1HD LYS 70 -3.758 13.570 14.228 509 2HD LYS 70 2HD LYS 70 -4.333 13.279 12.585 510 1HE LYS 70 1HE LYS 70 -5.119 15.426 13.210 511 2HE LYS 70 2HE LYS 70 -6.507 14.339 13.270 512 1HZ LYS 70 1HZ LYS 70 -5.009 15.550 15.502 513 2HZ LYS 70 2HZ LYS 70 -5.887 14.124 15.741 514 3HZ LYS 70 3HZ LYS 70 -6.678 15.528 15.226 515 H HIS 71 H HIS 71 -7.460 9.019 12.314 516 HA HIS 71 HA HIS 71 -6.750 7.681 9.821 517 1HB HIS 71 1HB HIS 71 -9.186 6.877 10.001 518 2HB HIS 71 2HB HIS 71 -8.048 6.284 11.206 519 HD1 HIS 71 HD1 HIS 71 -11.073 8.417 10.798 520 HD2 HIS 71 HD2 HIS 71 -8.473 7.246 13.821 521 HE1 HIS 71 HE1 HIS 71 -12.200 9.077 12.947 522 HE2 HIS 71 HE2 HIS 71 -10.566 8.442 14.757 523 H TYR 72 H TYR 72 -6.943 8.752 7.954 524 HA TYR 72 HA TYR 72 -8.880 10.963 7.801 525 1HB TYR 72 1HB TYR 72 -6.224 10.438 6.612 526 2HB TYR 72 2HB TYR 72 -7.391 11.204 5.544 527 HD1 TYR 72 HD1 TYR 72 -7.697 13.506 5.621 528 HD2 TYR 72 HD2 TYR 72 -5.844 11.551 8.916 529 HE1 TYR 72 HE1 TYR 72 -7.171 15.692 6.613 530 HE2 TYR 72 HE2 TYR 72 -5.314 13.732 9.921 531 HH TYR 72 HH TYR 72 -4.965 16.155 8.982 532 HA PRO 73 HA PRO 73 -11.011 8.107 5.008 533 1HB PRO 73 1HB PRO 73 -13.377 9.699 5.329 534 2HB PRO 73 2HB PRO 73 -13.021 8.122 6.035 535 1HG PRO 73 1HG PRO 73 -13.268 10.429 7.499 536 2HG PRO 73 2HG PRO 73 -12.318 9.018 8.009 537 1HD PRO 73 1HD PRO 73 -11.380 11.555 6.696 538 2HD PRO 73 2HD PRO 73 -10.674 10.667 8.069 539 H VAL 74 H VAL 74 -10.701 8.333 2.885 540 HA VAL 74 HA VAL 74 -11.593 10.806 1.582 541 HB VAL 74 HB VAL 74 -9.041 10.677 2.018 542 1HG1 VAL 74 1HG1 VAL 74 -7.759 9.522 0.295 543 2HG1 VAL 74 2HG1 VAL 74 -9.247 8.830 -0.352 544 3HG1 VAL 74 3HG1 VAL 74 -8.702 8.393 1.267 545 1HG2 VAL 74 1HG2 VAL 74 -8.576 11.684 -0.226 546 2HG2 VAL 74 2HG2 VAL 74 -9.920 12.402 0.663 547 3HG2 VAL 74 3HG2 VAL 74 -10.237 11.287 -0.668 548 H SER 75 H SER 75 -12.094 10.593 -0.655 549 HA SER 75 HA SER 75 -12.909 7.879 -1.375 550 1HB SER 75 1HB SER 75 -13.581 10.462 -2.803 551 2HB SER 75 2HB SER 75 -14.375 8.899 -2.993 552 HG SER 75 HG SER 75 -14.432 10.627 -0.750 553 H PHE 76 H PHE 76 -11.844 6.727 -2.884 554 HA PHE 76 HA PHE 76 -10.083 8.185 -4.729 555 1HB PHE 76 1HB PHE 76 -8.842 5.691 -4.259 556 2HB PHE 76 2HB PHE 76 -8.248 7.289 -3.841 557 HD1 PHE 76 HD1 PHE 76 -7.368 7.318 -1.753 558 HD2 PHE 76 HD2 PHE 76 -10.912 5.069 -2.433 559 HE1 PHE 76 HE1 PHE 76 -7.449 6.749 0.633 560 HE2 PHE 76 HE2 PHE 76 -11.006 4.490 -0.044 561 HZ PHE 76 HZ PHE 76 -9.275 5.330 1.493 562 H GLU 77 H GLU 77 -9.384 6.929 -6.584 563 HA GLU 77 HA GLU 77 -11.486 5.080 -7.495 564 1HB GLU 77 1HB GLU 77 -9.844 7.143 -8.945 565 2HB GLU 77 2HB GLU 77 -10.573 5.802 -9.817 566 1HG GLU 77 1HG GLU 77 -12.428 6.989 -9.979 567 2HG GLU 77 2HG GLU 77 -12.616 6.857 -8.231 568 H GLY 78 H GLY 78 -10.736 3.349 -8.968 569 1HA GLY 78 1HA GLY 78 -8.063 2.443 -8.133 570 2HA GLY 78 2HA GLY 78 -9.372 1.397 -8.649 571 HA PRO 79 HA PRO 79 -7.667 3.307 -12.742 572 1HB PRO 79 1HB PRO 79 -5.380 4.775 -12.576 573 2HB PRO 79 2HB PRO 79 -6.996 5.488 -12.507 574 1HG PRO 79 1HG PRO 79 -5.115 4.832 -10.280 575 2HG PRO 79 2HG PRO 79 -6.142 6.260 -10.495 576 1HD PRO 79 1HD PRO 79 -6.811 4.219 -8.848 577 2HD PRO 79 2HD PRO 79 -8.020 5.185 -9.712 578 H GLY 80 H GLY 80 -6.580 1.904 -13.965 579 1HA GLY 80 1HA GLY 80 -4.999 -0.132 -12.877 580 2HA GLY 80 2HA GLY 80 -5.120 0.251 -14.589 581 H LEU 81 H LEU 81 -3.647 1.786 -15.496 582 HA LEU 81 HA LEU 81 -1.105 1.814 -14.051 583 1HB LEU 81 1HB LEU 81 -1.654 1.155 -16.616 584 2HB LEU 81 2HB LEU 81 -1.186 2.834 -16.802 585 HG LEU 81 HG LEU 81 0.797 1.665 -17.113 586 1HD1 LEU 81 1HD1 LEU 81 2.094 1.962 -14.911 587 2HD1 LEU 81 2HD1 LEU 81 0.601 2.685 -14.324 588 3HD1 LEU 81 3HD1 LEU 81 1.426 3.381 -15.715 589 1HD2 LEU 81 1HD2 LEU 81 1.516 -0.059 -15.313 590 2HD2 LEU 81 2HD2 LEU 81 0.381 -0.531 -16.577 591 3HD2 LEU 81 3HD2 LEU 81 -0.212 -0.130 -14.965 592 H VAL 82 H VAL 82 -0.493 3.564 -13.007 593 HA VAL 82 HA VAL 82 -1.346 6.194 -14.021 594 HB VAL 82 HB VAL 82 -0.926 5.484 -11.103 595 1HG1 VAL 82 1HG1 VAL 82 -1.642 8.010 -12.548 596 2HG1 VAL 82 2HG1 VAL 82 -0.421 7.747 -11.304 597 3HG1 VAL 82 3HG1 VAL 82 -2.131 7.751 -10.874 598 1HG2 VAL 82 1HG2 VAL 82 -3.390 5.843 -10.931 599 2HG2 VAL 82 2HG2 VAL 82 -2.936 4.414 -11.861 600 3HG2 VAL 82 3HG2 VAL 82 -3.461 5.879 -12.692 601 H GLU 83 H GLU 83 0.322 7.416 -14.635 602 HA GLU 83 HA GLU 83 3.004 6.566 -14.186 603 1HB GLU 83 1HB GLU 83 3.618 8.647 -15.389 604 2HB GLU 83 2HB GLU 83 2.445 7.668 -16.258 605 1HG GLU 83 1HG GLU 83 1.088 9.549 -14.580 606 2HG GLU 83 2HG GLU 83 2.270 10.380 -15.590 607 H VAL 84 H VAL 84 3.875 6.721 -12.237 608 HA VAL 84 HA VAL 84 3.143 8.750 -10.361 609 HB VAL 84 HB VAL 84 3.753 6.626 -9.467 610 1HG1 VAL 84 1HG1 VAL 84 6.239 5.913 -9.723 611 2HG1 VAL 84 2HG1 VAL 84 6.188 6.923 -11.166 612 3HG1 VAL 84 3HG1 VAL 84 5.088 5.555 -11.009 613 1HG2 VAL 84 1HG2 VAL 84 6.091 8.426 -8.878 614 2HG2 VAL 84 2HG2 VAL 84 5.367 7.210 -7.826 615 3HG2 VAL 84 3HG2 VAL 84 4.474 8.678 -8.221 616 H GLN 85 H GLN 85 3.864 10.751 -10.340 617 HA GLN 85 HA GLN 85 5.955 11.661 -12.028 618 1HB GLN 85 1HB GLN 85 4.755 13.168 -9.707 619 2HB GLN 85 2HB GLN 85 5.511 13.836 -11.147 620 1HG GLN 85 1HG GLN 85 3.633 12.702 -12.446 621 2HG GLN 85 2HG GLN 85 2.842 12.502 -10.884 622 1HE2 GLN 85 1HE2 GLN 85 3.673 14.675 -13.403 623 2HE2 GLN 85 2HE2 GLN 85 2.868 16.067 -12.772 624 H GLU 86 H GLU 86 7.974 12.539 -11.481 625 HA GLU 86 HA GLU 86 9.376 11.117 -9.473 626 1HB GLU 86 1HB GLU 86 10.341 11.988 -11.637 627 2HB GLU 86 2HB GLU 86 10.322 13.592 -10.916 628 1HG GLU 86 1HG GLU 86 12.007 13.097 -9.433 629 2HG GLU 86 2HG GLU 86 11.693 11.362 -9.493 630 H SER 87 H SER 87 8.842 11.498 -7.397 631 HA SER 87 HA SER 87 9.324 14.191 -6.374 632 1HB SER 87 1HB SER 87 6.728 13.257 -6.761 633 2HB SER 87 2HB SER 87 7.026 13.012 -5.039 634 HG SER 87 HG SER 87 6.363 15.065 -5.126 635 H GLU 88 H GLU 88 9.623 14.267 -4.054 636 HA GLU 88 HA GLU 88 10.705 13.585 -2.181 637 1HB GLU 88 1HB GLU 88 8.429 12.471 -1.999 638 2HB GLU 88 2HB GLU 88 9.213 10.987 -2.514 639 1HG GLU 88 1HG GLU 88 10.254 10.685 -0.535 640 2HG GLU 88 2HG GLU 88 10.465 12.413 -0.257 641 H TYR 89 H TYR 89 10.501 10.287 -3.466 642 HA TYR 89 HA TYR 89 13.334 10.334 -4.146 643 1HB TYR 89 1HB TYR 89 13.531 8.102 -2.816 644 2HB TYR 89 2HB TYR 89 13.650 9.632 -1.952 645 HD1 TYR 89 HD1 TYR 89 12.738 9.401 0.153 646 HD2 TYR 89 HD2 TYR 89 10.734 7.609 -3.145 647 HE1 TYR 89 HE1 TYR 89 10.914 8.703 1.647 648 HE2 TYR 89 HE2 TYR 89 8.905 6.909 -1.660 649 HH TYR 89 HH TYR 89 8.590 6.441 0.780 650 H TYR 90 H TYR 90 10.585 9.893 -5.411 651 HA TYR 90 HA TYR 90 11.148 7.265 -6.611 652 1HB TYR 90 1HB TYR 90 8.852 7.990 -5.370 653 2HB TYR 90 2HB TYR 90 8.479 8.474 -7.021 654 HD1 TYR 90 HD1 TYR 90 8.165 6.832 -8.757 655 HD2 TYR 90 HD2 TYR 90 9.241 5.634 -4.820 656 HE1 TYR 90 HE1 TYR 90 7.595 4.506 -9.316 657 HE2 TYR 90 HE2 TYR 90 8.676 3.303 -5.368 658 HH TYR 90 HH TYR 90 8.392 2.133 -8.352 659 HA PRO 91 HA PRO 91 11.803 9.573 -10.365 660 1HB PRO 91 1HB PRO 91 12.350 7.540 -11.998 661 2HB PRO 91 2HB PRO 91 13.435 7.947 -10.663 662 1HG PRO 91 1HG PRO 91 11.415 5.757 -10.864 663 2HG PRO 91 2HG PRO 91 13.035 5.725 -10.148 664 1HD PRO 91 1HD PRO 91 10.658 6.033 -8.736 665 2HD PRO 91 2HD PRO 91 12.270 6.467 -8.137 666 H LYS 92 H LYS 92 10.720 10.148 -12.238 667 HA LYS 92 HA LYS 92 7.976 9.732 -12.414 668 1HB LYS 92 1HB LYS 92 9.595 11.485 -13.554 669 2HB LYS 92 2HB LYS 92 9.523 10.348 -14.892 670 1HG LYS 92 1HG LYS 92 7.021 11.374 -13.613 671 2HG LYS 92 2HG LYS 92 7.868 12.310 -14.845 672 1HD LYS 92 1HD LYS 92 7.562 9.557 -15.662 673 2HD LYS 92 2HD LYS 92 6.002 10.271 -15.252 674 1HE LYS 92 1HE LYS 92 6.947 12.273 -16.697 675 2HE LYS 92 2HE LYS 92 7.918 10.987 -17.411 676 1HZ LYS 92 1HZ LYS 92 5.041 10.538 -17.120 677 2HZ LYS 92 2HZ LYS 92 6.102 9.991 -18.318 678 3HZ LYS 92 3HZ LYS 92 5.556 11.592 -18.340 679 H ARG 93 H ARG 93 7.712 7.430 -12.221 680 HA ARG 93 HA ARG 93 8.134 6.017 -14.773 681 1HB ARG 93 1HB ARG 93 9.241 5.366 -12.301 682 2HB ARG 93 2HB ARG 93 7.909 4.235 -12.495 683 1HG ARG 93 1HG ARG 93 9.597 4.564 -14.871 684 2HG ARG 93 2HG ARG 93 10.408 3.864 -13.469 685 1HD ARG 93 1HD ARG 93 9.400 1.911 -13.796 686 2HD ARG 93 2HD ARG 93 7.814 2.679 -13.789 687 HE ARG 93 HE ARG 93 8.829 3.203 -16.273 688 1HH1 ARG 93 1HH1 ARG 93 8.217 0.313 -14.415 689 2HH1 ARG 93 2HH1 ARG 93 7.919 -0.670 -15.810 690 1HH2 ARG 93 1HH2 ARG 93 8.436 1.913 -18.107 691 2HH2 ARG 93 2HH2 ARG 93 8.043 0.239 -17.905 692 H TYR 94 H TYR 94 6.711 3.965 -14.838 693 HA TYR 94 HA TYR 94 3.961 4.824 -14.402 694 1HB TYR 94 1HB TYR 94 5.333 2.906 -16.209 695 2HB TYR 94 2HB TYR 94 3.676 2.528 -15.752 696 HD1 TYR 94 HD1 TYR 94 5.385 5.751 -16.512 697 HD2 TYR 94 HD2 TYR 94 2.285 3.027 -17.527 698 HE1 TYR 94 HE1 TYR 94 4.576 7.321 -18.209 699 HE2 TYR 94 HE2 TYR 94 1.458 4.589 -19.231 700 HH TYR 94 HH TYR 94 2.290 6.453 -20.583 701 H GLN 95 H GLN 95 2.597 3.909 -12.979 702 HA GLN 95 HA GLN 95 3.480 1.468 -11.584 703 1HB GLN 95 1HB GLN 95 3.284 3.986 -10.447 704 2HB GLN 95 2HB GLN 95 1.772 3.216 -9.987 705 1HG GLN 95 1HG GLN 95 4.200 1.591 -9.630 706 2HG GLN 95 2HG GLN 95 4.054 3.005 -8.589 707 1HE2 GLN 95 1HE2 GLN 95 4.007 1.236 -6.960 708 2HE2 GLN 95 2HE2 GLN 95 2.468 0.566 -6.551 709 H SER 96 H SER 96 2.058 -0.162 -11.651 710 HA SER 96 HA SER 96 -0.625 0.393 -12.675 711 1HB SER 96 1HB SER 96 0.839 -1.355 -13.736 712 2HB SER 96 2HB SER 96 0.681 -2.299 -12.256 713 HG SER 96 HG SER 96 -1.221 -1.724 -14.221 714 H HIS 97 H HIS 97 -2.498 -0.568 -11.760 715 HA HIS 97 HA HIS 97 -3.948 -0.994 -10.067 716 1HB HIS 97 1HB HIS 97 -2.229 -3.020 -10.057 717 2HB HIS 97 2HB HIS 97 -1.839 -2.365 -8.470 718 HD1 HIS 97 HD1 HIS 97 -2.970 -3.813 -6.826 719 HD2 HIS 97 HD2 HIS 97 -5.414 -2.973 -10.078 720 HE1 HIS 97 HE1 HIS 97 -5.181 -4.882 -6.296 721 HE2 HIS 97 HE2 HIS 97 -6.613 -4.450 -8.325 722 H VAL 98 H VAL 98 -3.266 1.519 -9.798 723 HA VAL 98 HA VAL 98 -2.644 1.800 -6.929 724 HB VAL 98 HB VAL 98 -0.790 2.655 -8.336 725 1HG1 VAL 98 1HG1 VAL 98 -2.984 4.170 -9.580 726 2HG1 VAL 98 2HG1 VAL 98 -1.450 3.620 -10.253 727 3HG1 VAL 98 3HG1 VAL 98 -1.506 5.076 -9.257 728 1HG2 VAL 98 1HG2 VAL 98 -1.031 5.116 -7.339 729 2HG2 VAL 98 2HG2 VAL 98 -0.649 3.711 -6.341 730 3HG2 VAL 98 3HG2 VAL 98 -2.305 4.314 -6.417 731 H LEU 99 H LEU 99 -3.892 3.163 -5.722 732 HA LEU 99 HA LEU 99 -6.309 4.188 -7.028 733 1HB LEU 99 1HB LEU 99 -5.728 3.450 -4.162 734 2HB LEU 99 2HB LEU 99 -7.191 4.282 -4.657 735 HG LEU 99 HG LEU 99 -7.460 2.238 -6.279 736 1HD1 LEU 99 1HD1 LEU 99 -6.379 0.293 -5.766 737 2HD1 LEU 99 2HD1 LEU 99 -6.093 0.763 -4.090 738 3HD1 LEU 99 3HD1 LEU 99 -5.112 1.457 -5.380 739 1HD2 LEU 99 1HD2 LEU 99 -8.804 2.970 -4.195 740 2HD2 LEU 99 2HD2 LEU 99 -7.939 1.666 -3.381 741 3HD2 LEU 99 3HD2 LEU 99 -8.961 1.312 -4.775 742 H LEU 100 H LEU 100 -6.917 6.343 -6.806 743 HA LEU 100 HA LEU 100 -4.987 8.040 -5.375 744 1HB LEU 100 1HB LEU 100 -5.858 8.140 -8.171 745 2HB LEU 100 2HB LEU 100 -5.854 9.689 -7.348 746 HG LEU 100 HG LEU 100 -3.481 7.828 -7.506 747 1HD1 LEU 100 1HD1 LEU 100 -3.765 10.452 -8.922 748 2HD1 LEU 100 2HD1 LEU 100 -4.284 8.938 -9.667 749 3HD1 LEU 100 3HD1 LEU 100 -2.597 9.159 -9.198 750 1HD2 LEU 100 1HD2 LEU 100 -3.126 10.670 -6.871 751 2HD2 LEU 100 2HD2 LEU 100 -2.357 9.244 -6.177 752 3HD2 LEU 100 3HD2 LEU 100 -3.963 9.732 -5.635 753 H ALA 101 H ALA 101 -5.720 9.635 -4.135 754 HA ALA 101 HA ALA 101 -8.521 10.460 -4.285 755 1HB ALA 101 1HB ALA 101 -8.727 8.770 -2.658 756 2HB ALA 101 2HB ALA 101 -8.627 10.277 -1.750 757 3HB ALA 101 3HB ALA 101 -7.215 9.229 -1.875 758 H THR 102 H THR 102 -8.872 12.555 -3.597 759 HA THR 102 HA THR 102 -6.445 14.106 -3.082 760 HB THR 102 HB THR 102 -7.633 14.971 -4.924 761 HG1 THR 102 HG1 THR 102 -7.216 16.799 -3.961 762 1HG2 THR 102 1HG2 THR 102 -9.770 14.416 -5.168 763 2HG2 THR 102 2HG2 THR 102 -10.132 15.791 -4.123 764 3HG2 THR 102 3HG2 THR 102 -9.992 14.171 -3.435 765 H GLY 103 H GLY 103 -6.065 15.158 -1.227 766 1HA GLY 103 1HA GLY 103 -8.176 15.029 0.845 767 2HA GLY 103 2HA GLY 103 -6.457 14.898 1.186 768 H PHE 104 H PHE 104 -6.005 16.621 2.406 769 HA PHE 104 HA PHE 104 -6.866 19.263 1.423 770 1HB PHE 104 1HB PHE 104 -6.258 18.398 4.259 771 2HB PHE 104 2HB PHE 104 -6.669 20.038 3.768 772 HD1 PHE 104 HD1 PHE 104 -8.910 20.030 2.198 773 HD2 PHE 104 HD2 PHE 104 -7.951 17.248 5.272 774 HE1 PHE 104 HE1 PHE 104 -11.300 19.516 2.473 775 HE2 PHE 104 HE2 PHE 104 -10.340 16.728 5.552 776 HZ PHE 104 HZ PHE 104 -12.018 17.863 4.151 777 H SER 105 H SER 105 -4.226 17.444 2.916 778 HA SER 105 HA SER 105 -2.315 19.231 1.635 779 1HB SER 105 1HB SER 105 -2.912 19.381 4.428 780 2HB SER 105 2HB SER 105 -1.277 18.748 4.241 781 HG SER 105 HG SER 105 -2.188 21.037 2.851 782 H GLU 106 H GLU 106 -0.218 18.328 1.402 783 HA GLU 106 HA GLU 106 -0.253 15.424 1.333 784 1HB GLU 106 1HB GLU 106 1.575 17.526 0.200 785 2HB GLU 106 2HB GLU 106 2.042 15.831 0.218 786 1HG GLU 106 1HG GLU 106 -0.628 16.282 -0.857 787 2HG GLU 106 2HG GLU 106 0.646 17.092 -1.767 788 HA PRO 107 HA PRO 107 2.182 14.884 4.978 789 1HB PRO 107 1HB PRO 107 3.336 12.495 4.459 790 2HB PRO 107 2HB PRO 107 1.616 12.656 4.831 791 1HG PRO 107 1HG PRO 107 2.958 12.366 2.170 792 2HG PRO 107 2HG PRO 107 1.490 11.576 2.775 793 1HD PRO 107 1HD PRO 107 1.433 13.728 1.117 794 2HD PRO 107 2HD PRO 107 0.170 13.406 2.321 795 H GLY 108 H GLY 108 4.573 13.798 5.401 796 1HA GLY 108 1HA GLY 108 6.387 15.446 3.751 797 2HA GLY 108 2HA GLY 108 6.644 15.088 5.451 798 H ASP 109 H ASP 109 6.729 12.621 5.900 799 HA ASP 109 HA ASP 109 8.699 11.523 4.037 800 1HB ASP 109 1HB ASP 109 7.971 10.745 6.868 801 2HB ASP 109 2HB ASP 109 9.188 9.925 5.895 802 H ALA 110 H ALA 110 5.514 10.929 5.317 803 HA ALA 110 HA ALA 110 3.884 9.445 4.755 804 1HB ALA 110 1HB ALA 110 5.287 8.378 2.392 805 2HB ALA 110 2HB ALA 110 5.009 10.120 2.404 806 3HB ALA 110 3HB ALA 110 3.648 9.008 2.554 807 H GLY 111 H GLY 111 3.364 7.164 4.716 808 1HA GLY 111 1HA GLY 111 4.873 4.963 4.581 809 2HA GLY 111 2HA GLY 111 5.374 5.614 6.133 810 H GLY 112 H GLY 112 2.203 5.401 4.520 811 1HA GLY 112 1HA GLY 112 1.269 3.802 6.820 812 2HA GLY 112 2HA GLY 112 0.338 5.168 6.226 813 H ILE 113 H ILE 113 -1.064 2.986 6.315 814 HA ILE 113 HA ILE 113 -1.130 2.005 3.539 815 HB ILE 113 HB ILE 113 -1.962 -0.150 4.324 816 1HG1 ILE 113 1HG1 ILE 113 -1.488 0.986 7.091 817 2HG1 ILE 113 2HG1 ILE 113 -3.046 0.555 6.392 818 1HG2 ILE 113 1HG2 ILE 113 0.619 0.628 5.674 819 2HG2 ILE 113 2HG2 ILE 113 0.441 0.162 3.983 820 3HG2 ILE 113 3HG2 ILE 113 0.112 -1.009 5.259 821 1HD1 ILE 113 1HD1 ILE 113 -1.264 -1.689 6.296 822 2HD1 ILE 113 2HD1 ILE 113 -2.833 -1.531 7.088 823 3HD1 ILE 113 3HD1 ILE 113 -1.364 -1.048 7.935 824 H LEU 114 H LEU 114 -3.154 1.721 2.602 825 HA LEU 114 HA LEU 114 -5.275 3.292 3.817 826 1HB LEU 114 1HB LEU 114 -4.974 3.786 1.541 827 2HB LEU 114 2HB LEU 114 -4.823 2.096 1.101 828 HG LEU 114 HG LEU 114 -7.207 1.756 1.450 829 1HD1 LEU 114 1HD1 LEU 114 -7.383 4.694 2.070 830 2HD1 LEU 114 2HD1 LEU 114 -7.445 3.412 3.279 831 3HD1 LEU 114 3HD1 LEU 114 -8.701 3.522 2.047 832 1HD2 LEU 114 1HD2 LEU 114 -6.206 2.749 -0.706 833 2HD2 LEU 114 2HD2 LEU 114 -6.984 4.246 -0.194 834 3HD2 LEU 114 3HD2 LEU 114 -7.954 2.803 -0.483 835 H ARG 115 H ARG 115 -6.728 2.370 5.102 836 HA ARG 115 HA ARG 115 -7.412 -0.457 4.625 837 1HB ARG 115 1HB ARG 115 -8.036 -0.425 7.110 838 2HB ARG 115 2HB ARG 115 -6.327 -0.437 6.697 839 1HG ARG 115 1HG ARG 115 -7.428 2.248 6.969 840 2HG ARG 115 2HG ARG 115 -7.544 1.284 8.442 841 1HD ARG 115 1HD ARG 115 -4.965 1.105 7.052 842 2HD ARG 115 2HD ARG 115 -5.352 2.706 7.681 843 HE ARG 115 HE ARG 115 -5.872 0.880 9.708 844 1HH1 ARG 115 1HH1 ARG 115 -3.121 2.003 7.877 845 2HH1 ARG 115 2HH1 ARG 115 -1.992 1.713 9.159 846 1HH2 ARG 115 1HH2 ARG 115 -4.389 0.497 11.393 847 2HH2 ARG 115 2HH2 ARG 115 -2.712 0.857 11.153 848 H CYS 116 H CYS 116 -9.550 -1.126 5.022 849 HA CYS 116 HA CYS 116 -11.541 1.041 4.889 850 1HB CYS 116 1HB CYS 116 -11.175 -0.469 2.823 851 2HB CYS 116 2HB CYS 116 -11.980 -1.718 3.765 852 H GLU 117 H GLU 117 -13.703 0.422 5.734 853 HA GLU 117 HA GLU 117 -13.575 -0.465 8.368 854 1HB GLU 117 1HB GLU 117 -15.966 -0.429 6.518 855 2HB GLU 117 2HB GLU 117 -16.042 -0.581 8.268 856 1HG GLU 117 1HG GLU 117 -14.558 1.744 7.233 857 2HG GLU 117 2HG GLU 117 -16.299 1.743 6.961 858 H HIS 118 H HIS 118 -13.715 -2.277 5.450 859 HA HIS 118 HA HIS 118 -14.666 -4.690 6.756 860 1HB HIS 118 1HB HIS 118 -13.717 -4.326 3.909 861 2HB HIS 118 2HB HIS 118 -14.629 -5.688 4.553 862 HD2 HIS 118 HD2 HIS 118 -17.294 -5.456 4.145 863 HE1 HIS 118 HE1 HIS 118 -17.449 -1.253 3.573 864 HE2 HIS 118 HE2 HIS 118 -18.777 -3.394 3.652 865 H GLY 119 H GLY 119 -11.662 -3.338 5.495 866 1HA GLY 119 1HA GLY 119 -10.023 -4.903 7.141 867 2HA GLY 119 2HA GLY 119 -10.122 -5.709 5.583 868 H VAL 120 H VAL 120 -8.129 -5.415 4.823 869 HA VAL 120 HA VAL 120 -6.987 -2.713 4.785 870 HB VAL 120 HB VAL 120 -5.540 -5.211 3.943 871 1HG1 VAL 120 1HG1 VAL 120 -3.706 -3.624 5.074 872 2HG1 VAL 120 2HG1 VAL 120 -4.845 -2.407 4.500 873 3HG1 VAL 120 3HG1 VAL 120 -4.136 -3.558 3.366 874 1HG2 VAL 120 1HG2 VAL 120 -4.824 -4.412 6.599 875 2HG2 VAL 120 2HG2 VAL 120 -5.382 -5.981 6.017 876 3HG2 VAL 120 3HG2 VAL 120 -6.551 -4.763 6.529 877 H ILE 121 H ILE 121 -6.636 -1.615 2.922 878 HA ILE 121 HA ILE 121 -7.677 -2.802 0.460 879 HB ILE 121 HB ILE 121 -6.819 0.043 0.979 880 1HG1 ILE 121 1HG1 ILE 121 -9.009 -1.231 2.066 881 2HG1 ILE 121 2HG1 ILE 121 -8.850 0.505 1.837 882 1HG2 ILE 121 1HG2 ILE 121 -8.342 0.386 -1.084 883 2HG2 ILE 121 2HG2 ILE 121 -8.066 -1.333 -1.366 884 3HG2 ILE 121 3HG2 ILE 121 -6.700 -0.217 -1.318 885 1HD1 ILE 121 1HD1 ILE 121 -10.958 -0.804 0.990 886 2HD1 ILE 121 2HD1 ILE 121 -9.930 -1.125 -0.403 887 3HD1 ILE 121 3HD1 ILE 121 -10.286 0.539 0.065 888 H GLY 122 H GLY 122 -4.940 -0.638 1.221 889 1HA GLY 122 1HA GLY 122 -3.042 -2.404 -0.018 890 2HA GLY 122 2HA GLY 122 -3.421 -1.009 -1.014 891 H LEU 123 H LEU 123 -1.125 -0.534 -0.770 892 HA LEU 123 HA LEU 123 -0.532 0.771 1.805 893 1HB LEU 123 1HB LEU 123 1.886 0.471 1.125 894 2HB LEU 123 2HB LEU 123 1.018 -0.984 1.576 895 HG LEU 123 HG LEU 123 1.093 -0.286 -1.312 896 1HD1 LEU 123 1HD1 LEU 123 3.275 -1.153 -1.654 897 2HD1 LEU 123 2HD1 LEU 123 3.437 -1.597 0.046 898 3HD1 LEU 123 3HD1 LEU 123 3.408 0.103 -0.424 899 1HD2 LEU 123 1HD2 LEU 123 1.592 -2.955 -0.059 900 2HD2 LEU 123 2HD2 LEU 123 0.868 -2.567 -1.620 901 3HD2 LEU 123 3HD2 LEU 123 -0.042 -2.298 -0.133 902 H VAL 124 H VAL 124 0.978 2.650 1.615 903 HA VAL 124 HA VAL 124 -0.045 4.476 -0.322 904 HB VAL 124 HB VAL 124 1.528 6.108 0.667 905 1HG1 VAL 124 1HG1 VAL 124 -0.381 6.292 1.854 906 2HG1 VAL 124 2HG1 VAL 124 0.606 5.606 3.145 907 3HG1 VAL 124 3HG1 VAL 124 -0.460 4.565 2.200 908 1HG2 VAL 124 1HG2 VAL 124 2.850 5.452 2.634 909 2HG2 VAL 124 2HG2 VAL 124 3.378 4.620 1.172 910 3HG2 VAL 124 3HG2 VAL 124 2.397 3.769 2.365 911 H THR 125 H THR 125 0.739 5.043 -2.249 912 HA THR 125 HA THR 125 3.408 4.051 -2.984 913 HB THR 125 HB THR 125 0.893 4.389 -4.598 914 HG1 THR 125 HG1 THR 125 1.465 2.375 -3.587 915 1HG2 THR 125 1HG2 THR 125 3.597 4.803 -5.583 916 2HG2 THR 125 2HG2 THR 125 2.044 5.106 -6.362 917 3HG2 THR 125 3HG2 THR 125 2.751 3.490 -6.403 918 H MET 126 H MET 126 1.624 6.419 -4.920 919 HA MET 126 HA MET 126 3.289 8.559 -3.830 920 1HB MET 126 1HB MET 126 3.638 7.343 -6.499 921 2HB MET 126 2HB MET 126 3.648 9.102 -6.452 922 1HG MET 126 1HG MET 126 5.413 7.298 -4.810 923 2HG MET 126 2HG MET 126 5.898 8.160 -6.268 924 1HE MET 126 1HE MET 126 5.829 11.444 -5.938 925 2HE MET 126 2HE MET 126 6.742 10.042 -6.496 926 3HE MET 126 3HE MET 126 7.392 11.065 -5.215 927 H GLY 127 H GLY 127 2.456 10.598 -4.040 928 1HA GLY 127 1HA GLY 127 -0.233 10.735 -5.255 929 2HA GLY 127 2HA GLY 127 0.262 11.658 -3.844 930 H GLY 128 H GLY 128 -0.838 13.184 -5.613 931 1HA GLY 128 1HA GLY 128 1.312 14.286 -7.306 932 2HA GLY 128 2HA GLY 128 -0.407 14.508 -7.595 933 H GLU 129 H GLU 129 -0.567 16.693 -7.536 934 HA GLU 129 HA GLU 129 0.801 18.305 -5.619 935 1HB GLU 129 1HB GLU 129 -1.596 19.103 -7.271 936 2HB GLU 129 2HB GLU 129 -0.376 20.160 -6.576 937 1HG GLU 129 1HG GLU 129 1.074 19.811 -8.253 938 2HG GLU 129 2HG GLU 129 0.644 18.108 -8.413 939 H GLY 130 H GLY 130 -2.132 16.527 -5.574 940 1HA GLY 130 1HA GLY 130 -2.613 17.250 -2.841 941 2HA GLY 130 2HA GLY 130 -3.819 17.918 -3.928 942 H VAL 131 H VAL 131 -2.418 14.908 -4.842 943 HA VAL 131 HA VAL 131 -4.806 13.492 -3.863 944 HB VAL 131 HB VAL 131 -3.434 12.547 -6.334 945 1HG1 VAL 131 1HG1 VAL 131 -6.321 12.575 -5.475 946 2HG1 VAL 131 2HG1 VAL 131 -5.209 11.219 -5.292 947 3HG1 VAL 131 3HG1 VAL 131 -5.666 11.774 -6.902 948 1HG2 VAL 131 1HG2 VAL 131 -4.763 13.974 -7.761 949 2HG2 VAL 131 2HG2 VAL 131 -3.766 14.966 -6.697 950 3HG2 VAL 131 3HG2 VAL 131 -5.483 14.757 -6.353 951 H VAL 132 H VAL 132 -4.515 11.187 -3.482 952 HA VAL 132 HA VAL 132 -1.739 10.555 -2.715 953 HB VAL 132 HB VAL 132 -2.593 9.234 -0.897 954 1HG1 VAL 132 1HG1 VAL 132 -4.237 11.145 0.089 955 2HG1 VAL 132 2HG1 VAL 132 -3.408 12.038 -1.187 956 3HG1 VAL 132 3HG1 VAL 132 -2.475 11.250 0.086 957 1HG2 VAL 132 1HG2 VAL 132 -5.247 9.699 -2.203 958 2HG2 VAL 132 2HG2 VAL 132 -5.152 9.366 -0.474 959 3HG2 VAL 132 3HG2 VAL 132 -4.532 8.190 -1.634 960 H GLY 133 H GLY 133 -0.821 8.988 -3.912 961 1HA GLY 133 1HA GLY 133 -2.562 7.090 -5.319 962 2HA GLY 133 2HA GLY 133 -0.870 7.378 -5.673 963 H PHE 134 H PHE 134 -2.983 5.210 -4.348 964 HA PHE 134 HA PHE 134 -0.896 4.047 -2.621 965 1HB PHE 134 1HB PHE 134 -3.877 3.588 -2.447 966 2HB PHE 134 2HB PHE 134 -2.656 2.983 -1.336 967 HD1 PHE 134 HD1 PHE 134 -1.045 5.631 -1.311 968 HD2 PHE 134 HD2 PHE 134 -5.164 4.711 -0.794 969 HE1 PHE 134 HE1 PHE 134 -1.311 7.632 0.093 970 HE2 PHE 134 HE2 PHE 134 -5.442 6.713 0.602 971 HZ PHE 134 HZ PHE 134 -3.514 8.178 1.051 972 H ALA 135 H ALA 135 -0.345 1.922 -2.844 973 HA ALA 135 HA ALA 135 -1.165 0.639 -5.324 974 1HB ALA 135 1HB ALA 135 0.631 -1.014 -4.698 975 2HB ALA 135 2HB ALA 135 0.989 0.018 -3.313 976 3HB ALA 135 3HB ALA 135 1.180 0.643 -4.952 977 H ASP 136 H ASP 136 -2.994 -0.499 -5.233 978 HA ASP 136 HA ASP 136 -4.090 -1.541 -2.843 979 1HB ASP 136 1HB ASP 136 -4.991 -1.089 -5.441 980 2HB ASP 136 2HB ASP 136 -5.115 -2.833 -5.231 981 H VAL 137 H VAL 137 -4.472 -3.688 -2.227 982 HA VAL 137 HA VAL 137 -2.330 -5.530 -3.014 983 HB VAL 137 HB VAL 137 -4.207 -5.687 -0.647 984 1HG1 VAL 137 1HG1 VAL 137 -3.490 -7.864 -0.958 985 2HG1 VAL 137 2HG1 VAL 137 -2.281 -7.228 0.155 986 3HG1 VAL 137 3HG1 VAL 137 -1.910 -7.367 -1.561 987 1HG2 VAL 137 1HG2 VAL 137 -1.397 -5.179 -0.092 988 2HG2 VAL 137 2HG2 VAL 137 -2.839 -4.378 0.531 989 3HG2 VAL 137 3HG2 VAL 137 -2.158 -3.886 -1.018 990 H ARG 138 H ARG 138 -5.229 -4.922 -4.177 991 HA ARG 138 HA ARG 138 -6.556 -7.438 -4.027 992 1HB ARG 138 1HB ARG 138 -7.018 -5.455 -6.229 993 2HB ARG 138 2HB ARG 138 -8.171 -6.526 -5.448 994 1HG ARG 138 1HG ARG 138 -7.406 -4.988 -3.354 995 2HG ARG 138 2HG ARG 138 -7.273 -3.840 -4.687 996 1HD ARG 138 1HD ARG 138 -9.702 -5.487 -3.991 997 2HD ARG 138 2HD ARG 138 -9.488 -3.765 -3.675 998 HE ARG 138 HE ARG 138 -9.291 -4.650 -6.445 999 1HH1 ARG 138 1HH1 ARG 138 -11.221 -3.144 -3.949 1000 2HH1 ARG 138 2HH1 ARG 138 -12.305 -2.396 -5.070 1001 1HH2 ARG 138 1HH2 ARG 138 -10.724 -3.670 -7.913 1002 2HH2 ARG 138 2HH2 ARG 138 -12.028 -2.698 -7.318 1003 H ASP 139 H ASP 139 -3.777 -6.528 -5.638 1004 HA ASP 139 HA ASP 139 -4.233 -8.288 -7.924 1005 1HB ASP 139 1HB ASP 139 -2.918 -5.923 -7.771 1006 2HB ASP 139 2HB ASP 139 -1.577 -7.043 -7.552 1007 H LEU 140 H LEU 140 -3.633 -8.915 -4.891 1008 HA LEU 140 HA LEU 140 -2.447 -11.408 -5.319 1009 1HB LEU 140 1HB LEU 140 -0.271 -11.112 -4.250 1010 2HB LEU 140 2HB LEU 140 -0.395 -10.184 -5.728 1011 HG LEU 140 HG LEU 140 0.588 -8.585 -4.481 1012 1HD1 LEU 140 1HD1 LEU 140 -1.547 -7.569 -4.895 1013 2HD1 LEU 140 2HD1 LEU 140 -0.975 -7.093 -3.294 1014 3HD1 LEU 140 3HD1 LEU 140 -2.225 -8.326 -3.454 1015 1HD2 LEU 140 1HD2 LEU 140 0.373 -10.419 -2.490 1016 2HD2 LEU 140 2HD2 LEU 140 -0.565 -9.073 -1.841 1017 3HD2 LEU 140 3HD2 LEU 140 1.113 -8.826 -2.326 1018 H LEU 141 H LEU 141 -4.637 -11.030 -4.076 1019 HA LEU 141 HA LEU 141 -4.443 -10.415 -1.302 1020 1HB LEU 141 1HB LEU 141 -6.498 -10.843 -3.165 1021 2HB LEU 141 2HB LEU 141 -6.722 -12.051 -1.913 1022 HG LEU 141 HG LEU 141 -8.002 -10.265 -1.170 1023 1HD1 LEU 141 1HD1 LEU 141 -5.882 -9.148 0.381 1024 2HD1 LEU 141 2HD1 LEU 141 -5.668 -10.891 0.247 1025 3HD1 LEU 141 3HD1 LEU 141 -7.178 -10.237 0.876 1026 1HD2 LEU 141 1HD2 LEU 141 -6.022 -8.667 -2.589 1027 2HD2 LEU 141 2HD2 LEU 141 -6.554 -7.945 -1.070 1028 3HD2 LEU 141 3HD2 LEU 141 -7.737 -8.362 -2.311 1029 H TRP 142 H TRP 142 -3.667 -13.198 -3.093 1030 HA TRP 142 HA TRP 142 -4.355 -15.264 -1.368 1031 1HB TRP 142 1HB TRP 142 -2.451 -16.514 -2.406 1032 2HB TRP 142 2HB TRP 142 -3.550 -15.780 -3.567 1033 HD1 TRP 142 HD1 TRP 142 -2.597 -13.337 -4.637 1034 HE1 TRP 142 HE1 TRP 142 -0.190 -12.757 -5.331 1035 HE3 TRP 142 HE3 TRP 142 -0.104 -16.938 -2.006 1036 HZ2 TRP 142 HZ2 TRP 142 2.418 -13.703 -4.831 1037 HZ3 TRP 142 HZ3 TRP 142 2.350 -17.033 -2.168 1038 HH2 TRP 142 HH2 TRP 142 3.584 -15.448 -3.554 1039 H LEU 143 H LEU 143 -4.059 -14.437 0.754 1040 HA LEU 143 HA LEU 143 -1.438 -15.045 1.831 1041 1HB LEU 143 1HB LEU 143 -2.736 -12.375 2.380 1042 2HB LEU 143 2HB LEU 143 -1.265 -12.973 3.119 1043 HG LEU 143 HG LEU 143 -0.477 -13.070 0.569 1044 1HD1 LEU 143 1HD1 LEU 143 -1.519 -10.654 -0.140 1045 2HD1 LEU 143 2HD1 LEU 143 -2.912 -11.463 0.577 1046 3HD1 LEU 143 3HD1 LEU 143 -2.047 -12.216 -0.764 1047 1HD2 LEU 143 1HD2 LEU 143 0.785 -11.187 1.006 1048 2HD2 LEU 143 2HD2 LEU 143 0.349 -11.715 2.630 1049 3HD2 LEU 143 3HD2 LEU 143 -0.521 -10.383 1.873 1050 H GLU 144 H GLU 144 -4.703 -13.840 2.542 1051 HA GLU 144 HA GLU 144 -5.006 -15.893 4.569 1052 1HB GLU 144 1HB GLU 144 -4.366 -13.185 5.260 1053 2HB GLU 144 2HB GLU 144 -5.991 -13.550 5.816 1054 1HG GLU 144 1HG GLU 144 -3.921 -15.576 6.375 1055 2HG GLU 144 2HG GLU 144 -3.793 -14.050 7.247 1056 H ASP 145 H ASP 145 -7.322 -15.003 5.764 1057 HA ASP 145 HA ASP 145 -9.259 -15.643 3.809 1058 1HB ASP 145 1HB ASP 145 -9.187 -15.185 6.676 1059 2HB ASP 145 2HB ASP 145 -10.640 -14.502 5.951 1060 H ASP 146 H ASP 146 -10.931 -14.405 2.938 1061 HA ASP 146 HA ASP 146 -10.257 -11.583 2.577 1062 1HB ASP 146 1HB ASP 146 -12.397 -13.128 1.115 1063 2HB ASP 146 2HB ASP 146 -11.598 -11.642 0.615 1064 H ALA 147 H ALA 147 -11.902 -9.923 2.727 1065 HA ALA 147 HA ALA 147 -13.467 -10.131 5.063 1066 1HB ALA 147 1HB ALA 147 -14.342 -7.936 4.472 1067 2HB ALA 147 2HB ALA 147 -13.676 -8.095 2.848 1068 3HB ALA 147 3HB ALA 147 -12.596 -8.000 4.239 1069 H MET 148 H MET 148 -15.664 -10.318 5.384 1070 HA MET 148 HA MET 148 -17.681 -10.344 3.498 1071 1HB MET 148 1HB MET 148 -18.064 -12.874 3.374 1072 2HB MET 148 2HB MET 148 -16.797 -12.199 2.358 1073 1HG MET 148 1HG MET 148 -15.240 -12.810 4.341 1074 2HG MET 148 2HG MET 148 -16.560 -13.878 4.813 1075 1HE MET 148 1HE MET 148 -16.986 -16.471 2.754 1076 2HE MET 148 2HE MET 148 -16.770 -15.851 4.390 1077 3HE MET 148 3HE MET 148 -15.506 -16.827 3.643 1078 H GLU 149 H GLU 149 -16.396 -11.745 6.440 1079 HA GLU 149 HA GLU 149 -17.286 -11.996 8.518 1080 1HB GLU 149 1HB GLU 149 -19.715 -10.521 7.496 1081 2HB GLU 149 2HB GLU 149 -19.205 -10.706 9.169 1082 1HG GLU 149 1HG GLU 149 -17.515 -9.159 8.970 1083 2HG GLU 149 2HG GLU 149 -17.394 -9.361 7.222 1084 H GLN 150 H GLN 150 -17.411 -14.245 8.166 1085 HA GLN 150 HA GLN 150 -20.115 -15.254 7.572 1086 1HB GLN 150 1HB GLN 150 -18.838 -17.458 7.183 1087 2HB GLN 150 2HB GLN 150 -18.713 -16.201 5.959 1088 1HG GLN 150 1HG GLN 150 -16.524 -15.787 6.401 1089 2HG GLN 150 2HG GLN 150 -16.664 -16.243 8.099 1090 1HE2 GLN 150 1HE2 GLN 150 -14.519 -17.149 6.883 1091 2HE2 GLN 150 2HE2 GLN 150 -14.645 -18.831 6.508 Start of MODEL 9 1 1H GLY 1 1H GLY 1 12.034 -8.950 15.778 2 2H GLY 1 2H GLY 1 12.600 -8.927 17.372 3 3H GLY 1 3H GLY 1 12.725 -7.541 16.411 4 1HA GLY 1 1HA GLY 1 10.165 -8.787 17.249 5 2HA GLY 1 2HA GLY 1 10.903 -7.405 18.044 6 HA PRO 2 HA PRO 2 8.215 -6.192 14.274 7 1HB PRO 2 1HB PRO 2 5.964 -5.381 15.555 8 2HB PRO 2 2HB PRO 2 6.193 -7.034 14.972 9 1HG PRO 2 1HG PRO 2 6.544 -5.935 17.735 10 2HG PRO 2 2HG PRO 2 5.778 -7.450 17.223 11 1HD PRO 2 1HD PRO 2 8.299 -7.354 18.205 12 2HD PRO 2 2HD PRO 2 7.796 -8.538 16.980 13 H TYR 3 H TYR 3 9.422 -4.392 13.894 14 HA TYR 3 HA TYR 3 9.624 -2.258 15.816 15 1HB TYR 3 1HB TYR 3 11.183 -3.099 13.708 16 2HB TYR 3 2HB TYR 3 10.434 -1.639 13.066 17 HD1 TYR 3 HD1 TYR 3 11.738 0.243 13.270 18 HD2 TYR 3 HD2 TYR 3 11.916 -2.698 16.340 19 HE1 TYR 3 HE1 TYR 3 13.375 1.618 14.483 20 HE2 TYR 3 HE2 TYR 3 13.553 -1.331 17.562 21 HH TYR 3 HH TYR 3 15.365 0.785 16.470 22 H GLY 4 H GLY 4 8.193 -0.683 16.081 23 1HA GLY 4 1HA GLY 4 6.631 0.213 13.753 24 2HA GLY 4 2HA GLY 4 5.801 -0.212 15.242 25 H HIS 5 H HIS 5 7.121 2.284 13.485 26 HA HIS 5 HA HIS 5 7.451 3.967 15.878 27 1HB HIS 5 1HB HIS 5 8.798 3.907 13.239 28 2HB HIS 5 2HB HIS 5 8.471 5.503 13.906 29 HD1 HIS 5 HD1 HIS 5 10.734 6.216 14.679 30 HD2 HIS 5 HD2 HIS 5 9.763 2.383 15.959 31 HE1 HIS 5 HE1 HIS 5 12.581 5.542 16.248 32 HE2 HIS 5 HE2 HIS 5 11.927 3.255 17.076 33 H GLN 6 H GLN 6 6.278 4.140 12.515 34 HA GLN 6 HA GLN 6 4.023 5.757 13.450 35 1HB GLN 6 1HB GLN 6 4.322 7.232 11.417 36 2HB GLN 6 2HB GLN 6 5.507 7.449 12.697 37 1HG GLN 6 1HG GLN 6 6.979 5.844 11.371 38 2HG GLN 6 2HG GLN 6 5.851 6.105 10.041 39 1HE2 GLN 6 1HE2 GLN 6 8.048 6.841 9.189 40 2HE2 GLN 6 2HE2 GLN 6 8.393 8.526 9.347 41 H SER 7 H SER 7 5.497 4.096 10.677 42 HA SER 7 HA SER 7 3.019 2.705 10.162 43 1HB SER 7 1HB SER 7 3.932 4.967 8.486 44 2HB SER 7 2HB SER 7 3.431 3.520 7.611 45 HG SER 7 HG SER 7 1.755 5.140 8.149 46 H GLY 8 H GLY 8 3.269 1.103 8.378 47 1HA GLY 8 1HA GLY 8 5.956 0.476 7.524 48 2HA GLY 8 2HA GLY 8 5.318 -0.633 8.728 49 H ALA 9 H ALA 9 5.928 -1.893 6.574 50 HA ALA 9 HA ALA 9 4.163 -1.862 4.399 51 1HB ALA 9 1HB ALA 9 4.967 -4.449 4.456 52 2HB ALA 9 2HB ALA 9 6.209 -3.689 5.452 53 3HB ALA 9 3HB ALA 9 5.928 -3.123 3.805 54 H VAL 10 H VAL 10 3.049 -4.238 3.969 55 HA VAL 10 HA VAL 10 1.030 -4.448 6.102 56 HB VAL 10 HB VAL 10 0.746 -5.236 3.198 57 1HG1 VAL 10 1HG1 VAL 10 -1.660 -4.713 4.762 58 2HG1 VAL 10 2HG1 VAL 10 -0.721 -6.082 5.355 59 3HG1 VAL 10 3HG1 VAL 10 -1.277 -6.053 3.683 60 1HG2 VAL 10 1HG2 VAL 10 1.045 -2.768 3.641 61 2HG2 VAL 10 2HG2 VAL 10 -0.468 -2.835 4.545 62 3HG2 VAL 10 3HG2 VAL 10 -0.450 -3.226 2.826 63 H TYR 11 H TYR 11 1.394 -6.167 7.375 64 HA TYR 11 HA TYR 11 2.544 -8.600 6.203 65 1HB TYR 11 1HB TYR 11 3.696 -7.757 8.165 66 2HB TYR 11 2HB TYR 11 2.193 -7.711 9.075 67 HD1 TYR 11 HD1 TYR 11 5.107 -9.568 8.420 68 HD2 TYR 11 HD2 TYR 11 0.979 -10.041 9.340 69 HE1 TYR 11 HE1 TYR 11 5.557 -11.833 9.267 70 HE2 TYR 11 HE2 TYR 11 1.420 -12.307 10.181 71 HH TYR 11 HH TYR 11 3.573 -14.117 9.558 72 H VAL 12 H VAL 12 1.164 -10.125 5.573 73 HA VAL 12 HA VAL 12 -1.326 -10.473 7.107 74 HB VAL 12 HB VAL 12 -0.976 -10.966 4.145 75 1HG1 VAL 12 1HG1 VAL 12 -2.647 -12.429 4.665 76 2HG1 VAL 12 2HG1 VAL 12 -3.606 -10.960 4.479 77 3HG1 VAL 12 3HG1 VAL 12 -3.152 -11.520 6.089 78 1HG2 VAL 12 1HG2 VAL 12 -1.270 -8.765 3.957 79 2HG2 VAL 12 2HG2 VAL 12 -1.663 -8.592 5.668 80 3HG2 VAL 12 3HG2 VAL 12 -2.921 -9.038 4.516 81 H GLY 13 H GLY 13 -1.194 -12.263 8.286 82 1HA GLY 13 1HA GLY 13 -0.731 -14.418 8.930 83 2HA GLY 13 2HA GLY 13 -1.067 -14.824 7.255 84 H ASN 14 H ASN 14 0.481 -16.063 6.454 85 HA ASN 14 HA ASN 14 3.202 -15.840 7.472 86 1HB ASN 14 1HB ASN 14 1.812 -17.863 5.721 87 2HB ASN 14 2HB ASN 14 3.551 -17.895 6.000 88 1HD2 ASN 14 1HD2 ASN 14 0.412 -18.357 7.394 89 2HD2 ASN 14 2HD2 ASN 14 0.943 -19.129 8.846 90 H TYR 15 H TYR 15 1.846 -13.921 5.510 91 HA TYR 15 HA TYR 15 4.044 -13.895 3.550 92 1HB TYR 15 1HB TYR 15 1.095 -13.514 3.075 93 2HB TYR 15 2HB TYR 15 2.279 -12.775 2.008 94 HD1 TYR 15 HD1 TYR 15 0.169 -14.759 1.209 95 HD2 TYR 15 HD2 TYR 15 4.216 -15.308 2.391 96 HE1 TYR 15 HE1 TYR 15 0.254 -16.844 -0.078 97 HE2 TYR 15 HE2 TYR 15 4.309 -17.391 1.104 98 HH TYR 15 HH TYR 15 1.515 -18.896 -0.182 99 H LYS 16 H LYS 16 4.735 -11.795 2.928 100 HA LYS 16 HA LYS 16 3.545 -9.542 4.373 101 1HB LYS 16 1HB LYS 16 5.399 -10.308 5.771 102 2HB LYS 16 2HB LYS 16 6.492 -10.219 4.396 103 1HG LYS 16 1HG LYS 16 6.473 -7.889 4.376 104 2HG LYS 16 2HG LYS 16 5.008 -7.802 5.357 105 1HD LYS 16 1HD LYS 16 6.136 -8.263 7.318 106 2HD LYS 16 2HD LYS 16 7.462 -9.074 6.485 107 1HE LYS 16 1HE LYS 16 8.587 -7.167 6.827 108 2HE LYS 16 2HE LYS 16 7.633 -6.542 5.483 109 1HZ LYS 16 1HZ LYS 16 7.720 -5.336 7.808 110 2HZ LYS 16 2HZ LYS 16 6.454 -6.401 8.152 111 3HZ LYS 16 3HZ LYS 16 6.323 -5.324 6.854 112 H VAL 17 H VAL 17 3.010 -8.095 2.854 113 HA VAL 17 HA VAL 17 4.670 -7.967 0.447 114 HB VAL 17 HB VAL 17 2.868 -7.405 -0.787 115 1HG1 VAL 17 1HG1 VAL 17 2.257 -9.344 0.896 116 2HG1 VAL 17 2HG1 VAL 17 1.085 -8.720 -0.263 117 3HG1 VAL 17 3HG1 VAL 17 1.035 -8.183 1.415 118 1HG2 VAL 17 1HG2 VAL 17 1.726 -5.872 1.548 119 2HG2 VAL 17 2HG2 VAL 17 1.000 -5.977 -0.059 120 3HG2 VAL 17 3HG2 VAL 17 2.567 -5.194 0.153 121 H VAL 18 H VAL 18 6.080 -6.409 0.203 122 HA VAL 18 HA VAL 18 5.593 -3.798 1.450 123 HB VAL 18 HB VAL 18 7.110 -4.986 2.947 124 1HG1 VAL 18 1HG1 VAL 18 8.008 -6.448 1.041 125 2HG1 VAL 18 2HG1 VAL 18 9.135 -5.952 2.304 126 3HG1 VAL 18 3HG1 VAL 18 9.140 -5.126 0.745 127 1HG2 VAL 18 1HG2 VAL 18 8.763 -3.323 3.150 128 2HG2 VAL 18 2HG2 VAL 18 7.381 -2.514 2.410 129 3HG2 VAL 18 3HG2 VAL 18 8.757 -2.995 1.417 130 H ASN 19 H ASN 19 6.918 -2.063 0.516 131 HA ASN 19 HA ASN 19 6.896 -2.103 -2.298 132 1HB ASN 19 1HB ASN 19 7.096 -0.148 -0.373 133 2HB ASN 19 2HB ASN 19 8.707 -0.132 -1.087 134 1HD2 ASN 19 1HD2 ASN 19 8.875 0.188 -3.379 135 2HD2 ASN 19 2HD2 ASN 19 7.662 1.093 -4.211 136 H ARG 20 H ARG 20 8.520 -2.367 -3.808 137 HA ARG 20 HA ARG 20 10.577 -4.158 -3.256 138 1HB ARG 20 1HB ARG 20 9.560 -3.504 -5.521 139 2HB ARG 20 2HB ARG 20 10.705 -2.169 -5.512 140 1HG ARG 20 1HG ARG 20 12.562 -3.717 -5.422 141 2HG ARG 20 2HG ARG 20 11.447 -5.081 -5.329 142 1HD ARG 20 1HD ARG 20 11.659 -5.163 -7.556 143 2HD ARG 20 2HD ARG 20 10.569 -3.777 -7.564 144 HE ARG 20 HE ARG 20 12.994 -2.627 -7.306 145 1HH1 ARG 20 1HH1 ARG 20 11.731 -4.997 -9.535 146 2HH1 ARG 20 2HH1 ARG 20 12.766 -4.510 -10.835 147 1HH2 ARG 20 1HH2 ARG 20 14.355 -1.984 -9.014 148 2HH2 ARG 20 2HH2 ARG 20 14.255 -2.800 -10.539 149 H HIS 21 H HIS 21 10.696 -0.623 -3.554 150 HA HIS 21 HA HIS 21 13.487 -0.406 -3.132 151 1HB HIS 21 1HB HIS 21 11.561 1.326 -3.927 152 2HB HIS 21 2HB HIS 21 11.789 1.852 -2.262 153 HD1 HIS 21 HD1 HIS 21 14.126 0.965 -5.146 154 HD2 HIS 21 HD2 HIS 21 13.642 3.803 -2.150 155 HE1 HIS 21 HE1 HIS 21 16.032 2.580 -5.435 156 HE2 HIS 21 HE2 HIS 21 15.771 4.235 -3.554 157 H LEU 22 H LEU 22 10.990 -1.238 -1.011 158 HA LEU 22 HA LEU 22 12.530 -0.337 1.323 159 1HB LEU 22 1HB LEU 22 9.900 0.047 0.807 160 2HB LEU 22 2HB LEU 22 9.829 -1.444 1.726 161 HG LEU 22 HG LEU 22 11.438 -0.006 3.338 162 1HD1 LEU 22 1HD1 LEU 22 11.531 2.083 2.476 163 2HD1 LEU 22 2HD1 LEU 22 10.012 2.253 3.357 164 3HD1 LEU 22 3HD1 LEU 22 9.995 1.921 1.625 165 1HD2 LEU 22 1HD2 LEU 22 9.135 0.718 4.408 166 2HD2 LEU 22 2HD2 LEU 22 9.651 -0.968 4.384 167 3HD2 LEU 22 3HD2 LEU 22 8.494 -0.384 3.189 168 H ALA 23 H ALA 23 11.762 -3.123 -0.489 169 HA ALA 23 HA ALA 23 11.703 -5.030 1.606 170 1HB ALA 23 1HB ALA 23 10.965 -6.184 -0.147 171 2HB ALA 23 2HB ALA 23 12.650 -6.355 -0.639 172 3HB ALA 23 3HB ALA 23 11.669 -5.040 -1.289 173 H THR 24 H THR 24 13.328 -6.484 2.264 174 HA THR 24 HA THR 24 16.044 -5.399 1.982 175 HB THR 24 HB THR 24 16.576 -6.502 4.063 176 HG1 THR 24 HG1 THR 24 14.996 -7.744 5.138 177 1HG2 THR 24 1HG2 THR 24 14.773 -5.597 5.603 178 2HG2 THR 24 2HG2 THR 24 13.986 -5.001 4.141 179 3HG2 THR 24 3HG2 THR 24 15.603 -4.440 4.563 180 H HIS 25 H HIS 25 17.800 -7.134 2.138 181 HA HIS 25 HA HIS 25 17.678 -8.805 -0.076 182 1HB HIS 25 1HB HIS 25 19.723 -9.845 0.773 183 2HB HIS 25 2HB HIS 25 19.785 -8.098 0.991 184 HD1 HIS 25 HD1 HIS 25 19.593 -7.205 3.441 185 HD2 HIS 25 HD2 HIS 25 19.786 -11.342 3.107 186 HE1 HIS 25 HE1 HIS 25 20.088 -8.043 5.759 187 HE2 HIS 25 HE2 HIS 25 20.105 -10.554 5.551 188 H VAL 26 H VAL 26 16.683 -9.348 3.209 189 HA VAL 26 HA VAL 26 16.449 -12.189 3.011 190 HB VAL 26 HB VAL 26 15.056 -10.378 4.983 191 1HG1 VAL 26 1HG1 VAL 26 15.473 -13.301 4.734 192 2HG1 VAL 26 2HG1 VAL 26 14.111 -12.400 5.403 193 3HG1 VAL 26 3HG1 VAL 26 15.584 -12.603 6.350 194 1HG2 VAL 26 1HG2 VAL 26 17.802 -11.616 5.162 195 2HG2 VAL 26 2HG2 VAL 26 16.978 -10.747 6.457 196 3HG2 VAL 26 3HG2 VAL 26 17.445 -9.899 4.983 197 H ASP 27 H ASP 27 14.325 -9.470 2.365 198 HA ASP 27 HA ASP 27 11.900 -10.923 2.318 199 1HB ASP 27 1HB ASP 27 12.485 -8.281 2.244 200 2HB ASP 27 2HB ASP 27 12.181 -8.560 0.533 201 H TRP 28 H TRP 28 14.258 -9.995 -0.137 202 HA TRP 28 HA TRP 28 12.823 -11.254 -2.236 203 1HB TRP 28 1HB TRP 28 15.599 -10.114 -2.066 204 2HB TRP 28 2HB TRP 28 14.996 -10.903 -3.524 205 HD1 TRP 28 HD1 TRP 28 12.612 -9.762 -4.521 206 HE1 TRP 28 HE1 TRP 28 11.986 -7.271 -4.652 207 HE3 TRP 28 HE3 TRP 28 15.928 -7.918 -1.107 208 HZ2 TRP 28 HZ2 TRP 28 12.781 -4.843 -3.447 209 HZ3 TRP 28 HZ3 TRP 28 15.935 -5.503 -0.657 210 HH2 TRP 28 HH2 TRP 28 14.400 -3.996 -1.807 211 H GLN 29 H GLN 29 15.278 -12.234 0.010 212 HA GLN 29 HA GLN 29 16.254 -14.513 -1.289 213 1HB GLN 29 1HB GLN 29 16.363 -13.372 1.365 214 2HB GLN 29 2HB GLN 29 16.181 -15.118 1.455 215 1HG GLN 29 1HG GLN 29 18.116 -14.699 -0.500 216 2HG GLN 29 2HG GLN 29 18.490 -13.539 0.773 217 1HE2 GLN 29 1HE2 GLN 29 20.067 -14.349 1.955 218 2HE2 GLN 29 2HE2 GLN 29 20.151 -15.961 2.572 219 H ASN 30 H ASN 30 13.452 -14.050 0.811 220 HA ASN 30 HA ASN 30 12.528 -16.748 0.062 221 1HB ASN 30 1HB ASN 30 11.100 -16.540 2.179 222 2HB ASN 30 2HB ASN 30 12.828 -16.793 2.406 223 1HD2 ASN 30 1HD2 ASN 30 12.865 -15.889 4.433 224 2HD2 ASN 30 2HD2 ASN 30 12.661 -14.195 4.709 225 H CYS 31 H CYS 31 12.172 -14.327 -1.470 226 HA CYS 31 HA CYS 31 9.494 -13.384 -1.065 227 1HB CYS 31 1HB CYS 31 11.020 -11.842 -2.043 228 2HB CYS 31 2HB CYS 31 11.511 -12.995 -3.276 229 HG CYS 31 HG CYS 31 9.816 -11.114 -4.168 230 H VAL 32 H VAL 32 7.658 -14.090 -1.929 231 HA VAL 32 HA VAL 32 7.756 -16.472 -3.614 232 HB VAL 32 HB VAL 32 5.298 -16.612 -3.129 233 1HG1 VAL 32 1HG1 VAL 32 6.467 -18.042 -1.773 234 2HG1 VAL 32 2HG1 VAL 32 5.719 -16.997 -0.562 235 3HG1 VAL 32 3HG1 VAL 32 7.404 -16.747 -1.026 236 1HG2 VAL 32 1HG2 VAL 32 5.845 -14.463 -1.098 237 2HG2 VAL 32 2HG2 VAL 32 4.303 -15.237 -1.459 238 3HG2 VAL 32 3HG2 VAL 32 5.050 -14.165 -2.643 239 H TRP 33 H TRP 33 6.471 -13.171 -3.558 240 HA TRP 33 HA TRP 33 6.147 -13.335 -6.466 241 1HB TRP 33 1HB TRP 33 3.920 -13.629 -6.019 242 2HB TRP 33 2HB TRP 33 4.006 -12.794 -4.474 243 HD1 TRP 33 HD1 TRP 33 3.221 -12.224 -8.134 244 HE1 TRP 33 HE1 TRP 33 2.360 -9.817 -8.444 245 HE3 TRP 33 HE3 TRP 33 4.288 -10.387 -3.500 246 HZ2 TRP 33 HZ2 TRP 33 2.165 -7.442 -6.907 247 HZ3 TRP 33 HZ3 TRP 33 3.745 -8.042 -2.995 248 HH2 TRP 33 HH2 TRP 33 2.706 -6.608 -4.671 249 H GLU 34 H GLU 34 6.197 -11.314 -7.570 250 HA GLU 34 HA GLU 34 6.775 -8.894 -6.103 251 1HB GLU 34 1HB GLU 34 8.980 -9.705 -6.014 252 2HB GLU 34 2HB GLU 34 8.894 -10.384 -7.631 253 1HG GLU 34 1HG GLU 34 10.334 -8.439 -7.579 254 2HG GLU 34 2HG GLU 34 8.917 -8.140 -8.584 255 H ASP 35 H ASP 35 5.740 -7.330 -7.154 256 HA ASP 35 HA ASP 35 5.291 -7.619 -10.047 257 1HB ASP 35 1HB ASP 35 3.661 -6.575 -7.820 258 2HB ASP 35 2HB ASP 35 3.587 -5.635 -9.307 259 H TYR 36 H TYR 36 6.999 -6.642 -10.982 260 HA TYR 36 HA TYR 36 8.356 -4.382 -10.076 261 1HB TYR 36 1HB TYR 36 9.201 -4.210 -12.419 262 2HB TYR 36 2HB TYR 36 9.359 -5.819 -11.720 263 HD1 TYR 36 HD1 TYR 36 8.258 -7.691 -12.686 264 HD2 TYR 36 HD2 TYR 36 7.406 -3.767 -14.095 265 HE1 TYR 36 HE1 TYR 36 7.055 -8.647 -14.606 266 HE2 TYR 36 HE2 TYR 36 6.200 -4.713 -16.017 267 HH TYR 36 HH TYR 36 6.175 -6.840 -17.309 268 H ASN 37 H ASN 37 5.388 -4.643 -11.902 269 HA ASN 37 HA ASN 37 5.313 -2.115 -13.054 270 1HB ASN 37 1HB ASN 37 3.533 -4.326 -12.703 271 2HB ASN 37 2HB ASN 37 2.674 -2.842 -12.308 272 1HD2 ASN 37 1HD2 ASN 37 2.930 -4.874 -14.673 273 2HD2 ASN 37 2HD2 ASN 37 2.915 -3.833 -16.052 274 H ARG 38 H ARG 38 4.377 -3.192 -9.811 275 HA ARG 38 HA ARG 38 3.946 -0.358 -9.136 276 1HB ARG 38 1HB ARG 38 2.639 -1.511 -7.122 277 2HB ARG 38 2HB ARG 38 1.868 -1.109 -8.645 278 1HG ARG 38 1HG ARG 38 1.153 -3.218 -8.611 279 2HG ARG 38 2HG ARG 38 2.781 -3.634 -9.138 280 1HD ARG 38 1HD ARG 38 2.610 -5.006 -7.331 281 2HD ARG 38 2HD ARG 38 3.250 -3.570 -6.539 282 HE ARG 38 HE ARG 38 0.491 -4.548 -6.418 283 1HH1 ARG 38 1HH1 ARG 38 2.899 -2.233 -5.380 284 2HH1 ARG 38 2HH1 ARG 38 1.973 -1.699 -4.023 285 1HH2 ARG 38 1HH2 ARG 38 -0.725 -3.830 -4.642 286 2HH2 ARG 38 2HH2 ARG 38 -0.088 -2.598 -3.607 287 H ASP 39 H ASP 39 6.149 -2.724 -8.820 288 HA ASP 39 HA ASP 39 7.935 -3.071 -7.468 289 1HB ASP 39 1HB ASP 39 7.401 -0.277 -7.417 290 2HB ASP 39 2HB ASP 39 7.890 -0.754 -5.795 291 H LEU 40 H LEU 40 5.936 -4.520 -6.576 292 HA LEU 40 HA LEU 40 6.189 -4.303 -3.663 293 1HB LEU 40 1HB LEU 40 3.992 -3.385 -4.282 294 2HB LEU 40 2HB LEU 40 3.598 -4.884 -5.099 295 HG LEU 40 HG LEU 40 3.859 -6.045 -2.870 296 1HD1 LEU 40 1HD1 LEU 40 3.286 -3.884 -1.172 297 2HD1 LEU 40 2HD1 LEU 40 4.698 -3.410 -2.115 298 3HD1 LEU 40 3HD1 LEU 40 4.724 -4.903 -1.178 299 1HD2 LEU 40 1HD2 LEU 40 1.644 -5.626 -2.253 300 2HD2 LEU 40 2HD2 LEU 40 1.688 -5.255 -3.977 301 3HD2 LEU 40 3HD2 LEU 40 1.715 -3.948 -2.792 302 H LEU 41 H LEU 41 6.631 -6.188 -2.685 303 HA LEU 41 HA LEU 41 6.225 -8.659 -4.210 304 1HB LEU 41 1HB LEU 41 8.389 -9.513 -3.577 305 2HB LEU 41 2HB LEU 41 8.549 -8.031 -4.483 306 HG LEU 41 HG LEU 41 9.838 -8.696 -2.114 307 1HD1 LEU 41 1HD1 LEU 41 10.186 -6.954 -4.092 308 2HD1 LEU 41 2HD1 LEU 41 11.066 -6.858 -2.565 309 3HD1 LEU 41 3HD1 LEU 41 9.652 -5.840 -2.835 310 1HD2 LEU 41 1HD2 LEU 41 8.115 -8.182 -0.624 311 2HD2 LEU 41 2HD2 LEU 41 7.633 -6.751 -1.529 312 3HD2 LEU 41 3HD2 LEU 41 9.146 -6.755 -0.636 313 H VAL 42 H VAL 42 6.161 -10.616 -2.972 314 HA VAL 42 HA VAL 42 5.367 -10.140 -0.181 315 HB VAL 42 HB VAL 42 4.197 -12.042 -2.213 316 1HG1 VAL 42 1HG1 VAL 42 3.632 -12.155 0.749 317 2HG1 VAL 42 2HG1 VAL 42 4.689 -13.286 -0.088 318 3HG1 VAL 42 3HG1 VAL 42 2.980 -13.209 -0.507 319 1HG2 VAL 42 1HG2 VAL 42 3.385 -9.570 -1.024 320 2HG2 VAL 42 2HG2 VAL 42 2.233 -10.839 -0.597 321 3HG2 VAL 42 3HG2 VAL 42 2.598 -10.511 -2.291 322 H SER 43 H SER 43 6.399 -11.218 1.331 323 HA SER 43 HA SER 43 8.122 -13.470 0.540 324 1HB SER 43 1HB SER 43 9.832 -12.732 1.964 325 2HB SER 43 2HB SER 43 9.240 -11.229 1.257 326 HG SER 43 HG SER 43 8.691 -12.288 3.824 327 H THR 44 H THR 44 8.452 -15.090 2.228 328 HA THR 44 HA THR 44 6.026 -15.366 3.831 329 HB THR 44 HB THR 44 6.465 -17.707 3.892 330 HG1 THR 44 HG1 THR 44 8.485 -18.240 4.059 331 1HG2 THR 44 1HG2 THR 44 7.453 -17.272 1.160 332 2HG2 THR 44 2HG2 THR 44 5.950 -16.452 1.594 333 3HG2 THR 44 3HG2 THR 44 6.075 -18.208 1.745 334 H THR 45 H THR 45 6.006 -15.045 5.911 335 HA THR 45 HA THR 45 8.539 -14.771 7.346 336 HB THR 45 HB THR 45 7.529 -13.204 8.645 337 HG1 THR 45 HG1 THR 45 5.150 -14.734 8.485 338 1HG2 THR 45 1HG2 THR 45 6.722 -12.853 6.138 339 2HG2 THR 45 2HG2 THR 45 6.232 -11.788 7.454 340 3HG2 THR 45 3HG2 THR 45 5.145 -13.064 6.901 341 H THR 46 H THR 46 7.636 -15.173 9.946 342 HA THR 46 HA THR 46 6.663 -17.935 10.011 343 HB THR 46 HB THR 46 9.121 -18.051 10.024 344 HG1 THR 46 HG1 THR 46 8.077 -18.619 12.595 345 1HG2 THR 46 1HG2 THR 46 10.278 -17.292 12.142 346 2HG2 THR 46 2HG2 THR 46 8.879 -16.251 12.408 347 3HG2 THR 46 3HG2 THR 46 9.871 -16.044 10.965 348 H ALA 47 H ALA 47 5.201 -15.664 10.637 349 HA ALA 47 HA ALA 47 4.819 -16.044 13.524 350 1HB ALA 47 1HB ALA 47 5.057 -13.421 12.079 351 2HB ALA 47 2HB ALA 47 5.951 -13.986 13.490 352 3HB ALA 47 3HB ALA 47 4.245 -13.567 13.638 353 H HIS 48 H HIS 48 2.656 -14.688 14.084 354 HA HIS 48 HA HIS 48 0.618 -15.900 12.384 355 1HB HIS 48 1HB HIS 48 0.577 -14.722 15.156 356 2HB HIS 48 2HB HIS 48 -0.908 -15.115 14.294 357 HD1 HIS 48 HD1 HIS 48 0.894 -17.727 13.098 358 HD2 HIS 48 HD2 HIS 48 -0.324 -16.809 16.964 359 HE1 HIS 48 HE1 HIS 48 0.913 -19.910 14.345 360 HE2 HIS 48 HE2 HIS 48 0.088 -19.343 16.657 361 H GLY 49 H GLY 49 -1.120 -14.758 11.498 362 1HA GLY 49 1HA GLY 49 -0.496 -12.185 10.489 363 2HA GLY 49 2HA GLY 49 -2.038 -13.009 10.324 364 H CYS 50 H CYS 50 -1.692 -10.221 10.741 365 HA CYS 50 HA CYS 50 -3.114 -9.956 13.296 366 1HB CYS 50 1HB CYS 50 -0.553 -9.131 13.088 367 2HB CYS 50 2HB CYS 50 -1.378 -7.686 12.513 368 HG CYS 50 HG CYS 50 -2.017 -7.149 14.814 369 H ASP 51 H ASP 51 -2.235 -8.314 10.265 370 HA ASP 51 HA ASP 51 -4.643 -6.693 10.383 371 1HB ASP 51 1HB ASP 51 -2.377 -6.824 8.386 372 2HB ASP 51 2HB ASP 51 -3.761 -5.746 8.223 373 H THR 52 H THR 52 -6.276 -6.709 8.794 374 HA THR 52 HA THR 52 -6.425 -9.191 7.209 375 HB THR 52 HB THR 52 -8.727 -7.770 8.563 376 HG1 THR 52 HG1 THR 52 -7.279 -8.919 9.986 377 1HG2 THR 52 1HG2 THR 52 -9.549 -8.903 6.639 378 2HG2 THR 52 2HG2 THR 52 -9.958 -9.867 8.058 379 3HG2 THR 52 3HG2 THR 52 -8.614 -10.347 7.024 380 H ILE 53 H ILE 53 -6.393 -8.769 5.110 381 HA ILE 53 HA ILE 53 -6.881 -6.142 4.079 382 HB ILE 53 HB ILE 53 -6.792 -8.520 2.284 383 1HG1 ILE 53 1HG1 ILE 53 -4.780 -7.959 4.267 384 2HG1 ILE 53 2HG1 ILE 53 -4.844 -9.262 3.088 385 1HG2 ILE 53 1HG2 ILE 53 -7.113 -6.299 1.350 386 2HG2 ILE 53 2HG2 ILE 53 -5.576 -6.984 0.832 387 3HG2 ILE 53 3HG2 ILE 53 -5.613 -5.756 2.097 388 1HD1 ILE 53 1HD1 ILE 53 -2.812 -8.155 2.723 389 2HD1 ILE 53 2HD1 ILE 53 -3.564 -6.564 2.815 390 3HD1 ILE 53 3HD1 ILE 53 -3.876 -7.609 1.430 391 H ALA 54 H ALA 54 -8.588 -5.367 2.957 392 HA ALA 54 HA ALA 54 -11.074 -6.844 3.210 393 1HB ALA 54 1HB ALA 54 -10.347 -4.112 3.269 394 2HB ALA 54 2HB ALA 54 -11.939 -4.825 3.524 395 3HB ALA 54 3HB ALA 54 -11.438 -4.338 1.905 396 H ARG 55 H ARG 55 -11.886 -8.029 1.614 397 HA ARG 55 HA ARG 55 -10.776 -7.803 -1.066 398 1HB ARG 55 1HB ARG 55 -11.186 -10.015 0.120 399 2HB ARG 55 2HB ARG 55 -12.903 -9.727 -0.125 400 1HG ARG 55 1HG ARG 55 -12.391 -11.061 -1.921 401 2HG ARG 55 2HG ARG 55 -12.228 -9.450 -2.622 402 1HD ARG 55 1HD ARG 55 -10.048 -9.730 -3.004 403 2HD ARG 55 2HD ARG 55 -9.766 -10.388 -1.396 404 HE ARG 55 HE ARG 55 -10.617 -12.544 -2.336 405 1HH1 ARG 55 1HH1 ARG 55 -9.170 -10.141 -4.430 406 2HH1 ARG 55 2HH1 ARG 55 -8.686 -11.300 -5.618 407 1HH2 ARG 55 1HH2 ARG 55 -9.974 -14.054 -3.903 408 2HH2 ARG 55 2HH2 ARG 55 -9.140 -13.515 -5.322 409 H CYS 56 H CYS 56 -12.470 -5.698 0.047 410 HA CYS 56 HA CYS 56 -14.897 -5.865 -1.574 411 1HB CYS 56 1HB CYS 56 -15.643 -3.920 -0.296 412 2HB CYS 56 2HB CYS 56 -15.112 -5.195 0.798 413 H GLN 57 H GLN 57 -15.544 -3.897 -2.757 414 HA GLN 57 HA GLN 57 -13.254 -2.783 -4.192 415 1HB GLN 57 1HB GLN 57 -16.215 -2.870 -4.766 416 2HB GLN 57 2HB GLN 57 -15.114 -1.867 -5.700 417 1HG GLN 57 1HG GLN 57 -13.894 -3.794 -6.439 418 2HG GLN 57 2HG GLN 57 -14.834 -4.845 -5.380 419 1HE2 GLN 57 1HE2 GLN 57 -15.001 -2.756 -8.198 420 2HE2 GLN 57 2HE2 GLN 57 -16.384 -3.509 -8.907 421 H CYS 58 H CYS 58 -16.407 -1.473 -3.206 422 HA CYS 58 HA CYS 58 -17.034 0.542 -2.367 423 1HB CYS 58 1HB CYS 58 -14.403 0.189 -0.922 424 2HB CYS 58 2HB CYS 58 -15.590 1.425 -0.519 425 H THR 59 H THR 59 -16.638 2.850 -2.318 426 HA THR 59 HA THR 59 -14.587 3.672 -4.266 427 HB THR 59 HB THR 59 -17.006 5.350 -3.827 428 HG1 THR 59 HG1 THR 59 -18.135 4.074 -5.367 429 1HG2 THR 59 1HG2 THR 59 -15.678 6.320 -5.420 430 2HG2 THR 59 2HG2 THR 59 -16.773 5.360 -6.416 431 3HG2 THR 59 3HG2 THR 59 -15.145 4.772 -6.078 432 H THR 60 H THR 60 -15.523 3.866 -1.064 433 HA THR 60 HA THR 60 -13.898 6.282 -0.692 434 HB THR 60 HB THR 60 -15.377 7.183 0.916 435 HG1 THR 60 HG1 THR 60 -15.968 5.357 2.040 436 1HG2 THR 60 1HG2 THR 60 -17.642 6.292 -0.642 437 2HG2 THR 60 2HG2 THR 60 -16.289 6.786 -1.659 438 3HG2 THR 60 3HG2 THR 60 -16.950 7.905 -0.466 439 H GLY 61 H GLY 61 -12.235 5.958 0.598 440 1HA GLY 61 1HA GLY 61 -12.461 3.974 2.760 441 2HA GLY 61 2HA GLY 61 -11.098 3.898 1.652 442 H VAL 62 H VAL 62 -10.769 4.215 4.422 443 HA VAL 62 HA VAL 62 -10.069 7.051 4.715 444 HB VAL 62 HB VAL 62 -11.427 6.168 6.525 445 1HG1 VAL 62 1HG1 VAL 62 -10.842 3.823 6.377 446 2HG1 VAL 62 2HG1 VAL 62 -10.556 4.410 8.015 447 3HG1 VAL 62 3HG1 VAL 62 -9.200 4.172 6.914 448 1HG2 VAL 62 1HG2 VAL 62 -9.143 6.315 8.197 449 2HG2 VAL 62 2HG2 VAL 62 -10.331 7.570 7.844 450 3HG2 VAL 62 3HG2 VAL 62 -8.891 7.410 6.838 451 H TYR 63 H TYR 63 -8.026 7.734 4.822 452 HA TYR 63 HA TYR 63 -5.905 5.694 4.880 453 1HB TYR 63 1HB TYR 63 -4.661 6.880 3.287 454 2HB TYR 63 2HB TYR 63 -6.307 6.964 2.683 455 HD1 TYR 63 HD1 TYR 63 -3.777 8.896 4.607 456 HD2 TYR 63 HD2 TYR 63 -7.270 9.050 2.175 457 HE1 TYR 63 HE1 TYR 63 -3.583 11.343 4.491 458 HE2 TYR 63 HE2 TYR 63 -7.081 11.497 2.057 459 HH TYR 63 HH TYR 63 -5.135 13.296 4.089 460 H PHE 64 H PHE 64 -4.294 5.926 6.320 461 HA PHE 64 HA PHE 64 -4.583 7.782 8.446 462 1HB PHE 64 1HB PHE 64 -3.584 5.510 8.685 463 2HB PHE 64 2HB PHE 64 -2.179 6.069 7.783 464 HD1 PHE 64 HD1 PHE 64 -0.485 7.356 8.818 465 HD2 PHE 64 HD2 PHE 64 -4.081 6.469 10.914 466 HE1 PHE 64 HE1 PHE 64 0.539 8.156 10.906 467 HE2 PHE 64 HE2 PHE 64 -3.064 7.268 13.007 468 HZ PHE 64 HZ PHE 64 -0.751 8.114 13.005 469 H CYS 65 H CYS 65 -3.680 9.724 8.790 470 HA CYS 65 HA CYS 65 -2.096 10.879 6.635 471 1HB CYS 65 1HB CYS 65 -3.905 11.895 8.697 472 2HB CYS 65 2HB CYS 65 -2.451 12.868 8.518 473 HG CYS 65 HG CYS 65 -3.134 13.477 6.153 474 H ALA 66 H ALA 66 -0.156 12.088 7.058 475 HA ALA 66 HA ALA 66 1.482 10.812 9.104 476 1HB ALA 66 1HB ALA 66 2.218 12.613 6.801 477 2HB ALA 66 2HB ALA 66 2.401 10.861 6.878 478 3HB ALA 66 3HB ALA 66 3.371 11.895 7.926 479 H SER 67 H SER 67 0.271 13.987 8.194 480 HA SER 67 HA SER 67 1.687 15.262 10.396 481 1HB SER 67 1HB SER 67 1.594 16.481 8.293 482 2HB SER 67 2HB SER 67 -0.166 16.394 8.287 483 HG SER 67 HG SER 67 1.158 18.340 9.220 484 H LYS 68 H LYS 68 -1.667 14.741 9.339 485 HA LYS 68 HA LYS 68 -2.892 15.914 11.585 486 1HB LYS 68 1HB LYS 68 -3.905 13.777 9.707 487 2HB LYS 68 2HB LYS 68 -4.901 14.618 10.886 488 1HG LYS 68 1HG LYS 68 -3.382 16.026 8.709 489 2HG LYS 68 2HG LYS 68 -5.048 15.473 8.536 490 1HD LYS 68 1HD LYS 68 -5.413 16.807 10.754 491 2HD LYS 68 2HD LYS 68 -3.932 17.637 10.269 492 1HE LYS 68 1HE LYS 68 -5.579 17.497 7.982 493 2HE LYS 68 2HE LYS 68 -6.607 18.010 9.320 494 1HZ LYS 68 1HZ LYS 68 -5.798 20.019 8.763 495 2HZ LYS 68 2HZ LYS 68 -4.400 19.398 8.040 496 3HZ LYS 68 3HZ LYS 68 -4.483 19.552 9.722 497 H SER 69 H SER 69 -1.475 12.781 11.074 498 HA SER 69 HA SER 69 -1.173 10.974 12.427 499 1HB SER 69 1HB SER 69 -1.810 12.665 14.824 500 2HB SER 69 2HB SER 69 -0.588 11.407 14.642 501 HG SER 69 HG SER 69 0.653 13.111 14.414 502 H LYS 70 H LYS 70 -3.909 11.771 11.524 503 HA LYS 70 HA LYS 70 -5.409 10.067 13.386 504 1HB LYS 70 1HB LYS 70 -6.604 12.489 12.038 505 2HB LYS 70 2HB LYS 70 -7.343 11.472 13.265 506 1HG LYS 70 1HG LYS 70 -6.440 12.648 14.921 507 2HG LYS 70 2HG LYS 70 -4.844 12.633 14.170 508 1HD LYS 70 1HD LYS 70 -5.293 14.876 14.101 509 2HD LYS 70 2HD LYS 70 -5.968 14.381 12.548 510 1HE LYS 70 1HE LYS 70 -7.746 15.560 13.319 511 2HE LYS 70 2HE LYS 70 -8.126 14.007 14.061 512 1HZ LYS 70 1HZ LYS 70 -8.292 15.343 15.869 513 2HZ LYS 70 2HZ LYS 70 -7.173 16.475 15.299 514 3HZ LYS 70 3HZ LYS 70 -6.634 15.018 15.967 515 H HIS 71 H HIS 71 -7.525 9.339 12.329 516 HA HIS 71 HA HIS 71 -6.855 8.241 9.733 517 1HB HIS 71 1HB HIS 71 -8.876 6.896 10.007 518 2HB HIS 71 2HB HIS 71 -7.899 6.823 11.468 519 HD1 HIS 71 HD1 HIS 71 -11.270 7.449 10.333 520 HD2 HIS 71 HD2 HIS 71 -8.941 8.638 13.562 521 HE1 HIS 71 HE1 HIS 71 -12.894 8.295 12.057 522 HE2 HIS 71 HE2 HIS 71 -11.468 8.927 14.035 523 H TYR 72 H TYR 72 -7.523 9.041 7.840 524 HA TYR 72 HA TYR 72 -9.632 11.098 7.884 525 1HB TYR 72 1HB TYR 72 -6.967 11.060 6.759 526 2HB TYR 72 2HB TYR 72 -8.166 11.386 5.515 527 HD1 TYR 72 HD1 TYR 72 -8.682 13.591 5.120 528 HD2 TYR 72 HD2 TYR 72 -7.389 12.463 9.014 529 HE1 TYR 72 HE1 TYR 72 -8.767 15.944 5.822 530 HE2 TYR 72 HE2 TYR 72 -7.471 14.814 9.732 531 HH TYR 72 HH TYR 72 -8.561 16.895 9.093 532 HA PRO 73 HA PRO 73 -11.646 8.097 5.159 533 1HB PRO 73 1HB PRO 73 -14.036 9.704 5.403 534 2HB PRO 73 2HB PRO 73 -13.717 8.107 6.083 535 1HG PRO 73 1HG PRO 73 -13.999 10.371 7.593 536 2HG PRO 73 2HG PRO 73 -13.057 8.955 8.096 537 1HD PRO 73 1HD PRO 73 -12.108 11.543 6.918 538 2HD PRO 73 2HD PRO 73 -11.407 10.577 8.238 539 H VAL 74 H VAL 74 -11.279 8.304 3.024 540 HA VAL 74 HA VAL 74 -12.144 10.781 1.700 541 HB VAL 74 HB VAL 74 -9.494 9.429 1.186 542 1HG1 VAL 74 1HG1 VAL 74 -10.886 11.778 -0.042 543 2HG1 VAL 74 2HG1 VAL 74 -10.095 10.410 -0.829 544 3HG1 VAL 74 3HG1 VAL 74 -9.125 11.660 -0.047 545 1HG2 VAL 74 1HG2 VAL 74 -8.989 12.002 2.041 546 2HG2 VAL 74 2HG2 VAL 74 -8.789 10.530 2.991 547 3HG2 VAL 74 3HG2 VAL 74 -10.283 11.459 3.109 548 H SER 75 H SER 75 -12.638 10.617 -0.494 549 HA SER 75 HA SER 75 -13.290 7.901 -1.379 550 1HB SER 75 1HB SER 75 -14.232 10.549 -2.509 551 2HB SER 75 2HB SER 75 -14.834 8.950 -2.947 552 HG SER 75 HG SER 75 -16.255 9.505 -1.453 553 H PHE 76 H PHE 76 -12.326 7.001 -3.138 554 HA PHE 76 HA PHE 76 -10.779 8.712 -4.922 555 1HB PHE 76 1HB PHE 76 -8.929 6.804 -4.674 556 2HB PHE 76 2HB PHE 76 -8.932 8.253 -3.681 557 HD1 PHE 76 HD1 PHE 76 -7.808 7.424 -1.796 558 HD2 PHE 76 HD2 PHE 76 -11.221 5.370 -3.284 559 HE1 PHE 76 HE1 PHE 76 -7.850 6.052 0.234 560 HE2 PHE 76 HE2 PHE 76 -11.272 3.984 -1.252 561 HZ PHE 76 HZ PHE 76 -9.585 4.323 0.510 562 H GLU 77 H GLU 77 -9.682 7.312 -6.643 563 HA GLU 77 HA GLU 77 -11.635 5.316 -7.577 564 1HB GLU 77 1HB GLU 77 -11.152 7.568 -8.860 565 2HB GLU 77 2HB GLU 77 -9.731 6.702 -9.425 566 1HG GLU 77 1HG GLU 77 -10.949 5.731 -10.987 567 2HG GLU 77 2HG GLU 77 -11.942 4.976 -9.742 568 H GLY 78 H GLY 78 -10.733 3.519 -8.863 569 1HA GLY 78 1HA GLY 78 -8.031 2.838 -7.887 570 2HA GLY 78 2HA GLY 78 -9.299 1.662 -8.180 571 HA PRO 79 HA PRO 79 -7.796 2.992 -12.583 572 1HB PRO 79 1HB PRO 79 -5.351 4.536 -12.113 573 2HB PRO 79 2HB PRO 79 -6.742 4.927 -13.124 574 1HG PRO 79 1HG PRO 79 -6.197 6.233 -10.819 575 2HG PRO 79 2HG PRO 79 -7.846 5.995 -11.424 576 1HD PRO 79 1HD PRO 79 -6.397 4.546 -9.251 577 2HD PRO 79 2HD PRO 79 -8.094 5.029 -9.355 578 H GLY 80 H GLY 80 -6.623 1.543 -13.705 579 1HA GLY 80 1HA GLY 80 -5.079 -0.392 -12.420 580 2HA GLY 80 2HA GLY 80 -5.114 -0.123 -14.156 581 H LEU 81 H LEU 81 -3.535 1.192 -15.118 582 HA LEU 81 HA LEU 81 -1.100 1.409 -13.521 583 1HB LEU 81 1HB LEU 81 -1.517 0.470 -16.035 584 2HB LEU 81 2HB LEU 81 -0.974 2.105 -16.364 585 HG LEU 81 HG LEU 81 0.973 0.830 -16.411 586 1HD1 LEU 81 1HD1 LEU 81 2.142 1.365 -14.179 587 2HD1 LEU 81 2HD1 LEU 81 0.642 2.195 -13.779 588 3HD1 LEU 81 3HD1 LEU 81 1.574 2.695 -15.188 589 1HD2 LEU 81 1HD2 LEU 81 0.641 -1.260 -15.644 590 2HD2 LEU 81 2HD2 LEU 81 -0.345 -0.718 -14.285 591 3HD2 LEU 81 3HD2 LEU 81 1.414 -0.607 -14.200 592 H VAL 82 H VAL 82 -0.523 3.276 -12.658 593 HA VAL 82 HA VAL 82 -1.284 5.766 -14.039 594 HB VAL 82 HB VAL 82 -1.015 5.502 -11.037 595 1HG1 VAL 82 1HG1 VAL 82 -1.993 7.688 -10.956 596 2HG1 VAL 82 2HG1 VAL 82 -2.268 7.682 -12.699 597 3HG1 VAL 82 3HG1 VAL 82 -0.622 7.734 -12.068 598 1HG2 VAL 82 1HG2 VAL 82 -2.919 4.163 -11.903 599 2HG2 VAL 82 2HG2 VAL 82 -3.567 5.625 -12.644 600 3HG2 VAL 82 3HG2 VAL 82 -3.423 5.517 -10.889 601 H GLU 83 H GLU 83 0.425 6.904 -14.676 602 HA GLU 83 HA GLU 83 3.072 6.151 -13.929 603 1HB GLU 83 1HB GLU 83 3.695 8.218 -15.280 604 2HB GLU 83 2HB GLU 83 2.818 6.958 -16.137 605 1HG GLU 83 1HG GLU 83 0.924 8.215 -16.341 606 2HG GLU 83 2HG GLU 83 1.265 9.165 -14.894 607 H VAL 84 H VAL 84 3.799 6.573 -11.950 608 HA VAL 84 HA VAL 84 2.885 8.779 -10.390 609 HB VAL 84 HB VAL 84 4.796 8.106 -8.853 610 1HG1 VAL 84 1HG1 VAL 84 3.617 6.196 -8.003 611 2HG1 VAL 84 2HG1 VAL 84 2.850 5.920 -9.567 612 3HG1 VAL 84 3HG1 VAL 84 2.437 7.352 -8.625 613 1HG2 VAL 84 1HG2 VAL 84 4.982 5.555 -10.351 614 2HG2 VAL 84 2HG2 VAL 84 6.160 6.344 -9.300 615 3HG2 VAL 84 3HG2 VAL 84 5.909 6.933 -10.941 616 H GLN 85 H GLN 85 3.568 10.791 -10.419 617 HA GLN 85 HA GLN 85 5.654 11.668 -12.132 618 1HB GLN 85 1HB GLN 85 3.691 13.055 -11.635 619 2HB GLN 85 2HB GLN 85 4.181 13.156 -9.950 620 1HG GLN 85 1HG GLN 85 6.265 14.286 -10.682 621 2HG GLN 85 2HG GLN 85 5.633 14.290 -12.328 622 1HE2 GLN 85 1HE2 GLN 85 5.498 15.731 -9.211 623 2HE2 GLN 85 2HE2 GLN 85 4.398 17.004 -9.603 624 H GLU 86 H GLU 86 7.644 12.663 -11.579 625 HA GLU 86 HA GLU 86 9.041 11.348 -9.504 626 1HB GLU 86 1HB GLU 86 10.172 12.083 -11.539 627 2HB GLU 86 2HB GLU 86 9.817 13.760 -11.152 628 1HG GLU 86 1HG GLU 86 11.153 13.335 -9.002 629 2HG GLU 86 2HG GLU 86 11.747 11.897 -9.829 630 H SER 87 H SER 87 8.411 11.728 -7.472 631 HA SER 87 HA SER 87 8.767 14.435 -6.437 632 1HB SER 87 1HB SER 87 6.211 12.871 -6.347 633 2HB SER 87 2HB SER 87 6.613 13.960 -5.019 634 HG SER 87 HG SER 87 5.536 14.595 -7.323 635 H GLU 88 H GLU 88 8.794 14.473 -4.036 636 HA GLU 88 HA GLU 88 9.735 13.798 -2.086 637 1HB GLU 88 1HB GLU 88 7.610 12.284 -2.403 638 2HB GLU 88 2HB GLU 88 8.793 11.001 -2.588 639 1HG GLU 88 1HG GLU 88 8.453 10.860 -0.356 640 2HG GLU 88 2HG GLU 88 9.753 12.052 -0.363 641 H TYR 89 H TYR 89 10.086 10.647 -3.677 642 HA TYR 89 HA TYR 89 12.900 11.041 -4.158 643 1HB TYR 89 1HB TYR 89 13.448 8.976 -2.718 644 2HB TYR 89 2HB TYR 89 13.198 10.509 -1.890 645 HD1 TYR 89 HD1 TYR 89 11.017 7.717 -3.112 646 HD2 TYR 89 HD2 TYR 89 12.048 10.321 0.092 647 HE1 TYR 89 HE1 TYR 89 9.282 6.677 -1.717 648 HE2 TYR 89 HE2 TYR 89 10.316 9.284 1.497 649 HH TYR 89 HH TYR 89 9.136 6.896 1.505 650 H TYR 90 H TYR 90 10.358 10.224 -5.534 651 HA TYR 90 HA TYR 90 11.324 7.662 -6.612 652 1HB TYR 90 1HB TYR 90 8.988 7.912 -5.303 653 2HB TYR 90 2HB TYR 90 8.453 8.349 -6.922 654 HD1 TYR 90 HD1 TYR 90 8.843 6.706 -8.807 655 HD2 TYR 90 HD2 TYR 90 9.360 5.662 -4.715 656 HE1 TYR 90 HE1 TYR 90 8.690 4.326 -9.402 657 HE2 TYR 90 HE2 TYR 90 9.210 3.278 -5.298 658 HH TYR 90 HH TYR 90 7.944 2.101 -7.919 659 HA PRO 91 HA PRO 91 11.487 10.022 -10.400 660 1HB PRO 91 1HB PRO 91 12.470 8.118 -11.994 661 2HB PRO 91 2HB PRO 91 13.450 8.826 -10.702 662 1HG PRO 91 1HG PRO 91 11.989 6.216 -10.761 663 2HG PRO 91 2HG PRO 91 13.602 6.582 -10.125 664 1HD PRO 91 1HD PRO 91 11.323 6.373 -8.584 665 2HD PRO 91 2HD PRO 91 12.774 7.278 -8.115 666 H LYS 92 H LYS 92 10.299 10.278 -12.277 667 HA LYS 92 HA LYS 92 7.714 9.497 -12.463 668 1HB LYS 92 1HB LYS 92 9.701 10.506 -14.378 669 2HB LYS 92 2HB LYS 92 8.346 9.664 -15.119 670 1HG LYS 92 1HG LYS 92 7.362 11.447 -13.117 671 2HG LYS 92 2HG LYS 92 8.452 12.319 -14.195 672 1HD LYS 92 1HD LYS 92 7.137 11.189 -16.097 673 2HD LYS 92 2HD LYS 92 5.926 10.842 -14.860 674 1HE LYS 92 1HE LYS 92 6.894 13.615 -14.913 675 2HE LYS 92 2HE LYS 92 6.009 13.110 -16.350 676 1HZ LYS 92 1HZ LYS 92 4.086 12.948 -15.216 677 2HZ LYS 92 2HZ LYS 92 4.831 14.043 -14.166 678 3HZ LYS 92 3HZ LYS 92 4.819 12.393 -13.796 679 H ARG 93 H ARG 93 7.417 7.323 -11.904 680 HA ARG 93 HA ARG 93 8.131 5.408 -14.028 681 1HB ARG 93 1HB ARG 93 9.193 5.292 -11.577 682 2HB ARG 93 2HB ARG 93 7.710 4.399 -11.269 683 1HG ARG 93 1HG ARG 93 8.370 2.617 -12.475 684 2HG ARG 93 2HG ARG 93 9.197 3.605 -13.682 685 1HD ARG 93 1HD ARG 93 11.162 3.602 -12.539 686 2HD ARG 93 2HD ARG 93 10.371 3.535 -10.965 687 HE ARG 93 HE ARG 93 9.856 1.099 -12.007 688 1HH1 ARG 93 1HH1 ARG 93 12.795 2.935 -11.601 689 2HH1 ARG 93 2HH1 ARG 93 13.795 1.532 -11.424 690 1HH2 ARG 93 1HH2 ARG 93 11.169 -0.748 -11.775 691 2HH2 ARG 93 2HH2 ARG 93 12.872 -0.558 -11.523 692 H TYR 94 H TYR 94 6.759 3.379 -13.894 693 HA TYR 94 HA TYR 94 3.947 4.174 -13.761 694 1HB TYR 94 1HB TYR 94 5.499 2.152 -15.303 695 2HB TYR 94 2HB TYR 94 3.813 1.794 -14.948 696 HD1 TYR 94 HD1 TYR 94 2.617 2.086 -16.907 697 HD2 TYR 94 HD2 TYR 94 5.515 4.990 -15.805 698 HE1 TYR 94 HE1 TYR 94 1.924 3.481 -18.803 699 HE2 TYR 94 HE2 TYR 94 4.839 6.396 -17.693 700 HH TYR 94 HH TYR 94 2.020 6.020 -19.355 701 H GLN 95 H GLN 95 2.538 3.300 -12.343 702 HA GLN 95 HA GLN 95 3.429 0.998 -10.737 703 1HB GLN 95 1HB GLN 95 3.406 3.366 -9.626 704 2HB GLN 95 2HB GLN 95 1.667 3.110 -9.560 705 1HG GLN 95 1HG GLN 95 2.182 2.232 -7.553 706 2HG GLN 95 2HG GLN 95 2.472 0.789 -8.521 707 1HE2 GLN 95 1HE2 GLN 95 3.634 2.079 -5.972 708 2HE2 GLN 95 2HE2 GLN 95 5.340 1.923 -6.199 709 H SER 96 H SER 96 2.129 -0.718 -11.158 710 HA SER 96 HA SER 96 -0.507 -0.279 -12.258 711 1HB SER 96 1HB SER 96 -0.626 -2.656 -12.531 712 2HB SER 96 2HB SER 96 1.011 -2.157 -12.956 713 HG SER 96 HG SER 96 0.160 -3.308 -10.504 714 H HIS 97 H HIS 97 -2.476 -0.748 -11.371 715 HA HIS 97 HA HIS 97 -4.085 -0.937 -9.786 716 1HB HIS 97 1HB HIS 97 -1.955 -2.764 -8.785 717 2HB HIS 97 2HB HIS 97 -3.297 -2.387 -7.709 718 HD1 HIS 97 HD1 HIS 97 -2.603 -3.939 -11.084 719 HD2 HIS 97 HD2 HIS 97 -5.630 -3.730 -8.246 720 HE1 HIS 97 HE1 HIS 97 -4.346 -5.588 -11.838 721 HE2 HIS 97 HE2 HIS 97 -6.144 -5.484 -10.076 722 H VAL 98 H VAL 98 -3.265 1.488 -9.622 723 HA VAL 98 HA VAL 98 -2.748 1.957 -6.755 724 HB VAL 98 HB VAL 98 -0.793 2.582 -8.188 725 1HG1 VAL 98 1HG1 VAL 98 -0.955 3.910 -9.960 726 2HG1 VAL 98 2HG1 VAL 98 -1.943 5.087 -9.089 727 3HG1 VAL 98 3HG1 VAL 98 -2.700 3.684 -9.850 728 1HG2 VAL 98 1HG2 VAL 98 -0.974 5.130 -7.296 729 2HG2 VAL 98 2HG2 VAL 98 -0.542 3.748 -6.285 730 3HG2 VAL 98 3HG2 VAL 98 -2.204 4.340 -6.305 731 H LEU 99 H LEU 99 -4.170 3.203 -5.718 732 HA LEU 99 HA LEU 99 -6.310 4.463 -7.274 733 1HB LEU 99 1HB LEU 99 -6.276 3.969 -4.302 734 2HB LEU 99 2HB LEU 99 -7.660 4.342 -5.309 735 HG LEU 99 HG LEU 99 -6.993 2.065 -6.480 736 1HD1 LEU 99 1HD1 LEU 99 -5.170 2.145 -4.352 737 2HD1 LEU 99 2HD1 LEU 99 -5.509 0.794 -5.432 738 3HD1 LEU 99 3HD1 LEU 99 -6.386 0.948 -3.910 739 1HD2 LEU 99 1HD2 LEU 99 -8.328 1.838 -3.814 740 2HD2 LEU 99 2HD2 LEU 99 -8.753 1.079 -5.348 741 3HD2 LEU 99 3HD2 LEU 99 -9.069 2.796 -5.097 742 H LEU 100 H LEU 100 -6.947 6.624 -6.830 743 HA LEU 100 HA LEU 100 -5.016 8.142 -5.229 744 1HB LEU 100 1HB LEU 100 -5.741 8.482 -8.059 745 2HB LEU 100 2HB LEU 100 -5.646 9.961 -7.117 746 HG LEU 100 HG LEU 100 -3.419 7.922 -7.266 747 1HD1 LEU 100 1HD1 LEU 100 -3.956 9.039 -9.451 748 2HD1 LEU 100 2HD1 LEU 100 -2.325 9.299 -8.832 749 3HD1 LEU 100 3HD1 LEU 100 -3.540 10.570 -8.678 750 1HD2 LEU 100 1HD2 LEU 100 -2.879 10.723 -6.572 751 2HD2 LEU 100 2HD2 LEU 100 -2.259 9.235 -5.860 752 3HD2 LEU 100 3HD2 LEU 100 -3.847 9.843 -5.392 753 H ALA 101 H ALA 101 -5.769 9.685 -3.932 754 HA ALA 101 HA ALA 101 -8.650 10.315 -4.024 755 1HB ALA 101 1HB ALA 101 -8.773 9.201 -2.080 756 2HB ALA 101 2HB ALA 101 -7.971 10.609 -1.387 757 3HB ALA 101 3HB ALA 101 -7.022 9.205 -1.866 758 H THR 102 H THR 102 -9.060 12.434 -4.210 759 HA THR 102 HA THR 102 -6.893 14.322 -3.662 760 HB THR 102 HB THR 102 -7.770 14.676 -5.816 761 HG1 THR 102 HG1 THR 102 -9.201 16.514 -4.204 762 1HG2 THR 102 1HG2 THR 102 -10.512 14.494 -4.598 763 2HG2 THR 102 2HG2 THR 102 -9.791 13.431 -5.808 764 3HG2 THR 102 3HG2 THR 102 -10.194 15.097 -6.226 765 H GLY 103 H GLY 103 -6.840 15.136 -1.678 766 1HA GLY 103 1HA GLY 103 -8.763 15.010 0.282 767 2HA GLY 103 2HA GLY 103 -7.515 16.244 0.224 768 H PHE 104 H PHE 104 -10.288 16.418 1.155 769 HA PHE 104 HA PHE 104 -11.821 17.870 -0.750 770 1HB PHE 104 1HB PHE 104 -12.165 16.892 1.918 771 2HB PHE 104 2HB PHE 104 -12.622 18.592 1.880 772 HD1 PHE 104 HD1 PHE 104 -14.148 19.259 -0.173 773 HD2 PHE 104 HD2 PHE 104 -13.760 15.327 1.406 774 HE1 PHE 104 HE1 PHE 104 -16.324 18.656 -1.152 775 HE2 PHE 104 HE2 PHE 104 -15.934 14.716 0.429 776 HZ PHE 104 HZ PHE 104 -17.219 16.381 -0.852 777 H SER 105 H SER 105 -10.541 19.086 2.345 778 HA SER 105 HA SER 105 -9.557 21.475 0.974 779 1HB SER 105 1HB SER 105 -11.547 21.472 3.247 780 2HB SER 105 2HB SER 105 -10.588 22.887 2.815 781 HG SER 105 HG SER 105 -12.248 21.499 0.983 782 H GLU 106 H GLU 106 -7.817 22.460 1.956 783 HA GLU 106 HA GLU 106 -5.940 22.617 3.226 784 1HB GLU 106 1HB GLU 106 -8.040 22.647 4.983 785 2HB GLU 106 2HB GLU 106 -7.065 21.330 5.619 786 1HG GLU 106 1HG GLU 106 -5.472 23.659 4.942 787 2HG GLU 106 2HG GLU 106 -6.728 24.015 6.127 788 HA PRO 107 HA PRO 107 -4.987 18.138 2.529 789 1HB PRO 107 1HB PRO 107 -2.802 18.578 0.987 790 2HB PRO 107 2HB PRO 107 -4.444 18.550 0.332 791 1HG PRO 107 1HG PRO 107 -2.736 20.897 1.064 792 2HG PRO 107 2HG PRO 107 -3.763 20.661 -0.364 793 1HD PRO 107 1HD PRO 107 -4.543 22.142 1.768 794 2HD PRO 107 2HD PRO 107 -5.688 21.221 0.771 795 H GLY 108 H GLY 108 -3.077 16.916 3.150 796 1HA GLY 108 1HA GLY 108 -1.021 18.352 4.641 797 2HA GLY 108 2HA GLY 108 -2.054 17.279 5.574 798 H ASP 109 H ASP 109 0.350 16.527 5.870 799 HA ASP 109 HA ASP 109 1.537 14.994 3.806 800 1HB ASP 109 1HB ASP 109 1.923 14.813 6.803 801 2HB ASP 109 2HB ASP 109 2.976 14.087 5.592 802 H ALA 110 H ALA 110 1.917 12.624 3.947 803 HA ALA 110 HA ALA 110 -0.052 11.040 5.342 804 1HB ALA 110 1HB ALA 110 -1.548 11.332 3.654 805 2HB ALA 110 2HB ALA 110 -0.629 9.992 2.968 806 3HB ALA 110 3HB ALA 110 -0.299 11.646 2.450 807 H GLY 111 H GLY 111 0.668 9.009 5.714 808 1HA GLY 111 1HA GLY 111 2.543 7.683 4.004 809 2HA GLY 111 2HA GLY 111 3.308 8.307 5.458 810 H GLY 112 H GLY 112 1.707 5.703 4.104 811 1HA GLY 112 1HA GLY 112 2.018 3.918 6.114 812 2HA GLY 112 2HA GLY 112 0.501 4.700 6.531 813 H ILE 113 H ILE 113 -0.909 3.062 6.172 814 HA ILE 113 HA ILE 113 -1.024 2.009 3.419 815 HB ILE 113 HB ILE 113 -2.018 -0.058 4.333 816 1HG1 ILE 113 1HG1 ILE 113 -1.276 1.139 7.011 817 2HG1 ILE 113 2HG1 ILE 113 -2.911 0.857 6.423 818 1HG2 ILE 113 1HG2 ILE 113 0.366 0.031 3.836 819 2HG2 ILE 113 2HG2 ILE 113 0.050 -1.013 5.224 820 3HG2 ILE 113 3HG2 ILE 113 0.693 0.612 5.469 821 1HD1 ILE 113 1HD1 ILE 113 -1.320 -1.552 6.340 822 2HD1 ILE 113 2HD1 ILE 113 -2.877 -1.247 7.112 823 3HD1 ILE 113 3HD1 ILE 113 -1.380 -0.854 7.958 824 H LEU 114 H LEU 114 -3.036 1.805 2.465 825 HA LEU 114 HA LEU 114 -5.117 3.479 3.611 826 1HB LEU 114 1HB LEU 114 -4.748 3.929 1.341 827 2HB LEU 114 2HB LEU 114 -4.642 2.231 0.925 828 HG LEU 114 HG LEU 114 -7.026 1.965 1.131 829 1HD1 LEU 114 1HD1 LEU 114 -7.375 4.868 1.731 830 2HD1 LEU 114 2HD1 LEU 114 -7.130 3.706 3.034 831 3HD1 LEU 114 3HD1 LEU 114 -8.508 3.534 1.946 832 1HD2 LEU 114 1HD2 LEU 114 -6.531 4.517 -0.383 833 2HD2 LEU 114 2HD2 LEU 114 -7.748 3.283 -0.709 834 3HD2 LEU 114 3HD2 LEU 114 -6.041 2.927 -0.965 835 H ARG 115 H ARG 115 -6.735 2.674 4.784 836 HA ARG 115 HA ARG 115 -7.430 -0.166 4.414 837 1HB ARG 115 1HB ARG 115 -8.050 -0.231 6.779 838 2HB ARG 115 2HB ARG 115 -6.368 0.235 6.574 839 1HG ARG 115 1HG ARG 115 -6.781 2.448 7.174 840 2HG ARG 115 2HG ARG 115 -8.517 2.294 6.899 841 1HD ARG 115 1HD ARG 115 -7.907 0.375 8.832 842 2HD ARG 115 2HD ARG 115 -6.980 1.802 9.292 843 HE ARG 115 HE ARG 115 -8.937 2.859 9.831 844 1HH1 ARG 115 1HH1 ARG 115 -9.668 0.030 7.922 845 2HH1 ARG 115 2HH1 ARG 115 -11.378 0.150 8.171 846 1HH2 ARG 115 1HH2 ARG 115 -11.185 3.019 10.160 847 2HH2 ARG 115 2HH2 ARG 115 -12.239 1.847 9.441 848 H CYS 116 H CYS 116 -9.580 -0.789 4.568 849 HA CYS 116 HA CYS 116 -11.535 1.379 4.183 850 1HB CYS 116 1HB CYS 116 -11.056 -0.325 2.294 851 2HB CYS 116 2HB CYS 116 -11.944 -1.469 3.292 852 H GLU 117 H GLU 117 -13.769 0.826 4.925 853 HA GLU 117 HA GLU 117 -13.790 0.164 7.639 854 1HB GLU 117 1HB GLU 117 -15.666 1.054 5.701 855 2HB GLU 117 2HB GLU 117 -16.376 -0.333 6.517 856 1HG GLU 117 1HG GLU 117 -15.950 0.755 8.683 857 2HG GLU 117 2HG GLU 117 -15.311 2.159 7.830 858 H HIS 118 H HIS 118 -13.716 -1.867 4.894 859 HA HIS 118 HA HIS 118 -14.825 -4.149 6.332 860 1HB HIS 118 1HB HIS 118 -13.805 -4.025 3.491 861 2HB HIS 118 2HB HIS 118 -14.780 -5.303 4.213 862 HD2 HIS 118 HD2 HIS 118 -17.435 -5.004 3.771 863 HE1 HIS 118 HE1 HIS 118 -17.413 -0.874 2.793 864 HE2 HIS 118 HE2 HIS 118 -18.793 -2.980 2.902 865 H GLY 119 H GLY 119 -11.751 -2.904 5.175 866 1HA GLY 119 1HA GLY 119 -10.223 -4.468 6.921 867 2HA GLY 119 2HA GLY 119 -10.257 -5.301 5.374 868 H VAL 120 H VAL 120 -8.165 -5.062 4.837 869 HA VAL 120 HA VAL 120 -7.002 -2.375 4.752 870 HB VAL 120 HB VAL 120 -5.538 -4.909 4.066 871 1HG1 VAL 120 1HG1 VAL 120 -4.071 -3.291 3.562 872 2HG1 VAL 120 2HG1 VAL 120 -3.768 -3.320 5.299 873 3HG1 VAL 120 3HG1 VAL 120 -4.846 -2.105 4.611 874 1HG2 VAL 120 1HG2 VAL 120 -4.994 -4.074 6.751 875 2HG2 VAL 120 2HG2 VAL 120 -5.532 -5.646 6.159 876 3HG2 VAL 120 3HG2 VAL 120 -6.716 -4.405 6.571 877 H ILE 121 H ILE 121 -6.527 -1.341 2.875 878 HA ILE 121 HA ILE 121 -7.474 -2.572 0.402 879 HB ILE 121 HB ILE 121 -6.516 0.244 0.899 880 1HG1 ILE 121 1HG1 ILE 121 -8.767 -0.809 1.940 881 2HG1 ILE 121 2HG1 ILE 121 -8.635 0.871 1.438 882 1HG2 ILE 121 1HG2 ILE 121 -6.256 0.079 -1.353 883 2HG2 ILE 121 2HG2 ILE 121 -7.965 0.506 -1.298 884 3HG2 ILE 121 3HG2 ILE 121 -7.485 -1.176 -1.518 885 1HD1 ILE 121 1HD1 ILE 121 -10.214 0.617 -0.091 886 2HD1 ILE 121 2HD1 ILE 121 -10.537 -0.961 0.630 887 3HD1 ILE 121 3HD1 ILE 121 -9.456 -0.831 -0.752 888 H GLY 122 H GLY 122 -4.664 -0.520 1.227 889 1HA GLY 122 1HA GLY 122 -2.793 -2.416 0.175 890 2HA GLY 122 2HA GLY 122 -3.087 -1.094 -0.939 891 H LEU 123 H LEU 123 -0.865 -0.523 -0.729 892 HA LEU 123 HA LEU 123 -0.225 0.822 1.815 893 1HB LEU 123 1HB LEU 123 2.186 0.542 1.029 894 2HB LEU 123 2HB LEU 123 1.352 -0.888 1.608 895 HG LEU 123 HG LEU 123 1.409 -0.286 -1.325 896 1HD1 LEU 123 1HD1 LEU 123 3.456 -1.622 -1.521 897 2HD1 LEU 123 2HD1 LEU 123 3.591 -1.658 0.236 898 3HD1 LEU 123 3HD1 LEU 123 3.727 -0.127 -0.626 899 1HD2 LEU 123 1HD2 LEU 123 0.193 -2.229 0.152 900 2HD2 LEU 123 2HD2 LEU 123 1.696 -3.021 -0.321 901 3HD2 LEU 123 3HD2 LEU 123 0.617 -2.369 -1.554 902 H VAL 124 H VAL 124 1.272 2.697 1.578 903 HA VAL 124 HA VAL 124 0.195 4.583 -0.230 904 HB VAL 124 HB VAL 124 1.116 5.225 1.951 905 1HG1 VAL 124 1HG1 VAL 124 3.876 4.899 0.827 906 2HG1 VAL 124 2HG1 VAL 124 3.083 3.593 1.707 907 3HG1 VAL 124 3HG1 VAL 124 3.380 5.139 2.503 908 1HG2 VAL 124 1HG2 VAL 124 1.641 7.297 1.240 909 2HG2 VAL 124 2HG2 VAL 124 1.212 6.650 -0.344 910 3HG2 VAL 124 3HG2 VAL 124 2.903 6.719 0.152 911 H THR 125 H THR 125 0.755 5.148 -2.230 912 HA THR 125 HA THR 125 3.232 4.016 -3.344 913 HB THR 125 HB THR 125 0.562 4.621 -4.601 914 HG1 THR 125 HG1 THR 125 0.840 2.454 -5.297 915 1HG2 THR 125 1HG2 THR 125 1.582 3.888 -6.766 916 2HG2 THR 125 2HG2 THR 125 3.162 4.167 -6.035 917 3HG2 THR 125 3HG2 THR 125 2.032 5.505 -6.235 918 H MET 126 H MET 126 1.246 6.584 -4.760 919 HA MET 126 HA MET 126 3.610 8.332 -4.626 920 1HB MET 126 1HB MET 126 1.867 7.673 -6.739 921 2HB MET 126 2HB MET 126 1.528 9.349 -6.335 922 1HG MET 126 1HG MET 126 4.228 8.211 -7.000 923 2HG MET 126 2HG MET 126 3.209 9.159 -8.080 924 1HE MET 126 1HE MET 126 6.546 10.363 -6.906 925 2HE MET 126 2HE MET 126 5.939 8.887 -6.154 926 3HE MET 126 3HE MET 126 6.247 10.319 -5.167 927 H GLY 127 H GLY 127 3.474 10.432 -3.877 928 1HA GLY 127 1HA GLY 127 0.963 11.106 -2.469 929 2HA GLY 127 2HA GLY 127 2.558 11.479 -1.830 930 H GLY 128 H GLY 128 0.043 12.437 -4.002 931 1HA GLY 128 1HA GLY 128 1.565 14.489 -5.322 932 2HA GLY 128 2HA GLY 128 -0.174 14.263 -5.409 933 H GLU 129 H GLU 129 0.575 16.781 -5.325 934 HA GLU 129 HA GLU 129 0.930 17.839 -2.701 935 1HB GLU 129 1HB GLU 129 -0.132 19.315 -5.109 936 2HB GLU 129 2HB GLU 129 0.683 19.997 -3.708 937 1HG GLU 129 1HG GLU 129 2.752 19.383 -4.435 938 2HG GLU 129 2HG GLU 129 2.146 17.996 -5.339 939 H GLY 130 H GLY 130 -1.792 16.738 -4.475 940 1HA GLY 130 1HA GLY 130 -3.533 17.610 -2.288 941 2HA GLY 130 2HA GLY 130 -3.979 18.069 -3.923 942 H VAL 131 H VAL 131 -2.465 15.090 -4.049 943 HA VAL 131 HA VAL 131 -5.009 13.654 -3.723 944 HB VAL 131 HB VAL 131 -3.137 12.737 -5.847 945 1HG1 VAL 131 1HG1 VAL 131 -6.136 12.764 -5.559 946 2HG1 VAL 131 2HG1 VAL 131 -5.065 11.390 -5.292 947 3HG1 VAL 131 3HG1 VAL 131 -5.250 12.060 -6.912 948 1HG2 VAL 131 1HG2 VAL 131 -4.085 14.193 -7.516 949 2HG2 VAL 131 2HG2 VAL 131 -3.373 15.174 -6.235 950 3HG2 VAL 131 3HG2 VAL 131 -5.122 14.958 -6.312 951 H VAL 132 H VAL 132 -4.796 11.351 -3.333 952 HA VAL 132 HA VAL 132 -2.235 10.676 -2.028 953 HB VAL 132 HB VAL 132 -4.857 9.360 -1.364 954 1HG1 VAL 132 1HG1 VAL 132 -2.904 8.211 -0.585 955 2HG1 VAL 132 2HG1 VAL 132 -3.711 8.957 0.794 956 3HG1 VAL 132 3HG1 VAL 132 -2.257 9.694 0.117 957 1HG2 VAL 132 1HG2 VAL 132 -3.769 11.688 0.191 958 2HG2 VAL 132 2HG2 VAL 132 -5.345 10.907 0.333 959 3HG2 VAL 132 3HG2 VAL 132 -4.971 11.888 -1.084 960 H GLY 133 H GLY 133 -1.105 9.170 -3.096 961 1HA GLY 133 1HA GLY 133 -2.515 7.364 -4.931 962 2HA GLY 133 2HA GLY 133 -0.782 7.657 -4.898 963 H PHE 134 H PHE 134 -3.086 5.403 -4.229 964 HA PHE 134 HA PHE 134 -1.354 4.082 -2.241 965 1HB PHE 134 1HB PHE 134 -4.338 4.330 -2.346 966 2HB PHE 134 2HB PHE 134 -3.607 2.919 -1.588 967 HD1 PHE 134 HD1 PHE 134 -1.512 3.674 0.000 968 HD2 PHE 134 HD2 PHE 134 -4.980 5.969 -0.894 969 HE1 PHE 134 HE1 PHE 134 -1.195 4.953 2.078 970 HE2 PHE 134 HE2 PHE 134 -4.671 7.252 1.180 971 HZ PHE 134 HZ PHE 134 -2.775 6.746 2.669 972 H ALA 135 H ALA 135 -0.709 2.061 -2.685 973 HA ALA 135 HA ALA 135 -1.619 0.850 -5.184 974 1HB ALA 135 1HB ALA 135 0.585 0.508 -5.349 975 2HB ALA 135 2HB ALA 135 0.351 -0.786 -4.175 976 3HB ALA 135 3HB ALA 135 0.846 0.818 -3.633 977 H ASP 136 H ASP 136 -3.398 -0.355 -4.950 978 HA ASP 136 HA ASP 136 -4.210 -1.550 -2.524 979 1HB ASP 136 1HB ASP 136 -5.948 -2.658 -3.915 980 2HB ASP 136 2HB ASP 136 -5.850 -0.920 -4.173 981 H VAL 137 H VAL 137 -4.454 -3.720 -1.966 982 HA VAL 137 HA VAL 137 -2.310 -5.449 -2.943 983 HB VAL 137 HB VAL 137 -4.174 -5.874 -0.599 984 1HG1 VAL 137 1HG1 VAL 137 -3.291 -7.966 -1.089 985 2HG1 VAL 137 2HG1 VAL 137 -2.176 -7.337 0.123 986 3HG1 VAL 137 3HG1 VAL 137 -1.733 -7.301 -1.580 987 1HG2 VAL 137 1HG2 VAL 137 -1.480 -5.256 0.155 988 2HG2 VAL 137 2HG2 VAL 137 -2.980 -4.441 0.600 989 3HG2 VAL 137 3HG2 VAL 137 -2.124 -3.972 -0.869 990 H ARG 138 H ARG 138 -5.135 -4.855 -4.154 991 HA ARG 138 HA ARG 138 -6.524 -7.330 -4.124 992 1HB ARG 138 1HB ARG 138 -6.725 -5.167 -6.217 993 2HB ARG 138 2HB ARG 138 -7.938 -6.368 -5.801 994 1HG ARG 138 1HG ARG 138 -7.441 -5.048 -3.413 995 2HG ARG 138 2HG ARG 138 -7.424 -3.774 -4.633 996 1HD ARG 138 1HD ARG 138 -9.628 -5.746 -4.061 997 2HD ARG 138 2HD ARG 138 -9.663 -3.999 -3.838 998 HE ARG 138 HE ARG 138 -9.833 -3.723 -6.172 999 1HH1 ARG 138 1HH1 ARG 138 -9.824 -7.094 -5.236 1000 2HH1 ARG 138 2HH1 ARG 138 -10.487 -7.635 -6.740 1001 1HH2 ARG 138 1HH2 ARG 138 -10.700 -4.444 -8.143 1002 2HH2 ARG 138 2HH2 ARG 138 -10.982 -6.135 -8.389 1003 H ASP 139 H ASP 139 -3.627 -6.505 -5.583 1004 HA ASP 139 HA ASP 139 -4.042 -8.249 -7.893 1005 1HB ASP 139 1HB ASP 139 -1.703 -7.482 -8.500 1006 2HB ASP 139 2HB ASP 139 -2.936 -6.225 -8.472 1007 H LEU 140 H LEU 140 -3.538 -8.904 -4.844 1008 HA LEU 140 HA LEU 140 -2.404 -11.414 -5.227 1009 1HB LEU 140 1HB LEU 140 -0.207 -11.164 -4.184 1010 2HB LEU 140 2HB LEU 140 -0.318 -10.271 -5.682 1011 HG LEU 140 HG LEU 140 0.717 -8.663 -4.491 1012 1HD1 LEU 140 1HD1 LEU 140 -1.411 -7.615 -4.892 1013 2HD1 LEU 140 2HD1 LEU 140 -0.783 -7.102 -3.324 1014 3HD1 LEU 140 3HD1 LEU 140 -2.067 -8.309 -3.409 1015 1HD2 LEU 140 1HD2 LEU 140 -0.400 -9.066 -1.822 1016 2HD2 LEU 140 2HD2 LEU 140 1.274 -8.871 -2.342 1017 3HD2 LEU 140 3HD2 LEU 140 0.492 -10.449 -2.457 1018 H LEU 141 H LEU 141 -4.564 -10.952 -3.944 1019 HA LEU 141 HA LEU 141 -4.254 -10.309 -1.182 1020 1HB LEU 141 1HB LEU 141 -6.394 -10.639 -2.970 1021 2HB LEU 141 2HB LEU 141 -6.642 -11.812 -1.689 1022 HG LEU 141 HG LEU 141 -7.786 -9.927 -0.945 1023 1HD1 LEU 141 1HD1 LEU 141 -5.615 -8.928 0.575 1024 2HD1 LEU 141 2HD1 LEU 141 -5.413 -10.669 0.399 1025 3HD1 LEU 141 3HD1 LEU 141 -6.905 -10.023 1.074 1026 1HD2 LEU 141 1HD2 LEU 141 -5.770 -7.867 -1.070 1027 2HD2 LEU 141 2HD2 LEU 141 -7.421 -7.867 -1.692 1028 3HD2 LEU 141 3HD2 LEU 141 -6.111 -8.532 -2.666 1029 H TRP 142 H TRP 142 -3.680 -13.140 -2.969 1030 HA TRP 142 HA TRP 142 -4.425 -15.164 -1.227 1031 1HB TRP 142 1HB TRP 142 -2.562 -16.489 -2.264 1032 2HB TRP 142 2HB TRP 142 -3.657 -15.737 -3.420 1033 HD1 TRP 142 HD1 TRP 142 -2.659 -13.348 -4.545 1034 HE1 TRP 142 HE1 TRP 142 -0.246 -12.834 -5.271 1035 HE3 TRP 142 HE3 TRP 142 -0.218 -16.951 -1.866 1036 HZ2 TRP 142 HZ2 TRP 142 2.342 -13.824 -4.774 1037 HZ3 TRP 142 HZ3 TRP 142 2.234 -17.099 -2.048 1038 HH2 TRP 142 HH2 TRP 142 3.486 -15.568 -3.475 1039 H LEU 143 H LEU 143 -4.077 -14.291 0.875 1040 HA LEU 143 HA LEU 143 -1.454 -14.969 1.932 1041 1HB LEU 143 1HB LEU 143 -2.755 -12.296 2.471 1042 2HB LEU 143 2HB LEU 143 -1.317 -12.904 3.267 1043 HG LEU 143 HG LEU 143 -0.442 -13.014 0.737 1044 1HD1 LEU 143 1HD1 LEU 143 -1.405 -10.577 -0.002 1045 2HD1 LEU 143 2HD1 LEU 143 -2.841 -11.347 0.673 1046 3HD1 LEU 143 3HD1 LEU 143 -1.958 -12.125 -0.640 1047 1HD2 LEU 143 1HD2 LEU 143 -0.471 -10.333 2.050 1048 2HD2 LEU 143 2HD2 LEU 143 0.851 -11.175 1.240 1049 3HD2 LEU 143 3HD2 LEU 143 0.329 -11.689 2.844 1050 H GLU 144 H GLU 144 -4.726 -13.805 2.648 1051 HA GLU 144 HA GLU 144 -5.036 -15.876 4.646 1052 1HB GLU 144 1HB GLU 144 -4.717 -13.008 5.322 1053 2HB GLU 144 2HB GLU 144 -6.013 -13.860 6.147 1054 1HG GLU 144 1HG GLU 144 -4.187 -15.624 6.660 1055 2HG GLU 144 2HG GLU 144 -3.068 -14.316 6.281 1056 H ASP 145 H ASP 145 -7.358 -15.223 5.806 1057 HA ASP 145 HA ASP 145 -9.276 -15.743 3.844 1058 1HB ASP 145 1HB ASP 145 -9.373 -14.934 6.716 1059 2HB ASP 145 2HB ASP 145 -10.861 -14.853 5.776 1060 H ASP 146 H ASP 146 -10.443 -14.502 2.520 1061 HA ASP 146 HA ASP 146 -9.917 -11.659 2.440 1062 1HB ASP 146 1HB ASP 146 -11.280 -13.628 0.646 1063 2HB ASP 146 2HB ASP 146 -11.618 -11.912 0.443 1064 H ALA 147 H ALA 147 -11.572 -10.033 2.416 1065 HA ALA 147 HA ALA 147 -13.580 -10.489 4.419 1066 1HB ALA 147 1HB ALA 147 -13.503 -8.004 2.772 1067 2HB ALA 147 2HB ALA 147 -12.189 -8.336 3.901 1068 3HB ALA 147 3HB ALA 147 -13.847 -8.208 4.490 1069 H MET 148 H MET 148 -15.677 -10.931 4.154 1070 HA MET 148 HA MET 148 -16.704 -11.083 1.407 1071 1HB MET 148 1HB MET 148 -17.954 -12.323 3.854 1072 2HB MET 148 2HB MET 148 -18.251 -12.722 2.167 1073 1HG MET 148 1HG MET 148 -16.222 -13.847 1.951 1074 2HG MET 148 2HG MET 148 -15.550 -13.100 3.400 1075 1HE MET 148 1HE MET 148 -16.562 -17.216 3.428 1076 2HE MET 148 2HE MET 148 -15.352 -16.157 2.704 1077 3HE MET 148 3HE MET 148 -16.955 -16.289 1.979 1078 H GLU 149 H GLU 149 -19.040 -10.591 1.122 1079 HA GLU 149 HA GLU 149 -20.459 -9.005 2.976 1080 1HB GLU 149 1HB GLU 149 -18.440 -7.598 1.651 1081 2HB GLU 149 2HB GLU 149 -19.918 -7.157 0.809 1082 1HG GLU 149 1HG GLU 149 -19.471 -6.943 3.777 1083 2HG GLU 149 2HG GLU 149 -19.385 -5.610 2.625 1084 H GLN 150 H GLN 150 -19.954 -8.989 -0.559 1085 HA GLN 150 HA GLN 150 -21.375 -9.345 -2.298 1086 1HB GLN 150 1HB GLN 150 -22.836 -11.023 -0.251 1087 2HB GLN 150 2HB GLN 150 -23.147 -11.049 -1.981 1088 1HG GLN 150 1HG GLN 150 -20.893 -11.859 -2.392 1089 2HG GLN 150 2HG GLN 150 -20.544 -11.792 -0.665 1090 1HE2 GLN 150 1HE2 GLN 150 -22.179 -13.489 -3.198 1091 2HE2 GLN 150 2HE2 GLN 150 -22.606 -14.886 -2.275 Start of MODEL 10 1 1H GLY 1 1H GLY 1 8.541 1.175 24.915 2 2H GLY 1 2H GLY 1 10.054 1.929 24.963 3 3H GLY 1 3H GLY 1 9.916 0.350 24.373 4 1HA GLY 1 1HA GLY 1 8.632 2.710 23.114 5 2HA GLY 1 2HA GLY 1 10.184 2.059 22.610 6 HA PRO 2 HA PRO 2 6.830 -0.021 20.133 7 1HB PRO 2 1HB PRO 2 8.045 0.273 17.724 8 2HB PRO 2 2HB PRO 2 6.997 1.510 18.425 9 1HG PRO 2 1HG PRO 2 9.986 1.352 18.404 10 2HG PRO 2 2HG PRO 2 8.938 2.752 18.109 11 1HD PRO 2 1HD PRO 2 10.171 2.330 20.482 12 2HD PRO 2 2HD PRO 2 8.586 3.121 20.358 13 H TYR 3 H TYR 3 6.858 -2.127 19.469 14 HA TYR 3 HA TYR 3 9.243 -3.484 18.675 15 1HB TYR 3 1HB TYR 3 9.237 -5.109 20.583 16 2HB TYR 3 2HB TYR 3 9.748 -3.484 21.024 17 HD1 TYR 3 HD1 TYR 3 6.839 -5.793 21.100 18 HD2 TYR 3 HD2 TYR 3 8.656 -2.312 22.739 19 HE1 TYR 3 HE1 TYR 3 5.137 -5.747 22.875 20 HE2 TYR 3 HE2 TYR 3 6.960 -2.257 24.520 21 HH TYR 3 HH TYR 3 5.423 -3.830 25.648 22 H GLY 4 H GLY 4 8.829 -5.499 17.773 23 1HA GLY 4 1HA GLY 4 7.537 -7.354 17.167 24 2HA GLY 4 2HA GLY 4 6.174 -6.656 18.028 25 H HIS 5 H HIS 5 5.383 -4.519 16.976 26 HA HIS 5 HA HIS 5 4.843 -5.153 14.188 27 1HB HIS 5 1HB HIS 5 3.276 -4.152 16.227 28 2HB HIS 5 2HB HIS 5 3.615 -2.720 15.262 29 HD1 HIS 5 HD1 HIS 5 3.232 -3.332 12.503 30 HD2 HIS 5 HD2 HIS 5 1.031 -5.369 15.379 31 HE1 HIS 5 HE1 HIS 5 1.230 -4.250 11.291 32 HE2 HIS 5 HE2 HIS 5 -0.044 -5.550 13.034 33 H GLN 6 H GLN 6 5.475 -3.959 12.463 34 HA GLN 6 HA GLN 6 7.166 -1.608 13.015 35 1HB GLN 6 1HB GLN 6 7.651 -4.006 11.409 36 2HB GLN 6 2HB GLN 6 7.956 -2.514 10.529 37 1HG GLN 6 1HG GLN 6 9.223 -1.954 12.826 38 2HG GLN 6 2HG GLN 6 9.400 -3.708 12.800 39 1HE2 GLN 6 1HE2 GLN 6 11.459 -4.002 12.245 40 2HE2 GLN 6 2HE2 GLN 6 12.211 -3.362 10.826 41 H SER 7 H SER 7 6.328 0.225 12.298 42 HA SER 7 HA SER 7 4.115 0.235 10.458 43 1HB SER 7 1HB SER 7 4.294 2.750 10.760 44 2HB SER 7 2HB SER 7 4.005 1.826 12.234 45 HG SER 7 HG SER 7 6.592 2.599 11.378 46 H GLY 8 H GLY 8 4.237 0.389 8.320 47 1HA GLY 8 1HA GLY 8 5.534 2.061 6.703 48 2HA GLY 8 2HA GLY 8 6.817 0.922 7.079 49 H ALA 9 H ALA 9 5.128 -1.403 7.203 50 HA ALA 9 HA ALA 9 4.192 -1.609 4.422 51 1HB ALA 9 1HB ALA 9 5.764 -3.789 5.774 52 2HB ALA 9 2HB ALA 9 6.510 -2.559 4.753 53 3HB ALA 9 3HB ALA 9 5.312 -3.663 4.074 54 H VAL 10 H VAL 10 3.006 -3.800 4.129 55 HA VAL 10 HA VAL 10 1.368 -4.329 6.524 56 HB VAL 10 HB VAL 10 0.094 -2.970 4.924 57 1HG1 VAL 10 1HG1 VAL 10 1.377 -3.959 2.927 58 2HG1 VAL 10 2HG1 VAL 10 -0.332 -3.578 2.718 59 3HG1 VAL 10 3HG1 VAL 10 0.174 -5.247 2.980 60 1HG2 VAL 10 1HG2 VAL 10 -1.522 -4.133 5.954 61 2HG2 VAL 10 2HG2 VAL 10 -0.670 -5.666 5.768 62 3HG2 VAL 10 3HG2 VAL 10 -1.637 -5.026 4.439 63 H TYR 11 H TYR 11 1.810 -6.341 7.169 64 HA TYR 11 HA TYR 11 2.187 -8.400 5.104 65 1HB TYR 11 1HB TYR 11 3.644 -9.588 6.568 66 2HB TYR 11 2HB TYR 11 4.161 -7.908 6.584 67 HD1 TYR 11 HD1 TYR 11 3.149 -6.455 8.544 68 HD2 TYR 11 HD2 TYR 11 3.416 -10.701 8.569 69 HE1 TYR 11 HE1 TYR 11 3.033 -6.442 11.000 70 HE2 TYR 11 HE2 TYR 11 3.299 -10.701 11.023 71 HH TYR 11 HH TYR 11 2.324 -9.064 12.820 72 H VAL 12 H VAL 12 0.966 -10.188 5.110 73 HA VAL 12 HA VAL 12 -1.053 -10.434 7.244 74 HB VAL 12 HB VAL 12 -1.320 -11.061 4.300 75 1HG1 VAL 12 1HG1 VAL 12 -3.394 -11.357 6.467 76 2HG1 VAL 12 2HG1 VAL 12 -2.526 -12.690 5.706 77 3HG1 VAL 12 3HG1 VAL 12 -3.608 -11.681 4.746 78 1HG2 VAL 12 1HG2 VAL 12 -2.289 -8.855 6.057 79 2HG2 VAL 12 2HG2 VAL 12 -3.236 -9.341 4.651 80 3HG2 VAL 12 3HG2 VAL 12 -1.577 -8.778 4.445 81 H GLY 13 H GLY 13 -1.310 -12.360 8.220 82 1HA GLY 13 1HA GLY 13 -0.704 -14.459 8.951 83 2HA GLY 13 2HA GLY 13 -0.986 -14.895 7.274 84 H ASN 14 H ASN 14 0.619 -16.071 6.501 85 HA ASN 14 HA ASN 14 3.304 -15.763 7.587 86 1HB ASN 14 1HB ASN 14 2.287 -17.775 5.570 87 2HB ASN 14 2HB ASN 14 3.821 -17.834 6.434 88 1HD2 ASN 14 1HD2 ASN 14 2.708 -20.022 6.813 89 2HD2 ASN 14 2HD2 ASN 14 1.802 -20.149 8.278 90 H TYR 15 H TYR 15 1.901 -13.888 5.597 91 HA TYR 15 HA TYR 15 4.124 -13.788 3.663 92 1HB TYR 15 1HB TYR 15 1.172 -13.413 3.197 93 2HB TYR 15 2HB TYR 15 2.356 -12.672 2.131 94 HD1 TYR 15 HD1 TYR 15 0.235 -14.664 1.342 95 HD2 TYR 15 HD2 TYR 15 4.299 -15.190 2.489 96 HE1 TYR 15 HE1 TYR 15 0.328 -16.745 0.043 97 HE2 TYR 15 HE2 TYR 15 4.399 -17.267 1.193 98 HH TYR 15 HH TYR 15 2.482 -19.050 0.416 99 H LYS 16 H LYS 16 4.855 -11.711 3.121 100 HA LYS 16 HA LYS 16 3.663 -9.474 4.600 101 1HB LYS 16 1HB LYS 16 5.562 -10.176 5.917 102 2HB LYS 16 2HB LYS 16 6.594 -10.198 4.495 103 1HG LYS 16 1HG LYS 16 5.457 -7.604 4.729 104 2HG LYS 16 2HG LYS 16 6.112 -8.072 6.299 105 1HD LYS 16 1HD LYS 16 8.134 -8.867 4.737 106 2HD LYS 16 2HD LYS 16 7.497 -7.564 3.731 107 1HE LYS 16 1HE LYS 16 7.886 -7.040 6.631 108 2HE LYS 16 2HE LYS 16 9.316 -7.122 5.604 109 1HZ LYS 16 1HZ LYS 16 6.983 -5.386 5.024 110 2HZ LYS 16 2HZ LYS 16 8.496 -5.361 4.267 111 3HZ LYS 16 3HZ LYS 16 8.348 -4.861 5.877 112 H VAL 17 H VAL 17 3.028 -8.005 3.130 113 HA VAL 17 HA VAL 17 4.598 -7.794 0.664 114 HB VAL 17 HB VAL 17 2.741 -7.392 -0.508 115 1HG1 VAL 17 1HG1 VAL 17 0.890 -8.565 0.175 116 2HG1 VAL 17 2HG1 VAL 17 0.990 -7.974 1.834 117 3HG1 VAL 17 3HG1 VAL 17 2.119 -9.207 1.266 118 1HG2 VAL 17 1HG2 VAL 17 1.717 -5.645 1.724 119 2HG2 VAL 17 2HG2 VAL 17 0.918 -5.870 0.167 120 3HG2 VAL 17 3HG2 VAL 17 2.510 -5.113 0.241 121 H VAL 18 H VAL 18 5.932 -6.186 0.412 122 HA VAL 18 HA VAL 18 5.367 -3.604 1.678 123 HB VAL 18 HB VAL 18 6.957 -4.845 3.125 124 1HG1 VAL 18 1HG1 VAL 18 8.882 -4.605 0.821 125 2HG1 VAL 18 2HG1 VAL 18 8.059 -6.097 1.277 126 3HG1 VAL 18 3HG1 VAL 18 9.187 -5.334 2.398 127 1HG2 VAL 18 1HG2 VAL 18 6.931 -2.282 2.676 128 2HG2 VAL 18 2HG2 VAL 18 8.480 -2.592 1.893 129 3HG2 VAL 18 3HG2 VAL 18 8.255 -2.998 3.594 130 H ASN 19 H ASN 19 6.660 -1.818 0.759 131 HA ASN 19 HA ASN 19 6.580 -1.788 -2.044 132 1HB ASN 19 1HB ASN 19 7.249 0.056 0.075 133 2HB ASN 19 2HB ASN 19 8.416 0.200 -1.236 134 1HD2 ASN 19 1HD2 ASN 19 7.895 1.482 -2.849 135 2HD2 ASN 19 2HD2 ASN 19 6.302 2.013 -3.251 136 H ARG 20 H ARG 20 8.163 -2.042 -3.611 137 HA ARG 20 HA ARG 20 10.181 -3.897 -3.159 138 1HB ARG 20 1HB ARG 20 9.470 -2.051 -5.363 139 2HB ARG 20 2HB ARG 20 11.113 -2.678 -5.374 140 1HG ARG 20 1HG ARG 20 10.257 -4.957 -5.348 141 2HG ARG 20 2HG ARG 20 8.604 -4.342 -5.304 142 1HD ARG 20 1HD ARG 20 8.840 -4.734 -7.549 143 2HD ARG 20 2HD ARG 20 9.366 -3.055 -7.462 144 HE ARG 20 HE ARG 20 11.013 -5.381 -8.003 145 1HH1 ARG 20 1HH1 ARG 20 10.913 -1.978 -7.215 146 2HH1 ARG 20 2HH1 ARG 20 12.526 -1.679 -7.765 147 1HH2 ARG 20 1HH2 ARG 20 13.134 -4.983 -8.725 148 2HH2 ARG 20 2HH2 ARG 20 13.786 -3.381 -8.621 149 H HIS 21 H HIS 21 10.453 -0.357 -3.427 150 HA HIS 21 HA HIS 21 13.259 -0.324 -2.999 151 1HB HIS 21 1HB HIS 21 11.105 1.659 -3.258 152 2HB HIS 21 2HB HIS 21 12.436 2.168 -2.223 153 HD1 HIS 21 HD1 HIS 21 14.870 2.079 -3.392 154 HD2 HIS 21 HD2 HIS 21 11.587 1.888 -5.933 155 HE1 HIS 21 HE1 HIS 21 15.756 2.633 -5.679 156 HE2 HIS 21 HE2 HIS 21 13.765 2.447 -7.211 157 H LEU 22 H LEU 22 10.746 -1.024 -0.885 158 HA LEU 22 HA LEU 22 12.346 -0.162 1.428 159 1HB LEU 22 1HB LEU 22 9.849 0.613 0.935 160 2HB LEU 22 2HB LEU 22 9.489 -0.897 1.750 161 HG LEU 22 HG LEU 22 11.054 -0.012 3.614 162 1HD1 LEU 22 1HD1 LEU 22 11.562 1.986 1.896 163 2HD1 LEU 22 2HD1 LEU 22 11.677 2.156 3.647 164 3HD1 LEU 22 3HD1 LEU 22 10.228 2.700 2.801 165 1HD2 LEU 22 1HD2 LEU 22 8.254 0.696 2.979 166 2HD2 LEU 22 2HD2 LEU 22 9.020 1.585 4.295 167 3HD2 LEU 22 3HD2 LEU 22 8.922 -0.174 4.360 168 H ALA 23 H ALA 23 11.910 -2.899 -0.303 169 HA ALA 23 HA ALA 23 11.379 -4.655 1.956 170 1HB ALA 23 1HB ALA 23 10.402 -5.681 0.213 171 2HB ALA 23 2HB ALA 23 12.010 -6.358 -0.025 172 3HB ALA 23 3HB ALA 23 11.492 -4.960 -0.968 173 H THR 24 H THR 24 12.862 -5.647 3.151 174 HA THR 24 HA THR 24 15.637 -5.046 2.790 175 HB THR 24 HB THR 24 15.993 -6.235 4.846 176 HG1 THR 24 HG1 THR 24 13.350 -7.223 4.571 177 1HG2 THR 24 1HG2 THR 24 14.089 -5.373 6.305 178 2HG2 THR 24 2HG2 THR 24 13.446 -4.665 4.824 179 3HG2 THR 24 3HG2 THR 24 15.040 -4.190 5.409 180 H HIS 25 H HIS 25 17.319 -6.790 2.848 181 HA HIS 25 HA HIS 25 17.198 -8.378 0.584 182 1HB HIS 25 1HB HIS 25 18.907 -8.728 3.055 183 2HB HIS 25 2HB HIS 25 19.176 -9.570 1.532 184 HD1 HIS 25 HD1 HIS 25 19.459 -7.766 -0.591 185 HD2 HIS 25 HD2 HIS 25 20.360 -6.465 3.252 186 HE1 HIS 25 HE1 HIS 25 20.921 -5.741 -0.892 187 HE2 HIS 25 HE2 HIS 25 21.392 -4.927 1.446 188 H VAL 26 H VAL 26 16.131 -9.076 3.830 189 HA VAL 26 HA VAL 26 15.920 -11.892 3.537 190 HB VAL 26 HB VAL 26 14.284 -10.149 5.378 191 1HG1 VAL 26 1HG1 VAL 26 13.646 -12.026 6.450 192 2HG1 VAL 26 2HG1 VAL 26 15.200 -12.823 6.201 193 3HG1 VAL 26 3HG1 VAL 26 14.007 -12.793 4.903 194 1HG2 VAL 26 1HG2 VAL 26 16.254 -11.046 6.959 195 2HG2 VAL 26 2HG2 VAL 26 16.326 -9.499 6.116 196 3HG2 VAL 26 3HG2 VAL 26 17.140 -10.910 5.439 197 H ASP 27 H ASP 27 13.793 -9.199 2.804 198 HA ASP 27 HA ASP 27 11.442 -10.716 2.387 199 1HB ASP 27 1HB ASP 27 12.334 -7.933 1.846 200 2HB ASP 27 2HB ASP 27 11.005 -8.540 0.862 201 H TRP 28 H TRP 28 14.004 -9.512 0.276 202 HA TRP 28 HA TRP 28 12.813 -10.538 -2.076 203 1HB TRP 28 1HB TRP 28 15.642 -9.614 -1.596 204 2HB TRP 28 2HB TRP 28 14.947 -9.963 -3.178 205 HD1 TRP 28 HD1 TRP 28 14.438 -7.535 -0.229 206 HE1 TRP 28 HE1 TRP 28 13.468 -5.342 -1.133 207 HE3 TRP 28 HE3 TRP 28 13.793 -8.896 -5.108 208 HZ2 TRP 28 HZ2 TRP 28 12.519 -4.330 -3.560 209 HZ3 TRP 28 HZ3 TRP 28 12.838 -7.245 -6.665 210 HH2 TRP 28 HH2 TRP 28 12.217 -5.007 -5.909 211 H GLN 29 H GLN 29 15.486 -11.657 -0.023 212 HA GLN 29 HA GLN 29 16.280 -13.843 -1.542 213 1HB GLN 29 1HB GLN 29 17.347 -14.683 0.399 214 2HB GLN 29 2HB GLN 29 17.392 -12.932 0.543 215 1HG GLN 29 1HG GLN 29 15.489 -13.011 2.070 216 2HG GLN 29 2HG GLN 29 15.451 -14.766 1.931 217 1HE2 GLN 29 1HE2 GLN 29 18.058 -12.399 2.372 218 2HE2 GLN 29 2HE2 GLN 29 18.719 -13.134 3.789 219 H ASN 30 H ASN 30 13.607 -13.522 0.725 220 HA ASN 30 HA ASN 30 12.725 -16.236 -0.022 221 1HB ASN 30 1HB ASN 30 12.652 -14.747 2.549 222 2HB ASN 30 2HB ASN 30 11.261 -15.763 2.178 223 1HD2 ASN 30 1HD2 ASN 30 13.475 -15.954 4.180 224 2HD2 ASN 30 2HD2 ASN 30 14.116 -17.544 3.971 225 H CYS 31 H CYS 31 12.241 -13.874 -1.587 226 HA CYS 31 HA CYS 31 9.537 -13.027 -1.085 227 1HB CYS 31 1HB CYS 31 9.759 -11.668 -3.054 228 2HB CYS 31 2HB CYS 31 11.254 -11.547 -2.139 229 HG CYS 31 HG CYS 31 11.867 -13.576 -4.096 230 H VAL 32 H VAL 32 7.732 -13.929 -1.794 231 HA VAL 32 HA VAL 32 7.901 -16.256 -3.526 232 HB VAL 32 HB VAL 32 5.439 -16.459 -3.057 233 1HG1 VAL 32 1HG1 VAL 32 6.532 -17.867 -1.658 234 2HG1 VAL 32 2HG1 VAL 32 5.937 -16.736 -0.441 235 3HG1 VAL 32 3HG1 VAL 32 7.593 -16.602 -1.035 236 1HG2 VAL 32 1HG2 VAL 32 5.913 -14.304 -1.017 237 2HG2 VAL 32 2HG2 VAL 32 4.392 -15.101 -1.416 238 3HG2 VAL 32 3HG2 VAL 32 5.144 -14.005 -2.574 239 H TRP 33 H TRP 33 6.525 -12.997 -3.510 240 HA TRP 33 HA TRP 33 6.261 -13.173 -6.422 241 1HB TRP 33 1HB TRP 33 4.028 -13.499 -6.068 242 2HB TRP 33 2HB TRP 33 4.058 -12.742 -4.482 243 HD1 TRP 33 HD1 TRP 33 3.312 -12.011 -8.120 244 HE1 TRP 33 HE1 TRP 33 2.409 -9.607 -8.325 245 HE3 TRP 33 HE3 TRP 33 4.300 -10.376 -3.395 246 HZ2 TRP 33 HZ2 TRP 33 2.157 -7.311 -6.675 247 HZ3 TRP 33 HZ3 TRP 33 3.712 -8.069 -2.784 248 HH2 TRP 33 HH2 TRP 33 2.662 -6.576 -4.399 249 H GLU 34 H GLU 34 6.298 -11.133 -7.514 250 HA GLU 34 HA GLU 34 6.648 -8.678 -6.101 251 1HB GLU 34 1HB GLU 34 8.823 -9.555 -5.577 252 2HB GLU 34 2HB GLU 34 9.088 -10.043 -7.244 253 1HG GLU 34 1HG GLU 34 8.689 -7.382 -7.554 254 2HG GLU 34 2HG GLU 34 9.434 -7.429 -5.957 255 H ASP 35 H ASP 35 5.426 -7.500 -7.451 256 HA ASP 35 HA ASP 35 5.922 -7.714 -10.343 257 1HB ASP 35 1HB ASP 35 3.700 -6.739 -10.660 258 2HB ASP 35 2HB ASP 35 3.610 -8.183 -9.656 259 H TYR 36 H TYR 36 6.901 -6.122 -11.351 260 HA TYR 36 HA TYR 36 7.847 -3.825 -10.004 261 1HB TYR 36 1HB TYR 36 8.672 -5.129 -12.182 262 2HB TYR 36 2HB TYR 36 7.753 -3.856 -12.977 263 HD1 TYR 36 HD1 TYR 36 10.827 -4.717 -11.345 264 HD2 TYR 36 HD2 TYR 36 8.348 -1.440 -12.450 265 HE1 TYR 36 HE1 TYR 36 12.737 -3.191 -11.081 266 HE2 TYR 36 HE2 TYR 36 10.252 0.095 -12.191 267 HH TYR 36 HH TYR 36 13.436 -0.950 -11.944 268 H ASN 37 H ASN 37 5.087 -4.387 -12.119 269 HA ASN 37 HA ASN 37 4.438 -1.729 -12.690 270 1HB ASN 37 1HB ASN 37 2.803 -4.249 -12.510 271 2HB ASN 37 2HB ASN 37 2.047 -2.699 -12.867 272 1HD2 ASN 37 1HD2 ASN 37 3.669 -1.459 -14.527 273 2HD2 ASN 37 2HD2 ASN 37 3.935 -2.371 -15.970 274 H ARG 38 H ARG 38 4.107 -3.597 -9.800 275 HA ARG 38 HA ARG 38 2.521 -1.434 -8.590 276 1HB ARG 38 1HB ARG 38 1.536 -3.776 -8.619 277 2HB ARG 38 2HB ARG 38 2.821 -4.232 -7.510 278 1HG ARG 38 1HG ARG 38 0.732 -3.762 -6.343 279 2HG ARG 38 2HG ARG 38 2.012 -2.644 -5.870 280 1HD ARG 38 1HD ARG 38 0.074 -1.950 -8.045 281 2HD ARG 38 2HD ARG 38 -0.339 -1.701 -6.348 282 HE ARG 38 HE ARG 38 1.942 -0.422 -6.410 283 1HH1 ARG 38 1HH1 ARG 38 -0.586 -0.404 -8.822 284 2HH1 ARG 38 2HH1 ARG 38 -0.174 1.168 -9.414 285 1HH2 ARG 38 1HH2 ARG 38 2.474 1.636 -7.186 286 2HH2 ARG 38 2HH2 ARG 38 1.549 2.336 -8.471 287 H ASP 39 H ASP 39 5.609 -2.630 -8.805 288 HA ASP 39 HA ASP 39 7.498 -2.490 -7.535 289 1HB ASP 39 1HB ASP 39 5.980 0.016 -7.093 290 2HB ASP 39 2HB ASP 39 7.278 -0.306 -5.947 291 H LEU 40 H LEU 40 5.485 -4.190 -6.522 292 HA LEU 40 HA LEU 40 6.059 -4.012 -3.639 293 1HB LEU 40 1HB LEU 40 3.735 -3.323 -4.147 294 2HB LEU 40 2HB LEU 40 3.453 -4.887 -4.883 295 HG LEU 40 HG LEU 40 3.978 -5.918 -2.631 296 1HD1 LEU 40 1HD1 LEU 40 4.927 -3.476 -1.976 297 2HD1 LEU 40 2HD1 LEU 40 4.392 -4.677 -0.802 298 3HD1 LEU 40 3HD1 LEU 40 3.302 -3.384 -1.300 299 1HD2 LEU 40 1HD2 LEU 40 1.652 -5.143 -3.695 300 2HD2 LEU 40 2HD2 LEU 40 1.641 -4.145 -2.238 301 3HD2 LEU 40 3HD2 LEU 40 1.771 -5.899 -2.105 302 H LEU 41 H LEU 41 6.116 -6.030 -2.512 303 HA LEU 41 HA LEU 41 6.117 -8.453 -4.114 304 1HB LEU 41 1HB LEU 41 8.324 -9.181 -3.394 305 2HB LEU 41 2HB LEU 41 8.401 -7.732 -4.362 306 HG LEU 41 HG LEU 41 9.726 -8.194 -1.979 307 1HD1 LEU 41 1HD1 LEU 41 9.176 -5.807 -3.669 308 2HD1 LEU 41 2HD1 LEU 41 10.680 -6.689 -3.409 309 3HD1 LEU 41 3HD1 LEU 41 10.061 -5.611 -2.158 310 1HD2 LEU 41 1HD2 LEU 41 8.845 -6.327 -0.524 311 2HD2 LEU 41 2HD2 LEU 41 7.925 -7.828 -0.519 312 3HD2 LEU 41 3HD2 LEU 41 7.350 -6.443 -1.439 313 H VAL 42 H VAL 42 6.159 -10.420 -2.872 314 HA VAL 42 HA VAL 42 5.348 -9.987 -0.079 315 HB VAL 42 HB VAL 42 4.168 -11.876 -2.117 316 1HG1 VAL 42 1HG1 VAL 42 4.736 -13.151 -0.027 317 2HG1 VAL 42 2HG1 VAL 42 3.021 -13.108 -0.414 318 3HG1 VAL 42 3HG1 VAL 42 3.667 -12.063 0.852 319 1HG2 VAL 42 1HG2 VAL 42 3.318 -9.469 -0.762 320 2HG2 VAL 42 2HG2 VAL 42 2.182 -10.796 -0.491 321 3HG2 VAL 42 3HG2 VAL 42 2.593 -10.306 -2.135 322 H SER 43 H SER 43 6.408 -11.051 1.405 323 HA SER 43 HA SER 43 8.152 -13.285 0.606 324 1HB SER 43 1HB SER 43 9.857 -12.529 2.052 325 2HB SER 43 2HB SER 43 9.283 -11.054 1.275 326 HG SER 43 HG SER 43 8.913 -10.360 3.213 327 H THR 44 H THR 44 8.504 -14.892 2.314 328 HA THR 44 HA THR 44 6.087 -15.152 3.933 329 HB THR 44 HB THR 44 6.515 -17.485 4.020 330 HG1 THR 44 HG1 THR 44 9.105 -16.795 3.127 331 1HG2 THR 44 1HG2 THR 44 7.563 -17.084 1.298 332 2HG2 THR 44 2HG2 THR 44 6.030 -16.299 1.692 333 3HG2 THR 44 3HG2 THR 44 6.201 -18.048 1.869 334 H THR 45 H THR 45 6.100 -14.670 5.985 335 HA THR 45 HA THR 45 8.654 -14.704 7.449 336 HB THR 45 HB THR 45 7.910 -12.488 7.485 337 HG1 THR 45 HG1 THR 45 6.678 -13.545 9.803 338 1HG2 THR 45 1HG2 THR 45 5.459 -12.059 8.341 339 2HG2 THR 45 2HG2 THR 45 5.177 -13.633 7.597 340 3HG2 THR 45 3HG2 THR 45 5.812 -12.302 6.629 341 H THR 46 H THR 46 5.287 -15.681 7.507 342 HA THR 46 HA THR 46 4.164 -17.229 8.740 343 HB THR 46 HB THR 46 6.832 -18.149 9.804 344 HG1 THR 46 HG1 THR 46 5.621 -18.822 7.330 345 1HG2 THR 46 1HG2 THR 46 5.280 -20.328 9.105 346 2HG2 THR 46 2HG2 THR 46 4.151 -19.213 9.875 347 3HG2 THR 46 3HG2 THR 46 5.600 -19.734 10.734 348 H ALA 47 H ALA 47 4.311 -14.718 9.819 349 HA ALA 47 HA ALA 47 4.361 -15.312 12.699 350 1HB ALA 47 1HB ALA 47 5.494 -12.870 11.347 351 2HB ALA 47 2HB ALA 47 6.355 -14.061 12.323 352 3HB ALA 47 3HB ALA 47 5.187 -12.978 13.080 353 H HIS 48 H HIS 48 3.014 -13.850 13.990 354 HA HIS 48 HA HIS 48 0.427 -13.598 12.965 355 1HB HIS 48 1HB HIS 48 1.776 -12.410 15.384 356 2HB HIS 48 2HB HIS 48 0.084 -12.089 15.018 357 HD1 HIS 48 HD1 HIS 48 -0.405 -15.111 13.987 358 HD2 HIS 48 HD2 HIS 48 1.152 -13.916 17.650 359 HE1 HIS 48 HE1 HIS 48 -0.835 -17.027 15.557 360 HE2 HIS 48 HE2 HIS 48 0.195 -16.317 17.744 361 H GLY 49 H GLY 49 -0.595 -12.066 11.830 362 1HA GLY 49 1HA GLY 49 0.914 -9.616 11.209 363 2HA GLY 49 2HA GLY 49 -0.334 -10.321 10.197 364 H CYS 50 H CYS 50 -2.167 -10.763 12.429 365 HA CYS 50 HA CYS 50 -3.905 -9.699 13.439 366 1HB CYS 50 1HB CYS 50 -1.694 -8.682 14.588 367 2HB CYS 50 2HB CYS 50 -2.367 -7.206 13.904 368 HG CYS 50 HG CYS 50 -3.971 -7.145 15.740 369 H ASP 51 H ASP 51 -3.183 -9.172 10.530 370 HA ASP 51 HA ASP 51 -4.959 -6.853 10.194 371 1HB ASP 51 1HB ASP 51 -2.535 -7.474 8.490 372 2HB ASP 51 2HB ASP 51 -3.661 -6.142 8.236 373 H THR 52 H THR 52 -6.547 -7.074 8.710 374 HA THR 52 HA THR 52 -6.569 -9.553 7.114 375 HB THR 52 HB THR 52 -8.937 -8.172 8.397 376 HG1 THR 52 HG1 THR 52 -8.914 -9.792 9.846 377 1HG2 THR 52 1HG2 THR 52 -10.074 -9.216 6.778 378 2HG2 THR 52 2HG2 THR 52 -9.800 -10.647 7.770 379 3HG2 THR 52 3HG2 THR 52 -8.743 -10.310 6.399 380 H ILE 53 H ILE 53 -6.553 -9.175 4.997 381 HA ILE 53 HA ILE 53 -6.919 -6.540 3.956 382 HB ILE 53 HB ILE 53 -6.944 -8.960 2.202 383 1HG1 ILE 53 1HG1 ILE 53 -5.029 -8.860 4.090 384 2HG1 ILE 53 2HG1 ILE 53 -4.747 -9.483 2.472 385 1HG2 ILE 53 1HG2 ILE 53 -5.879 -6.164 1.921 386 2HG2 ILE 53 2HG2 ILE 53 -7.277 -6.868 1.108 387 3HG2 ILE 53 3HG2 ILE 53 -5.653 -7.434 0.719 388 1HD1 ILE 53 1HD1 ILE 53 -4.062 -6.740 3.503 389 2HD1 ILE 53 2HD1 ILE 53 -3.883 -7.252 1.825 390 3HD1 ILE 53 3HD1 ILE 53 -2.943 -8.041 3.091 391 H ALA 54 H ALA 54 -8.609 -5.674 2.855 392 HA ALA 54 HA ALA 54 -11.152 -7.062 3.121 393 1HB ALA 54 1HB ALA 54 -11.924 -5.030 3.544 394 2HB ALA 54 2HB ALA 54 -11.469 -4.504 1.925 395 3HB ALA 54 3HB ALA 54 -10.321 -4.358 3.255 396 H ARG 55 H ARG 55 -12.030 -8.159 1.509 397 HA ARG 55 HA ARG 55 -11.006 -7.788 -1.202 398 1HB ARG 55 1HB ARG 55 -11.345 -10.072 0.033 399 2HB ARG 55 2HB ARG 55 -13.025 -9.870 -0.442 400 1HG ARG 55 1HG ARG 55 -11.759 -11.253 -2.022 401 2HG ARG 55 2HG ARG 55 -12.399 -9.789 -2.773 402 1HD ARG 55 1HD ARG 55 -10.354 -8.973 -3.204 403 2HD ARG 55 2HD ARG 55 -9.717 -9.482 -1.641 404 HE ARG 55 HE ARG 55 -8.973 -11.434 -2.603 405 1HH1 ARG 55 1HH1 ARG 55 -11.096 -9.780 -4.830 406 2HH1 ARG 55 2HH1 ARG 55 -10.696 -10.806 -6.167 407 1HH2 ARG 55 1HH2 ARG 55 -8.451 -12.784 -4.361 408 2HH2 ARG 55 2HH2 ARG 55 -9.196 -12.512 -5.901 409 H CYS 56 H CYS 56 -12.600 -5.723 -0.171 410 HA CYS 56 HA CYS 56 -15.195 -6.050 -1.482 411 1HB CYS 56 1HB CYS 56 -15.731 -3.872 -0.350 412 2HB CYS 56 2HB CYS 56 -15.368 -5.197 0.748 413 H GLN 57 H GLN 57 -16.016 -4.085 -2.668 414 HA GLN 57 HA GLN 57 -13.852 -2.973 -4.331 415 1HB GLN 57 1HB GLN 57 -16.473 -4.154 -4.993 416 2HB GLN 57 2HB GLN 57 -16.071 -2.690 -5.878 417 1HG GLN 57 1HG GLN 57 -13.893 -4.631 -5.756 418 2HG GLN 57 2HG GLN 57 -15.337 -5.218 -6.580 419 1HE2 GLN 57 1HE2 GLN 57 -14.602 -5.190 -8.636 420 2HE2 GLN 57 2HE2 GLN 57 -14.121 -3.759 -9.477 421 H CYS 58 H CYS 58 -14.908 -1.833 -1.849 422 HA CYS 58 HA CYS 58 -16.724 0.247 -2.303 423 1HB CYS 58 1HB CYS 58 -14.422 0.206 -0.341 424 2HB CYS 58 2HB CYS 58 -15.820 1.271 -0.268 425 H THR 59 H THR 59 -16.217 2.591 -2.265 426 HA THR 59 HA THR 59 -13.845 3.179 -3.914 427 HB THR 59 HB THR 59 -16.303 4.898 -3.927 428 HG1 THR 59 HG1 THR 59 -15.895 2.659 -5.615 429 1HG2 THR 59 1HG2 THR 59 -15.540 5.052 -6.389 430 2HG2 THR 59 2HG2 THR 59 -14.006 4.436 -5.773 431 3HG2 THR 59 3HG2 THR 59 -14.661 5.951 -5.152 432 H THR 60 H THR 60 -14.940 3.458 -0.871 433 HA THR 60 HA THR 60 -13.433 5.931 -0.432 434 HB THR 60 HB THR 60 -15.044 6.809 1.083 435 HG1 THR 60 HG1 THR 60 -16.316 4.299 0.812 436 1HG2 THR 60 1HG2 THR 60 -16.980 7.189 -0.229 437 2HG2 THR 60 2HG2 THR 60 -16.707 5.720 -1.169 438 3HG2 THR 60 3HG2 THR 60 -15.608 7.090 -1.333 439 H GLY 61 H GLY 61 -11.900 5.700 1.044 440 1HA GLY 61 1HA GLY 61 -12.246 3.659 3.142 441 2HA GLY 61 2HA GLY 61 -10.764 3.713 2.197 442 H VAL 62 H VAL 62 -9.723 3.984 4.313 443 HA VAL 62 HA VAL 62 -9.571 6.828 4.985 444 HB VAL 62 HB VAL 62 -11.072 5.908 6.653 445 1HG1 VAL 62 1HG1 VAL 62 -9.617 4.238 8.266 446 2HG1 VAL 62 2HG1 VAL 62 -9.145 3.719 6.648 447 3HG1 VAL 62 3HG1 VAL 62 -10.846 3.731 7.109 448 1HG2 VAL 62 1HG2 VAL 62 -8.336 6.727 7.513 449 2HG2 VAL 62 2HG2 VAL 62 -9.542 6.274 8.718 450 3HG2 VAL 62 3HG2 VAL 62 -9.861 7.607 7.612 451 H TYR 63 H TYR 63 -7.571 7.550 5.444 452 HA TYR 63 HA TYR 63 -5.429 5.647 5.987 453 1HB TYR 63 1HB TYR 63 -4.055 6.292 4.185 454 2HB TYR 63 2HB TYR 63 -5.645 6.074 3.464 455 HD1 TYR 63 HD1 TYR 63 -3.290 8.653 4.725 456 HD2 TYR 63 HD2 TYR 63 -6.681 7.837 2.286 457 HE1 TYR 63 HE1 TYR 63 -3.167 10.929 3.802 458 HE2 TYR 63 HE2 TYR 63 -6.564 10.109 1.357 459 HH TYR 63 HH TYR 63 -4.706 12.562 2.723 460 H PHE 64 H PHE 64 -4.053 6.408 7.483 461 HA PHE 64 HA PHE 64 -4.536 8.816 8.821 462 1HB PHE 64 1HB PHE 64 -2.527 8.355 10.084 463 2HB PHE 64 2HB PHE 64 -3.387 6.844 9.812 464 HD1 PHE 64 HD1 PHE 64 -0.338 8.687 9.275 465 HD2 PHE 64 HD2 PHE 64 -2.554 5.252 8.094 466 HE1 PHE 64 HE1 PHE 64 1.703 7.707 8.313 467 HE2 PHE 64 HE2 PHE 64 -0.518 4.264 7.131 468 HZ PHE 64 HZ PHE 64 1.616 5.493 7.242 469 H CYS 65 H CYS 65 -3.783 10.842 8.616 470 HA CYS 65 HA CYS 65 -2.534 11.615 6.181 471 1HB CYS 65 1HB CYS 65 -3.828 12.911 8.409 472 2HB CYS 65 2HB CYS 65 -2.345 13.762 7.994 473 HG CYS 65 HG CYS 65 -4.651 14.455 6.633 474 H ALA 66 H ALA 66 -0.543 12.867 6.005 475 HA ALA 66 HA ALA 66 1.629 11.543 7.308 476 1HB ALA 66 1HB ALA 66 1.965 12.162 5.049 477 2HB ALA 66 2HB ALA 66 3.020 13.200 6.008 478 3HB ALA 66 3HB ALA 66 1.505 13.836 5.365 479 H SER 67 H SER 67 0.285 14.826 7.437 480 HA SER 67 HA SER 67 2.145 15.599 9.523 481 1HB SER 67 1HB SER 67 -0.030 17.014 8.003 482 2HB SER 67 2HB SER 67 0.652 17.730 9.464 483 HG SER 67 HG SER 67 1.875 17.210 6.991 484 H LYS 68 H LYS 68 -1.317 14.965 9.177 485 HA LYS 68 HA LYS 68 -1.838 15.421 11.978 486 1HB LYS 68 1HB LYS 68 -3.538 14.383 9.711 487 2HB LYS 68 2HB LYS 68 -4.128 14.523 11.361 488 1HG LYS 68 1HG LYS 68 -2.946 17.001 10.622 489 2HG LYS 68 2HG LYS 68 -4.049 16.500 9.341 490 1HD LYS 68 1HD LYS 68 -5.822 16.181 11.016 491 2HD LYS 68 2HD LYS 68 -4.715 16.730 12.275 492 1HE LYS 68 1HE LYS 68 -4.526 18.763 10.487 493 2HE LYS 68 2HE LYS 68 -6.202 18.266 10.258 494 1HZ LYS 68 1HZ LYS 68 -6.354 18.391 12.780 495 2HZ LYS 68 2HZ LYS 68 -6.277 19.857 11.939 496 3HZ LYS 68 3HZ LYS 68 -4.901 19.258 12.720 497 H SER 69 H SER 69 -1.777 13.950 13.568 498 HA SER 69 HA SER 69 -0.997 11.230 12.915 499 1HB SER 69 1HB SER 69 -0.230 12.890 14.920 500 2HB SER 69 2HB SER 69 -1.477 11.954 15.744 501 HG SER 69 HG SER 69 1.024 11.227 15.076 502 H LYS 70 H LYS 70 -3.466 11.560 11.970 503 HA LYS 70 HA LYS 70 -5.050 9.805 13.669 504 1HB LYS 70 1HB LYS 70 -6.266 12.297 12.473 505 2HB LYS 70 2HB LYS 70 -7.041 11.140 13.546 506 1HG LYS 70 1HG LYS 70 -6.578 12.751 15.062 507 2HG LYS 70 2HG LYS 70 -5.047 11.878 15.140 508 1HD LYS 70 1HD LYS 70 -4.109 13.875 14.737 509 2HD LYS 70 2HD LYS 70 -4.611 13.604 13.066 510 1HE LYS 70 1HE LYS 70 -6.106 15.258 13.151 511 2HE LYS 70 2HE LYS 70 -6.754 14.694 14.690 512 1HZ LYS 70 1HZ LYS 70 -5.846 16.888 14.944 513 2HZ LYS 70 2HZ LYS 70 -4.355 16.402 14.310 514 3HZ LYS 70 3HZ LYS 70 -4.877 15.795 15.800 515 H HIS 71 H HIS 71 -7.070 9.083 12.435 516 HA HIS 71 HA HIS 71 -6.210 8.232 9.807 517 1HB HIS 71 1HB HIS 71 -8.115 6.746 9.862 518 2HB HIS 71 2HB HIS 71 -7.296 6.668 11.416 519 HD1 HIS 71 HD1 HIS 71 -8.615 7.341 13.471 520 HD2 HIS 71 HD2 HIS 71 -10.637 8.093 9.919 521 HE1 HIS 71 HE1 HIS 71 -10.962 7.940 14.146 522 HE2 HIS 71 HE2 HIS 71 -12.137 8.494 11.988 523 H TYR 72 H TYR 72 -7.111 8.821 7.867 524 HA TYR 72 HA TYR 72 -9.146 10.954 7.964 525 1HB TYR 72 1HB TYR 72 -6.499 10.861 6.700 526 2HB TYR 72 2HB TYR 72 -7.779 11.396 5.619 527 HD1 TYR 72 HD1 TYR 72 -8.236 13.653 5.534 528 HD2 TYR 72 HD2 TYR 72 -6.545 12.037 9.093 529 HE1 TYR 72 HE1 TYR 72 -8.084 15.915 6.484 530 HE2 TYR 72 HE2 TYR 72 -6.388 14.297 10.053 531 HH TYR 72 HH TYR 72 -6.375 16.957 8.497 532 HA PRO 73 HA PRO 73 -11.187 7.945 5.271 533 1HB PRO 73 1HB PRO 73 -13.470 9.762 5.373 534 2HB PRO 73 2HB PRO 73 -13.333 8.116 5.996 535 1HG PRO 73 1HG PRO 73 -13.518 10.278 7.616 536 2HG PRO 73 2HG PRO 73 -12.627 8.812 8.065 537 1HD PRO 73 1HD PRO 73 -11.580 11.420 7.016 538 2HD PRO 73 2HD PRO 73 -10.942 10.388 8.316 539 H VAL 74 H VAL 74 -10.713 8.021 3.158 540 HA VAL 74 HA VAL 74 -11.308 10.499 1.686 541 HB VAL 74 HB VAL 74 -8.783 8.854 1.548 542 1HG1 VAL 74 1HG1 VAL 74 -9.816 10.915 -0.371 543 2HG1 VAL 74 2HG1 VAL 74 -9.300 9.259 -0.706 544 3HG1 VAL 74 3HG1 VAL 74 -8.110 10.479 -0.245 545 1HG2 VAL 74 1HG2 VAL 74 -8.257 10.390 3.111 546 2HG2 VAL 74 2HG2 VAL 74 -9.530 11.499 2.603 547 3HG2 VAL 74 3HG2 VAL 74 -8.014 11.428 1.705 548 H SER 75 H SER 75 -12.078 10.289 -0.358 549 HA SER 75 HA SER 75 -12.907 7.609 -1.174 550 1HB SER 75 1HB SER 75 -14.358 8.803 -2.797 551 2HB SER 75 2HB SER 75 -14.651 9.327 -1.139 552 HG SER 75 HG SER 75 -14.403 11.222 -2.075 553 H PHE 76 H PHE 76 -11.745 6.531 -2.642 554 HA PHE 76 HA PHE 76 -10.131 8.105 -4.539 555 1HB PHE 76 1HB PHE 76 -8.912 5.555 -4.150 556 2HB PHE 76 2HB PHE 76 -8.261 7.148 -3.789 557 HD1 PHE 76 HD1 PHE 76 -10.590 4.621 -2.342 558 HD2 PHE 76 HD2 PHE 76 -7.655 7.618 -1.632 559 HE1 PHE 76 HE1 PHE 76 -10.648 4.103 0.063 560 HE2 PHE 76 HE2 PHE 76 -7.711 7.110 0.771 561 HZ PHE 76 HZ PHE 76 -9.207 5.349 1.623 562 H GLU 77 H GLU 77 -9.453 6.894 -6.458 563 HA GLU 77 HA GLU 77 -11.595 5.112 -7.406 564 1HB GLU 77 1HB GLU 77 -10.102 7.344 -8.680 565 2HB GLU 77 2HB GLU 77 -10.456 5.954 -9.697 566 1HG GLU 77 1HG GLU 77 -12.864 6.202 -8.957 567 2HG GLU 77 2HG GLU 77 -12.390 7.764 -8.288 568 H GLY 78 H GLY 78 -10.890 3.425 -8.955 569 1HA GLY 78 1HA GLY 78 -8.228 2.443 -8.173 570 2HA GLY 78 2HA GLY 78 -9.558 1.440 -8.724 571 HA PRO 79 HA PRO 79 -7.834 3.472 -12.756 572 1HB PRO 79 1HB PRO 79 -5.516 4.890 -12.535 573 2HB PRO 79 2HB PRO 79 -7.118 5.630 -12.449 574 1HG PRO 79 1HG PRO 79 -5.257 4.869 -10.239 575 2HG PRO 79 2HG PRO 79 -6.261 6.319 -10.408 576 1HD PRO 79 1HD PRO 79 -6.965 4.235 -8.832 577 2HD PRO 79 2HD PRO 79 -8.157 5.248 -9.666 578 H GLY 80 H GLY 80 -6.744 2.108 -14.040 579 1HA GLY 80 1HA GLY 80 -5.182 0.022 -12.993 580 2HA GLY 80 2HA GLY 80 -5.327 0.430 -14.697 581 H LEU 81 H LEU 81 -3.835 1.897 -15.626 582 HA LEU 81 HA LEU 81 -1.251 1.855 -14.288 583 1HB LEU 81 1HB LEU 81 -1.959 1.429 -16.865 584 2HB LEU 81 2HB LEU 81 -1.471 3.111 -16.932 585 HG LEU 81 HG LEU 81 0.468 1.958 -17.463 586 1HD1 LEU 81 1HD1 LEU 81 0.440 2.733 -14.593 587 2HD1 LEU 81 2HD1 LEU 81 1.253 3.494 -15.954 588 3HD1 LEU 81 3HD1 LEU 81 1.875 1.988 -15.285 589 1HD2 LEU 81 1HD2 LEU 81 1.183 0.074 -15.715 590 2HD2 LEU 81 2HD2 LEU 81 0.230 -0.259 -17.160 591 3HD2 LEU 81 3HD2 LEU 81 -0.571 -0.068 -15.601 592 H VAL 82 H VAL 82 -0.555 3.519 -13.129 593 HA VAL 82 HA VAL 82 -1.357 6.231 -13.944 594 HB VAL 82 HB VAL 82 -1.051 5.365 -11.059 595 1HG1 VAL 82 1HG1 VAL 82 -2.516 7.813 -11.787 596 2HG1 VAL 82 2HG1 VAL 82 -0.780 7.846 -12.095 597 3HG1 VAL 82 3HG1 VAL 82 -1.381 7.514 -10.471 598 1HG2 VAL 82 1HG2 VAL 82 -3.013 4.285 -11.881 599 2HG2 VAL 82 2HG2 VAL 82 -3.527 5.737 -12.741 600 3HG2 VAL 82 3HG2 VAL 82 -3.542 5.704 -10.978 601 H GLU 83 H GLU 83 0.342 7.443 -14.403 602 HA GLU 83 HA GLU 83 2.999 6.539 -13.868 603 1HB GLU 83 1HB GLU 83 3.711 8.555 -15.040 604 2HB GLU 83 2HB GLU 83 2.429 7.746 -15.931 605 1HG GLU 83 1HG GLU 83 0.850 9.377 -14.727 606 2HG GLU 83 2HG GLU 83 2.314 10.293 -14.368 607 H VAL 84 H VAL 84 3.793 6.646 -11.865 608 HA VAL 84 HA VAL 84 2.956 8.609 -9.967 609 HB VAL 84 HB VAL 84 4.687 7.677 -8.499 610 1HG1 VAL 84 1HG1 VAL 84 2.468 6.574 -8.775 611 2HG1 VAL 84 2HG1 VAL 84 3.753 5.489 -8.245 612 3HG1 VAL 84 3HG1 VAL 84 3.218 5.467 -9.925 613 1HG2 VAL 84 1HG2 VAL 84 5.721 6.659 -11.036 614 2HG2 VAL 84 2HG2 VAL 84 5.687 5.457 -9.747 615 3HG2 VAL 84 3HG2 VAL 84 6.556 6.974 -9.516 616 H GLN 85 H GLN 85 3.688 10.597 -9.718 617 HA GLN 85 HA GLN 85 5.683 11.689 -11.409 618 1HB GLN 85 1HB GLN 85 5.328 13.763 -10.141 619 2HB GLN 85 2HB GLN 85 3.807 13.028 -10.630 620 1HG GLN 85 1HG GLN 85 3.363 12.262 -8.441 621 2HG GLN 85 2HG GLN 85 5.004 12.624 -7.907 622 1HE2 GLN 85 1HE2 GLN 85 2.302 14.320 -9.469 623 2HE2 GLN 85 2HE2 GLN 85 2.399 15.736 -8.483 624 H GLU 86 H GLU 86 7.700 12.574 -10.886 625 HA GLU 86 HA GLU 86 9.246 11.018 -9.104 626 1HB GLU 86 1HB GLU 86 11.045 12.740 -9.647 627 2HB GLU 86 2HB GLU 86 10.377 11.840 -11.001 628 1HG GLU 86 1HG GLU 86 9.241 13.662 -11.829 629 2HG GLU 86 2HG GLU 86 9.209 14.483 -10.270 630 H SER 87 H SER 87 8.834 11.171 -6.978 631 HA SER 87 HA SER 87 9.295 13.766 -5.713 632 1HB SER 87 1HB SER 87 6.743 12.253 -5.660 633 2HB SER 87 2HB SER 87 7.279 12.954 -4.133 634 HG SER 87 HG SER 87 7.165 14.447 -6.533 635 H GLU 88 H GLU 88 9.839 13.643 -3.471 636 HA GLU 88 HA GLU 88 10.983 12.802 -1.705 637 1HB GLU 88 1HB GLU 88 8.750 11.317 -1.884 638 2HB GLU 88 2HB GLU 88 9.946 10.049 -2.084 639 1HG GLU 88 1HG GLU 88 10.437 10.050 0.076 640 2HG GLU 88 2HG GLU 88 10.638 11.802 0.100 641 H TYR 89 H TYR 89 10.907 9.767 -3.554 642 HA TYR 89 HA TYR 89 13.653 10.070 -4.387 643 1HB TYR 89 1HB TYR 89 14.263 7.850 -3.233 644 2HB TYR 89 2HB TYR 89 14.216 9.303 -2.241 645 HD1 TYR 89 HD1 TYR 89 11.778 6.703 -3.390 646 HD2 TYR 89 HD2 TYR 89 13.286 9.021 -0.157 647 HE1 TYR 89 HE1 TYR 89 10.187 5.606 -1.871 648 HE2 TYR 89 HE2 TYR 89 11.699 7.930 1.373 649 HH TYR 89 HH TYR 89 10.293 5.225 0.943 650 H TYR 90 H TYR 90 10.913 9.522 -5.474 651 HA TYR 90 HA TYR 90 11.541 7.012 -6.881 652 1HB TYR 90 1HB TYR 90 9.204 7.726 -5.431 653 2HB TYR 90 2HB TYR 90 8.766 7.685 -7.135 654 HD1 TYR 90 HD1 TYR 90 7.993 5.676 -7.949 655 HD2 TYR 90 HD2 TYR 90 10.749 5.637 -4.709 656 HE1 TYR 90 HE1 TYR 90 7.831 3.225 -7.848 657 HE2 TYR 90 HE2 TYR 90 10.596 3.186 -4.600 658 HH TYR 90 HH TYR 90 8.502 1.432 -5.465 659 HA PRO 91 HA PRO 91 11.565 9.748 -10.417 660 1HB PRO 91 1HB PRO 91 12.338 7.978 -12.262 661 2HB PRO 91 2HB PRO 91 13.439 8.509 -10.986 662 1HG PRO 91 1HG PRO 91 11.881 5.971 -11.212 663 2HG PRO 91 2HG PRO 91 13.532 6.225 -10.622 664 1HD PRO 91 1HD PRO 91 11.287 5.939 -9.016 665 2HD PRO 91 2HD PRO 91 12.818 6.677 -8.508 666 H LYS 92 H LYS 92 10.255 10.254 -12.156 667 HA LYS 92 HA LYS 92 7.629 9.500 -12.208 668 1HB LYS 92 1HB LYS 92 8.676 11.443 -13.414 669 2HB LYS 92 2HB LYS 92 9.178 10.315 -14.665 670 1HG LYS 92 1HG LYS 92 7.239 10.681 -15.666 671 2HG LYS 92 2HG LYS 92 6.454 9.843 -14.326 672 1HD LYS 92 1HD LYS 92 5.371 11.758 -13.939 673 2HD LYS 92 2HD LYS 92 6.905 12.380 -13.328 674 1HE LYS 92 1HE LYS 92 6.641 12.490 -16.242 675 2HE LYS 92 2HE LYS 92 5.460 13.471 -15.375 676 1HZ LYS 92 1HZ LYS 92 7.909 14.308 -15.986 677 2HZ LYS 92 2HZ LYS 92 8.199 13.684 -14.441 678 3HZ LYS 92 3HZ LYS 92 7.032 14.888 -14.661 679 H ARG 93 H ARG 93 7.279 7.288 -12.061 680 HA ARG 93 HA ARG 93 7.940 5.760 -14.499 681 1HB ARG 93 1HB ARG 93 7.980 4.853 -11.626 682 2HB ARG 93 2HB ARG 93 7.964 3.729 -12.978 683 1HG ARG 93 1HG ARG 93 10.016 5.337 -13.692 684 2HG ARG 93 2HG ARG 93 10.139 5.398 -11.933 685 1HD ARG 93 1HD ARG 93 10.954 3.327 -11.838 686 2HD ARG 93 2HD ARG 93 9.668 2.701 -12.870 687 HE ARG 93 HE ARG 93 11.298 3.928 -14.630 688 1HH1 ARG 93 1HH1 ARG 93 11.889 1.598 -12.101 689 2HH1 ARG 93 2HH1 ARG 93 13.238 0.874 -12.911 690 1HH2 ARG 93 1HH2 ARG 93 13.073 2.977 -15.697 691 2HH2 ARG 93 2HH2 ARG 93 13.910 1.657 -14.951 692 H TYR 94 H TYR 94 6.541 3.827 -14.824 693 HA TYR 94 HA TYR 94 3.745 4.572 -14.395 694 1HB TYR 94 1HB TYR 94 5.216 2.946 -16.410 695 2HB TYR 94 2HB TYR 94 3.543 2.514 -16.077 696 HD1 TYR 94 HD1 TYR 94 2.210 3.266 -17.802 697 HD2 TYR 94 HD2 TYR 94 5.296 5.794 -16.337 698 HE1 TYR 94 HE1 TYR 94 1.450 5.050 -19.308 699 HE2 TYR 94 HE2 TYR 94 4.552 7.586 -17.833 700 HH TYR 94 HH TYR 94 3.262 7.711 -20.067 701 H GLN 95 H GLN 95 2.425 3.461 -13.089 702 HA GLN 95 HA GLN 95 3.237 0.776 -12.205 703 1HB GLN 95 1HB GLN 95 2.004 2.813 -10.354 704 2HB GLN 95 2HB GLN 95 2.691 1.250 -9.932 705 1HG GLN 95 1HG GLN 95 4.439 3.283 -11.220 706 2HG GLN 95 2HG GLN 95 4.013 3.472 -9.519 707 1HE2 GLN 95 1HE2 GLN 95 6.214 2.187 -11.606 708 2HE2 GLN 95 2HE2 GLN 95 6.927 0.999 -10.573 709 H SER 96 H SER 96 1.603 -0.716 -12.059 710 HA SER 96 HA SER 96 -1.044 0.231 -12.921 711 1HB SER 96 1HB SER 96 0.103 -1.476 -14.324 712 2HB SER 96 2HB SER 96 0.043 -2.591 -12.960 713 HG SER 96 HG SER 96 -2.309 -2.197 -13.029 714 H HIS 97 H HIS 97 -2.903 -0.268 -11.855 715 HA HIS 97 HA HIS 97 -4.324 -0.958 -10.224 716 1HB HIS 97 1HB HIS 97 -2.006 -2.623 -9.229 717 2HB HIS 97 2HB HIS 97 -3.657 -2.719 -8.632 718 HD1 HIS 97 HD1 HIS 97 -5.469 -3.595 -10.384 719 HD2 HIS 97 HD2 HIS 97 -1.493 -4.108 -11.477 720 HE1 HIS 97 HE1 HIS 97 -5.497 -5.281 -12.247 721 HE2 HIS 97 HE2 HIS 97 -3.074 -5.643 -12.832 722 H VAL 98 H VAL 98 -3.507 1.492 -9.871 723 HA VAL 98 HA VAL 98 -2.870 1.641 -6.995 724 HB VAL 98 HB VAL 98 -0.982 2.487 -8.364 725 1HG1 VAL 98 1HG1 VAL 98 -1.593 3.530 -10.253 726 2HG1 VAL 98 2HG1 VAL 98 -1.628 4.956 -9.212 727 3HG1 VAL 98 3HG1 VAL 98 -3.123 4.092 -9.578 728 1HG2 VAL 98 1HG2 VAL 98 -0.826 3.474 -6.335 729 2HG2 VAL 98 2HG2 VAL 98 -2.454 4.147 -6.412 730 3HG2 VAL 98 3HG2 VAL 98 -1.138 4.918 -7.301 731 H LEU 99 H LEU 99 -4.033 3.090 -5.764 732 HA LEU 99 HA LEU 99 -6.451 4.146 -7.026 733 1HB LEU 99 1HB LEU 99 -5.779 3.232 -4.262 734 2HB LEU 99 2HB LEU 99 -7.067 4.402 -4.480 735 HG LEU 99 HG LEU 99 -8.250 2.821 -5.950 736 1HD1 LEU 99 1HD1 LEU 99 -5.913 1.036 -5.313 737 2HD1 LEU 99 2HD1 LEU 99 -6.471 1.568 -6.900 738 3HD1 LEU 99 3HD1 LEU 99 -7.447 0.445 -5.953 739 1HD2 LEU 99 1HD2 LEU 99 -7.537 1.428 -3.385 740 2HD2 LEU 99 2HD2 LEU 99 -9.080 1.439 -4.240 741 3HD2 LEU 99 3HD2 LEU 99 -8.515 2.894 -3.420 742 H LEU 100 H LEU 100 -6.993 6.314 -6.875 743 HA LEU 100 HA LEU 100 -5.072 8.018 -5.450 744 1HB LEU 100 1HB LEU 100 -5.665 7.961 -8.302 745 2HB LEU 100 2HB LEU 100 -5.812 9.562 -7.600 746 HG LEU 100 HG LEU 100 -3.365 7.799 -7.426 747 1HD1 LEU 100 1HD1 LEU 100 -2.441 8.948 -9.159 748 2HD1 LEU 100 2HD1 LEU 100 -3.394 10.402 -8.854 749 3HD1 LEU 100 3HD1 LEU 100 -4.132 9.013 -9.655 750 1HD2 LEU 100 1HD2 LEU 100 -2.446 9.274 -6.006 751 2HD2 LEU 100 2HD2 LEU 100 -4.113 9.741 -5.666 752 3HD2 LEU 100 3HD2 LEU 100 -3.159 10.661 -6.829 753 H ALA 101 H ALA 101 -5.826 9.785 -4.445 754 HA ALA 101 HA ALA 101 -8.550 10.706 -4.844 755 1HB ALA 101 1HB ALA 101 -8.800 8.864 -3.231 756 2HB ALA 101 2HB ALA 101 -9.208 10.427 -2.532 757 3HB ALA 101 3HB ALA 101 -7.658 9.670 -2.152 758 H THR 102 H THR 102 -8.975 12.720 -3.648 759 HA THR 102 HA THR 102 -6.462 14.129 -3.049 760 HB THR 102 HB THR 102 -7.350 15.204 -4.920 761 HG1 THR 102 HG1 THR 102 -8.520 16.652 -2.786 762 1HG2 THR 102 1HG2 THR 102 -9.955 14.471 -3.804 763 2HG2 THR 102 2HG2 THR 102 -9.437 14.638 -5.481 764 3HG2 THR 102 3HG2 THR 102 -9.887 16.066 -4.550 765 H GLY 103 H GLY 103 -6.149 14.877 -1.070 766 1HA GLY 103 1HA GLY 103 -8.500 15.147 0.712 767 2HA GLY 103 2HA GLY 103 -6.990 14.430 1.250 768 H PHE 104 H PHE 104 -5.857 15.735 2.498 769 HA PHE 104 HA PHE 104 -5.351 18.464 1.693 770 1HB PHE 104 1HB PHE 104 -7.334 17.838 3.709 771 2HB PHE 104 2HB PHE 104 -6.023 18.791 4.397 772 HD1 PHE 104 HD1 PHE 104 -9.137 19.044 3.004 773 HD2 PHE 104 HD2 PHE 104 -5.259 20.763 2.666 774 HE1 PHE 104 HE1 PHE 104 -10.129 21.085 2.049 775 HE2 PHE 104 HE2 PHE 104 -6.242 22.806 1.711 776 HZ PHE 104 HZ PHE 104 -8.680 22.969 1.402 777 H SER 105 H SER 105 -3.262 17.391 1.521 778 HA SER 105 HA SER 105 -1.858 17.412 4.099 779 1HB SER 105 1HB SER 105 -0.677 15.409 3.635 780 2HB SER 105 2HB SER 105 -2.360 15.052 3.244 781 HG SER 105 HG SER 105 -1.296 14.349 1.499 782 H GLU 106 H GLU 106 0.683 16.787 3.076 783 HA GLU 106 HA GLU 106 1.313 18.491 0.864 784 1HB GLU 106 1HB GLU 106 1.212 19.669 3.459 785 2HB GLU 106 2HB GLU 106 2.896 19.594 2.962 786 1HG GLU 106 1HG GLU 106 2.595 21.386 1.712 787 2HG GLU 106 2HG GLU 106 1.427 20.499 0.735 788 HA PRO 107 HA PRO 107 5.464 16.716 2.625 789 1HB PRO 107 1HB PRO 107 5.244 15.194 4.900 790 2HB PRO 107 2HB PRO 107 5.679 16.906 4.893 791 1HG PRO 107 1HG PRO 107 3.024 15.627 5.408 792 2HG PRO 107 2HG PRO 107 3.796 16.984 6.250 793 1HD PRO 107 1HD PRO 107 1.858 17.374 4.436 794 2HD PRO 107 2HD PRO 107 3.221 18.500 4.595 795 H GLY 108 H GLY 108 2.661 14.704 3.526 796 1HA GLY 108 1HA GLY 108 1.954 12.677 2.693 797 2HA GLY 108 2HA GLY 108 3.099 12.888 1.377 798 H ASP 109 H ASP 109 5.475 12.616 2.133 799 HA ASP 109 HA ASP 109 7.101 11.203 2.861 800 1HB ASP 109 1HB ASP 109 5.239 11.394 5.158 801 2HB ASP 109 2HB ASP 109 6.370 10.044 5.189 802 H ALA 110 H ALA 110 7.384 8.807 3.769 803 HA ALA 110 HA ALA 110 5.685 7.145 2.049 804 1HB ALA 110 1HB ALA 110 7.480 5.851 1.613 805 2HB ALA 110 2HB ALA 110 8.096 5.964 3.262 806 3HB ALA 110 3HB ALA 110 8.373 7.284 2.125 807 H GLY 111 H GLY 111 5.883 4.691 3.031 808 1HA GLY 111 1HA GLY 111 5.143 3.240 4.652 809 2HA GLY 111 2HA GLY 111 5.592 4.451 5.843 810 H GLY 112 H GLY 112 3.151 2.626 5.251 811 1HA GLY 112 1HA GLY 112 1.131 3.397 6.562 812 2HA GLY 112 2HA GLY 112 1.106 4.750 5.441 813 H ILE 113 H ILE 113 -0.781 2.434 6.057 814 HA ILE 113 HA ILE 113 -1.148 1.613 3.256 815 HB ILE 113 HB ILE 113 -2.159 -0.508 4.096 816 1HG1 ILE 113 1HG1 ILE 113 -1.080 -1.021 6.502 817 2HG1 ILE 113 2HG1 ILE 113 -1.350 0.709 6.684 818 1HG2 ILE 113 1HG2 ILE 113 0.590 0.220 3.886 819 2HG2 ILE 113 2HG2 ILE 113 -0.183 -1.318 3.504 820 3HG2 ILE 113 3HG2 ILE 113 0.418 -1.015 5.134 821 1HD1 ILE 113 1HD1 ILE 113 -3.698 -0.408 5.582 822 2HD1 ILE 113 2HD1 ILE 113 -3.461 0.309 7.175 823 3HD1 ILE 113 3HD1 ILE 113 -3.200 -1.419 6.938 824 H LEU 114 H LEU 114 -3.234 1.480 2.472 825 HA LEU 114 HA LEU 114 -5.178 3.096 3.903 826 1HB LEU 114 1HB LEU 114 -5.044 3.707 1.655 827 2HB LEU 114 2HB LEU 114 -4.920 2.046 1.109 828 HG LEU 114 HG LEU 114 -7.292 1.691 1.573 829 1HD1 LEU 114 1HD1 LEU 114 -7.380 3.342 3.464 830 2HD1 LEU 114 2HD1 LEU 114 -8.740 3.396 2.341 831 3HD1 LEU 114 3HD1 LEU 114 -7.467 4.615 2.245 832 1HD2 LEU 114 1HD2 LEU 114 -8.104 2.793 -0.295 833 2HD2 LEU 114 2HD2 LEU 114 -6.366 2.768 -0.587 834 3HD2 LEU 114 3HD2 LEU 114 -7.139 4.237 0.011 835 H ARG 115 H ARG 115 -6.754 2.257 5.108 836 HA ARG 115 HA ARG 115 -7.447 -0.579 4.700 837 1HB ARG 115 1HB ARG 115 -7.273 1.085 7.196 838 2HB ARG 115 2HB ARG 115 -8.219 -0.396 7.153 839 1HG ARG 115 1HG ARG 115 -5.745 -1.083 6.065 840 2HG ARG 115 2HG ARG 115 -5.380 -0.041 7.441 841 1HD ARG 115 1HD ARG 115 -7.015 -2.571 7.434 842 2HD ARG 115 2HD ARG 115 -5.460 -2.300 8.220 843 HE ARG 115 HE ARG 115 -7.548 -0.539 9.124 844 1HH1 ARG 115 1HH1 ARG 115 -6.026 -3.649 9.572 845 2HH1 ARG 115 2HH1 ARG 115 -6.552 -3.809 11.214 846 1HH2 ARG 115 1HH2 ARG 115 -8.239 -0.748 11.283 847 2HH2 ARG 115 2HH2 ARG 115 -7.808 -2.163 12.185 848 H CYS 116 H CYS 116 -9.568 -1.218 4.750 849 HA CYS 116 HA CYS 116 -11.560 0.935 4.491 850 1HB CYS 116 1HB CYS 116 -11.046 -0.749 2.561 851 2HB CYS 116 2HB CYS 116 -11.995 -1.876 3.522 852 H GLU 117 H GLU 117 -13.798 0.283 5.195 853 HA GLU 117 HA GLU 117 -13.787 -0.483 7.895 854 1HB GLU 117 1HB GLU 117 -16.280 -0.624 7.618 855 2HB GLU 117 2HB GLU 117 -15.567 0.895 7.094 856 1HG GLU 117 1HG GLU 117 -15.546 -0.625 4.803 857 2HG GLU 117 2HG GLU 117 -17.056 -1.091 5.585 858 H HIS 118 H HIS 118 -13.681 -2.357 5.055 859 HA HIS 118 HA HIS 118 -14.776 -4.733 6.340 860 1HB HIS 118 1HB HIS 118 -13.723 -4.409 3.525 861 2HB HIS 118 2HB HIS 118 -14.680 -5.752 4.149 862 HD2 HIS 118 HD2 HIS 118 -17.337 -5.470 3.691 863 HE1 HIS 118 HE1 HIS 118 -17.376 -1.281 3.007 864 HE2 HIS 118 HE2 HIS 118 -18.758 -3.385 3.119 865 H GLY 119 H GLY 119 -11.714 -3.355 5.349 866 1HA GLY 119 1HA GLY 119 -10.151 -4.934 7.007 867 2HA GLY 119 2HA GLY 119 -10.201 -5.772 5.463 868 H VAL 120 H VAL 120 -8.158 -5.516 4.814 869 HA VAL 120 HA VAL 120 -6.982 -2.833 4.755 870 HB VAL 120 HB VAL 120 -5.530 -5.329 3.932 871 1HG1 VAL 120 1HG1 VAL 120 -4.025 -3.728 3.549 872 2HG1 VAL 120 2HG1 VAL 120 -3.792 -3.757 5.297 873 3HG1 VAL 120 3HG1 VAL 120 -4.859 -2.555 4.568 874 1HG2 VAL 120 1HG2 VAL 120 -6.652 -4.924 6.507 875 2HG2 VAL 120 2HG2 VAL 120 -4.908 -4.711 6.635 876 3HG2 VAL 120 3HG2 VAL 120 -5.564 -6.204 5.969 877 H ILE 121 H ILE 121 -6.576 -1.754 2.884 878 HA ILE 121 HA ILE 121 -7.539 -3.012 0.416 879 HB ILE 121 HB ILE 121 -6.959 -0.104 0.973 880 1HG1 ILE 121 1HG1 ILE 121 -9.206 -1.756 1.635 881 2HG1 ILE 121 2HG1 ILE 121 -8.972 -0.043 1.947 882 1HG2 ILE 121 1HG2 ILE 121 -8.196 0.256 -1.173 883 2HG2 ILE 121 2HG2 ILE 121 -8.104 -1.485 -1.447 884 3HG2 ILE 121 3HG2 ILE 121 -6.626 -0.528 -1.346 885 1HD1 ILE 121 1HD1 ILE 121 -10.000 -1.072 -0.678 886 2HD1 ILE 121 2HD1 ILE 121 -10.070 0.570 -0.037 887 3HD1 ILE 121 3HD1 ILE 121 -11.055 -0.703 0.684 888 H GLY 122 H GLY 122 -5.026 -0.544 1.050 889 1HA GLY 122 1HA GLY 122 -3.034 -2.231 -0.237 890 2HA GLY 122 2HA GLY 122 -3.472 -0.772 -1.107 891 H LEU 123 H LEU 123 -1.101 -0.449 -0.819 892 HA LEU 123 HA LEU 123 -0.527 0.817 1.777 893 1HB LEU 123 1HB LEU 123 1.882 0.416 1.209 894 2HB LEU 123 2HB LEU 123 0.941 -1.027 1.532 895 HG LEU 123 HG LEU 123 1.246 -0.149 -1.301 896 1HD1 LEU 123 1HD1 LEU 123 3.368 -1.192 -1.545 897 2HD1 LEU 123 2HD1 LEU 123 3.363 -1.737 0.132 898 3HD1 LEU 123 3HD1 LEU 123 3.509 -0.018 -0.236 899 1HD2 LEU 123 1HD2 LEU 123 0.766 -2.328 -1.795 900 2HD2 LEU 123 2HD2 LEU 123 -0.097 -2.166 -0.266 901 3HD2 LEU 123 3HD2 LEU 123 1.487 -2.941 -0.306 902 H VAL 124 H VAL 124 1.060 2.642 1.640 903 HA VAL 124 HA VAL 124 0.143 4.584 -0.199 904 HB VAL 124 HB VAL 124 1.946 6.021 0.690 905 1HG1 VAL 124 1HG1 VAL 124 -0.263 4.979 2.052 906 2HG1 VAL 124 2HG1 VAL 124 0.595 6.482 2.392 907 3HG1 VAL 124 3HG1 VAL 124 1.052 4.998 3.227 908 1HG2 VAL 124 1HG2 VAL 124 3.347 5.136 2.543 909 2HG2 VAL 124 2HG2 VAL 124 3.711 4.416 0.975 910 3HG2 VAL 124 3HG2 VAL 124 2.763 3.517 2.160 911 H THR 125 H THR 125 0.771 5.037 -2.217 912 HA THR 125 HA THR 125 3.267 3.815 -3.176 913 HB THR 125 HB THR 125 0.669 4.425 -4.558 914 HG1 THR 125 HG1 THR 125 1.233 2.347 -3.557 915 1HG2 THR 125 1HG2 THR 125 1.749 5.050 -6.407 916 2HG2 THR 125 2HG2 THR 125 2.226 3.360 -6.527 917 3HG2 THR 125 3HG2 THR 125 3.313 4.528 -5.782 918 H MET 126 H MET 126 1.575 6.359 -4.956 919 HA MET 126 HA MET 126 3.571 8.308 -4.077 920 1HB MET 126 1HB MET 126 3.257 7.351 -6.915 921 2HB MET 126 2HB MET 126 3.997 8.896 -6.520 922 1HG MET 126 1HG MET 126 4.957 6.171 -5.680 923 2HG MET 126 2HG MET 126 5.702 7.237 -6.869 924 1HE MET 126 1HE MET 126 7.297 8.873 -6.504 925 2HE MET 126 2HE MET 126 7.809 9.611 -4.986 926 3HE MET 126 3HE MET 126 6.276 10.080 -5.723 927 H GLY 127 H GLY 127 3.138 10.501 -4.893 928 1HA GLY 127 1HA GLY 127 0.801 11.268 -6.206 929 2HA GLY 127 2HA GLY 127 0.430 11.199 -4.490 930 H GLY 128 H GLY 128 0.023 13.498 -4.658 931 1HA GLY 128 1HA GLY 128 2.547 15.028 -4.495 932 2HA GLY 128 2HA GLY 128 1.161 15.654 -5.376 933 H GLU 129 H GLU 129 1.126 17.493 -4.043 934 HA GLU 129 HA GLU 129 0.584 17.122 -1.208 935 1HB GLU 129 1HB GLU 129 0.483 19.680 -1.267 936 2HB GLU 129 2HB GLU 129 2.038 18.925 -1.591 937 1HG GLU 129 1HG GLU 129 1.854 19.333 -3.915 938 2HG GLU 129 2HG GLU 129 0.160 19.798 -3.765 939 H GLY 130 H GLY 130 -1.284 16.594 -3.687 940 1HA GLY 130 1HA GLY 130 -3.647 17.785 -2.397 941 2HA GLY 130 2HA GLY 130 -3.446 17.874 -4.140 942 H VAL 131 H VAL 131 -2.352 15.225 -4.463 943 HA VAL 131 HA VAL 131 -4.762 13.647 -3.862 944 HB VAL 131 HB VAL 131 -3.295 12.437 -5.993 945 1HG1 VAL 131 1HG1 VAL 131 -6.011 13.661 -5.679 946 2HG1 VAL 131 2HG1 VAL 131 -5.566 11.957 -5.758 947 3HG1 VAL 131 3HG1 VAL 131 -5.478 12.959 -7.206 948 1HG2 VAL 131 1HG2 VAL 131 -3.375 14.093 -7.713 949 2HG2 VAL 131 2HG2 VAL 131 -2.435 14.747 -6.371 950 3HG2 VAL 131 3HG2 VAL 131 -4.102 15.271 -6.618 951 H VAL 132 H VAL 132 -4.484 11.353 -3.570 952 HA VAL 132 HA VAL 132 -1.831 10.637 -2.504 953 HB VAL 132 HB VAL 132 -2.843 9.426 -0.719 954 1HG1 VAL 132 1HG1 VAL 132 -4.711 11.640 -0.466 955 2HG1 VAL 132 2HG1 VAL 132 -3.101 12.154 -0.975 956 3HG1 VAL 132 3HG1 VAL 132 -3.302 11.227 0.512 957 1HG2 VAL 132 1HG2 VAL 132 -5.415 9.852 -2.212 958 2HG2 VAL 132 2HG2 VAL 132 -5.394 9.449 -0.495 959 3HG2 VAL 132 3HG2 VAL 132 -4.691 8.338 -1.669 960 H GLY 133 H GLY 133 -0.907 9.016 -3.621 961 1HA GLY 133 1HA GLY 133 -2.660 7.189 -5.123 962 2HA GLY 133 2HA GLY 133 -0.959 7.461 -5.455 963 H PHE 134 H PHE 134 -3.135 5.332 -4.158 964 HA PHE 134 HA PHE 134 -1.089 4.085 -2.444 965 1HB PHE 134 1HB PHE 134 -4.076 3.640 -2.316 966 2HB PHE 134 2HB PHE 134 -2.867 3.070 -1.170 967 HD1 PHE 134 HD1 PHE 134 -1.251 5.629 -1.006 968 HD2 PHE 134 HD2 PHE 134 -5.443 4.897 -0.861 969 HE1 PHE 134 HE1 PHE 134 -1.554 7.661 0.341 970 HE2 PHE 134 HE2 PHE 134 -5.750 6.931 0.486 971 HZ PHE 134 HZ PHE 134 -3.806 8.315 1.089 972 H ALA 135 H ALA 135 -0.551 1.960 -2.751 973 HA ALA 135 HA ALA 135 -1.371 0.779 -5.279 974 1HB ALA 135 1HB ALA 135 0.385 -0.981 -4.483 975 2HB ALA 135 2HB ALA 135 0.832 0.276 -3.327 976 3HB ALA 135 3HB ALA 135 0.915 0.600 -5.058 977 H ASP 136 H ASP 136 -3.093 -0.497 -5.340 978 HA ASP 136 HA ASP 136 -4.342 -1.548 -3.030 979 1HB ASP 136 1HB ASP 136 -4.864 -1.453 -5.889 980 2HB ASP 136 2HB ASP 136 -5.363 -2.986 -5.181 981 H VAL 137 H VAL 137 -4.473 -3.584 -2.200 982 HA VAL 137 HA VAL 137 -2.300 -5.404 -2.897 983 HB VAL 137 HB VAL 137 -4.275 -5.500 -0.601 984 1HG1 VAL 137 1HG1 VAL 137 -1.995 -7.279 -1.371 985 2HG1 VAL 137 2HG1 VAL 137 -3.617 -7.713 -0.834 986 3HG1 VAL 137 3HG1 VAL 137 -2.444 -7.082 0.321 987 1HG2 VAL 137 1HG2 VAL 137 -2.921 -4.164 0.555 988 2HG2 VAL 137 2HG2 VAL 137 -2.099 -3.814 -0.966 989 3HG2 VAL 137 3HG2 VAL 137 -1.494 -5.092 0.090 990 H ARG 138 H ARG 138 -5.142 -4.917 -4.219 991 HA ARG 138 HA ARG 138 -6.429 -7.448 -4.087 992 1HB ARG 138 1HB ARG 138 -6.689 -5.301 -6.196 993 2HB ARG 138 2HB ARG 138 -7.819 -6.617 -5.906 994 1HG ARG 138 1HG ARG 138 -7.456 -5.208 -3.465 995 2HG ARG 138 2HG ARG 138 -7.775 -4.035 -4.742 996 1HD ARG 138 1HD ARG 138 -9.455 -6.499 -4.506 997 2HD ARG 138 2HD ARG 138 -9.760 -5.117 -3.455 998 HE ARG 138 HE ARG 138 -10.312 -5.316 -6.273 999 1HH1 ARG 138 1HH1 ARG 138 -9.749 -3.139 -3.604 1000 2HH1 ARG 138 2HH1 ARG 138 -10.579 -1.813 -4.348 1001 1HH2 ARG 138 1HH2 ARG 138 -11.401 -3.572 -7.254 1002 2HH2 ARG 138 2HH2 ARG 138 -11.516 -2.059 -6.419 1003 H ASP 139 H ASP 139 -3.559 -6.545 -5.542 1004 HA ASP 139 HA ASP 139 -3.847 -8.368 -7.805 1005 1HB ASP 139 1HB ASP 139 -1.631 -7.526 -8.490 1006 2HB ASP 139 2HB ASP 139 -2.788 -6.219 -8.256 1007 H LEU 140 H LEU 140 -3.419 -8.933 -4.726 1008 HA LEU 140 HA LEU 140 -2.159 -11.409 -5.052 1009 1HB LEU 140 1HB LEU 140 -0.066 -11.058 -3.840 1010 2HB LEU 140 2HB LEU 140 -0.108 -10.151 -5.335 1011 HG LEU 140 HG LEU 140 0.760 -8.521 -4.041 1012 1HD1 LEU 140 1HD1 LEU 140 -1.378 -7.579 -4.639 1013 2HD1 LEU 140 2HD1 LEU 140 -0.901 -7.026 -3.032 1014 3HD1 LEU 140 3HD1 LEU 140 -2.116 -8.292 -3.207 1015 1HD2 LEU 140 1HD2 LEU 140 0.382 -10.331 -2.030 1016 2HD2 LEU 140 2HD2 LEU 140 -0.566 -8.948 -1.484 1017 3HD2 LEU 140 3HD2 LEU 140 1.145 -8.750 -1.860 1018 H LEU 141 H LEU 141 -4.399 -11.190 -3.972 1019 HA LEU 141 HA LEU 141 -4.395 -10.538 -1.179 1020 1HB LEU 141 1HB LEU 141 -6.327 -10.937 -3.184 1021 2HB LEU 141 2HB LEU 141 -6.650 -12.127 -1.936 1022 HG LEU 141 HG LEU 141 -7.944 -10.283 -1.329 1023 1HD1 LEU 141 1HD1 LEU 141 -5.862 -11.092 0.300 1024 2HD1 LEU 141 2HD1 LEU 141 -7.310 -10.218 0.791 1025 3HD1 LEU 141 3HD1 LEU 141 -5.837 -9.333 0.394 1026 1HD2 LEU 141 1HD2 LEU 141 -7.547 -8.283 -2.199 1027 2HD2 LEU 141 2HD2 LEU 141 -5.935 -8.795 -2.701 1028 3HD2 LEU 141 3HD2 LEU 141 -6.180 -8.095 -1.101 1029 H TRP 142 H TRP 142 -3.521 -13.292 -2.961 1030 HA TRP 142 HA TRP 142 -4.340 -15.363 -1.281 1031 1HB TRP 142 1HB TRP 142 -2.402 -16.639 -2.271 1032 2HB TRP 142 2HB TRP 142 -3.520 -15.938 -3.436 1033 HD1 TRP 142 HD1 TRP 142 -2.610 -13.562 -4.622 1034 HE1 TRP 142 HE1 TRP 142 -0.214 -12.952 -5.330 1035 HE3 TRP 142 HE3 TRP 142 -0.038 -16.955 -1.795 1036 HZ2 TRP 142 HZ2 TRP 142 2.412 -13.800 -4.770 1037 HZ3 TRP 142 HZ3 TRP 142 2.417 -16.990 -1.942 1038 HH2 TRP 142 HH2 TRP 142 3.617 -15.446 -3.399 1039 H LEU 143 H LEU 143 -4.039 -14.350 0.814 1040 HA LEU 143 HA LEU 143 -1.446 -15.071 1.956 1041 1HB LEU 143 1HB LEU 143 -2.847 -12.462 2.562 1042 2HB LEU 143 2HB LEU 143 -1.398 -13.053 3.349 1043 HG LEU 143 HG LEU 143 -0.500 -13.007 0.815 1044 1HD1 LEU 143 1HD1 LEU 143 -1.493 -10.598 0.154 1045 2HD1 LEU 143 2HD1 LEU 143 -2.920 -11.336 0.882 1046 3HD1 LEU 143 3HD1 LEU 143 -2.112 -12.125 -0.475 1047 1HD2 LEU 143 1HD2 LEU 143 -0.559 -10.364 2.144 1048 2HD2 LEU 143 2HD2 LEU 143 0.803 -11.289 1.512 1049 3HD2 LEU 143 3HD2 LEU 143 0.097 -11.713 3.071 1050 H GLU 144 H GLU 144 -4.748 -13.958 2.586 1051 HA GLU 144 HA GLU 144 -5.111 -16.083 4.531 1052 1HB GLU 144 1HB GLU 144 -4.385 -13.561 5.418 1053 2HB GLU 144 2HB GLU 144 -6.133 -13.556 5.581 1054 1HG GLU 144 1HG GLU 144 -4.898 -14.273 7.612 1055 2HG GLU 144 2HG GLU 144 -6.084 -15.439 7.027 1056 H ASP 145 H ASP 145 -7.542 -15.111 5.597 1057 HA ASP 145 HA ASP 145 -9.327 -15.809 3.500 1058 1HB ASP 145 1HB ASP 145 -9.582 -15.040 6.363 1059 2HB ASP 145 2HB ASP 145 -11.013 -14.865 5.352 1060 H ASP 146 H ASP 146 -10.856 -14.561 2.424 1061 HA ASP 146 HA ASP 146 -10.142 -11.744 2.166 1062 1HB ASP 146 1HB ASP 146 -11.656 -13.700 0.477 1063 2HB ASP 146 2HB ASP 146 -11.921 -11.974 0.245 1064 H ALA 147 H ALA 147 -11.744 -10.075 2.170 1065 HA ALA 147 HA ALA 147 -13.834 -10.577 4.138 1066 1HB ALA 147 1HB ALA 147 -12.117 -8.564 4.012 1067 2HB ALA 147 2HB ALA 147 -13.743 -8.361 4.662 1068 3HB ALA 147 3HB ALA 147 -13.388 -7.869 3.006 1069 H MET 148 H MET 148 -15.959 -10.614 3.703 1070 HA MET 148 HA MET 148 -17.114 -9.333 1.425 1071 1HB MET 148 1HB MET 148 -16.048 -11.468 0.505 1072 2HB MET 148 2HB MET 148 -17.274 -12.342 1.413 1073 1HG MET 148 1HG MET 148 -19.024 -11.419 0.132 1074 2HG MET 148 2HG MET 148 -17.958 -10.211 -0.585 1075 1HE MET 148 1HE MET 148 -19.006 -10.730 -2.768 1076 2HE MET 148 2HE MET 148 -19.888 -12.238 -2.522 1077 3HE MET 148 3HE MET 148 -18.654 -12.133 -3.777 1078 H GLU 149 H GLU 149 -17.668 -12.100 3.607 1079 HA GLU 149 HA GLU 149 -20.333 -10.995 4.190 1080 1HB GLU 149 1HB GLU 149 -19.753 -13.488 3.320 1081 2HB GLU 149 2HB GLU 149 -19.678 -13.748 5.057 1082 1HG GLU 149 1HG GLU 149 -21.954 -12.713 5.214 1083 2HG GLU 149 2HG GLU 149 -22.010 -12.738 3.452 1084 H GLN 150 H GLN 150 -21.124 -11.375 6.433 1085 HA GLN 150 HA GLN 150 -19.406 -10.202 8.310 1086 1HB GLN 150 1HB GLN 150 -21.979 -10.319 8.293 1087 2HB GLN 150 2HB GLN 150 -21.783 -11.885 9.067 1088 1HG GLN 150 1HG GLN 150 -22.034 -10.541 10.890 1089 2HG GLN 150 2HG GLN 150 -20.279 -10.537 10.728 1090 1HE2 GLN 150 1HE2 GLN 150 -23.135 -8.675 10.698 1091 2HE2 GLN 150 2HE2 GLN 150 -22.409 -7.141 10.379 Start of MODEL 11 1 1H GLY 1 1H GLY 1 4.680 5.431 18.012 2 2H GLY 1 2H GLY 1 6.302 5.066 17.704 3 3H GLY 1 3H GLY 1 5.318 5.655 16.462 4 1HA GLY 1 1HA GLY 1 5.340 7.799 17.224 5 2HA GLY 1 2HA GLY 1 5.660 7.286 18.875 6 HA PRO 2 HA PRO 2 9.932 8.195 18.316 7 1HB PRO 2 1HB PRO 2 11.170 6.253 19.751 8 2HB PRO 2 2HB PRO 2 10.280 7.581 20.504 9 1HG PRO 2 1HG PRO 2 9.402 4.766 19.987 10 2HG PRO 2 2HG PRO 2 9.164 5.765 21.433 11 1HD PRO 2 1HD PRO 2 7.222 5.393 19.583 12 2HD PRO 2 2HD PRO 2 7.382 6.899 20.510 13 H TYR 3 H TYR 3 12.088 7.201 17.671 14 HA TYR 3 HA TYR 3 13.354 6.137 16.109 15 1HB TYR 3 1HB TYR 3 11.317 3.942 16.539 16 2HB TYR 3 2HB TYR 3 12.827 3.748 15.654 17 HD1 TYR 3 HD1 TYR 3 14.996 3.944 16.873 18 HD2 TYR 3 HD2 TYR 3 11.263 3.881 18.913 19 HE1 TYR 3 HE1 TYR 3 16.158 3.401 18.970 20 HE2 TYR 3 HE2 TYR 3 12.415 3.340 21.017 21 HH TYR 3 HH TYR 3 15.780 3.592 21.388 22 H GLY 4 H GLY 4 13.029 4.744 13.912 23 1HA GLY 4 1HA GLY 4 10.822 4.950 12.310 24 2HA GLY 4 2HA GLY 4 11.587 6.527 12.187 25 H HIS 5 H HIS 5 12.080 3.070 11.685 26 HA HIS 5 HA HIS 5 14.241 3.719 9.793 27 1HB HIS 5 1HB HIS 5 14.402 2.040 11.923 28 2HB HIS 5 2HB HIS 5 13.928 0.913 10.657 29 HD1 HIS 5 HD1 HIS 5 15.530 1.352 8.346 30 HD2 HIS 5 HD2 HIS 5 17.082 2.216 12.102 31 HE1 HIS 5 HE1 HIS 5 18.027 1.360 8.054 32 HE2 HIS 5 HE2 HIS 5 18.941 1.979 10.319 33 H GLN 6 H GLN 6 11.288 1.874 10.285 34 HA GLN 6 HA GLN 6 10.739 1.906 7.465 35 1HB GLN 6 1HB GLN 6 12.261 -0.070 7.742 36 2HB GLN 6 2HB GLN 6 11.053 -0.786 8.800 37 1HG GLN 6 1HG GLN 6 9.434 -0.554 6.860 38 2HG GLN 6 2HG GLN 6 10.847 -0.209 5.864 39 1HE2 GLN 6 1HE2 GLN 6 12.438 -1.836 5.614 40 2HE2 GLN 6 2HE2 GLN 6 12.043 -3.503 5.836 41 H SER 7 H SER 7 8.738 2.700 7.633 42 HA SER 7 HA SER 7 6.765 1.131 9.120 43 1HB SER 7 1HB SER 7 7.342 4.058 9.498 44 2HB SER 7 2HB SER 7 5.727 3.417 9.795 45 HG SER 7 HG SER 7 6.824 1.860 11.209 46 H GLY 8 H GLY 8 6.261 0.429 6.939 47 1HA GLY 8 1HA GLY 8 4.045 1.751 5.846 48 2HA GLY 8 2HA GLY 8 5.453 2.175 4.885 49 H ALA 9 H ALA 9 4.859 -0.916 6.478 50 HA ALA 9 HA ALA 9 4.579 -2.154 3.817 51 1HB ALA 9 1HB ALA 9 5.978 -3.953 4.432 52 2HB ALA 9 2HB ALA 9 5.982 -3.470 6.128 53 3HB ALA 9 3HB ALA 9 6.830 -2.491 4.932 54 H VAL 10 H VAL 10 3.073 -3.747 3.595 55 HA VAL 10 HA VAL 10 1.333 -4.218 5.924 56 HB VAL 10 HB VAL 10 0.625 -4.575 3.010 57 1HG1 VAL 10 1HG1 VAL 10 -0.600 -5.651 5.173 58 2HG1 VAL 10 2HG1 VAL 10 -1.417 -5.248 3.664 59 3HG1 VAL 10 3HG1 VAL 10 -1.467 -4.123 5.022 60 1HG2 VAL 10 1HG2 VAL 10 0.942 -2.164 4.481 61 2HG2 VAL 10 2HG2 VAL 10 -0.780 -2.409 4.191 62 3HG2 VAL 10 3HG2 VAL 10 0.347 -2.379 2.835 63 H TYR 11 H TYR 11 1.721 -6.134 6.861 64 HA TYR 11 HA TYR 11 2.288 -8.429 5.108 65 1HB TYR 11 1HB TYR 11 3.821 -9.292 6.612 66 2HB TYR 11 2HB TYR 11 4.098 -7.564 6.786 67 HD1 TYR 11 HD1 TYR 11 3.778 -10.513 8.548 68 HD2 TYR 11 HD2 TYR 11 2.457 -6.471 8.664 69 HE1 TYR 11 HE1 TYR 11 3.396 -10.716 10.966 70 HE2 TYR 11 HE2 TYR 11 2.071 -6.661 11.085 71 HH TYR 11 HH TYR 11 2.910 -8.071 12.979 72 H VAL 12 H VAL 12 0.824 -9.977 5.075 73 HA VAL 12 HA VAL 12 -1.080 -10.164 7.316 74 HB VAL 12 HB VAL 12 -1.548 -10.588 4.366 75 1HG1 VAL 12 1HG1 VAL 12 -3.832 -11.177 4.886 76 2HG1 VAL 12 2HG1 VAL 12 -3.504 -11.035 6.615 77 3HG1 VAL 12 3HG1 VAL 12 -2.729 -12.307 5.670 78 1HG2 VAL 12 1HG2 VAL 12 -2.116 -8.447 4.410 79 2HG2 VAL 12 2HG2 VAL 12 -1.899 -8.372 6.159 80 3HG2 VAL 12 3HG2 VAL 12 -3.450 -8.869 5.483 81 H GLY 13 H GLY 13 -1.589 -12.149 8.131 82 1HA GLY 13 1HA GLY 13 -1.136 -14.317 8.759 83 2HA GLY 13 2HA GLY 13 -1.376 -14.640 7.052 84 H ASN 14 H ASN 14 0.159 -15.992 6.416 85 HA ASN 14 HA ASN 14 2.834 -15.827 7.545 86 1HB ASN 14 1HB ASN 14 3.247 -17.910 6.283 87 2HB ASN 14 2HB ASN 14 1.829 -18.036 7.319 88 1HD2 ASN 14 1HD2 ASN 14 0.614 -19.472 6.269 89 2HD2 ASN 14 2HD2 ASN 14 0.057 -19.301 4.643 90 H TYR 15 H TYR 15 1.611 -13.863 5.542 91 HA TYR 15 HA TYR 15 3.863 -13.902 3.640 92 1HB TYR 15 1HB TYR 15 0.954 -13.283 3.149 93 2HB TYR 15 2HB TYR 15 2.211 -12.650 2.099 94 HD1 TYR 15 HD1 TYR 15 -0.120 -14.512 1.409 95 HD2 TYR 15 HD2 TYR 15 3.961 -15.256 2.346 96 HE1 TYR 15 HE1 TYR 15 -0.207 -16.592 0.109 97 HE2 TYR 15 HE2 TYR 15 3.883 -17.333 1.047 98 HH TYR 15 HH TYR 15 2.608 -18.357 -0.722 99 H LYS 16 H LYS 16 4.741 -11.858 3.143 100 HA LYS 16 HA LYS 16 3.676 -9.584 4.664 101 1HB LYS 16 1HB LYS 16 5.581 -10.534 5.906 102 2HB LYS 16 2HB LYS 16 6.596 -10.346 4.483 103 1HG LYS 16 1HG LYS 16 5.423 -7.830 5.016 104 2HG LYS 16 2HG LYS 16 6.033 -8.467 6.544 105 1HD LYS 16 1HD LYS 16 8.214 -8.889 5.446 106 2HD LYS 16 2HD LYS 16 7.588 -8.134 3.979 107 1HE LYS 16 1HE LYS 16 7.365 -6.028 5.062 108 2HE LYS 16 2HE LYS 16 7.675 -6.739 6.645 109 1HZ LYS 16 1HZ LYS 16 9.573 -5.504 5.542 110 2HZ LYS 16 2HZ LYS 16 9.689 -6.815 4.480 111 3HZ LYS 16 3HZ LYS 16 9.922 -7.048 6.139 112 H VAL 17 H VAL 17 3.129 -8.049 3.224 113 HA VAL 17 HA VAL 17 4.701 -7.892 0.757 114 HB VAL 17 HB VAL 17 2.859 -7.400 -0.386 115 1HG1 VAL 17 1HG1 VAL 17 0.676 -7.960 0.635 116 2HG1 VAL 17 2HG1 VAL 17 1.461 -8.022 2.213 117 3HG1 VAL 17 3HG1 VAL 17 1.922 -9.169 0.953 118 1HG2 VAL 17 1HG2 VAL 17 2.884 -5.079 0.314 119 2HG2 VAL 17 2HG2 VAL 17 2.005 -5.491 1.788 120 3HG2 VAL 17 3HG2 VAL 17 1.225 -5.671 0.215 121 H VAL 18 H VAL 18 6.140 -6.380 0.521 122 HA VAL 18 HA VAL 18 5.778 -3.791 1.848 123 HB VAL 18 HB VAL 18 7.293 -5.172 3.248 124 1HG1 VAL 18 1HG1 VAL 18 8.284 -6.468 1.380 125 2HG1 VAL 18 2HG1 VAL 18 9.484 -5.784 2.478 126 3HG1 VAL 18 3HG1 VAL 18 9.189 -5.028 0.911 127 1HG2 VAL 18 1HG2 VAL 18 7.437 -2.616 2.896 128 2HG2 VAL 18 2HG2 VAL 18 8.923 -2.984 2.019 129 3HG2 VAL 18 3HG2 VAL 18 8.764 -3.440 3.715 130 H ASN 19 H ASN 19 7.185 -2.082 0.950 131 HA ASN 19 HA ASN 19 7.096 -2.018 -1.862 132 1HB ASN 19 1HB ASN 19 7.885 -0.233 0.285 133 2HB ASN 19 2HB ASN 19 8.989 -0.105 -1.080 134 1HD2 ASN 19 1HD2 ASN 19 8.454 1.456 -2.403 135 2HD2 ASN 19 2HD2 ASN 19 6.849 1.951 -2.810 136 H ARG 20 H ARG 20 8.669 -2.325 -3.423 137 HA ARG 20 HA ARG 20 10.622 -4.252 -2.978 138 1HB ARG 20 1HB ARG 20 11.533 -3.576 -5.200 139 2HB ARG 20 2HB ARG 20 9.802 -3.880 -5.198 140 1HG ARG 20 1HG ARG 20 9.626 -1.934 -6.256 141 2HG ARG 20 2HG ARG 20 9.937 -1.188 -4.688 142 1HD ARG 20 1HD ARG 20 12.462 -1.707 -5.501 143 2HD ARG 20 2HD ARG 20 11.676 -1.437 -7.055 144 HE ARG 20 HE ARG 20 11.059 0.596 -5.140 145 1HH1 ARG 20 1HH1 ARG 20 13.438 -0.472 -7.459 146 2HH1 ARG 20 2HH1 ARG 20 14.079 1.115 -7.720 147 1HH2 ARG 20 1HH2 ARG 20 11.902 2.684 -5.481 148 2HH2 ARG 20 2HH2 ARG 20 13.208 2.907 -6.597 149 H HIS 21 H HIS 21 10.967 -0.722 -3.141 150 HA HIS 21 HA HIS 21 13.785 -0.746 -2.782 151 1HB HIS 21 1HB HIS 21 12.374 1.149 -3.734 152 2HB HIS 21 2HB HIS 21 11.943 1.534 -2.070 153 HD1 HIS 21 HD1 HIS 21 15.382 0.397 -2.275 154 HD2 HIS 21 HD2 HIS 21 13.380 4.002 -2.780 155 HE1 HIS 21 HE1 HIS 21 17.152 2.176 -2.124 156 HE2 HIS 21 HE2 HIS 21 15.905 4.353 -2.344 157 H LEU 22 H LEU 22 11.316 -1.525 -0.659 158 HA LEU 22 HA LEU 22 12.949 -0.768 1.668 159 1HB LEU 22 1HB LEU 22 9.978 -1.125 1.373 160 2HB LEU 22 2HB LEU 22 10.766 -1.077 2.938 161 HG LEU 22 HG LEU 22 10.904 1.151 0.907 162 1HD1 LEU 22 1HD1 LEU 22 9.395 1.480 3.420 163 2HD1 LEU 22 2HD1 LEU 22 8.650 0.466 2.185 164 3HD1 LEU 22 3HD1 LEU 22 9.085 2.133 1.812 165 1HD2 LEU 22 1HD2 LEU 22 12.090 0.672 3.572 166 2HD2 LEU 22 2HD2 LEU 22 11.462 2.289 3.260 167 3HD2 LEU 22 3HD2 LEU 22 12.702 1.606 2.208 168 H ALA 23 H ALA 23 12.188 -3.430 -0.205 169 HA ALA 23 HA ALA 23 11.915 -5.289 2.012 170 1HB ALA 23 1HB ALA 23 10.687 -6.150 0.320 171 2HB ALA 23 2HB ALA 23 12.222 -6.919 -0.077 172 3HB ALA 23 3HB ALA 23 11.717 -5.461 -0.933 173 H THR 24 H THR 24 13.506 -6.283 3.001 174 HA THR 24 HA THR 24 16.229 -5.761 2.300 175 HB THR 24 HB THR 24 15.750 -5.868 4.612 176 HG1 THR 24 HG1 THR 24 16.849 -8.417 4.382 177 1HG2 THR 24 1HG2 THR 24 14.919 -7.983 5.681 178 2HG2 THR 24 2HG2 THR 24 14.458 -8.518 4.065 179 3HG2 THR 24 3HG2 THR 24 13.729 -7.067 4.753 180 H HIS 25 H HIS 25 17.855 -7.559 2.160 181 HA HIS 25 HA HIS 25 17.438 -9.093 -0.097 182 1HB HIS 25 1HB HIS 25 19.537 -8.699 1.782 183 2HB HIS 25 2HB HIS 25 19.370 -10.431 1.523 184 HD1 HIS 25 HD1 HIS 25 19.837 -7.252 -0.497 185 HD2 HIS 25 HD2 HIS 25 20.546 -11.337 -0.757 186 HE1 HIS 25 HE1 HIS 25 21.157 -7.572 -2.613 187 HE2 HIS 25 HE2 HIS 25 21.649 -10.040 -2.703 188 H VAL 26 H VAL 26 16.708 -9.884 3.227 189 HA VAL 26 HA VAL 26 16.372 -12.683 2.788 190 HB VAL 26 HB VAL 26 16.823 -11.800 5.032 191 1HG1 VAL 26 1HG1 VAL 26 15.728 -9.785 5.254 192 2HG1 VAL 26 2HG1 VAL 26 14.720 -10.853 6.229 193 3HG1 VAL 26 3HG1 VAL 26 14.216 -10.410 4.599 194 1HG2 VAL 26 1HG2 VAL 26 15.230 -13.881 4.391 195 2HG2 VAL 26 2HG2 VAL 26 14.144 -12.957 5.429 196 3HG2 VAL 26 3HG2 VAL 26 15.713 -13.483 6.040 197 H ASP 27 H ASP 27 14.300 -9.874 2.508 198 HA ASP 27 HA ASP 27 11.830 -11.256 2.440 199 1HB ASP 27 1HB ASP 27 12.747 -8.522 1.588 200 2HB ASP 27 2HB ASP 27 11.141 -9.092 1.142 201 H TRP 28 H TRP 28 14.110 -10.149 -0.021 202 HA TRP 28 HA TRP 28 12.540 -11.133 -2.171 203 1HB TRP 28 1HB TRP 28 15.459 -10.360 -2.152 204 2HB TRP 28 2HB TRP 28 14.477 -10.627 -3.591 205 HD1 TRP 28 HD1 TRP 28 14.615 -8.243 -0.563 206 HE1 TRP 28 HE1 TRP 28 13.690 -5.963 -1.274 207 HE3 TRP 28 HE3 TRP 28 13.151 -9.424 -5.307 208 HZ2 TRP 28 HZ2 TRP 28 12.471 -4.815 -3.522 209 HZ3 TRP 28 HZ3 TRP 28 12.102 -7.669 -6.679 210 HH2 TRP 28 HH2 TRP 28 11.771 -5.412 -5.808 211 H GLN 29 H GLN 29 15.027 -12.432 -0.129 212 HA GLN 29 HA GLN 29 15.857 -14.612 -1.682 213 1HB GLN 29 1HB GLN 29 16.429 -13.630 0.844 214 2HB GLN 29 2HB GLN 29 15.694 -15.190 1.178 215 1HG GLN 29 1HG GLN 29 18.156 -15.259 0.986 216 2HG GLN 29 2HG GLN 29 17.323 -16.321 -0.149 217 1HE2 GLN 29 1HE2 GLN 29 17.790 -16.152 -2.240 218 2HE2 GLN 29 2HE2 GLN 29 18.731 -14.892 -2.957 219 H ASN 30 H ASN 30 13.216 -14.289 0.649 220 HA ASN 30 HA ASN 30 12.173 -16.893 -0.247 221 1HB ASN 30 1HB ASN 30 12.713 -16.418 2.256 222 2HB ASN 30 2HB ASN 30 11.227 -15.474 2.229 223 1HD2 ASN 30 1HD2 ASN 30 12.007 -18.010 3.590 224 2HD2 ASN 30 2HD2 ASN 30 10.770 -19.137 3.165 225 H CYS 31 H CYS 31 11.898 -14.287 -1.589 226 HA CYS 31 HA CYS 31 9.244 -13.335 -1.167 227 1HB CYS 31 1HB CYS 31 10.762 -11.769 -2.066 228 2HB CYS 31 2HB CYS 31 11.313 -12.885 -3.309 229 HG CYS 31 HG CYS 31 9.795 -11.354 -4.596 230 H VAL 32 H VAL 32 7.418 -14.174 -1.853 231 HA VAL 32 HA VAL 32 7.439 -16.421 -3.682 232 HB VAL 32 HB VAL 32 4.962 -16.469 -3.201 233 1HG1 VAL 32 1HG1 VAL 32 7.169 -17.000 -1.369 234 2HG1 VAL 32 2HG1 VAL 32 5.803 -18.018 -1.826 235 3HG1 VAL 32 3HG1 VAL 32 5.616 -16.811 -0.552 236 1HG2 VAL 32 1HG2 VAL 32 5.642 -14.441 -1.080 237 2HG2 VAL 32 2HG2 VAL 32 4.061 -15.133 -1.440 238 3HG2 VAL 32 3HG2 VAL 32 4.827 -14.041 -2.593 239 H TRP 33 H TRP 33 6.206 -13.099 -3.556 240 HA TRP 33 HA TRP 33 5.936 -13.176 -6.472 241 1HB TRP 33 1HB TRP 33 3.688 -13.412 -6.131 242 2HB TRP 33 2HB TRP 33 3.747 -12.700 -4.523 243 HD1 TRP 33 HD1 TRP 33 2.991 -11.853 -8.120 244 HE1 TRP 33 HE1 TRP 33 2.266 -9.386 -8.282 245 HE3 TRP 33 HE3 TRP 33 4.206 -10.348 -3.404 246 HZ2 TRP 33 HZ2 TRP 33 2.224 -7.095 -6.608 247 HZ3 TRP 33 HZ3 TRP 33 3.803 -8.010 -2.759 248 HH2 TRP 33 HH2 TRP 33 2.832 -6.424 -4.337 249 H GLU 34 H GLU 34 6.044 -11.121 -7.504 250 HA GLU 34 HA GLU 34 6.555 -8.742 -5.977 251 1HB GLU 34 1HB GLU 34 8.735 -9.838 -5.785 252 2HB GLU 34 2HB GLU 34 8.818 -10.005 -7.534 253 1HG GLU 34 1HG GLU 34 8.475 -7.288 -6.378 254 2HG GLU 34 2HG GLU 34 10.057 -8.060 -6.283 255 H ASP 35 H ASP 35 5.528 -7.228 -7.105 256 HA ASP 35 HA ASP 35 5.452 -7.456 -10.037 257 1HB ASP 35 1HB ASP 35 3.394 -7.098 -8.201 258 2HB ASP 35 2HB ASP 35 3.630 -5.497 -8.892 259 H TYR 36 H TYR 36 6.737 -6.146 -11.127 260 HA TYR 36 HA TYR 36 8.217 -4.052 -9.979 261 1HB TYR 36 1HB TYR 36 8.564 -5.456 -12.186 262 2HB TYR 36 2HB TYR 36 7.705 -4.107 -12.922 263 HD1 TYR 36 HD1 TYR 36 8.654 -1.724 -11.892 264 HD2 TYR 36 HD2 TYR 36 10.849 -5.335 -12.390 265 HE1 TYR 36 HE1 TYR 36 10.745 -0.434 -11.973 266 HE2 TYR 36 HE2 TYR 36 12.946 -4.054 -12.472 267 HH TYR 36 HH TYR 36 13.830 -1.921 -11.797 268 H ASN 37 H ASN 37 5.345 -3.963 -12.087 269 HA ASN 37 HA ASN 37 5.166 -1.183 -12.315 270 1HB ASN 37 1HB ASN 37 2.803 -3.059 -12.267 271 2HB ASN 37 2HB ASN 37 2.939 -1.518 -13.107 272 1HD2 ASN 37 1HD2 ASN 37 4.179 -1.390 -14.988 273 2HD2 ASN 37 2HD2 ASN 37 4.613 -2.799 -15.888 274 H ARG 38 H ARG 38 4.541 -3.222 -9.628 275 HA ARG 38 HA ARG 38 3.092 -1.040 -8.283 276 1HB ARG 38 1HB ARG 38 3.122 -4.007 -7.725 277 2HB ARG 38 2HB ARG 38 2.384 -2.821 -6.658 278 1HG ARG 38 1HG ARG 38 0.672 -3.796 -7.998 279 2HG ARG 38 2HG ARG 38 0.911 -2.133 -8.535 280 1HD ARG 38 1HD ARG 38 1.870 -2.770 -10.525 281 2HD ARG 38 2HD ARG 38 2.428 -4.314 -9.885 282 HE ARG 38 HE ARG 38 -0.431 -4.104 -10.043 283 1HH1 ARG 38 1HH1 ARG 38 2.475 -4.926 -11.793 284 2HH1 ARG 38 2HH1 ARG 38 1.653 -5.939 -12.931 285 1HH2 ARG 38 1HH2 ARG 38 -1.513 -5.438 -11.537 286 2HH2 ARG 38 2HH2 ARG 38 -0.611 -6.231 -12.785 287 H ASP 39 H ASP 39 6.107 -2.445 -8.517 288 HA ASP 39 HA ASP 39 7.969 -2.509 -7.197 289 1HB ASP 39 1HB ASP 39 6.632 0.084 -6.677 290 2HB ASP 39 2HB ASP 39 7.887 -0.379 -5.533 291 H LEU 40 H LEU 40 5.878 -4.129 -6.283 292 HA LEU 40 HA LEU 40 6.395 -4.092 -3.390 293 1HB LEU 40 1HB LEU 40 4.123 -3.239 -3.902 294 2HB LEU 40 2HB LEU 40 3.758 -4.756 -4.699 295 HG LEU 40 HG LEU 40 4.213 -5.889 -2.472 296 1HD1 LEU 40 1HD1 LEU 40 4.621 -4.718 -0.590 297 2HD1 LEU 40 2HD1 LEU 40 3.619 -3.356 -1.091 298 3HD1 LEU 40 3HD1 LEU 40 5.257 -3.524 -1.721 299 1HD2 LEU 40 1HD2 LEU 40 1.942 -4.958 -3.560 300 2HD2 LEU 40 2HD2 LEU 40 1.941 -4.054 -2.043 301 3HD2 LEU 40 3HD2 LEU 40 2.000 -5.817 -2.019 302 H LEU 41 H LEU 41 6.248 -6.175 -2.357 303 HA LEU 41 HA LEU 41 6.108 -8.516 -4.049 304 1HB LEU 41 1HB LEU 41 8.273 -9.413 -3.427 305 2HB LEU 41 2HB LEU 41 8.434 -7.923 -4.319 306 HG LEU 41 HG LEU 41 9.760 -8.609 -1.984 307 1HD1 LEU 41 1HD1 LEU 41 10.206 -6.919 -3.884 308 2HD1 LEU 41 2HD1 LEU 41 10.866 -6.607 -2.279 309 3HD1 LEU 41 3HD1 LEU 41 9.415 -5.761 -2.815 310 1HD2 LEU 41 1HD2 LEU 41 7.535 -6.705 -1.324 311 2HD2 LEU 41 2HD2 LEU 41 9.052 -6.733 -0.439 312 3HD2 LEU 41 3HD2 LEU 41 8.026 -8.164 -0.470 313 H VAL 42 H VAL 42 6.040 -10.528 -2.873 314 HA VAL 42 HA VAL 42 5.302 -10.130 -0.054 315 HB VAL 42 HB VAL 42 3.979 -11.879 -2.127 316 1HG1 VAL 42 1HG1 VAL 42 2.770 -13.075 -0.436 317 2HG1 VAL 42 2HG1 VAL 42 3.509 -12.113 0.843 318 3HG1 VAL 42 3HG1 VAL 42 4.486 -13.248 -0.080 319 1HG2 VAL 42 1HG2 VAL 42 3.304 -9.465 -0.683 320 2HG2 VAL 42 2HG2 VAL 42 2.082 -10.721 -0.461 321 3HG2 VAL 42 3HG2 VAL 42 2.524 -10.197 -2.086 322 H SER 43 H SER 43 6.225 -11.372 1.398 323 HA SER 43 HA SER 43 7.813 -13.682 0.510 324 1HB SER 43 1HB SER 43 9.547 -12.246 1.028 325 2HB SER 43 2HB SER 43 8.593 -11.358 2.213 326 HG SER 43 HG SER 43 10.373 -12.983 2.862 327 H THR 44 H THR 44 8.092 -15.331 2.191 328 HA THR 44 HA THR 44 5.706 -15.430 3.872 329 HB THR 44 HB THR 44 5.938 -17.783 3.898 330 HG1 THR 44 HG1 THR 44 8.077 -18.102 4.292 331 1HG2 THR 44 1HG2 THR 44 7.024 -17.436 1.186 332 2HG2 THR 44 2HG2 THR 44 5.571 -16.516 1.588 333 3HG2 THR 44 3HG2 THR 44 5.574 -18.275 1.741 334 H THR 45 H THR 45 5.800 -14.986 5.923 335 HA THR 45 HA THR 45 8.380 -15.168 7.324 336 HB THR 45 HB THR 45 7.701 -12.947 7.492 337 HG1 THR 45 HG1 THR 45 8.044 -13.335 9.559 338 1HG2 THR 45 1HG2 THR 45 5.282 -12.442 8.329 339 2HG2 THR 45 2HG2 THR 45 4.922 -14.007 7.597 340 3HG2 THR 45 3HG2 THR 45 5.602 -12.709 6.614 341 H THR 46 H THR 46 8.297 -15.791 9.614 342 HA THR 46 HA THR 46 6.295 -17.901 10.036 343 HB THR 46 HB THR 46 8.606 -18.689 9.981 344 HG1 THR 46 HG1 THR 46 7.032 -19.545 11.543 345 1HG2 THR 46 1HG2 THR 46 9.065 -16.784 12.260 346 2HG2 THR 46 2HG2 THR 46 9.846 -16.770 10.678 347 3HG2 THR 46 3HG2 THR 46 10.161 -18.089 11.805 348 H ALA 47 H ALA 47 5.496 -15.301 10.565 349 HA ALA 47 HA ALA 47 5.218 -15.394 13.490 350 1HB ALA 47 1HB ALA 47 6.784 -13.537 12.330 351 2HB ALA 47 2HB ALA 47 5.883 -13.263 13.821 352 3HB ALA 47 3HB ALA 47 5.229 -12.704 12.282 353 H HIS 48 H HIS 48 3.369 -13.923 14.213 354 HA HIS 48 HA HIS 48 1.025 -14.688 12.744 355 1HB HIS 48 1HB HIS 48 -0.196 -13.534 14.572 356 2HB HIS 48 2HB HIS 48 0.963 -14.718 15.166 357 HD1 HIS 48 HD1 HIS 48 2.606 -13.907 16.855 358 HD2 HIS 48 HD2 HIS 48 0.791 -10.783 14.803 359 HE1 HIS 48 HE1 HIS 48 3.393 -11.809 17.994 360 HE2 HIS 48 HE2 HIS 48 2.345 -9.927 16.684 361 H GLY 49 H GLY 49 -0.432 -13.385 11.668 362 1HA GLY 49 1HA GLY 49 0.679 -10.946 10.572 363 2HA GLY 49 2HA GLY 49 -0.819 -11.724 10.084 364 H CYS 50 H CYS 50 0.241 -8.939 11.190 365 HA CYS 50 HA CYS 50 -1.935 -8.529 13.121 366 1HB CYS 50 1HB CYS 50 0.663 -7.860 13.407 367 2HB CYS 50 2HB CYS 50 0.057 -6.382 12.669 368 HG CYS 50 HG CYS 50 -0.913 -7.477 15.413 369 H ASP 51 H ASP 51 -2.261 -8.675 10.201 370 HA ASP 51 HA ASP 51 -3.782 -6.232 9.887 371 1HB ASP 51 1HB ASP 51 -1.413 -6.906 8.161 372 2HB ASP 51 2HB ASP 51 -2.753 -5.958 7.524 373 H THR 52 H THR 52 -5.617 -6.582 8.782 374 HA THR 52 HA THR 52 -5.866 -9.138 7.333 375 HB THR 52 HB THR 52 -8.029 -7.642 8.830 376 HG1 THR 52 HG1 THR 52 -6.476 -9.906 9.495 377 1HG2 THR 52 1HG2 THR 52 -8.053 -10.259 7.365 378 2HG2 THR 52 2HG2 THR 52 -9.108 -8.864 7.139 379 3HG2 THR 52 3HG2 THR 52 -9.238 -9.840 8.602 380 H ILE 53 H ILE 53 -6.048 -8.859 5.218 381 HA ILE 53 HA ILE 53 -6.670 -6.322 4.056 382 HB ILE 53 HB ILE 53 -6.741 -8.871 2.487 383 1HG1 ILE 53 1HG1 ILE 53 -4.712 -8.883 4.006 384 2HG1 ILE 53 2HG1 ILE 53 -4.379 -8.968 2.283 385 1HG2 ILE 53 1HG2 ILE 53 -5.670 -7.377 0.790 386 2HG2 ILE 53 2HG2 ILE 53 -5.915 -6.041 1.915 387 3HG2 ILE 53 3HG2 ILE 53 -7.304 -6.914 1.267 388 1HD1 ILE 53 1HD1 ILE 53 -2.839 -7.419 2.844 389 2HD1 ILE 53 2HD1 ILE 53 -3.762 -6.842 4.234 390 3HD1 ILE 53 3HD1 ILE 53 -4.204 -6.327 2.606 391 H ALA 54 H ALA 54 -8.513 -5.625 3.075 392 HA ALA 54 HA ALA 54 -10.956 -6.982 3.809 393 1HB ALA 54 1HB ALA 54 -11.290 -4.653 2.115 394 2HB ALA 54 2HB ALA 54 -10.233 -4.335 3.489 395 3HB ALA 54 3HB ALA 54 -11.861 -4.954 3.754 396 H ARG 55 H ARG 55 -9.542 -5.801 0.751 397 HA ARG 55 HA ARG 55 -9.793 -6.495 -1.402 398 1HB ARG 55 1HB ARG 55 -9.252 -8.739 -0.309 399 2HB ARG 55 2HB ARG 55 -10.982 -9.052 -0.331 400 1HG ARG 55 1HG ARG 55 -10.897 -8.638 -2.822 401 2HG ARG 55 2HG ARG 55 -9.140 -8.677 -2.673 402 1HD ARG 55 1HD ARG 55 -9.113 -10.922 -2.081 403 2HD ARG 55 2HD ARG 55 -10.800 -10.908 -1.570 404 HE ARG 55 HE ARG 55 -9.796 -11.342 -4.228 405 1HH1 ARG 55 1HH1 ARG 55 -12.546 -10.324 -2.337 406 2HH1 ARG 55 2HH1 ARG 55 -13.696 -10.703 -3.575 407 1HH2 ARG 55 1HH2 ARG 55 -11.308 -11.841 -5.858 408 2HH2 ARG 55 2HH2 ARG 55 -12.994 -11.566 -5.573 409 H CYS 56 H CYS 56 -11.829 -5.001 -0.109 410 HA CYS 56 HA CYS 56 -14.318 -6.049 -1.245 411 1HB CYS 56 1HB CYS 56 -15.343 -4.094 0.021 412 2HB CYS 56 2HB CYS 56 -14.629 -5.368 1.003 413 H GLN 57 H GLN 57 -15.560 -4.885 -2.709 414 HA GLN 57 HA GLN 57 -14.043 -3.064 -4.385 415 1HB GLN 57 1HB GLN 57 -16.776 -4.304 -4.733 416 2HB GLN 57 2HB GLN 57 -15.993 -3.272 -5.922 417 1HG GLN 57 1HG GLN 57 -14.323 -5.496 -5.066 418 2HG GLN 57 2HG GLN 57 -15.841 -6.007 -5.803 419 1HE2 GLN 57 1HE2 GLN 57 -13.278 -3.605 -6.331 420 2HE2 GLN 57 2HE2 GLN 57 -13.179 -3.836 -8.039 421 H CYS 58 H CYS 58 -14.363 -1.723 -2.149 422 HA CYS 58 HA CYS 58 -16.811 -0.168 -2.185 423 1HB CYS 58 1HB CYS 58 -14.346 -0.090 -0.447 424 2HB CYS 58 2HB CYS 58 -15.651 1.080 -0.298 425 H THR 59 H THR 59 -16.662 2.238 -2.125 426 HA THR 59 HA THR 59 -14.707 3.170 -4.120 427 HB THR 59 HB THR 59 -17.152 4.758 -3.549 428 HG1 THR 59 HG1 THR 59 -18.501 3.365 -4.379 429 1HG2 THR 59 1HG2 THR 59 -15.420 4.199 -5.897 430 2HG2 THR 59 2HG2 THR 59 -16.003 5.737 -5.258 431 3HG2 THR 59 3HG2 THR 59 -17.096 4.685 -6.157 432 H THR 60 H THR 60 -15.821 3.539 -0.896 433 HA THR 60 HA THR 60 -14.091 5.898 -0.585 434 HB THR 60 HB THR 60 -15.580 6.868 0.981 435 HG1 THR 60 HG1 THR 60 -16.602 5.542 2.226 436 1HG2 THR 60 1HG2 THR 60 -16.402 7.307 -1.206 437 2HG2 THR 60 2HG2 THR 60 -17.784 6.954 -0.169 438 3HG2 THR 60 3HG2 THR 60 -17.186 5.730 -1.288 439 H GLY 61 H GLY 61 -12.449 5.602 0.740 440 1HA GLY 61 1HA GLY 61 -12.732 3.726 2.988 441 2HA GLY 61 2HA GLY 61 -11.370 3.553 1.890 442 H VAL 62 H VAL 62 -10.907 3.957 4.577 443 HA VAL 62 HA VAL 62 -10.227 6.806 4.791 444 HB VAL 62 HB VAL 62 -11.504 5.845 6.664 445 1HG1 VAL 62 1HG1 VAL 62 -10.584 3.558 6.523 446 2HG1 VAL 62 2HG1 VAL 62 -10.520 4.219 8.156 447 3HG1 VAL 62 3HG1 VAL 62 -9.058 4.156 7.172 448 1HG2 VAL 62 1HG2 VAL 62 -8.963 7.221 6.858 449 2HG2 VAL 62 2HG2 VAL 62 -9.348 6.331 8.331 450 3HG2 VAL 62 3HG2 VAL 62 -10.482 7.526 7.700 451 H TYR 63 H TYR 63 -8.197 7.505 4.714 452 HA TYR 63 HA TYR 63 -6.067 5.489 4.542 453 1HB TYR 63 1HB TYR 63 -4.868 6.940 3.127 454 2HB TYR 63 2HB TYR 63 -6.533 7.061 2.581 455 HD1 TYR 63 HD1 TYR 63 -7.548 9.164 2.383 456 HD2 TYR 63 HD2 TYR 63 -4.022 8.768 4.739 457 HE1 TYR 63 HE1 TYR 63 -7.436 11.609 2.627 458 HE2 TYR 63 HE2 TYR 63 -3.907 11.210 4.987 459 HH TYR 63 HH TYR 63 -4.745 13.236 3.661 460 H PHE 64 H PHE 64 -4.281 5.592 5.824 461 HA PHE 64 HA PHE 64 -4.497 6.953 8.298 462 1HB PHE 64 1HB PHE 64 -3.303 4.778 7.942 463 2HB PHE 64 2HB PHE 64 -2.027 5.668 7.119 464 HD1 PHE 64 HD1 PHE 64 -3.455 4.739 10.305 465 HD2 PHE 64 HD2 PHE 64 -0.638 7.282 8.379 466 HE1 PHE 64 HE1 PHE 64 -2.357 5.152 12.467 467 HE2 PHE 64 HE2 PHE 64 0.466 7.700 10.538 468 HZ PHE 64 HZ PHE 64 -0.393 6.634 12.586 469 H CYS 65 H CYS 65 -3.969 8.971 8.801 470 HA CYS 65 HA CYS 65 -2.544 10.605 6.872 471 1HB CYS 65 1HB CYS 65 -4.115 11.151 9.365 472 2HB CYS 65 2HB CYS 65 -3.019 12.380 8.743 473 HG CYS 65 HG CYS 65 -5.345 12.826 7.718 474 H ALA 66 H ALA 66 -0.524 11.399 7.084 475 HA ALA 66 HA ALA 66 1.155 10.244 9.140 476 1HB ALA 66 1HB ALA 66 2.889 10.610 7.741 477 2HB ALA 66 2HB ALA 66 2.310 12.207 7.267 478 3HB ALA 66 3HB ALA 66 1.607 10.761 6.539 479 H SER 67 H SER 67 -0.134 13.387 8.266 480 HA SER 67 HA SER 67 1.368 14.689 10.402 481 1HB SER 67 1HB SER 67 -0.254 15.642 8.076 482 2HB SER 67 2HB SER 67 -0.049 16.714 9.462 483 HG SER 67 HG SER 67 2.258 16.322 9.204 484 H LYS 68 H LYS 68 -2.030 14.357 9.381 485 HA LYS 68 HA LYS 68 -3.177 15.489 11.670 486 1HB LYS 68 1HB LYS 68 -4.425 13.301 10.012 487 2HB LYS 68 2HB LYS 68 -5.247 14.551 10.934 488 1HG LYS 68 1HG LYS 68 -3.477 15.740 9.010 489 2HG LYS 68 2HG LYS 68 -4.565 14.595 8.225 490 1HD LYS 68 1HD LYS 68 -5.983 16.346 8.193 491 2HD LYS 68 2HD LYS 68 -6.289 15.883 9.868 492 1HE LYS 68 1HE LYS 68 -4.070 17.463 10.102 493 2HE LYS 68 2HE LYS 68 -4.938 18.240 8.779 494 1HZ LYS 68 1HZ LYS 68 -6.949 18.069 10.329 495 2HZ LYS 68 2HZ LYS 68 -5.786 19.247 10.669 496 3HZ LYS 68 3HZ LYS 68 -5.821 17.811 11.562 497 H SER 69 H SER 69 -1.822 12.346 11.116 498 HA SER 69 HA SER 69 -1.514 10.533 12.455 499 1HB SER 69 1HB SER 69 -1.683 12.814 14.343 500 2HB SER 69 2HB SER 69 -1.869 11.206 15.043 501 HG SER 69 HG SER 69 0.246 11.297 15.014 502 H LYS 70 H LYS 70 -4.258 11.358 11.528 503 HA LYS 70 HA LYS 70 -5.759 9.568 13.308 504 1HB LYS 70 1HB LYS 70 -7.010 11.986 12.017 505 2HB LYS 70 2HB LYS 70 -7.691 10.949 13.261 506 1HG LYS 70 1HG LYS 70 -6.806 12.172 14.885 507 2HG LYS 70 2HG LYS 70 -5.212 12.150 14.131 508 1HD LYS 70 1HD LYS 70 -5.704 14.401 14.085 509 2HD LYS 70 2HD LYS 70 -6.278 13.886 12.498 510 1HE LYS 70 1HE LYS 70 -8.529 13.897 13.195 511 2HE LYS 70 2HE LYS 70 -8.083 13.985 14.899 512 1HZ LYS 70 1HZ LYS 70 -8.261 16.102 12.916 513 2HZ LYS 70 2HZ LYS 70 -6.957 16.210 13.989 514 3HZ LYS 70 3HZ LYS 70 -8.540 16.153 14.585 515 H HIS 71 H HIS 71 -7.847 8.848 12.207 516 HA HIS 71 HA HIS 71 -7.140 7.852 9.580 517 1HB HIS 71 1HB HIS 71 -8.959 7.084 11.722 518 2HB HIS 71 2HB HIS 71 -9.732 7.002 10.143 519 HD1 HIS 71 HD1 HIS 71 -7.077 6.097 8.623 520 HD2 HIS 71 HD2 HIS 71 -8.702 4.343 12.021 521 HE1 HIS 71 HE1 HIS 71 -6.204 3.739 8.645 522 HE2 HIS 71 HE2 HIS 71 -7.257 2.676 10.672 523 H TYR 72 H TYR 72 -7.661 8.880 7.770 524 HA TYR 72 HA TYR 72 -9.861 10.829 7.841 525 1HB TYR 72 1HB TYR 72 -7.200 10.851 6.703 526 2HB TYR 72 2HB TYR 72 -8.410 11.186 5.470 527 HD1 TYR 72 HD1 TYR 72 -8.954 13.398 5.124 528 HD2 TYR 72 HD2 TYR 72 -7.643 12.192 8.992 529 HE1 TYR 72 HE1 TYR 72 -9.077 15.731 5.889 530 HE2 TYR 72 HE2 TYR 72 -7.762 14.524 9.766 531 HH TYR 72 HH TYR 72 -8.181 17.158 7.610 532 HA PRO 73 HA PRO 73 -11.862 7.851 5.089 533 1HB PRO 73 1HB PRO 73 -14.260 9.449 5.357 534 2HB PRO 73 2HB PRO 73 -13.932 7.843 6.009 535 1HG PRO 73 1HG PRO 73 -14.217 10.074 7.560 536 2HG PRO 73 2HG PRO 73 -13.258 8.660 8.032 537 1HD PRO 73 1HD PRO 73 -12.343 11.276 6.888 538 2HD PRO 73 2HD PRO 73 -11.626 10.298 8.188 539 H VAL 74 H VAL 74 -11.510 8.062 2.959 540 HA VAL 74 HA VAL 74 -12.426 10.506 1.618 541 HB VAL 74 HB VAL 74 -9.713 9.261 1.170 542 1HG1 VAL 74 1HG1 VAL 74 -9.377 11.422 -0.136 543 2HG1 VAL 74 2HG1 VAL 74 -11.135 11.574 -0.110 544 3HG1 VAL 74 3HG1 VAL 74 -10.382 10.175 -0.880 545 1HG2 VAL 74 1HG2 VAL 74 -9.135 10.414 2.993 546 2HG2 VAL 74 2HG2 VAL 74 -10.639 11.336 2.999 547 3HG2 VAL 74 3HG2 VAL 74 -9.297 11.846 1.975 548 H SER 75 H SER 75 -13.054 10.280 -0.502 549 HA SER 75 HA SER 75 -13.541 7.541 -1.386 550 1HB SER 75 1HB SER 75 -14.478 9.964 -2.889 551 2HB SER 75 2HB SER 75 -15.249 8.384 -2.732 552 HG SER 75 HG SER 75 -15.125 10.478 -0.835 553 H PHE 76 H PHE 76 -12.529 6.634 -3.126 554 HA PHE 76 HA PHE 76 -10.938 8.369 -4.856 555 1HB PHE 76 1HB PHE 76 -9.119 6.427 -4.585 556 2HB PHE 76 2HB PHE 76 -9.132 7.867 -3.577 557 HD1 PHE 76 HD1 PHE 76 -11.420 4.959 -3.325 558 HD2 PHE 76 HD2 PHE 76 -8.138 7.061 -1.624 559 HE1 PHE 76 HE1 PHE 76 -11.563 3.554 -1.309 560 HE2 PHE 76 HE2 PHE 76 -8.273 5.675 0.390 561 HZ PHE 76 HZ PHE 76 -9.990 3.910 0.551 562 H GLU 77 H GLU 77 -9.897 7.120 -6.638 563 HA GLU 77 HA GLU 77 -11.755 5.067 -7.635 564 1HB GLU 77 1HB GLU 77 -10.808 7.501 -8.805 565 2HB GLU 77 2HB GLU 77 -10.198 6.155 -9.757 566 1HG GLU 77 1HG GLU 77 -12.727 5.366 -9.518 567 2HG GLU 77 2HG GLU 77 -12.970 7.105 -9.362 568 H GLY 78 H GLY 78 -10.770 3.397 -9.039 569 1HA GLY 78 1HA GLY 78 -8.029 2.808 -8.116 570 2HA GLY 78 2HA GLY 78 -9.230 1.586 -8.493 571 HA PRO 79 HA PRO 79 -7.723 3.365 -12.755 572 1HB PRO 79 1HB PRO 79 -5.215 4.732 -12.086 573 2HB PRO 79 2HB PRO 79 -6.564 5.288 -13.080 574 1HG PRO 79 1HG PRO 79 -6.027 6.327 -10.646 575 2HG PRO 79 2HG PRO 79 -7.671 6.211 -11.297 576 1HD PRO 79 1HD PRO 79 -6.317 4.501 -9.261 577 2HD PRO 79 2HD PRO 79 -7.995 5.049 -9.344 578 H GLY 80 H GLY 80 -6.654 1.986 -14.014 579 1HA GLY 80 1HA GLY 80 -5.115 -0.100 -12.918 580 2HA GLY 80 2HA GLY 80 -5.314 0.235 -14.631 581 H LEU 81 H LEU 81 -4.046 2.423 -15.227 582 HA LEU 81 HA LEU 81 -1.356 2.104 -14.073 583 1HB LEU 81 1HB LEU 81 -1.966 1.440 -16.585 584 2HB LEU 81 2HB LEU 81 -1.597 3.139 -16.823 585 HG LEU 81 HG LEU 81 0.459 2.198 -17.187 586 1HD1 LEU 81 1HD1 LEU 81 0.439 2.619 -14.217 587 2HD1 LEU 81 2HD1 LEU 81 0.748 3.839 -15.451 588 3HD1 LEU 81 3HD1 LEU 81 1.882 2.509 -15.220 589 1HD2 LEU 81 1HD2 LEU 81 -0.595 -0.073 -16.229 590 2HD2 LEU 81 2HD2 LEU 81 0.536 0.313 -14.931 591 3HD2 LEU 81 3HD2 LEU 81 1.120 0.131 -16.585 592 H VAL 82 H VAL 82 -0.634 3.805 -13.043 593 HA VAL 82 HA VAL 82 -1.434 6.482 -13.970 594 HB VAL 82 HB VAL 82 -0.955 5.735 -11.072 595 1HG1 VAL 82 1HG1 VAL 82 -1.187 7.914 -10.550 596 2HG1 VAL 82 2HG1 VAL 82 -2.387 8.201 -11.809 597 3HG1 VAL 82 3HG1 VAL 82 -0.671 8.164 -12.217 598 1HG2 VAL 82 1HG2 VAL 82 -3.558 6.255 -12.515 599 2HG2 VAL 82 2HG2 VAL 82 -3.374 6.020 -10.777 600 3HG2 VAL 82 3HG2 VAL 82 -3.011 4.700 -11.889 601 H GLU 83 H GLU 83 0.232 7.769 -14.463 602 HA GLU 83 HA GLU 83 2.898 6.791 -14.250 603 1HB GLU 83 1HB GLU 83 1.628 9.294 -15.284 604 2HB GLU 83 2HB GLU 83 3.367 9.265 -15.025 605 1HG GLU 83 1HG GLU 83 3.672 7.542 -16.603 606 2HG GLU 83 2HG GLU 83 1.945 7.196 -16.670 607 H VAL 84 H VAL 84 3.880 6.699 -12.344 608 HA VAL 84 HA VAL 84 3.310 8.503 -10.205 609 HB VAL 84 HB VAL 84 3.956 6.352 -9.502 610 1HG1 VAL 84 1HG1 VAL 84 6.226 5.403 -10.137 611 2HG1 VAL 84 2HG1 VAL 84 6.260 6.629 -11.401 612 3HG1 VAL 84 3HG1 VAL 84 4.985 5.412 -11.389 613 1HG2 VAL 84 1HG2 VAL 84 5.343 6.956 -7.854 614 2HG2 VAL 84 2HG2 VAL 84 5.338 8.547 -8.615 615 3HG2 VAL 84 3HG2 VAL 84 6.630 7.403 -8.974 616 H GLN 85 H GLN 85 3.966 10.513 -10.138 617 HA GLN 85 HA GLN 85 6.048 11.565 -11.761 618 1HB GLN 85 1HB GLN 85 4.043 12.848 -10.987 619 2HB GLN 85 2HB GLN 85 4.727 12.853 -9.367 620 1HG GLN 85 1HG GLN 85 6.221 14.456 -9.857 621 2HG GLN 85 2HG GLN 85 6.508 13.842 -11.485 622 1HE2 GLN 85 1HE2 GLN 85 5.980 15.252 -12.975 623 2HE2 GLN 85 2HE2 GLN 85 4.653 16.358 -12.919 624 H GLU 86 H GLU 86 8.060 12.449 -11.111 625 HA GLU 86 HA GLU 86 9.439 10.874 -9.209 626 1HB GLU 86 1HB GLU 86 11.353 12.347 -9.669 627 2HB GLU 86 2HB GLU 86 10.579 11.807 -11.153 628 1HG GLU 86 1HG GLU 86 9.339 14.227 -10.412 629 2HG GLU 86 2HG GLU 86 11.077 14.461 -10.244 630 H SER 87 H SER 87 8.803 11.037 -7.147 631 HA SER 87 HA SER 87 9.243 13.593 -5.809 632 1HB SER 87 1HB SER 87 6.625 12.302 -6.150 633 2HB SER 87 2HB SER 87 7.006 12.722 -4.480 634 HG SER 87 HG SER 87 6.034 14.485 -5.436 635 H GLU 88 H GLU 88 9.292 13.351 -3.424 636 HA GLU 88 HA GLU 88 10.256 12.417 -1.591 637 1HB GLU 88 1HB GLU 88 8.030 11.194 -1.810 638 2HB GLU 88 2HB GLU 88 8.945 9.847 -2.465 639 1HG GLU 88 1HG GLU 88 9.980 9.392 -0.457 640 2HG GLU 88 2HG GLU 88 9.733 11.027 0.157 641 H TYR 89 H TYR 89 10.324 9.378 -3.403 642 HA TYR 89 HA TYR 89 13.158 9.621 -3.940 643 1HB TYR 89 1HB TYR 89 13.481 7.315 -2.770 644 2HB TYR 89 2HB TYR 89 13.490 8.780 -1.794 645 HD1 TYR 89 HD1 TYR 89 12.634 8.219 0.285 646 HD2 TYR 89 HD2 TYR 89 10.652 6.793 -3.201 647 HE1 TYR 89 HE1 TYR 89 10.835 7.303 1.687 648 HE2 TYR 89 HE2 TYR 89 8.848 5.877 -1.809 649 HH TYR 89 HH TYR 89 9.001 5.177 1.173 650 H TYR 90 H TYR 90 10.489 9.138 -5.303 651 HA TYR 90 HA TYR 90 11.203 6.633 -6.673 652 1HB TYR 90 1HB TYR 90 8.931 6.930 -5.374 653 2HB TYR 90 2HB TYR 90 8.452 7.799 -6.827 654 HD1 TYR 90 HD1 TYR 90 9.077 6.480 -9.081 655 HD2 TYR 90 HD2 TYR 90 8.423 4.686 -5.282 656 HE1 TYR 90 HE1 TYR 90 8.538 4.352 -10.187 657 HE2 TYR 90 HE2 TYR 90 7.884 2.551 -6.377 658 HH TYR 90 HH TYR 90 8.680 1.729 -9.299 659 HA PRO 91 HA PRO 91 11.921 9.373 -10.142 660 1HB PRO 91 1HB PRO 91 12.552 7.478 -11.964 661 2HB PRO 91 2HB PRO 91 13.662 7.971 -10.680 662 1HG PRO 91 1HG PRO 91 11.885 5.573 -10.830 663 2HG PRO 91 2HG PRO 91 13.554 5.696 -10.248 664 1HD PRO 91 1HD PRO 91 11.386 5.619 -8.593 665 2HD PRO 91 2HD PRO 91 12.906 6.433 -8.176 666 H LYS 92 H LYS 92 10.837 10.053 -11.968 667 HA LYS 92 HA LYS 92 8.127 9.575 -12.206 668 1HB LYS 92 1HB LYS 92 9.279 11.542 -13.134 669 2HB LYS 92 2HB LYS 92 10.002 10.527 -14.373 670 1HG LYS 92 1HG LYS 92 8.255 10.928 -15.666 671 2HG LYS 92 2HG LYS 92 7.238 10.069 -14.510 672 1HD LYS 92 1HD LYS 92 6.154 12.051 -14.421 673 2HD LYS 92 2HD LYS 92 7.432 12.450 -13.273 674 1HE LYS 92 1HE LYS 92 8.356 13.955 -14.653 675 2HE LYS 92 2HE LYS 92 8.178 12.907 -16.060 676 1HZ LYS 92 1HZ LYS 92 5.834 13.556 -16.169 677 2HZ LYS 92 2HZ LYS 92 6.862 14.890 -16.326 678 3HZ LYS 92 3HZ LYS 92 6.058 14.610 -14.864 679 H ARG 93 H ARG 93 7.810 7.302 -12.184 680 HA ARG 93 HA ARG 93 8.288 6.020 -14.795 681 1HB ARG 93 1HB ARG 93 8.231 4.616 -12.122 682 2HB ARG 93 2HB ARG 93 8.571 3.887 -13.685 683 1HG ARG 93 1HG ARG 93 10.469 5.775 -13.658 684 2HG ARG 93 2HG ARG 93 10.300 5.497 -11.925 685 1HD ARG 93 1HD ARG 93 11.972 4.004 -12.636 686 2HD ARG 93 2HD ARG 93 10.521 3.024 -12.447 687 HE ARG 93 HE ARG 93 11.796 3.794 -14.965 688 1HH1 ARG 93 1HH1 ARG 93 9.253 2.053 -13.311 689 2HH1 ARG 93 2HH1 ARG 93 8.847 1.095 -14.693 690 1HH2 ARG 93 1HH2 ARG 93 11.253 2.532 -16.775 691 2HH2 ARG 93 2HH2 ARG 93 9.979 1.365 -16.657 692 H TYR 94 H TYR 94 6.852 3.805 -14.668 693 HA TYR 94 HA TYR 94 4.096 4.774 -14.429 694 1HB TYR 94 1HB TYR 94 5.442 2.688 -16.101 695 2HB TYR 94 2HB TYR 94 3.721 2.536 -15.766 696 HD1 TYR 94 HD1 TYR 94 6.275 4.784 -17.231 697 HD2 TYR 94 HD2 TYR 94 2.143 3.826 -16.945 698 HE1 TYR 94 HE1 TYR 94 5.788 6.365 -19.046 699 HE2 TYR 94 HE2 TYR 94 1.641 5.401 -18.756 700 HH TYR 94 HH TYR 94 3.529 7.763 -19.718 701 H GLN 95 H GLN 95 2.681 3.914 -13.006 702 HA GLN 95 HA GLN 95 3.511 1.496 -11.538 703 1HB GLN 95 1HB GLN 95 3.757 3.640 -10.228 704 2HB GLN 95 2HB GLN 95 2.010 3.815 -10.321 705 1HG GLN 95 1HG GLN 95 1.891 2.646 -8.446 706 2HG GLN 95 2HG GLN 95 2.387 1.236 -9.382 707 1HE2 GLN 95 1HE2 GLN 95 4.998 1.764 -9.899 708 2HE2 GLN 95 2HE2 GLN 95 5.899 1.817 -8.426 709 H SER 96 H SER 96 2.102 -0.125 -11.702 710 HA SER 96 HA SER 96 -0.570 0.427 -12.728 711 1HB SER 96 1HB SER 96 0.805 -1.346 -13.768 712 2HB SER 96 2HB SER 96 0.791 -2.230 -12.243 713 HG SER 96 HG SER 96 -1.038 -2.238 -14.180 714 H HIS 97 H HIS 97 -2.451 -0.609 -11.845 715 HA HIS 97 HA HIS 97 -3.955 -0.865 -10.167 716 1HB HIS 97 1HB HIS 97 -1.898 -2.820 -9.871 717 2HB HIS 97 2HB HIS 97 -2.443 -2.348 -8.265 718 HD1 HIS 97 HD1 HIS 97 -3.781 -3.760 -11.506 719 HD2 HIS 97 HD2 HIS 97 -4.869 -3.383 -7.514 720 HE1 HIS 97 HE1 HIS 97 -5.861 -5.149 -11.241 721 HE2 HIS 97 HE2 HIS 97 -6.456 -4.968 -8.801 722 H VAL 98 H VAL 98 -3.266 1.588 -9.868 723 HA VAL 98 HA VAL 98 -2.605 1.868 -7.005 724 HB VAL 98 HB VAL 98 -0.781 2.707 -8.522 725 1HG1 VAL 98 1HG1 VAL 98 -2.933 4.025 -9.792 726 2HG1 VAL 98 2HG1 VAL 98 -1.221 4.067 -10.203 727 3HG1 VAL 98 3HG1 VAL 98 -1.890 5.262 -9.087 728 1HG2 VAL 98 1HG2 VAL 98 -0.486 3.621 -6.475 729 2HG2 VAL 98 2HG2 VAL 98 -2.126 4.268 -6.405 730 3HG2 VAL 98 3HG2 VAL 98 -0.890 5.099 -7.352 731 H LEU 99 H LEU 99 -3.926 3.109 -5.785 732 HA LEU 99 HA LEU 99 -6.306 4.204 -7.104 733 1HB LEU 99 1HB LEU 99 -5.771 3.402 -4.244 734 2HB LEU 99 2HB LEU 99 -7.233 4.222 -4.756 735 HG LEU 99 HG LEU 99 -7.459 2.212 -6.411 736 1HD1 LEU 99 1HD1 LEU 99 -5.091 1.461 -5.473 737 2HD1 LEU 99 2HD1 LEU 99 -6.312 0.298 -5.989 738 3HD1 LEU 99 3HD1 LEU 99 -6.110 0.662 -4.276 739 1HD2 LEU 99 1HD2 LEU 99 -8.204 0.950 -4.044 740 2HD2 LEU 99 2HD2 LEU 99 -9.202 2.006 -5.042 741 3HD2 LEU 99 3HD2 LEU 99 -8.298 2.673 -3.683 742 H LEU 100 H LEU 100 -7.050 6.316 -6.604 743 HA LEU 100 HA LEU 100 -5.150 7.983 -5.135 744 1HB LEU 100 1HB LEU 100 -5.892 8.197 -7.956 745 2HB LEU 100 2HB LEU 100 -5.979 9.708 -7.066 746 HG LEU 100 HG LEU 100 -3.539 7.928 -7.125 747 1HD1 LEU 100 1HD1 LEU 100 -4.215 8.965 -9.342 748 2HD1 LEU 100 2HD1 LEU 100 -2.592 9.319 -8.750 749 3HD1 LEU 100 3HD1 LEU 100 -3.872 10.524 -8.592 750 1HD2 LEU 100 1HD2 LEU 100 -4.212 9.851 -5.314 751 2HD2 LEU 100 2HD2 LEU 100 -3.297 10.781 -6.499 752 3HD2 LEU 100 3HD2 LEU 100 -2.562 9.379 -5.722 753 H ALA 101 H ALA 101 -5.982 9.443 -3.799 754 HA ALA 101 HA ALA 101 -8.890 9.932 -3.891 755 1HB ALA 101 1HB ALA 101 -7.257 8.800 -1.781 756 2HB ALA 101 2HB ALA 101 -9.014 8.846 -1.945 757 3HB ALA 101 3HB ALA 101 -8.156 10.213 -1.237 758 H THR 102 H THR 102 -9.332 12.028 -4.190 759 HA THR 102 HA THR 102 -7.291 14.020 -3.660 760 HB THR 102 HB THR 102 -8.401 14.363 -5.710 761 HG1 THR 102 HG1 THR 102 -8.406 16.373 -5.120 762 1HG2 THR 102 1HG2 THR 102 -10.398 13.455 -6.034 763 2HG2 THR 102 2HG2 THR 102 -11.067 14.886 -5.249 764 3HG2 THR 102 3HG2 THR 102 -10.755 13.428 -4.307 765 H GLY 103 H GLY 103 -7.080 14.780 -1.672 766 1HA GLY 103 1HA GLY 103 -9.233 14.685 0.243 767 2HA GLY 103 2HA GLY 103 -7.615 15.312 0.516 768 H PHE 104 H PHE 104 -7.866 17.294 1.307 769 HA PHE 104 HA PHE 104 -9.124 19.302 -0.356 770 1HB PHE 104 1HB PHE 104 -10.812 18.233 1.382 771 2HB PHE 104 2HB PHE 104 -9.996 19.320 2.501 772 HD1 PHE 104 HD1 PHE 104 -12.677 19.008 0.303 773 HD2 PHE 104 HD2 PHE 104 -9.730 21.798 1.581 774 HE1 PHE 104 HE1 PHE 104 -14.101 20.859 -0.469 775 HE2 PHE 104 HE2 PHE 104 -11.148 23.655 0.811 776 HZ PHE 104 HZ PHE 104 -13.338 23.187 -0.215 777 H SER 105 H SER 105 -8.140 21.247 -0.177 778 HA SER 105 HA SER 105 -6.606 22.815 0.426 779 1HB SER 105 1HB SER 105 -7.393 21.639 3.063 780 2HB SER 105 2HB SER 105 -6.031 22.757 3.004 781 HG SER 105 HG SER 105 -7.348 24.362 2.546 782 H GLU 106 H GLU 106 -4.412 22.971 1.866 783 HA GLU 106 HA GLU 106 -2.557 21.344 0.561 784 1HB GLU 106 1HB GLU 106 -2.481 23.292 2.785 785 2HB GLU 106 2HB GLU 106 -1.141 22.157 2.715 786 1HG GLU 106 1HG GLU 106 -0.619 22.858 0.463 787 2HG GLU 106 2HG GLU 106 -2.020 23.928 0.446 788 HA PRO 107 HA PRO 107 -3.260 17.679 3.120 789 1HB PRO 107 1HB PRO 107 -1.746 16.001 1.622 790 2HB PRO 107 2HB PRO 107 -3.390 16.466 1.170 791 1HG PRO 107 1HG PRO 107 -0.777 17.545 0.181 792 2HG PRO 107 2HG PRO 107 -2.237 17.130 -0.738 793 1HD PRO 107 1HD PRO 107 -1.619 19.677 -0.062 794 2HD PRO 107 2HD PRO 107 -3.294 19.105 -0.195 795 H GLY 108 H GLY 108 -1.401 15.800 3.576 796 1HA GLY 108 1HA GLY 108 1.220 16.806 4.060 797 2HA GLY 108 2HA GLY 108 0.250 16.855 5.525 798 H ASP 109 H ASP 109 0.120 14.432 2.955 799 HA ASP 109 HA ASP 109 0.731 12.386 4.961 800 1HB ASP 109 1HB ASP 109 -1.314 12.465 3.209 801 2HB ASP 109 2HB ASP 109 -0.132 11.594 2.236 802 H ALA 110 H ALA 110 2.193 10.668 4.477 803 HA ALA 110 HA ALA 110 3.845 10.682 2.163 804 1HB ALA 110 1HB ALA 110 5.978 11.241 3.388 805 2HB ALA 110 2HB ALA 110 4.968 11.881 4.684 806 3HB ALA 110 3HB ALA 110 4.897 12.598 3.075 807 H GLY 111 H GLY 111 2.324 8.748 3.522 808 1HA GLY 111 1HA GLY 111 3.702 6.474 3.434 809 2HA GLY 111 2HA GLY 111 4.207 7.088 5.003 810 H GLY 112 H GLY 112 2.937 4.666 4.822 811 1HA GLY 112 1HA GLY 112 1.338 3.984 6.555 812 2HA GLY 112 2HA GLY 112 0.299 5.286 5.998 813 H ILE 113 H ILE 113 -1.084 3.177 6.091 814 HA ILE 113 HA ILE 113 -1.100 2.049 3.369 815 HB ILE 113 HB ILE 113 -1.963 -0.053 4.245 816 1HG1 ILE 113 1HG1 ILE 113 -1.529 1.180 6.976 817 2HG1 ILE 113 2HG1 ILE 113 -3.092 0.820 6.246 818 1HG2 ILE 113 1HG2 ILE 113 0.639 0.937 5.359 819 2HG2 ILE 113 2HG2 ILE 113 0.355 -0.092 3.956 820 3HG2 ILE 113 3HG2 ILE 113 0.111 -0.731 5.582 821 1HD1 ILE 113 1HD1 ILE 113 -3.017 -1.272 6.959 822 2HD1 ILE 113 2HD1 ILE 113 -1.593 -0.825 7.899 823 3HD1 ILE 113 3HD1 ILE 113 -1.405 -1.514 6.287 824 H LEU 114 H LEU 114 -3.112 1.732 2.408 825 HA LEU 114 HA LEU 114 -5.235 3.394 3.490 826 1HB LEU 114 1HB LEU 114 -4.825 3.715 1.179 827 2HB LEU 114 2HB LEU 114 -4.813 1.992 0.862 828 HG LEU 114 HG LEU 114 -7.179 1.841 1.066 829 1HD1 LEU 114 1HD1 LEU 114 -8.612 3.537 1.843 830 2HD1 LEU 114 2HD1 LEU 114 -7.324 4.743 1.821 831 3HD1 LEU 114 3HD1 LEU 114 -7.296 3.444 3.013 832 1HD2 LEU 114 1HD2 LEU 114 -7.896 3.156 -0.752 833 2HD2 LEU 114 2HD2 LEU 114 -6.179 2.858 -1.025 834 3HD2 LEU 114 3HD2 LEU 114 -6.716 4.419 -0.404 835 H ARG 115 H ARG 115 -6.692 2.560 4.823 836 HA ARG 115 HA ARG 115 -7.426 -0.274 4.489 837 1HB ARG 115 1HB ARG 115 -7.052 1.396 6.952 838 2HB ARG 115 2HB ARG 115 -8.087 -0.025 6.987 839 1HG ARG 115 1HG ARG 115 -6.028 -1.237 5.981 840 2HG ARG 115 2HG ARG 115 -5.132 0.153 6.597 841 1HD ARG 115 1HD ARG 115 -6.801 -0.599 8.694 842 2HD ARG 115 2HD ARG 115 -6.225 -2.121 8.015 843 HE ARG 115 HE ARG 115 -4.075 -0.312 8.347 844 1HH1 ARG 115 1HH1 ARG 115 -6.213 -2.384 10.168 845 2HH1 ARG 115 2HH1 ARG 115 -5.081 -2.632 11.454 846 1HH2 ARG 115 1HH2 ARG 115 -2.584 -0.638 10.038 847 2HH2 ARG 115 2HH2 ARG 115 -3.020 -1.640 11.380 848 H CYS 116 H CYS 116 -9.544 -0.880 4.667 849 HA CYS 116 HA CYS 116 -11.525 1.295 4.531 850 1HB CYS 116 1HB CYS 116 -11.198 -0.187 2.486 851 2HB CYS 116 2HB CYS 116 -11.852 -1.509 3.444 852 H GLU 117 H GLU 117 -13.722 0.649 5.366 853 HA GLU 117 HA GLU 117 -13.594 -0.132 8.031 854 1HB GLU 117 1HB GLU 117 -15.888 -0.058 6.079 855 2HB GLU 117 2HB GLU 117 -16.111 -0.497 7.766 856 1HG GLU 117 1HG GLU 117 -14.623 1.988 7.369 857 2HG GLU 117 2HG GLU 117 -16.276 2.026 6.757 858 H HIS 118 H HIS 118 -13.572 -2.061 5.199 859 HA HIS 118 HA HIS 118 -14.483 -4.453 6.573 860 1HB HIS 118 1HB HIS 118 -13.524 -4.086 3.730 861 2HB HIS 118 2HB HIS 118 -14.274 -5.537 4.386 862 HD2 HIS 118 HD2 HIS 118 -16.996 -5.574 4.210 863 HE1 HIS 118 HE1 HIS 118 -17.538 -1.496 3.165 864 HE2 HIS 118 HE2 HIS 118 -18.671 -3.713 3.559 865 H GLY 119 H GLY 119 -11.487 -3.066 5.295 866 1HA GLY 119 1HA GLY 119 -9.824 -4.448 7.058 867 2HA GLY 119 2HA GLY 119 -9.900 -5.402 5.587 868 H VAL 120 H VAL 120 -7.898 -5.155 4.839 869 HA VAL 120 HA VAL 120 -6.740 -2.482 4.582 870 HB VAL 120 HB VAL 120 -5.366 -5.052 3.844 871 1HG1 VAL 120 1HG1 VAL 120 -3.417 -3.567 4.734 872 2HG1 VAL 120 2HG1 VAL 120 -4.541 -2.250 4.400 873 3HG1 VAL 120 3HG1 VAL 120 -4.051 -3.341 3.105 874 1HG2 VAL 120 1HG2 VAL 120 -5.165 -5.708 5.951 875 2HG2 VAL 120 2HG2 VAL 120 -6.319 -4.459 6.416 876 3HG2 VAL 120 3HG2 VAL 120 -4.590 -4.117 6.443 877 H ILE 121 H ILE 121 -6.387 -1.489 2.659 878 HA ILE 121 HA ILE 121 -7.395 -2.847 0.257 879 HB ILE 121 HB ILE 121 -6.800 0.083 0.633 880 1HG1 ILE 121 1HG1 ILE 121 -8.951 -1.429 1.664 881 2HG1 ILE 121 2HG1 ILE 121 -8.782 0.320 1.639 882 1HG2 ILE 121 1HG2 ILE 121 -8.252 0.257 -1.443 883 2HG2 ILE 121 2HG2 ILE 121 -8.031 -1.485 -1.616 884 3HG2 ILE 121 3HG2 ILE 121 -6.633 -0.408 -1.656 885 1HD1 ILE 121 1HD1 ILE 121 -10.092 0.541 -0.265 886 2HD1 ILE 121 2HD1 ILE 121 -10.906 -0.714 0.670 887 3HD1 ILE 121 3HD1 ILE 121 -9.905 -1.157 -0.710 888 H GLY 122 H GLY 122 -4.882 -0.389 0.909 889 1HA GLY 122 1HA GLY 122 -2.911 -2.041 -0.468 890 2HA GLY 122 2HA GLY 122 -3.320 -0.514 -1.231 891 H LEU 123 H LEU 123 -0.964 -0.190 -0.929 892 HA LEU 123 HA LEU 123 -0.391 0.872 1.762 893 1HB LEU 123 1HB LEU 123 2.018 0.446 1.217 894 2HB LEU 123 2HB LEU 123 1.038 -0.992 1.429 895 HG LEU 123 HG LEU 123 1.394 0.034 -1.341 896 1HD1 LEU 123 1HD1 LEU 123 3.644 0.197 -0.612 897 2HD1 LEU 123 2HD1 LEU 123 3.502 -1.323 -1.495 898 3HD1 LEU 123 3HD1 LEU 123 3.540 -1.329 0.268 899 1HD2 LEU 123 1HD2 LEU 123 1.536 -2.786 -0.324 900 2HD2 LEU 123 2HD2 LEU 123 1.114 -2.211 -1.937 901 3HD2 LEU 123 3HD2 LEU 123 -0.005 -1.973 -0.595 902 H VAL 124 H VAL 124 1.239 2.652 1.763 903 HA VAL 124 HA VAL 124 0.400 4.766 0.120 904 HB VAL 124 HB VAL 124 1.398 5.106 2.339 905 1HG1 VAL 124 1HG1 VAL 124 3.505 4.530 2.921 906 2HG1 VAL 124 2HG1 VAL 124 4.158 4.869 1.319 907 3HG1 VAL 124 3HG1 VAL 124 3.302 3.356 1.621 908 1HG2 VAL 124 1HG2 VAL 124 1.336 7.043 1.008 909 2HG2 VAL 124 2HG2 VAL 124 2.662 6.486 -0.013 910 3HG2 VAL 124 3HG2 VAL 124 2.978 6.983 1.649 911 H THR 125 H THR 125 0.773 5.034 -1.975 912 HA THR 125 HA THR 125 3.309 4.062 -3.098 913 HB THR 125 HB THR 125 0.589 4.486 -4.318 914 HG1 THR 125 HG1 THR 125 2.390 2.302 -4.339 915 1HG2 THR 125 1HG2 THR 125 1.541 5.179 -6.213 916 2HG2 THR 125 2HG2 THR 125 2.074 3.505 -6.375 917 3HG2 THR 125 3HG2 THR 125 3.159 4.712 -5.685 918 H MET 126 H MET 126 1.262 6.453 -4.697 919 HA MET 126 HA MET 126 3.490 8.359 -4.420 920 1HB MET 126 1HB MET 126 1.887 7.558 -6.649 921 2HB MET 126 2HB MET 126 1.631 9.273 -6.358 922 1HG MET 126 1HG MET 126 4.347 8.019 -6.602 923 2HG MET 126 2HG MET 126 3.463 8.711 -7.961 924 1HE MET 126 1HE MET 126 6.000 10.491 -4.848 925 2HE MET 126 2HE MET 126 6.634 10.234 -6.475 926 3HE MET 126 3HE MET 126 5.890 8.897 -5.596 927 H GLY 127 H GLY 127 2.954 10.648 -4.197 928 1HA GLY 127 1HA GLY 127 0.331 11.124 -2.943 929 2HA GLY 127 2HA GLY 127 1.804 11.594 -2.106 930 H GLY 128 H GLY 128 -0.580 12.541 -4.308 931 1HA GLY 128 1HA GLY 128 0.975 14.530 -5.695 932 2HA GLY 128 2HA GLY 128 -0.769 14.330 -5.768 933 H GLU 129 H GLU 129 -0.218 16.817 -5.751 934 HA GLU 129 HA GLU 129 0.332 17.987 -3.211 935 1HB GLU 129 1HB GLU 129 -1.039 19.307 -5.554 936 2HB GLU 129 2HB GLU 129 -0.150 20.091 -4.255 937 1HG GLU 129 1HG GLU 129 1.834 19.744 -5.228 938 2HG GLU 129 2HG GLU 129 1.400 18.123 -5.772 939 H GLY 130 H GLY 130 -2.488 16.674 -4.656 940 1HA GLY 130 1HA GLY 130 -4.035 17.449 -2.308 941 2HA GLY 130 2HA GLY 130 -4.659 17.973 -3.864 942 H VAL 131 H VAL 131 -2.991 14.978 -3.882 943 HA VAL 131 HA VAL 131 -5.486 13.474 -3.588 944 HB VAL 131 HB VAL 131 -3.681 12.617 -5.788 945 1HG1 VAL 131 1HG1 VAL 131 -5.589 11.255 -5.156 946 2HG1 VAL 131 2HG1 VAL 131 -5.808 11.905 -6.781 947 3HG1 VAL 131 3HG1 VAL 131 -6.673 12.621 -5.421 948 1HG2 VAL 131 1HG2 VAL 131 -4.707 14.075 -7.412 949 2HG2 VAL 131 2HG2 VAL 131 -3.954 15.052 -6.152 950 3HG2 VAL 131 3HG2 VAL 131 -5.702 14.824 -6.163 951 H VAL 132 H VAL 132 -5.167 11.170 -3.236 952 HA VAL 132 HA VAL 132 -2.560 10.624 -1.966 953 HB VAL 132 HB VAL 132 -5.041 9.059 -1.344 954 1HG1 VAL 132 1HG1 VAL 132 -3.918 8.803 0.835 955 2HG1 VAL 132 2HG1 VAL 132 -2.558 9.740 0.215 956 3HG1 VAL 132 3HG1 VAL 132 -2.964 8.186 -0.513 957 1HG2 VAL 132 1HG2 VAL 132 -6.003 10.611 -0.045 958 2HG2 VAL 132 2HG2 VAL 132 -5.095 11.764 -1.023 959 3HG2 VAL 132 3HG2 VAL 132 -4.457 11.234 0.531 960 H GLY 133 H GLY 133 -1.324 9.222 -3.055 961 1HA GLY 133 1HA GLY 133 -2.594 7.354 -4.931 962 2HA GLY 133 2HA GLY 133 -0.889 7.779 -4.895 963 H PHE 134 H PHE 134 -2.999 5.336 -4.287 964 HA PHE 134 HA PHE 134 -1.178 4.119 -2.312 965 1HB PHE 134 1HB PHE 134 -4.179 4.034 -2.468 966 2HB PHE 134 2HB PHE 134 -3.274 2.783 -1.622 967 HD1 PHE 134 HD1 PHE 134 -5.128 5.558 -1.054 968 HD2 PHE 134 HD2 PHE 134 -1.286 3.993 -0.119 969 HE1 PHE 134 HE1 PHE 134 -5.043 6.980 0.951 970 HE2 PHE 134 HE2 PHE 134 -1.188 5.413 1.888 971 HZ PHE 134 HZ PHE 134 -3.067 6.909 2.425 972 H ALA 135 H ALA 135 -0.628 1.985 -2.568 973 HA ALA 135 HA ALA 135 -1.154 0.843 -5.206 974 1HB ALA 135 1HB ALA 135 1.038 0.427 -5.026 975 2HB ALA 135 2HB ALA 135 0.585 -0.868 -3.916 976 3HB ALA 135 3HB ALA 135 1.034 0.719 -3.287 977 H ASP 136 H ASP 136 -2.920 -0.390 -5.321 978 HA ASP 136 HA ASP 136 -4.204 -1.514 -3.076 979 1HB ASP 136 1HB ASP 136 -4.873 -1.040 -5.719 980 2HB ASP 136 2HB ASP 136 -4.888 -2.796 -5.604 981 H VAL 137 H VAL 137 -4.337 -3.544 -2.284 982 HA VAL 137 HA VAL 137 -2.152 -5.353 -2.944 983 HB VAL 137 HB VAL 137 -4.229 -5.620 -0.762 984 1HG1 VAL 137 1HG1 VAL 137 -3.257 -7.725 -1.043 985 2HG1 VAL 137 2HG1 VAL 137 -2.328 -6.998 0.267 986 3HG1 VAL 137 3HG1 VAL 137 -1.662 -7.046 -1.363 987 1HG2 VAL 137 1HG2 VAL 137 -1.709 -4.913 0.302 988 2HG2 VAL 137 2HG2 VAL 137 -3.209 -3.984 0.338 989 3HG2 VAL 137 3HG2 VAL 137 -2.070 -3.768 -0.991 990 H ARG 138 H ARG 138 -4.879 -4.854 -4.424 991 HA ARG 138 HA ARG 138 -6.231 -7.353 -4.371 992 1HB ARG 138 1HB ARG 138 -6.298 -5.219 -6.506 993 2HB ARG 138 2HB ARG 138 -7.485 -6.491 -6.261 994 1HG ARG 138 1HG ARG 138 -6.880 -4.312 -4.267 995 2HG ARG 138 2HG ARG 138 -8.213 -4.281 -5.424 996 1HD ARG 138 1HD ARG 138 -7.987 -6.694 -3.732 997 2HD ARG 138 2HD ARG 138 -8.452 -5.204 -2.915 998 HE ARG 138 HE ARG 138 -10.029 -6.737 -4.770 999 1HH1 ARG 138 1HH1 ARG 138 -9.543 -3.593 -3.333 1000 2HH1 ARG 138 2HH1 ARG 138 -11.171 -3.074 -3.616 1001 1HH2 ARG 138 1HH2 ARG 138 -12.170 -6.056 -5.142 1002 2HH2 ARG 138 2HH2 ARG 138 -12.662 -4.472 -4.642 1003 H ASP 139 H ASP 139 -3.253 -6.518 -5.631 1004 HA ASP 139 HA ASP 139 -3.429 -8.359 -7.888 1005 1HB ASP 139 1HB ASP 139 -1.108 -7.558 -8.380 1006 2HB ASP 139 2HB ASP 139 -2.325 -6.286 -8.386 1007 H LEU 140 H LEU 140 -3.084 -8.838 -4.727 1008 HA LEU 140 HA LEU 140 -1.829 -11.344 -5.021 1009 1HB LEU 140 1HB LEU 140 0.210 -11.018 -3.770 1010 2HB LEU 140 2HB LEU 140 0.208 -9.989 -5.185 1011 HG LEU 140 HG LEU 140 1.092 -8.589 -3.590 1012 1HD1 LEU 140 1HD1 LEU 140 -1.848 -8.065 -3.247 1013 2HD1 LEU 140 2HD1 LEU 140 -0.875 -7.532 -4.619 1014 3HD1 LEU 140 3HD1 LEU 140 -0.530 -6.918 -3.000 1015 1HD2 LEU 140 1HD2 LEU 140 0.310 -10.378 -1.771 1016 2HD2 LEU 140 2HD2 LEU 140 -0.845 -9.092 -1.422 1017 3HD2 LEU 140 3HD2 LEU 140 0.886 -8.764 -1.351 1018 H LEU 141 H LEU 141 -4.187 -10.207 -3.947 1019 HA LEU 141 HA LEU 141 -4.232 -9.917 -1.188 1020 1HB LEU 141 1HB LEU 141 -6.077 -9.930 -3.245 1021 2HB LEU 141 2HB LEU 141 -6.590 -11.253 -2.213 1022 HG LEU 141 HG LEU 141 -7.749 -9.359 -1.438 1023 1HD1 LEU 141 1HD1 LEU 141 -7.175 -9.312 0.777 1024 2HD1 LEU 141 2HD1 LEU 141 -5.444 -9.328 0.435 1025 3HD1 LEU 141 3HD1 LEU 141 -6.400 -10.796 0.232 1026 1HD2 LEU 141 1HD2 LEU 141 -5.234 -7.783 -1.095 1027 2HD2 LEU 141 2HD2 LEU 141 -6.904 -7.217 -1.152 1028 3HD2 LEU 141 3HD2 LEU 141 -6.111 -7.772 -2.623 1029 H TRP 142 H TRP 142 -3.603 -12.756 -2.965 1030 HA TRP 142 HA TRP 142 -4.731 -14.702 -1.299 1031 1HB TRP 142 1HB TRP 142 -2.882 -16.195 -2.235 1032 2HB TRP 142 2HB TRP 142 -3.978 -15.457 -3.397 1033 HD1 TRP 142 HD1 TRP 142 -2.944 -13.249 -4.745 1034 HE1 TRP 142 HE1 TRP 142 -0.529 -12.815 -5.516 1035 HE3 TRP 142 HE3 TRP 142 -0.517 -16.597 -1.741 1036 HZ2 TRP 142 HZ2 TRP 142 2.059 -13.770 -4.932 1037 HZ3 TRP 142 HZ3 TRP 142 1.932 -16.777 -1.914 1038 HH2 TRP 142 HH2 TRP 142 3.192 -15.391 -3.475 1039 H LEU 143 H LEU 143 -4.343 -13.751 0.815 1040 HA LEU 143 HA LEU 143 -1.818 -14.719 1.952 1041 1HB LEU 143 1HB LEU 143 -3.082 -12.050 2.595 1042 2HB LEU 143 2HB LEU 143 -1.750 -12.763 3.480 1043 HG LEU 143 HG LEU 143 -0.659 -12.725 1.013 1044 1HD1 LEU 143 1HD1 LEU 143 -2.392 -11.738 -0.180 1045 2HD1 LEU 143 2HD1 LEU 143 -1.274 -10.412 0.131 1046 3HD1 LEU 143 3HD1 LEU 143 -2.743 -10.577 1.097 1047 1HD2 LEU 143 1HD2 LEU 143 -0.125 -11.561 3.362 1048 2HD2 LEU 143 2HD2 LEU 143 -0.582 -10.134 2.434 1049 3HD2 LEU 143 3HD2 LEU 143 0.736 -11.162 1.876 1050 H GLU 144 H GLU 144 -5.001 -13.348 2.735 1051 HA GLU 144 HA GLU 144 -5.491 -15.575 4.559 1052 1HB GLU 144 1HB GLU 144 -4.630 -13.144 5.539 1053 2HB GLU 144 2HB GLU 144 -6.376 -13.018 5.678 1054 1HG GLU 144 1HG GLU 144 -5.250 -13.879 7.706 1055 2HG GLU 144 2HG GLU 144 -6.479 -14.961 7.053 1056 H ASP 145 H ASP 145 -7.868 -14.580 5.668 1057 HA ASP 145 HA ASP 145 -9.695 -15.115 3.569 1058 1HB ASP 145 1HB ASP 145 -10.191 -14.021 6.346 1059 2HB ASP 145 2HB ASP 145 -11.438 -14.621 5.257 1060 H ASP 146 H ASP 146 -11.150 -13.777 2.517 1061 HA ASP 146 HA ASP 146 -10.437 -10.926 2.544 1062 1HB ASP 146 1HB ASP 146 -11.627 -10.914 0.300 1063 2HB ASP 146 2HB ASP 146 -10.126 -11.834 0.370 1064 H ALA 147 H ALA 147 -12.113 -9.336 2.396 1065 HA ALA 147 HA ALA 147 -14.390 -9.987 4.031 1066 1HB ALA 147 1HB ALA 147 -14.918 -7.593 3.856 1067 2HB ALA 147 2HB ALA 147 -13.617 -7.402 2.681 1068 3HB ALA 147 3HB ALA 147 -13.245 -7.869 4.341 1069 H MET 148 H MET 148 -16.276 -10.702 3.308 1070 HA MET 148 HA MET 148 -17.064 -10.051 0.544 1071 1HB MET 148 1HB MET 148 -16.440 -12.482 1.059 1072 2HB MET 148 2HB MET 148 -17.919 -12.541 2.006 1073 1HG MET 148 1HG MET 148 -19.266 -12.161 0.098 1074 2HG MET 148 2HG MET 148 -17.866 -11.740 -0.887 1075 1HE MET 148 1HE MET 148 -20.398 -14.542 -0.790 1076 2HE MET 148 2HE MET 148 -19.915 -14.295 0.887 1077 3HE MET 148 3HE MET 148 -19.556 -15.823 0.082 1078 H GLU 149 H GLU 149 -17.683 -8.475 2.837 1079 HA GLU 149 HA GLU 149 -20.321 -9.056 3.757 1080 1HB GLU 149 1HB GLU 149 -18.723 -6.490 3.826 1081 2HB GLU 149 2HB GLU 149 -20.251 -6.738 4.659 1082 1HG GLU 149 1HG GLU 149 -18.333 -8.813 5.283 1083 2HG GLU 149 2HG GLU 149 -17.719 -7.204 5.662 1084 H GLN 150 H GLN 150 -22.254 -8.470 2.954 1085 HA GLN 150 HA GLN 150 -22.431 -6.423 0.895 1086 1HB GLN 150 1HB GLN 150 -23.101 -9.323 0.447 1087 2HB GLN 150 2HB GLN 150 -23.862 -8.048 -0.495 1088 1HG GLN 150 1HG GLN 150 -21.778 -7.364 -1.407 1089 2HG GLN 150 2HG GLN 150 -20.884 -8.400 -0.293 1090 1HE2 GLN 150 1HE2 GLN 150 -23.311 -8.526 -2.867 1091 2HE2 GLN 150 2HE2 GLN 150 -22.786 -10.034 -3.528 Start of MODEL 12 1 1H GLY 1 1H GLY 1 4.946 3.721 25.237 2 2H GLY 1 2H GLY 1 3.284 3.899 24.981 3 3H GLY 1 3H GLY 1 4.134 5.073 25.851 4 1HA GLY 1 1HA GLY 1 3.545 5.221 23.222 5 2HA GLY 1 2HA GLY 1 4.801 6.143 24.033 6 HA PRO 2 HA PRO 2 6.984 2.133 22.139 7 1HB PRO 2 1HB PRO 2 4.910 1.619 20.060 8 2HB PRO 2 2HB PRO 2 5.929 0.474 20.941 9 1HG PRO 2 1HG PRO 2 3.359 0.760 21.568 10 2HG PRO 2 2HG PRO 2 4.584 0.524 22.830 11 1HD PRO 2 1HD PRO 2 3.151 3.012 22.018 12 2HD PRO 2 2HD PRO 2 3.679 2.486 23.630 13 H TYR 3 H TYR 3 8.442 2.390 20.475 14 HA TYR 3 HA TYR 3 7.913 4.638 18.648 15 1HB TYR 3 1HB TYR 3 9.788 4.858 20.354 16 2HB TYR 3 2HB TYR 3 10.635 3.608 19.447 17 HD1 TYR 3 HD1 TYR 3 10.941 4.079 16.891 18 HD2 TYR 3 HD2 TYR 3 10.110 7.082 19.788 19 HE1 TYR 3 HE1 TYR 3 11.840 5.789 15.369 20 HE2 TYR 3 HE2 TYR 3 11.007 8.799 18.274 21 HH TYR 3 HH TYR 3 12.799 8.042 15.490 22 H GLY 4 H GLY 4 7.074 3.579 16.893 23 1HA GLY 4 1HA GLY 4 7.918 2.803 14.713 24 2HA GLY 4 2HA GLY 4 8.876 1.627 15.598 25 H HIS 5 H HIS 5 5.515 2.476 16.236 26 HA HIS 5 HA HIS 5 4.698 -0.228 16.333 27 1HB HIS 5 1HB HIS 5 3.617 2.213 17.098 28 2HB HIS 5 2HB HIS 5 2.528 1.653 15.834 29 HD1 HIS 5 HD1 HIS 5 0.706 0.195 16.641 30 HD2 HIS 5 HD2 HIS 5 4.022 0.043 19.140 31 HE1 HIS 5 HE1 HIS 5 0.039 -1.296 18.552 32 HE2 HIS 5 HE2 HIS 5 2.034 -1.312 20.091 33 H GLN 6 H GLN 6 4.724 2.173 13.796 34 HA GLN 6 HA GLN 6 3.675 0.140 11.940 35 1HB GLN 6 1HB GLN 6 2.648 1.955 10.629 36 2HB GLN 6 2HB GLN 6 1.984 1.861 12.254 37 1HG GLN 6 1HG GLN 6 3.989 3.650 12.612 38 2HG GLN 6 2HG GLN 6 3.506 4.000 10.953 39 1HE2 GLN 6 1HE2 GLN 6 3.206 5.555 13.442 40 2HE2 GLN 6 2HE2 GLN 6 1.518 5.902 13.569 41 H SER 7 H SER 7 4.186 0.971 9.567 42 HA SER 7 HA SER 7 6.767 2.264 9.346 43 1HB SER 7 1HB SER 7 6.430 -0.594 8.404 44 2HB SER 7 2HB SER 7 7.877 0.401 8.242 45 HG SER 7 HG SER 7 7.211 -1.159 10.259 46 H GLY 8 H GLY 8 4.268 0.376 7.665 47 1HA GLY 8 1HA GLY 8 3.132 1.973 5.968 48 2HA GLY 8 2HA GLY 8 4.736 1.988 5.252 49 H ALA 9 H ALA 9 5.085 -0.896 6.055 50 HA ALA 9 HA ALA 9 3.914 -2.006 3.652 51 1HB ALA 9 1HB ALA 9 5.255 -3.998 4.192 52 2HB ALA 9 2HB ALA 9 5.748 -3.237 5.705 53 3HB ALA 9 3HB ALA 9 6.224 -2.525 4.163 54 H VAL 10 H VAL 10 2.622 -3.895 3.590 55 HA VAL 10 HA VAL 10 0.893 -4.182 5.944 56 HB VAL 10 HB VAL 10 0.412 -5.083 3.098 57 1HG1 VAL 10 1HG1 VAL 10 -1.032 -5.502 5.621 58 2HG1 VAL 10 2HG1 VAL 10 -1.075 -6.425 4.118 59 3HG1 VAL 10 3HG1 VAL 10 -2.027 -4.949 4.273 60 1HG2 VAL 10 1HG2 VAL 10 -0.748 -3.154 2.689 61 2HG2 VAL 10 2HG2 VAL 10 0.493 -2.536 3.780 62 3HG2 VAL 10 3HG2 VAL 10 -1.124 -2.888 4.392 63 H TYR 11 H TYR 11 0.946 -5.983 7.144 64 HA TYR 11 HA TYR 11 2.381 -8.322 6.061 65 1HB TYR 11 1HB TYR 11 3.486 -7.321 7.991 66 2HB TYR 11 2HB TYR 11 1.996 -7.406 8.921 67 HD1 TYR 11 HD1 TYR 11 5.056 -8.995 8.221 68 HD2 TYR 11 HD2 TYR 11 1.007 -9.823 9.231 69 HE1 TYR 11 HE1 TYR 11 5.726 -11.202 9.071 70 HE2 TYR 11 HE2 TYR 11 1.665 -12.034 10.081 71 HH TYR 11 HH TYR 11 3.647 -13.673 9.614 72 H VAL 12 H VAL 12 1.077 -9.936 5.488 73 HA VAL 12 HA VAL 12 -1.360 -10.390 7.077 74 HB VAL 12 HB VAL 12 -1.036 -10.928 4.118 75 1HG1 VAL 12 1HG1 VAL 12 -2.528 -12.507 5.294 76 2HG1 VAL 12 2HG1 VAL 12 -3.390 -11.480 4.148 77 3HG1 VAL 12 3HG1 VAL 12 -3.477 -11.140 5.876 78 1HG2 VAL 12 1HG2 VAL 12 -3.083 -9.119 4.471 79 2HG2 VAL 12 2HG2 VAL 12 -1.453 -8.747 3.909 80 3HG2 VAL 12 3HG2 VAL 12 -1.858 -8.574 5.617 81 H GLY 13 H GLY 13 -1.093 -12.132 8.300 82 1HA GLY 13 1HA GLY 13 -0.458 -14.226 8.999 83 2HA GLY 13 2HA GLY 13 -0.881 -14.709 7.366 84 H ASN 14 H ASN 14 0.668 -15.903 6.501 85 HA ASN 14 HA ASN 14 3.433 -15.540 7.339 86 1HB ASN 14 1HB ASN 14 2.029 -17.661 5.721 87 2HB ASN 14 2HB ASN 14 3.781 -17.613 5.896 88 1HD2 ASN 14 1HD2 ASN 14 1.355 -19.293 6.916 89 2HD2 ASN 14 2HD2 ASN 14 1.769 -19.572 8.570 90 H TYR 15 H TYR 15 1.850 -13.756 5.389 91 HA TYR 15 HA TYR 15 3.947 -13.673 3.315 92 1HB TYR 15 1HB TYR 15 0.960 -13.502 2.996 93 2HB TYR 15 2HB TYR 15 2.018 -12.678 1.861 94 HD1 TYR 15 HD1 TYR 15 0.107 -14.651 0.956 95 HD2 TYR 15 HD2 TYR 15 4.080 -15.219 2.358 96 HE1 TYR 15 HE1 TYR 15 0.265 -16.717 -0.352 97 HE2 TYR 15 HE2 TYR 15 4.245 -17.284 1.047 98 HH TYR 15 HH TYR 15 2.118 -19.037 0.084 99 H LYS 16 H LYS 16 4.913 -11.711 3.208 100 HA LYS 16 HA LYS 16 3.477 -9.410 4.367 101 1HB LYS 16 1HB LYS 16 5.349 -10.091 5.792 102 2HB LYS 16 2HB LYS 16 6.448 -9.973 4.425 103 1HG LYS 16 1HG LYS 16 6.298 -7.636 4.360 104 2HG LYS 16 2HG LYS 16 4.859 -7.617 5.381 105 1HD LYS 16 1HD LYS 16 6.080 -7.584 7.249 106 2HD LYS 16 2HD LYS 16 7.091 -8.919 6.694 107 1HE LYS 16 1HE LYS 16 7.977 -6.879 5.125 108 2HE LYS 16 2HE LYS 16 7.567 -6.024 6.611 109 1HZ LYS 16 1HZ LYS 16 9.900 -6.900 6.450 110 2HZ LYS 16 2HZ LYS 16 9.256 -8.457 6.583 111 3HZ LYS 16 3HZ LYS 16 9.053 -7.348 7.844 112 H VAL 17 H VAL 17 2.905 -8.011 2.811 113 HA VAL 17 HA VAL 17 4.567 -7.874 0.404 114 HB VAL 17 HB VAL 17 2.750 -7.339 -0.830 115 1HG1 VAL 17 1HG1 VAL 17 2.174 -9.278 0.894 116 2HG1 VAL 17 2HG1 VAL 17 1.022 -8.714 -0.318 117 3HG1 VAL 17 3HG1 VAL 17 0.904 -8.137 1.345 118 1HG2 VAL 17 1HG2 VAL 17 2.401 -5.137 0.092 119 2HG2 VAL 17 2HG2 VAL 17 1.609 -5.820 1.512 120 3HG2 VAL 17 3HG2 VAL 17 0.847 -5.955 -0.074 121 H VAL 18 H VAL 18 5.950 -6.285 0.142 122 HA VAL 18 HA VAL 18 5.397 -3.668 1.345 123 HB VAL 18 HB VAL 18 6.936 -4.870 2.854 124 1HG1 VAL 18 1HG1 VAL 18 9.136 -4.714 0.870 125 2HG1 VAL 18 2HG1 VAL 18 7.996 -6.052 0.734 126 3HG1 VAL 18 3HG1 VAL 18 8.908 -5.818 2.226 127 1HG2 VAL 18 1HG2 VAL 18 8.522 -2.720 1.498 128 2HG2 VAL 18 2HG2 VAL 18 8.365 -3.072 3.219 129 3HG2 VAL 18 3HG2 VAL 18 7.019 -2.344 2.341 130 H ASN 19 H ASN 19 6.726 -1.918 0.413 131 HA ASN 19 HA ASN 19 6.700 -1.959 -2.397 132 1HB ASN 19 1HB ASN 19 6.599 0.081 -0.885 133 2HB ASN 19 2HB ASN 19 8.342 -0.078 -0.696 134 1HD2 ASN 19 1HD2 ASN 19 9.582 0.935 -2.106 135 2HD2 ASN 19 2HD2 ASN 19 9.071 1.566 -3.632 136 H ARG 20 H ARG 20 8.312 -2.243 -3.921 137 HA ARG 20 HA ARG 20 10.349 -4.057 -3.377 138 1HB ARG 20 1HB ARG 20 11.248 -3.466 -5.601 139 2HB ARG 20 2HB ARG 20 9.513 -3.746 -5.626 140 1HG ARG 20 1HG ARG 20 9.487 -1.849 -6.817 141 2HG ARG 20 2HG ARG 20 9.571 -1.078 -5.233 142 1HD ARG 20 1HD ARG 20 12.106 -1.207 -5.500 143 2HD ARG 20 2HD ARG 20 11.792 -1.585 -7.192 144 HE ARG 20 HE ARG 20 10.481 0.800 -6.240 145 1HH1 ARG 20 1HH1 ARG 20 13.371 -0.521 -7.686 146 2HH1 ARG 20 2HH1 ARG 20 13.854 0.982 -8.396 147 1HH2 ARG 20 1HH2 ARG 20 11.117 2.778 -7.173 148 2HH2 ARG 20 2HH2 ARG 20 12.575 2.855 -8.104 149 H HIS 21 H HIS 21 10.539 -0.525 -3.698 150 HA HIS 21 HA HIS 21 13.334 -0.368 -3.318 151 1HB HIS 21 1HB HIS 21 11.444 1.402 -4.092 152 2HB HIS 21 2HB HIS 21 11.682 1.920 -2.427 153 HD1 HIS 21 HD1 HIS 21 13.344 3.729 -2.270 154 HD2 HIS 21 HD2 HIS 21 14.225 1.106 -5.369 155 HE1 HIS 21 HE1 HIS 21 15.440 4.624 -3.332 156 HE2 HIS 21 HE2 HIS 21 16.001 2.974 -5.151 157 H LEU 22 H LEU 22 10.881 -1.185 -1.154 158 HA LEU 22 HA LEU 22 12.530 -0.360 1.136 159 1HB LEU 22 1HB LEU 22 9.585 -0.994 1.156 160 2HB LEU 22 2HB LEU 22 10.532 -0.345 2.481 161 HG LEU 22 HG LEU 22 10.071 1.117 -0.116 162 1HD1 LEU 22 1HD1 LEU 22 7.962 0.723 1.107 163 2HD1 LEU 22 2HD1 LEU 22 8.413 2.427 1.040 164 3HD1 LEU 22 3HD1 LEU 22 8.668 1.505 2.522 165 1HD2 LEU 22 1HD2 LEU 22 10.874 2.321 2.501 166 2HD2 LEU 22 2HD2 LEU 22 11.091 2.950 0.868 167 3HD2 LEU 22 3HD2 LEU 22 12.084 1.607 1.435 168 H ALA 23 H ALA 23 11.916 -3.064 -0.673 169 HA ALA 23 HA ALA 23 11.631 -4.876 1.591 170 1HB ALA 23 1HB ALA 23 10.436 -5.832 -0.066 171 2HB ALA 23 2HB ALA 23 11.996 -6.538 -0.480 172 3HB ALA 23 3HB ALA 23 11.416 -5.113 -1.343 173 H THR 24 H THR 24 13.241 -5.840 2.597 174 HA THR 24 HA THR 24 15.955 -5.262 1.905 175 HB THR 24 HB THR 24 15.540 -5.385 4.218 176 HG1 THR 24 HG1 THR 24 17.339 -6.438 4.349 177 1HG2 THR 24 1HG2 THR 24 14.660 -7.477 5.297 178 2HG2 THR 24 2HG2 THR 24 14.154 -7.993 3.688 179 3HG2 THR 24 3HG2 THR 24 13.484 -6.522 4.394 180 H HIS 25 H HIS 25 17.626 -6.989 1.723 181 HA HIS 25 HA HIS 25 17.200 -8.594 -0.490 182 1HB HIS 25 1HB HIS 25 19.292 -8.378 1.585 183 2HB HIS 25 2HB HIS 25 19.241 -9.912 0.722 184 HD1 HIS 25 HD1 HIS 25 18.947 -6.287 -0.433 185 HD2 HIS 25 HD2 HIS 25 21.023 -9.782 -1.294 186 HE1 HIS 25 HE1 HIS 25 20.424 -5.726 -2.389 187 HE2 HIS 25 HE2 HIS 25 21.600 -7.883 -2.952 188 H VAL 26 H VAL 26 16.595 -9.267 2.877 189 HA VAL 26 HA VAL 26 16.338 -12.087 2.626 190 HB VAL 26 HB VAL 26 15.014 -10.326 4.690 191 1HG1 VAL 26 1HG1 VAL 26 15.661 -12.602 5.966 192 2HG1 VAL 26 2HG1 VAL 26 15.383 -13.232 4.343 193 3HG1 VAL 26 3HG1 VAL 26 14.109 -12.339 5.171 194 1HG2 VAL 26 1HG2 VAL 26 17.011 -10.755 6.077 195 2HG2 VAL 26 2HG2 VAL 26 17.376 -9.807 4.636 196 3HG2 VAL 26 3HG2 VAL 26 17.784 -11.522 4.690 197 H ASP 27 H ASP 27 14.172 -9.377 2.164 198 HA ASP 27 HA ASP 27 11.755 -10.847 2.135 199 1HB ASP 27 1HB ASP 27 12.610 -8.095 1.566 200 2HB ASP 27 2HB ASP 27 11.264 -8.638 0.568 201 H TRP 28 H TRP 28 13.998 -9.747 -0.364 202 HA TRP 28 HA TRP 28 12.445 -10.777 -2.489 203 1HB TRP 28 1HB TRP 28 15.348 -9.963 -2.473 204 2HB TRP 28 2HB TRP 28 14.386 -10.277 -3.914 205 HD1 TRP 28 HD1 TRP 28 14.395 -7.856 -0.908 206 HE1 TRP 28 HE1 TRP 28 13.437 -5.605 -1.672 207 HE3 TRP 28 HE3 TRP 28 13.114 -9.119 -5.684 208 HZ2 TRP 28 HZ2 TRP 28 12.263 -4.508 -3.969 209 HZ3 TRP 28 HZ3 TRP 28 12.068 -7.405 -7.107 210 HH2 TRP 28 HH2 TRP 28 11.653 -5.150 -6.272 211 H GLN 29 H GLN 29 15.365 -11.954 -0.840 212 HA GLN 29 HA GLN 29 15.859 -14.185 -2.421 213 1HB GLN 29 1HB GLN 29 17.154 -15.053 -0.620 214 2HB GLN 29 2HB GLN 29 17.316 -13.304 -0.567 215 1HG GLN 29 1HG GLN 29 15.669 -13.206 1.231 216 2HG GLN 29 2HG GLN 29 15.510 -14.961 1.180 217 1HE2 GLN 29 1HE2 GLN 29 16.403 -15.723 2.962 218 2HE2 GLN 29 2HE2 GLN 29 17.958 -15.293 3.580 219 H ASN 30 H ASN 30 13.708 -13.855 0.371 220 HA ASN 30 HA ASN 30 12.645 -16.541 -0.163 221 1HB ASN 30 1HB ASN 30 12.682 -14.770 2.256 222 2HB ASN 30 2HB ASN 30 11.421 -15.990 2.098 223 1HD2 ASN 30 1HD2 ASN 30 12.220 -17.093 3.897 224 2HD2 ASN 30 2HD2 ASN 30 13.654 -18.052 3.812 225 H CYS 31 H CYS 31 12.089 -14.195 -1.798 226 HA CYS 31 HA CYS 31 9.418 -13.330 -1.182 227 1HB CYS 31 1HB CYS 31 10.877 -11.777 -2.296 228 2HB CYS 31 2HB CYS 31 11.193 -12.921 -3.592 229 HG CYS 31 HG CYS 31 8.653 -12.558 -4.318 230 H VAL 32 H VAL 32 7.540 -13.838 -2.249 231 HA VAL 32 HA VAL 32 7.580 -16.362 -3.739 232 HB VAL 32 HB VAL 32 5.095 -16.382 -3.243 233 1HG1 VAL 32 1HG1 VAL 32 6.115 -17.885 -1.888 234 2HG1 VAL 32 2HG1 VAL 32 5.636 -16.725 -0.646 235 3HG1 VAL 32 3HG1 VAL 32 7.283 -16.710 -1.280 236 1HG2 VAL 32 1HG2 VAL 32 4.257 -14.983 -1.468 237 2HG2 VAL 32 2HG2 VAL 32 4.906 -13.964 -2.752 238 3HG2 VAL 32 3HG2 VAL 32 5.836 -14.222 -1.275 239 H TRP 33 H TRP 33 6.266 -13.067 -3.774 240 HA TRP 33 HA TRP 33 6.019 -13.272 -6.686 241 1HB TRP 33 1HB TRP 33 3.775 -13.588 -6.291 242 2HB TRP 33 2HB TRP 33 3.811 -12.715 -4.763 243 HD1 TRP 33 HD1 TRP 33 3.067 -12.248 -8.436 244 HE1 TRP 33 HE1 TRP 33 2.272 -9.830 -8.842 245 HE3 TRP 33 HE3 TRP 33 4.170 -10.262 -3.872 246 HZ2 TRP 33 HZ2 TRP 33 2.138 -7.392 -7.395 247 HZ3 TRP 33 HZ3 TRP 33 3.689 -7.887 -3.459 248 HH2 TRP 33 HH2 TRP 33 2.697 -6.490 -5.193 249 H GLU 34 H GLU 34 6.092 -11.250 -7.797 250 HA GLU 34 HA GLU 34 6.544 -8.821 -6.311 251 1HB GLU 34 1HB GLU 34 8.753 -9.875 -6.166 252 2HB GLU 34 2HB GLU 34 8.801 -10.035 -7.916 253 1HG GLU 34 1HG GLU 34 8.306 -7.307 -7.036 254 2HG GLU 34 2HG GLU 34 9.834 -7.961 -6.449 255 H ASP 35 H ASP 35 5.477 -7.333 -7.425 256 HA ASP 35 HA ASP 35 5.332 -7.589 -10.352 257 1HB ASP 35 1HB ASP 35 3.179 -7.620 -9.075 258 2HB ASP 35 2HB ASP 35 3.522 -5.978 -8.544 259 H TYR 36 H TYR 36 6.921 -6.439 -11.229 260 HA TYR 36 HA TYR 36 8.142 -4.176 -10.107 261 1HB TYR 36 1HB TYR 36 9.013 -5.765 -11.931 262 2HB TYR 36 2HB TYR 36 8.114 -4.755 -13.059 263 HD1 TYR 36 HD1 TYR 36 10.133 -3.837 -10.057 264 HD2 TYR 36 HD2 TYR 36 9.688 -3.562 -14.280 265 HE1 TYR 36 HE1 TYR 36 12.025 -2.268 -10.149 266 HE2 TYR 36 HE2 TYR 36 11.578 -1.993 -14.382 267 HH TYR 36 HH TYR 36 12.642 -0.256 -12.345 268 H ASN 37 H ASN 37 5.331 -4.469 -12.174 269 HA ASN 37 HA ASN 37 5.260 -1.862 -13.178 270 1HB ASN 37 1HB ASN 37 2.886 -3.622 -12.542 271 2HB ASN 37 2HB ASN 37 2.939 -2.293 -13.696 272 1HD2 ASN 37 1HD2 ASN 37 2.047 -4.605 -14.617 273 2HD2 ASN 37 2HD2 ASN 37 3.216 -5.382 -15.626 274 H ARG 38 H ARG 38 4.333 -3.199 -10.087 275 HA ARG 38 HA ARG 38 3.340 -0.547 -9.282 276 1HB ARG 38 1HB ARG 38 2.173 -1.784 -7.435 277 2HB ARG 38 2HB ARG 38 1.583 -2.130 -9.055 278 1HG ARG 38 1HG ARG 38 2.807 -4.212 -9.091 279 2HG ARG 38 2HG ARG 38 3.499 -3.859 -7.507 280 1HD ARG 38 1HD ARG 38 0.569 -4.237 -8.118 281 2HD ARG 38 2HD ARG 38 1.621 -5.417 -7.337 282 HE ARG 38 HE ARG 38 1.869 -3.269 -5.737 283 1HH1 ARG 38 1HH1 ARG 38 -0.922 -4.925 -7.021 284 2HH1 ARG 38 2HH1 ARG 38 -1.928 -4.539 -5.666 285 1HH2 ARG 38 1HH2 ARG 38 0.550 -2.763 -3.956 286 2HH2 ARG 38 2HH2 ARG 38 -1.092 -3.313 -3.924 287 H ASP 39 H ASP 39 6.004 -2.491 -9.019 288 HA ASP 39 HA ASP 39 7.826 -2.495 -7.657 289 1HB ASP 39 1HB ASP 39 6.555 0.140 -6.985 290 2HB ASP 39 2HB ASP 39 7.972 -0.406 -6.097 291 H LEU 40 H LEU 40 5.817 -4.143 -6.833 292 HA LEU 40 HA LEU 40 6.091 -4.010 -3.912 293 1HB LEU 40 1HB LEU 40 3.840 -3.232 -4.509 294 2HB LEU 40 2HB LEU 40 3.561 -4.713 -5.403 295 HG LEU 40 HG LEU 40 3.916 -5.939 -3.191 296 1HD1 LEU 40 1HD1 LEU 40 4.784 -3.575 -2.261 297 2HD1 LEU 40 2HD1 LEU 40 4.091 -4.830 -1.234 298 3HD1 LEU 40 3HD1 LEU 40 3.090 -3.484 -1.780 299 1HD2 LEU 40 1HD2 LEU 40 1.526 -4.190 -2.962 300 2HD2 LEU 40 2HD2 LEU 40 1.664 -5.943 -2.832 301 3HD2 LEU 40 3HD2 LEU 40 1.698 -5.172 -4.418 302 H LEU 41 H LEU 41 6.021 -6.060 -2.844 303 HA LEU 41 HA LEU 41 5.951 -8.452 -4.458 304 1HB LEU 41 1HB LEU 41 8.147 -9.271 -3.879 305 2HB LEU 41 2HB LEU 41 8.259 -7.779 -4.776 306 HG LEU 41 HG LEU 41 9.596 -8.445 -2.412 307 1HD1 LEU 41 1HD1 LEU 41 10.652 -6.352 -2.688 308 2HD1 LEU 41 2HD1 LEU 41 9.255 -5.674 -3.526 309 3HD1 LEU 41 3HD1 LEU 41 10.231 -6.921 -4.303 310 1HD2 LEU 41 1HD2 LEU 41 8.898 -6.445 -0.984 311 2HD2 LEU 41 2HD2 LEU 41 7.914 -7.902 -0.900 312 3HD2 LEU 41 3HD2 LEU 41 7.369 -6.523 -1.846 313 H VAL 42 H VAL 42 5.959 -10.423 -3.237 314 HA VAL 42 HA VAL 42 5.187 -9.992 -0.432 315 HB VAL 42 HB VAL 42 4.062 -11.929 -2.460 316 1HG1 VAL 42 1HG1 VAL 42 2.976 -13.205 -0.817 317 2HG1 VAL 42 2HG1 VAL 42 3.329 -12.033 0.452 318 3HG1 VAL 42 3HG1 VAL 42 4.618 -13.036 -0.201 319 1HG2 VAL 42 1HG2 VAL 42 2.004 -10.831 -0.985 320 2HG2 VAL 42 2HG2 VAL 42 2.534 -10.314 -2.588 321 3HG2 VAL 42 3HG2 VAL 42 3.154 -9.500 -1.152 322 H SER 43 H SER 43 6.201 -11.117 1.077 323 HA SER 43 HA SER 43 7.989 -13.301 0.244 324 1HB SER 43 1HB SER 43 9.509 -11.580 0.724 325 2HB SER 43 2HB SER 43 8.527 -10.959 2.050 326 HG SER 43 HG SER 43 9.978 -12.055 3.157 327 H THR 44 H THR 44 8.412 -14.889 1.932 328 HA THR 44 HA THR 44 6.064 -15.185 3.641 329 HB THR 44 HB THR 44 6.554 -17.519 3.719 330 HG1 THR 44 HG1 THR 44 8.967 -16.968 2.336 331 1HG2 THR 44 1HG2 THR 44 7.363 -17.096 0.928 332 2HG2 THR 44 2HG2 THR 44 5.877 -16.293 1.447 333 3HG2 THR 44 3HG2 THR 44 6.039 -18.047 1.605 334 H THR 45 H THR 45 6.147 -15.552 5.810 335 HA THR 45 HA THR 45 8.751 -15.277 7.137 336 HB THR 45 HB THR 45 8.010 -13.089 7.351 337 HG1 THR 45 HG1 THR 45 8.184 -13.227 9.423 338 1HG2 THR 45 1HG2 THR 45 5.391 -13.077 8.304 339 2HG2 THR 45 2HG2 THR 45 5.387 -14.183 6.933 340 3HG2 THR 45 3HG2 THR 45 5.962 -12.528 6.728 341 H THR 46 H THR 46 8.477 -15.685 9.576 342 HA THR 46 HA THR 46 6.639 -17.959 9.936 343 HB THR 46 HB THR 46 9.202 -17.589 11.469 344 HG1 THR 46 HG1 THR 46 9.758 -17.659 9.279 345 1HG2 THR 46 1HG2 THR 46 7.903 -19.266 12.460 346 2HG2 THR 46 2HG2 THR 46 9.081 -20.117 11.459 347 3HG2 THR 46 3HG2 THR 46 7.418 -19.929 10.899 348 H ALA 47 H ALA 47 5.430 -15.705 10.467 349 HA ALA 47 HA ALA 47 5.421 -15.558 13.403 350 1HB ALA 47 1HB ALA 47 6.321 -13.509 13.175 351 2HB ALA 47 2HB ALA 47 4.672 -13.039 12.763 352 3HB ALA 47 3HB ALA 47 5.841 -13.370 11.484 353 H HIS 48 H HIS 48 3.344 -13.997 13.919 354 HA HIS 48 HA HIS 48 1.100 -15.457 12.730 355 1HB HIS 48 1HB HIS 48 1.730 -14.802 15.373 356 2HB HIS 48 2HB HIS 48 0.399 -13.729 14.954 357 HD1 HIS 48 HD1 HIS 48 1.242 -17.410 15.116 358 HD2 HIS 48 HD2 HIS 48 -2.074 -14.916 14.894 359 HE1 HIS 48 HE1 HIS 48 -0.750 -18.908 15.450 360 HE2 HIS 48 HE2 HIS 48 -2.748 -17.391 15.219 361 H GLY 49 H GLY 49 -0.741 -14.404 11.942 362 1HA GLY 49 1HA GLY 49 -0.247 -11.981 10.553 363 2HA GLY 49 2HA GLY 49 -1.796 -12.800 10.678 364 H CYS 50 H CYS 50 -1.839 -10.125 10.645 365 HA CYS 50 HA CYS 50 -2.817 -9.502 13.311 366 1HB CYS 50 1HB CYS 50 -0.427 -8.251 12.086 367 2HB CYS 50 2HB CYS 50 -1.573 -7.153 12.847 368 HG CYS 50 HG CYS 50 -0.099 -7.743 14.778 369 H ASP 51 H ASP 51 -2.098 -7.878 10.213 370 HA ASP 51 HA ASP 51 -4.607 -6.443 10.329 371 1HB ASP 51 1HB ASP 51 -2.349 -6.485 8.326 372 2HB ASP 51 2HB ASP 51 -3.820 -5.547 8.087 373 H THR 52 H THR 52 -6.278 -6.589 8.785 374 HA THR 52 HA THR 52 -6.329 -9.116 7.270 375 HB THR 52 HB THR 52 -8.642 -7.772 8.682 376 HG1 THR 52 HG1 THR 52 -8.458 -9.335 10.166 377 1HG2 THR 52 1HG2 THR 52 -9.810 -9.935 8.197 378 2HG2 THR 52 2HG2 THR 52 -8.518 -10.288 7.050 379 3HG2 THR 52 3HG2 THR 52 -9.553 -8.880 6.808 380 H ILE 53 H ILE 53 -6.434 -8.800 5.154 381 HA ILE 53 HA ILE 53 -7.060 -6.223 4.050 382 HB ILE 53 HB ILE 53 -6.929 -8.632 2.310 383 1HG1 ILE 53 1HG1 ILE 53 -4.883 -8.015 4.238 384 2HG1 ILE 53 2HG1 ILE 53 -4.947 -9.327 3.068 385 1HG2 ILE 53 1HG2 ILE 53 -7.312 -6.465 1.322 386 2HG2 ILE 53 2HG2 ILE 53 -5.738 -7.083 0.829 387 3HG2 ILE 53 3HG2 ILE 53 -5.846 -5.835 2.070 388 1HD1 ILE 53 1HD1 ILE 53 -4.037 -7.687 1.379 389 2HD1 ILE 53 2HD1 ILE 53 -2.941 -8.169 2.669 390 3HD1 ILE 53 3HD1 ILE 53 -3.740 -6.598 2.734 391 H ALA 54 H ALA 54 -8.857 -5.585 2.953 392 HA ALA 54 HA ALA 54 -11.234 -7.215 3.343 393 1HB ALA 54 1HB ALA 54 -11.109 -4.755 3.919 394 2HB ALA 54 2HB ALA 54 -12.493 -5.262 2.951 395 3HB ALA 54 3HB ALA 54 -11.130 -4.445 2.184 396 H ARG 55 H ARG 55 -12.394 -8.156 1.763 397 HA ARG 55 HA ARG 55 -11.273 -8.115 -0.937 398 1HB ARG 55 1HB ARG 55 -11.947 -10.240 0.449 399 2HB ARG 55 2HB ARG 55 -13.571 -9.853 -0.104 400 1HG ARG 55 1HG ARG 55 -12.291 -9.734 -2.444 401 2HG ARG 55 2HG ARG 55 -11.245 -10.882 -1.605 402 1HD ARG 55 1HD ARG 55 -13.675 -11.873 -0.969 403 2HD ARG 55 2HD ARG 55 -14.021 -11.178 -2.552 404 HE ARG 55 HE ARG 55 -11.646 -12.742 -2.600 405 1HH1 ARG 55 1HH1 ARG 55 -15.129 -12.981 -2.597 406 2HH1 ARG 55 2HH1 ARG 55 -15.149 -14.508 -3.413 407 1HH2 ARG 55 1HH2 ARG 55 -11.672 -14.750 -3.674 408 2HH2 ARG 55 2HH2 ARG 55 -13.187 -15.513 -4.023 409 H CYS 56 H CYS 56 -12.827 -5.898 0.227 410 HA CYS 56 HA CYS 56 -15.269 -5.918 -1.383 411 1HB CYS 56 1HB CYS 56 -15.838 -3.871 -0.097 412 2HB CYS 56 2HB CYS 56 -15.562 -5.272 0.933 413 H GLN 57 H GLN 57 -15.826 -3.796 -2.445 414 HA GLN 57 HA GLN 57 -13.422 -2.577 -3.633 415 1HB GLN 57 1HB GLN 57 -14.846 -4.175 -5.092 416 2HB GLN 57 2HB GLN 57 -16.011 -2.859 -5.130 417 1HG GLN 57 1HG GLN 57 -13.607 -1.645 -5.764 418 2HG GLN 57 2HG GLN 57 -13.543 -3.197 -6.599 419 1HE2 GLN 57 1HE2 GLN 57 -14.973 -3.620 -8.251 420 2HE2 GLN 57 2HE2 GLN 57 -15.962 -2.400 -8.970 421 H CYS 58 H CYS 58 -14.972 -1.652 -1.340 422 HA CYS 58 HA CYS 58 -16.786 0.377 -1.986 423 1HB CYS 58 1HB CYS 58 -14.863 0.494 0.338 424 2HB CYS 58 2HB CYS 58 -16.464 1.212 0.228 425 H THR 59 H THR 59 -16.578 2.400 -2.741 426 HA THR 59 HA THR 59 -14.042 3.254 -3.760 427 HB THR 59 HB THR 59 -15.901 3.827 -5.094 428 HG1 THR 59 HG1 THR 59 -15.748 6.054 -5.192 429 1HG2 THR 59 1HG2 THR 59 -17.239 4.313 -2.591 430 2HG2 THR 59 2HG2 THR 59 -17.912 4.022 -4.194 431 3HG2 THR 59 3HG2 THR 59 -17.458 5.657 -3.713 432 H THR 60 H THR 60 -15.436 3.468 -0.725 433 HA THR 60 HA THR 60 -13.997 5.951 -0.084 434 HB THR 60 HB THR 60 -15.434 6.228 1.787 435 HG1 THR 60 HG1 THR 60 -16.172 3.543 1.314 436 1HG2 THR 60 1HG2 THR 60 -17.771 5.850 0.826 437 2HG2 THR 60 2HG2 THR 60 -16.935 5.301 -0.627 438 3HG2 THR 60 3HG2 THR 60 -16.685 6.942 -0.033 439 H GLY 61 H GLY 61 -12.209 5.859 1.100 440 1HA GLY 61 1HA GLY 61 -11.798 3.664 2.982 441 2HA GLY 61 2HA GLY 61 -10.639 3.801 1.666 442 H VAL 62 H VAL 62 -10.330 4.113 4.617 443 HA VAL 62 HA VAL 62 -9.488 6.926 4.737 444 HB VAL 62 HB VAL 62 -10.955 6.204 6.556 445 1HG1 VAL 62 1HG1 VAL 62 -10.255 4.549 8.181 446 2HG1 VAL 62 2HG1 VAL 62 -8.758 4.272 7.292 447 3HG1 VAL 62 3HG1 VAL 62 -10.306 3.829 6.572 448 1HG2 VAL 62 1HG2 VAL 62 -8.274 7.270 6.924 449 2HG2 VAL 62 2HG2 VAL 62 -8.922 6.526 8.385 450 3HG2 VAL 62 3HG2 VAL 62 -9.814 7.820 7.585 451 H TYR 63 H TYR 63 -7.414 7.437 4.594 452 HA TYR 63 HA TYR 63 -5.424 5.291 4.886 453 1HB TYR 63 1HB TYR 63 -4.012 6.481 3.371 454 2HB TYR 63 2HB TYR 63 -5.619 6.449 2.654 455 HD1 TYR 63 HD1 TYR 63 -3.331 8.607 4.646 456 HD2 TYR 63 HD2 TYR 63 -6.637 8.445 1.970 457 HE1 TYR 63 HE1 TYR 63 -3.260 11.054 4.420 458 HE2 TYR 63 HE2 TYR 63 -6.574 10.892 1.738 459 HH TYR 63 HH TYR 63 -5.380 12.892 3.650 460 H PHE 64 H PHE 64 -3.270 5.990 5.712 461 HA PHE 64 HA PHE 64 -3.657 7.621 8.092 462 1HB PHE 64 1HB PHE 64 -2.266 5.285 7.625 463 2HB PHE 64 2HB PHE 64 -0.987 6.494 7.674 464 HD1 PHE 64 HD1 PHE 64 -0.592 7.804 9.702 465 HD2 PHE 64 HD2 PHE 64 -3.507 4.706 9.583 466 HE1 PHE 64 HE1 PHE 64 -0.664 7.781 12.161 467 HE2 PHE 64 HE2 PHE 64 -3.585 4.678 12.042 468 HZ PHE 64 HZ PHE 64 -2.161 6.218 13.334 469 H CYS 65 H CYS 65 -2.928 9.635 8.322 470 HA CYS 65 HA CYS 65 -1.538 10.887 6.113 471 1HB CYS 65 1HB CYS 65 -3.167 11.764 8.370 472 2HB CYS 65 2HB CYS 65 -1.756 12.786 8.121 473 HG CYS 65 HG CYS 65 -2.660 13.099 5.610 474 H ALA 66 H ALA 66 0.430 12.042 6.297 475 HA ALA 66 HA ALA 66 2.284 10.824 8.190 476 1HB ALA 66 1HB ALA 66 3.362 10.745 6.204 477 2HB ALA 66 2HB ALA 66 3.873 12.365 6.680 478 3HB ALA 66 3HB ALA 66 2.520 12.157 5.565 479 H SER 67 H SER 67 1.130 14.026 7.220 480 HA SER 67 HA SER 67 2.672 15.302 9.332 481 1HB SER 67 1HB SER 67 1.432 17.384 8.393 482 2HB SER 67 2HB SER 67 2.672 16.620 7.398 483 HG SER 67 HG SER 67 1.037 16.740 6.016 484 H LYS 68 H LYS 68 -0.740 14.928 8.403 485 HA LYS 68 HA LYS 68 -1.857 16.231 10.613 486 1HB LYS 68 1HB LYS 68 -2.794 14.429 8.495 487 2HB LYS 68 2HB LYS 68 -3.723 14.321 9.983 488 1HG LYS 68 1HG LYS 68 -3.134 16.941 8.644 489 2HG LYS 68 2HG LYS 68 -4.543 15.958 8.237 490 1HD LYS 68 1HD LYS 68 -5.476 16.210 10.371 491 2HD LYS 68 2HD LYS 68 -3.946 16.741 11.072 492 1HE LYS 68 1HE LYS 68 -4.958 18.427 8.891 493 2HE LYS 68 2HE LYS 68 -5.972 18.397 10.333 494 1HZ LYS 68 1HZ LYS 68 -4.567 20.015 10.976 495 2HZ LYS 68 2HZ LYS 68 -3.316 19.510 9.957 496 3HZ LYS 68 3HZ LYS 68 -3.576 18.721 11.430 497 H SER 69 H SER 69 -0.473 13.066 10.294 498 HA SER 69 HA SER 69 -0.163 11.347 11.754 499 1HB SER 69 1HB SER 69 0.859 13.302 13.027 500 2HB SER 69 2HB SER 69 -0.643 13.368 13.948 501 HG SER 69 HG SER 69 1.028 11.084 13.720 502 H LYS 70 H LYS 70 -2.923 12.132 10.904 503 HA LYS 70 HA LYS 70 -4.364 10.561 12.919 504 1HB LYS 70 1HB LYS 70 -5.501 13.008 11.556 505 2HB LYS 70 2HB LYS 70 -6.309 12.002 12.749 506 1HG LYS 70 1HG LYS 70 -5.327 13.041 14.466 507 2HG LYS 70 2HG LYS 70 -3.758 13.101 13.660 508 1HD LYS 70 1HD LYS 70 -4.275 15.335 13.739 509 2HD LYS 70 2HD LYS 70 -4.950 14.901 12.167 510 1HE LYS 70 1HE LYS 70 -7.079 15.200 12.851 511 2HE LYS 70 2HE LYS 70 -6.761 14.558 14.462 512 1HZ LYS 70 1HZ LYS 70 -7.274 16.854 14.671 513 2HZ LYS 70 2HZ LYS 70 -6.164 17.289 13.472 514 3HZ LYS 70 3HZ LYS 70 -5.614 16.691 14.956 515 H HIS 71 H HIS 71 -6.542 9.839 12.008 516 HA HIS 71 HA HIS 71 -6.039 8.619 9.430 517 1HB HIS 71 1HB HIS 71 -8.145 7.390 9.883 518 2HB HIS 71 2HB HIS 71 -6.984 7.238 11.196 519 HD1 HIS 71 HD1 HIS 71 -10.385 8.431 10.411 520 HD2 HIS 71 HD2 HIS 71 -7.679 8.709 13.553 521 HE1 HIS 71 HE1 HIS 71 -11.722 9.247 12.380 522 HE2 HIS 71 HE2 HIS 71 -10.078 9.337 14.288 523 H TYR 72 H TYR 72 -7.012 9.141 7.533 524 HA TYR 72 HA TYR 72 -9.054 11.265 7.602 525 1HB TYR 72 1HB TYR 72 -6.454 11.188 6.282 526 2HB TYR 72 2HB TYR 72 -7.762 11.551 5.165 527 HD1 TYR 72 HD1 TYR 72 -6.615 12.571 8.579 528 HD2 TYR 72 HD2 TYR 72 -8.284 13.769 4.850 529 HE1 TYR 72 HE1 TYR 72 -6.580 14.916 9.324 530 HE2 TYR 72 HE2 TYR 72 -8.257 16.115 5.586 531 HH TYR 72 HH TYR 72 -6.637 17.414 7.538 532 HA PRO 73 HA PRO 73 -11.171 8.084 5.170 533 1HB PRO 73 1HB PRO 73 -13.486 9.852 5.298 534 2HB PRO 73 2HB PRO 73 -13.274 8.254 6.014 535 1HG PRO 73 1HG PRO 73 -13.426 10.521 7.496 536 2HG PRO 73 2HG PRO 73 -12.490 9.100 7.997 537 1HD PRO 73 1HD PRO 73 -11.537 11.647 6.734 538 2HD PRO 73 2HD PRO 73 -10.819 10.708 8.062 539 H VAL 74 H VAL 74 -10.819 8.065 3.020 540 HA VAL 74 HA VAL 74 -11.622 10.424 1.465 541 HB VAL 74 HB VAL 74 -8.973 8.995 1.233 542 1HG1 VAL 74 1HG1 VAL 74 -8.495 10.683 -0.537 543 2HG1 VAL 74 2HG1 VAL 74 -10.213 11.089 -0.532 544 3HG1 VAL 74 3HG1 VAL 74 -9.689 9.463 -0.981 545 1HG2 VAL 74 1HG2 VAL 74 -8.410 11.628 1.456 546 2HG2 VAL 74 2HG2 VAL 74 -8.463 10.507 2.819 547 3HG2 VAL 74 3HG2 VAL 74 -9.862 11.517 2.451 548 H SER 75 H SER 75 -12.414 10.057 -0.541 549 HA SER 75 HA SER 75 -12.935 7.265 -1.262 550 1HB SER 75 1HB SER 75 -14.291 8.932 -3.067 551 2HB SER 75 2HB SER 75 -14.991 8.087 -1.686 552 HG SER 75 HG SER 75 -13.998 10.737 -1.793 553 H PHE 76 H PHE 76 -12.068 6.364 -3.095 554 HA PHE 76 HA PHE 76 -10.692 8.138 -4.977 555 1HB PHE 76 1HB PHE 76 -8.969 5.933 -4.681 556 2HB PHE 76 2HB PHE 76 -8.667 7.596 -4.199 557 HD1 PHE 76 HD1 PHE 76 -10.662 4.724 -2.885 558 HD2 PHE 76 HD2 PHE 76 -7.861 7.822 -2.072 559 HE1 PHE 76 HE1 PHE 76 -10.578 4.023 -0.528 560 HE2 PHE 76 HE2 PHE 76 -7.773 7.128 0.286 561 HZ PHE 76 HZ PHE 76 -9.133 5.228 1.059 562 H GLU 77 H GLU 77 -9.732 6.820 -6.815 563 HA GLU 77 HA GLU 77 -11.693 4.799 -7.671 564 1HB GLU 77 1HB GLU 77 -10.104 6.822 -9.253 565 2HB GLU 77 2HB GLU 77 -10.937 5.469 -10.007 566 1HG GLU 77 1HG GLU 77 -12.938 6.442 -9.829 567 2HG GLU 77 2HG GLU 77 -12.613 7.042 -8.204 568 H GLY 78 H GLY 78 -10.819 3.071 -9.071 569 1HA GLY 78 1HA GLY 78 -8.114 2.353 -8.167 570 2HA GLY 78 2HA GLY 78 -9.346 1.219 -8.687 571 HA PRO 79 HA PRO 79 -7.592 3.157 -12.769 572 1HB PRO 79 1HB PRO 79 -5.299 4.619 -12.513 573 2HB PRO 79 2HB PRO 79 -6.914 5.335 -12.530 574 1HG PRO 79 1HG PRO 79 -5.134 4.719 -10.216 575 2HG PRO 79 2HG PRO 79 -6.178 6.125 -10.485 576 1HD PRO 79 1HD PRO 79 -6.876 4.077 -8.850 577 2HD PRO 79 2HD PRO 79 -8.062 5.029 -9.759 578 H GLY 80 H GLY 80 -6.371 1.846 -14.007 579 1HA GLY 80 1HA GLY 80 -4.922 -0.270 -12.920 580 2HA GLY 80 2HA GLY 80 -4.843 0.242 -14.599 581 H LEU 81 H LEU 81 -3.175 1.599 -15.279 582 HA LEU 81 HA LEU 81 -0.870 1.615 -13.474 583 1HB LEU 81 1HB LEU 81 -0.981 0.745 -15.974 584 2HB LEU 81 2HB LEU 81 -0.625 2.431 -16.309 585 HG LEU 81 HG LEU 81 1.484 1.551 -16.226 586 1HD1 LEU 81 1HD1 LEU 81 2.562 2.210 -14.183 587 2HD1 LEU 81 2HD1 LEU 81 1.027 2.160 -13.321 588 3HD1 LEU 81 3HD1 LEU 81 1.293 3.367 -14.579 589 1HD2 LEU 81 1HD2 LEU 81 0.358 -0.368 -14.247 590 2HD2 LEU 81 2HD2 LEU 81 2.102 -0.126 -14.347 591 3HD2 LEU 81 3HD2 LEU 81 1.208 -0.686 -15.759 592 H VAL 82 H VAL 82 -0.253 3.399 -12.492 593 HA VAL 82 HA VAL 82 -0.998 5.994 -13.670 594 HB VAL 82 HB VAL 82 -0.735 5.323 -10.725 595 1HG1 VAL 82 1HG1 VAL 82 -1.965 7.848 -11.213 596 2HG1 VAL 82 2HG1 VAL 82 -0.421 7.801 -12.064 597 3HG1 VAL 82 3HG1 VAL 82 -0.482 7.494 -10.329 598 1HG2 VAL 82 1HG2 VAL 82 -2.790 4.453 -11.661 599 2HG2 VAL 82 2HG2 VAL 82 -3.140 6.008 -12.417 600 3HG2 VAL 82 3HG2 VAL 82 -3.147 5.860 -10.659 601 H GLU 83 H GLU 83 0.653 7.271 -14.200 602 HA GLU 83 HA GLU 83 3.339 6.425 -13.769 603 1HB GLU 83 1HB GLU 83 2.535 7.661 -15.794 604 2HB GLU 83 2HB GLU 83 2.376 9.100 -14.796 605 1HG GLU 83 1HG GLU 83 5.001 7.846 -14.612 606 2HG GLU 83 2HG GLU 83 4.586 8.387 -16.238 607 H VAL 84 H VAL 84 4.219 6.545 -11.819 608 HA VAL 84 HA VAL 84 3.466 8.512 -9.889 609 HB VAL 84 HB VAL 84 5.216 6.146 -9.953 610 1HG1 VAL 84 1HG1 VAL 84 6.956 7.628 -9.307 611 2HG1 VAL 84 2HG1 VAL 84 6.386 6.838 -7.840 612 3HG1 VAL 84 3HG1 VAL 84 5.897 8.494 -8.195 613 1HG2 VAL 84 1HG2 VAL 84 4.285 6.394 -7.427 614 2HG2 VAL 84 2HG2 VAL 84 3.392 5.637 -8.747 615 3HG2 VAL 84 3HG2 VAL 84 3.079 7.320 -8.319 616 H GLN 85 H GLN 85 4.101 10.542 -9.938 617 HA GLN 85 HA GLN 85 6.320 11.459 -11.474 618 1HB GLN 85 1HB GLN 85 4.903 13.014 -9.312 619 2HB GLN 85 2HB GLN 85 5.749 13.645 -10.717 620 1HG GLN 85 1HG GLN 85 3.472 11.856 -11.265 621 2HG GLN 85 2HG GLN 85 3.088 13.424 -10.558 622 1HE2 GLN 85 1HE2 GLN 85 4.807 15.119 -11.670 623 2HE2 GLN 85 2HE2 GLN 85 4.627 15.164 -13.388 624 H GLU 86 H GLU 86 8.283 12.378 -10.697 625 HA GLU 86 HA GLU 86 9.421 10.964 -8.528 626 1HB GLU 86 1HB GLU 86 11.347 12.607 -8.863 627 2HB GLU 86 2HB GLU 86 10.926 11.594 -10.235 628 1HG GLU 86 1HG GLU 86 9.870 13.376 -11.357 629 2HG GLU 86 2HG GLU 86 9.871 14.384 -9.911 630 H SER 87 H SER 87 8.551 11.327 -6.585 631 HA SER 87 HA SER 87 8.896 13.986 -5.442 632 1HB SER 87 1HB SER 87 6.496 13.349 -4.325 633 2HB SER 87 2HB SER 87 6.684 14.400 -5.728 634 HG SER 87 HG SER 87 5.294 12.238 -5.650 635 H GLU 88 H GLU 88 9.246 13.998 -3.236 636 HA GLU 88 HA GLU 88 10.185 13.131 -1.332 637 1HB GLU 88 1HB GLU 88 7.508 12.644 -1.451 638 2HB GLU 88 2HB GLU 88 8.132 11.029 -1.150 639 1HG GLU 88 1HG GLU 88 8.570 11.488 0.977 640 2HG GLU 88 2HG GLU 88 9.374 13.003 0.565 641 H TYR 89 H TYR 89 12.113 12.188 -1.962 642 HA TYR 89 HA TYR 89 13.598 10.547 -2.612 643 1HB TYR 89 1HB TYR 89 13.433 8.561 -1.059 644 2HB TYR 89 2HB TYR 89 13.459 10.136 -0.269 645 HD1 TYR 89 HD1 TYR 89 10.971 7.685 -1.616 646 HD2 TYR 89 HD2 TYR 89 11.927 10.510 1.418 647 HE1 TYR 89 HE1 TYR 89 8.869 7.146 -0.466 648 HE2 TYR 89 HE2 TYR 89 9.829 9.972 2.583 649 HH TYR 89 HH TYR 89 7.882 7.280 1.721 650 H TYR 90 H TYR 90 11.128 10.508 -4.293 651 HA TYR 90 HA TYR 90 11.341 7.696 -5.120 652 1HB TYR 90 1HB TYR 90 9.038 8.892 -4.064 653 2HB TYR 90 2HB TYR 90 8.756 8.790 -5.798 654 HD1 TYR 90 HD1 TYR 90 7.847 6.846 -6.641 655 HD2 TYR 90 HD2 TYR 90 10.006 6.673 -2.982 656 HE1 TYR 90 HE1 TYR 90 7.259 4.468 -6.414 657 HE2 TYR 90 HE2 TYR 90 9.426 4.296 -2.743 658 HH TYR 90 HH TYR 90 8.195 2.444 -5.246 659 HA PRO 91 HA PRO 91 12.169 9.755 -9.013 660 1HB PRO 91 1HB PRO 91 13.160 7.653 -10.311 661 2HB PRO 91 2HB PRO 91 14.041 8.380 -8.961 662 1HG PRO 91 1HG PRO 91 12.398 5.888 -9.031 663 2HG PRO 91 2HG PRO 91 13.918 6.205 -8.179 664 1HD PRO 91 1HD PRO 91 11.369 6.302 -7.047 665 2HD PRO 91 2HD PRO 91 12.835 7.024 -6.356 666 H LYS 92 H LYS 92 11.197 9.911 -11.025 667 HA LYS 92 HA LYS 92 8.581 9.241 -11.392 668 1HB LYS 92 1HB LYS 92 10.649 9.493 -13.582 669 2HB LYS 92 2HB LYS 92 8.909 9.653 -13.786 670 1HG LYS 92 1HG LYS 92 9.659 11.449 -11.750 671 2HG LYS 92 2HG LYS 92 10.830 11.632 -13.057 672 1HD LYS 92 1HD LYS 92 8.699 11.647 -14.571 673 2HD LYS 92 2HD LYS 92 7.874 12.083 -13.073 674 1HE LYS 92 1HE LYS 92 10.292 13.631 -13.454 675 2HE LYS 92 2HE LYS 92 9.193 13.799 -14.823 676 1HZ LYS 92 1HZ LYS 92 7.690 14.901 -13.590 677 2HZ LYS 92 2HZ LYS 92 9.016 15.248 -12.598 678 3HZ LYS 92 3HZ LYS 92 7.969 13.980 -12.197 679 H ARG 93 H ARG 93 8.027 7.149 -10.850 680 HA ARG 93 HA ARG 93 8.956 5.070 -12.721 681 1HB ARG 93 1HB ARG 93 9.321 5.121 -9.952 682 2HB ARG 93 2HB ARG 93 7.996 3.993 -10.206 683 1HG ARG 93 1HG ARG 93 9.621 2.490 -10.507 684 2HG ARG 93 2HG ARG 93 9.744 3.191 -12.122 685 1HD ARG 93 1HD ARG 93 11.255 4.624 -10.058 686 2HD ARG 93 2HD ARG 93 11.802 2.972 -10.343 687 HE ARG 93 HE ARG 93 11.452 4.315 -12.801 688 1HH1 ARG 93 1HH1 ARG 93 13.585 4.204 -10.042 689 2HH1 ARG 93 2HH1 ARG 93 14.970 4.739 -10.933 690 1HH2 ARG 93 1HH2 ARG 93 13.273 5.017 -13.976 691 2HH2 ARG 93 2HH2 ARG 93 14.794 5.201 -13.167 692 H TYR 94 H TYR 94 7.411 3.148 -12.733 693 HA TYR 94 HA TYR 94 4.680 4.181 -13.032 694 1HB TYR 94 1HB TYR 94 6.236 1.996 -14.361 695 2HB TYR 94 2HB TYR 94 4.478 1.897 -14.321 696 HD1 TYR 94 HD1 TYR 94 3.170 3.152 -15.822 697 HD2 TYR 94 HD2 TYR 94 7.306 4.034 -15.399 698 HE1 TYR 94 HE1 TYR 94 3.037 4.651 -17.757 699 HE2 TYR 94 HE2 TYR 94 7.190 5.540 -17.333 700 HH TYR 94 HH TYR 94 4.511 6.803 -18.526 701 H GLN 95 H GLN 95 3.030 3.411 -11.834 702 HA GLN 95 HA GLN 95 3.533 1.041 -10.163 703 1HB GLN 95 1HB GLN 95 3.149 3.683 -9.282 704 2HB GLN 95 2HB GLN 95 1.652 2.834 -8.924 705 1HG GLN 95 1HG GLN 95 2.579 1.877 -7.164 706 2HG GLN 95 2HG GLN 95 3.842 1.176 -8.176 707 1HE2 GLN 95 1HE2 GLN 95 4.045 2.167 -5.471 708 2HE2 GLN 95 2HE2 GLN 95 5.222 3.432 -5.494 709 H SER 96 H SER 96 2.231 -0.554 -10.897 710 HA SER 96 HA SER 96 -0.281 0.080 -12.184 711 1HB SER 96 1HB SER 96 -0.438 -2.324 -12.602 712 2HB SER 96 2HB SER 96 1.165 -1.732 -13.036 713 HG SER 96 HG SER 96 1.902 -2.521 -11.006 714 H HIS 97 H HIS 97 -2.327 -0.755 -11.549 715 HA HIS 97 HA HIS 97 -4.037 -0.994 -10.071 716 1HB HIS 97 1HB HIS 97 -1.987 -2.949 -9.298 717 2HB HIS 97 2HB HIS 97 -3.132 -2.571 -8.017 718 HD1 HIS 97 HD1 HIS 97 -5.727 -2.930 -8.685 719 HD2 HIS 97 HD2 HIS 97 -2.907 -4.713 -11.160 720 HE1 HIS 97 HE1 HIS 97 -6.988 -4.659 -10.004 721 HE2 HIS 97 HE2 HIS 97 -5.276 -5.674 -11.548 722 H VAL 98 H VAL 98 -3.319 1.407 -9.662 723 HA VAL 98 HA VAL 98 -2.935 1.674 -6.750 724 HB VAL 98 HB VAL 98 -0.951 2.471 -8.036 725 1HG1 VAL 98 1HG1 VAL 98 -1.400 3.516 -9.960 726 2HG1 VAL 98 2HG1 VAL 98 -1.595 4.948 -8.946 727 3HG1 VAL 98 3HG1 VAL 98 -3.010 4.012 -9.435 728 1HG2 VAL 98 1HG2 VAL 98 -2.538 4.210 -6.230 729 2HG2 VAL 98 2HG2 VAL 98 -1.108 4.892 -7.007 730 3HG2 VAL 98 3HG2 VAL 98 -0.960 3.459 -5.986 731 H LEU 99 H LEU 99 -4.176 3.223 -5.684 732 HA LEU 99 HA LEU 99 -6.482 4.198 -7.205 733 1HB LEU 99 1HB LEU 99 -6.338 4.087 -4.213 734 2HB LEU 99 2HB LEU 99 -7.760 4.121 -5.240 735 HG LEU 99 HG LEU 99 -6.823 1.796 -6.061 736 1HD1 LEU 99 1HD1 LEU 99 -5.125 2.439 -3.825 737 2HD1 LEU 99 2HD1 LEU 99 -5.041 1.078 -4.943 738 3HD1 LEU 99 3HD1 LEU 99 -6.052 0.973 -3.502 739 1HD2 LEU 99 1HD2 LEU 99 -8.025 0.917 -3.803 740 2HD2 LEU 99 2HD2 LEU 99 -8.891 1.544 -5.205 741 3HD2 LEU 99 3HD2 LEU 99 -8.565 2.596 -3.828 742 H LEU 100 H LEU 100 -7.165 6.362 -7.008 743 HA LEU 100 HA LEU 100 -5.291 8.122 -5.589 744 1HB LEU 100 1HB LEU 100 -5.833 8.013 -8.455 745 2HB LEU 100 2HB LEU 100 -5.978 9.625 -7.773 746 HG LEU 100 HG LEU 100 -3.546 7.851 -7.521 747 1HD1 LEU 100 1HD1 LEU 100 -2.531 9.072 -9.204 748 2HD1 LEU 100 2HD1 LEU 100 -3.693 10.394 -9.086 749 3HD1 LEU 100 3HD1 LEU 100 -4.172 8.861 -9.816 750 1HD2 LEU 100 1HD2 LEU 100 -2.631 9.378 -6.152 751 2HD2 LEU 100 2HD2 LEU 100 -4.303 9.838 -5.831 752 3HD2 LEU 100 3HD2 LEU 100 -3.352 10.735 -7.015 753 H ALA 101 H ALA 101 -6.076 9.965 -4.708 754 HA ALA 101 HA ALA 101 -8.825 10.783 -5.161 755 1HB ALA 101 1HB ALA 101 -9.214 9.167 -3.451 756 2HB ALA 101 2HB ALA 101 -9.312 10.759 -2.707 757 3HB ALA 101 3HB ALA 101 -7.865 9.774 -2.487 758 H THR 102 H THR 102 -9.151 12.939 -4.726 759 HA THR 102 HA THR 102 -6.750 14.447 -4.027 760 HB THR 102 HB THR 102 -7.679 15.253 -6.024 761 HG1 THR 102 HG1 THR 102 -8.804 16.946 -4.051 762 1HG2 THR 102 1HG2 THR 102 -10.211 16.153 -5.714 763 2HG2 THR 102 2HG2 THR 102 -10.259 14.663 -4.771 764 3HG2 THR 102 3HG2 THR 102 -9.776 14.618 -6.467 765 H GLY 103 H GLY 103 -6.462 15.122 -2.026 766 1HA GLY 103 1HA GLY 103 -8.515 14.978 -0.045 767 2HA GLY 103 2HA GLY 103 -6.900 15.634 0.177 768 H PHE 104 H PHE 104 -6.747 17.740 0.537 769 HA PHE 104 HA PHE 104 -8.369 19.676 -0.778 770 1HB PHE 104 1HB PHE 104 -9.890 18.707 1.048 771 2HB PHE 104 2HB PHE 104 -8.823 19.507 2.196 772 HD1 PHE 104 HD1 PHE 104 -9.223 21.702 2.797 773 HD2 PHE 104 HD2 PHE 104 -10.899 20.194 -0.813 774 HE1 PHE 104 HE1 PHE 104 -10.485 23.795 2.514 775 HE2 PHE 104 HE2 PHE 104 -12.164 22.284 -1.103 776 HZ PHE 104 HZ PHE 104 -11.957 24.088 0.561 777 H SER 105 H SER 105 -6.060 20.128 -1.186 778 HA SER 105 HA SER 105 -4.230 21.454 -0.933 779 1HB SER 105 1HB SER 105 -5.802 22.714 1.329 780 2HB SER 105 2HB SER 105 -4.399 23.413 0.519 781 HG SER 105 HG SER 105 -5.935 24.292 -0.652 782 H GLU 106 H GLU 106 -2.975 19.648 -0.286 783 HA GLU 106 HA GLU 106 -2.189 19.756 2.543 784 1HB GLU 106 1HB GLU 106 -2.465 17.218 0.926 785 2HB GLU 106 2HB GLU 106 -1.947 17.332 2.603 786 1HG GLU 106 1HG GLU 106 -4.038 17.428 3.359 787 2HG GLU 106 2HG GLU 106 -4.530 18.584 2.122 788 HA PRO 107 HA PRO 107 1.925 20.359 1.041 789 1HB PRO 107 1HB PRO 107 2.737 18.587 3.288 790 2HB PRO 107 2HB PRO 107 3.285 20.218 2.885 791 1HG PRO 107 1HG PRO 107 1.620 19.807 4.922 792 2HG PRO 107 2HG PRO 107 1.446 21.225 3.872 793 1HD PRO 107 1HD PRO 107 -0.156 18.704 3.940 794 2HD PRO 107 2HD PRO 107 -0.685 20.372 3.640 795 H GLY 108 H GLY 108 1.728 17.089 2.463 796 1HA GLY 108 1HA GLY 108 2.449 15.971 -0.158 797 2HA GLY 108 2HA GLY 108 3.445 15.584 1.237 798 H ASP 109 H ASP 109 1.805 15.013 3.218 799 HA ASP 109 HA ASP 109 0.470 13.402 4.108 800 1HB ASP 109 1HB ASP 109 -0.940 14.170 1.609 801 2HB ASP 109 2HB ASP 109 -1.447 12.666 2.373 802 H ALA 110 H ALA 110 -0.656 11.131 3.309 803 HA ALA 110 HA ALA 110 -0.292 8.984 2.647 804 1HB ALA 110 1HB ALA 110 1.833 9.289 0.747 805 2HB ALA 110 2HB ALA 110 0.614 10.537 0.487 806 3HB ALA 110 3HB ALA 110 0.150 8.836 0.476 807 H GLY 111 H GLY 111 0.654 7.758 4.132 808 1HA GLY 111 1HA GLY 111 3.457 7.322 4.164 809 2HA GLY 111 2HA GLY 111 2.990 8.339 5.520 810 H GLY 112 H GLY 112 1.004 5.780 4.139 811 1HA GLY 112 1HA GLY 112 1.742 3.833 6.113 812 2HA GLY 112 2HA GLY 112 0.218 4.622 6.491 813 H ILE 113 H ILE 113 -1.166 2.949 6.168 814 HA ILE 113 HA ILE 113 -1.302 1.892 3.425 815 HB ILE 113 HB ILE 113 -2.036 -0.257 4.244 816 1HG1 ILE 113 1HG1 ILE 113 -1.596 -0.507 6.883 817 2HG1 ILE 113 2HG1 ILE 113 -2.113 1.176 6.847 818 1HG2 ILE 113 1HG2 ILE 113 0.213 -0.442 4.019 819 2HG2 ILE 113 2HG2 ILE 113 0.100 -0.728 5.756 820 3HG2 ILE 113 3HG2 ILE 113 0.547 0.867 5.152 821 1HD1 ILE 113 1HD1 ILE 113 -3.644 -1.292 6.391 822 2HD1 ILE 113 2HD1 ILE 113 -4.040 0.073 5.345 823 3HD1 ILE 113 3HD1 ILE 113 -4.142 0.246 7.096 824 H LEU 114 H LEU 114 -3.350 1.550 2.553 825 HA LEU 114 HA LEU 114 -5.437 3.167 3.760 826 1HB LEU 114 1HB LEU 114 -5.055 3.465 1.402 827 2HB LEU 114 2HB LEU 114 -5.232 1.745 1.107 828 HG LEU 114 HG LEU 114 -7.587 1.831 1.553 829 1HD1 LEU 114 1HD1 LEU 114 -8.754 3.736 2.323 830 2HD1 LEU 114 2HD1 LEU 114 -7.341 4.772 2.125 831 3HD1 LEU 114 3HD1 LEU 114 -7.364 3.545 3.392 832 1HD2 LEU 114 1HD2 LEU 114 -7.039 4.268 -0.109 833 2HD2 LEU 114 2HD2 LEU 114 -8.309 3.060 -0.304 834 3HD2 LEU 114 3HD2 LEU 114 -6.634 2.647 -0.673 835 H ARG 115 H ARG 115 -6.941 2.348 5.039 836 HA ARG 115 HA ARG 115 -7.608 -0.509 4.771 837 1HB ARG 115 1HB ARG 115 -8.119 -0.510 7.171 838 2HB ARG 115 2HB ARG 115 -6.447 -0.061 6.864 839 1HG ARG 115 1HG ARG 115 -7.960 2.326 6.914 840 2HG ARG 115 2HG ARG 115 -8.445 1.357 8.308 841 1HD ARG 115 1HD ARG 115 -5.545 1.682 7.673 842 2HD ARG 115 2HD ARG 115 -6.411 2.993 8.474 843 HE ARG 115 HE ARG 115 -5.556 0.545 9.645 844 1HH1 ARG 115 1HH1 ARG 115 -8.089 2.944 9.755 845 2HH1 ARG 115 2HH1 ARG 115 -8.492 2.623 11.408 846 1HH2 ARG 115 1HH2 ARG 115 -6.086 0.121 11.818 847 2HH2 ARG 115 2HH2 ARG 115 -7.355 1.021 12.579 848 H CYS 116 H CYS 116 -9.727 -1.137 4.888 849 HA CYS 116 HA CYS 116 -11.716 1.014 4.601 850 1HB CYS 116 1HB CYS 116 -11.269 -0.741 2.728 851 2HB CYS 116 2HB CYS 116 -12.166 -1.841 3.767 852 H GLU 117 H GLU 117 -13.931 0.433 5.405 853 HA GLU 117 HA GLU 117 -13.882 -0.191 8.129 854 1HB GLU 117 1HB GLU 117 -15.694 1.091 7.100 855 2HB GLU 117 2HB GLU 117 -16.202 -0.325 6.192 856 1HG GLU 117 1HG GLU 117 -17.493 -0.971 7.862 857 2HG GLU 117 2HG GLU 117 -16.112 -0.997 8.958 858 H HIS 118 H HIS 118 -13.853 -2.226 5.383 859 HA HIS 118 HA HIS 118 -14.827 -4.556 6.828 860 1HB HIS 118 1HB HIS 118 -13.817 -4.351 3.986 861 2HB HIS 118 2HB HIS 118 -14.715 -5.694 4.692 862 HD2 HIS 118 HD2 HIS 118 -17.391 -5.533 4.278 863 HE1 HIS 118 HE1 HIS 118 -17.594 -1.404 3.317 864 HE2 HIS 118 HE2 HIS 118 -18.895 -3.545 3.586 865 H GLY 119 H GLY 119 -11.821 -3.213 5.573 866 1HA GLY 119 1HA GLY 119 -10.182 -4.639 7.338 867 2HA GLY 119 2HA GLY 119 -10.224 -5.536 5.827 868 H VAL 120 H VAL 120 -8.419 -5.196 4.783 869 HA VAL 120 HA VAL 120 -7.289 -2.475 4.686 870 HB VAL 120 HB VAL 120 -5.734 -4.957 4.014 871 1HG1 VAL 120 1HG1 VAL 120 -4.049 -3.140 5.165 872 2HG1 VAL 120 2HG1 VAL 120 -5.192 -2.110 4.302 873 3HG1 VAL 120 3HG1 VAL 120 -4.302 -3.360 3.433 874 1HG2 VAL 120 1HG2 VAL 120 -5.078 -4.015 6.632 875 2HG2 VAL 120 2HG2 VAL 120 -5.591 -5.622 6.124 876 3HG2 VAL 120 3HG2 VAL 120 -6.795 -4.413 6.568 877 H ILE 121 H ILE 121 -6.969 -1.513 2.726 878 HA ILE 121 HA ILE 121 -7.886 -3.018 0.383 879 HB ILE 121 HB ILE 121 -8.114 -0.223 1.194 880 1HG1 ILE 121 1HG1 ILE 121 -9.578 -1.238 -1.152 881 2HG1 ILE 121 2HG1 ILE 121 -9.765 -2.203 0.306 882 1HG2 ILE 121 1HG2 ILE 121 -6.409 0.198 -0.457 883 2HG2 ILE 121 2HG2 ILE 121 -7.971 0.704 -1.102 884 3HG2 ILE 121 3HG2 ILE 121 -7.247 -0.814 -1.634 885 1HD1 ILE 121 1HD1 ILE 121 -11.428 -0.787 0.756 886 2HD1 ILE 121 2HD1 ILE 121 -10.815 0.440 -0.354 887 3HD1 ILE 121 3HD1 ILE 121 -10.142 0.304 1.271 888 H GLY 122 H GLY 122 -5.247 -0.823 1.369 889 1HA GLY 122 1HA GLY 122 -3.318 -2.353 -0.070 890 2HA GLY 122 2HA GLY 122 -3.737 -0.889 -0.940 891 H LEU 123 H LEU 123 -1.407 -0.501 -0.639 892 HA LEU 123 HA LEU 123 -0.852 0.701 1.992 893 1HB LEU 123 1HB LEU 123 1.577 0.392 1.345 894 2HB LEU 123 2HB LEU 123 0.681 -1.063 1.737 895 HG LEU 123 HG LEU 123 0.781 -0.305 -1.126 896 1HD1 LEU 123 1HD1 LEU 123 3.041 0.130 -0.725 897 2HD1 LEU 123 2HD1 LEU 123 3.010 -1.553 -1.253 898 3HD1 LEU 123 3HD1 LEU 123 3.175 -1.170 0.461 899 1HD2 LEU 123 1HD2 LEU 123 1.426 -3.003 -0.097 900 2HD2 LEU 123 2HD2 LEU 123 0.425 -2.519 -1.465 901 3HD2 LEU 123 3HD2 LEU 123 -0.213 -2.412 0.176 902 H VAL 124 H VAL 124 0.693 2.562 1.897 903 HA VAL 124 HA VAL 124 -0.272 4.511 0.072 904 HB VAL 124 HB VAL 124 0.462 5.095 2.343 905 1HG1 VAL 124 1HG1 VAL 124 3.317 5.134 1.704 906 2HG1 VAL 124 2HG1 VAL 124 2.630 3.515 1.844 907 3HG1 VAL 124 3HG1 VAL 124 2.489 4.653 3.184 908 1HG2 VAL 124 1HG2 VAL 124 1.960 6.446 0.103 909 2HG2 VAL 124 2HG2 VAL 124 1.808 7.101 1.732 910 3HG2 VAL 124 3HG2 VAL 124 0.371 6.872 0.737 911 H THR 125 H THR 125 0.474 5.140 -1.866 912 HA THR 125 HA THR 125 3.056 4.039 -2.749 913 HB THR 125 HB THR 125 0.514 4.578 -4.272 914 HG1 THR 125 HG1 THR 125 1.133 2.495 -3.205 915 1HG2 THR 125 1HG2 THR 125 3.235 4.701 -5.312 916 2HG2 THR 125 2HG2 THR 125 1.714 5.221 -6.038 917 3HG2 THR 125 3HG2 THR 125 2.204 3.529 -6.132 918 H MET 126 H MET 126 1.330 6.516 -4.581 919 HA MET 126 HA MET 126 3.133 8.571 -3.529 920 1HB MET 126 1HB MET 126 3.055 7.685 -6.404 921 2HB MET 126 2HB MET 126 3.702 9.241 -5.907 922 1HG MET 126 1HG MET 126 4.708 6.582 -4.923 923 2HG MET 126 2HG MET 126 5.423 7.499 -6.247 924 1HE MET 126 1HE MET 126 6.469 10.789 -4.428 925 2HE MET 126 2HE MET 126 5.423 10.216 -5.732 926 3HE MET 126 3HE MET 126 7.127 9.772 -5.712 927 H GLY 127 H GLY 127 2.346 10.629 -3.625 928 1HA GLY 127 1HA GLY 127 -0.338 10.921 -4.827 929 2HA GLY 127 2HA GLY 127 0.171 11.739 -3.358 930 H GLY 128 H GLY 128 -0.911 12.951 -5.738 931 1HA GLY 128 1HA GLY 128 1.336 14.235 -7.059 932 2HA GLY 128 2HA GLY 128 -0.367 14.490 -7.411 933 H GLU 129 H GLU 129 -0.153 16.740 -7.429 934 HA GLU 129 HA GLU 129 0.980 18.181 -5.244 935 1HB GLU 129 1HB GLU 129 -0.971 19.253 -7.281 936 2HB GLU 129 2HB GLU 129 0.221 20.156 -6.357 937 1HG GLU 129 1HG GLU 129 1.887 19.663 -7.774 938 2HG GLU 129 2HG GLU 129 1.324 18.012 -8.027 939 H GLY 130 H GLY 130 -2.074 16.724 -5.803 940 1HA GLY 130 1HA GLY 130 -2.999 17.613 -3.205 941 2HA GLY 130 2HA GLY 130 -3.965 18.180 -4.559 942 H VAL 131 H VAL 131 -2.527 15.135 -5.088 943 HA VAL 131 HA VAL 131 -5.033 13.786 -4.337 944 HB VAL 131 HB VAL 131 -3.393 12.670 -6.553 945 1HG1 VAL 131 1HG1 VAL 131 -5.373 11.509 -5.685 946 2HG1 VAL 131 2HG1 VAL 131 -5.557 11.958 -7.379 947 3HG1 VAL 131 3HG1 VAL 131 -6.366 12.897 -6.125 948 1HG2 VAL 131 1HG2 VAL 131 -3.547 15.086 -7.077 949 2HG2 VAL 131 2HG2 VAL 131 -5.305 14.958 -6.997 950 3HG2 VAL 131 3HG2 VAL 131 -4.411 14.068 -8.230 951 H VAL 132 H VAL 132 -4.836 11.511 -3.808 952 HA VAL 132 HA VAL 132 -2.174 10.861 -2.719 953 HB VAL 132 HB VAL 132 -3.218 9.679 -0.921 954 1HG1 VAL 132 1HG1 VAL 132 -3.772 11.493 0.278 955 2HG1 VAL 132 2HG1 VAL 132 -5.036 11.980 -0.853 956 3HG1 VAL 132 3HG1 VAL 132 -3.349 12.372 -1.192 957 1HG2 VAL 132 1HG2 VAL 132 -5.063 8.579 -1.832 958 2HG2 VAL 132 2HG2 VAL 132 -5.745 10.066 -2.490 959 3HG2 VAL 132 3HG2 VAL 132 -5.787 9.771 -0.752 960 H GLY 133 H GLY 133 -1.187 9.229 -3.731 961 1HA GLY 133 1HA GLY 133 -2.838 7.290 -5.199 962 2HA GLY 133 2HA GLY 133 -1.134 7.591 -5.484 963 H PHE 134 H PHE 134 -3.298 5.465 -4.181 964 HA PHE 134 HA PHE 134 -1.267 4.324 -2.373 965 1HB PHE 134 1HB PHE 134 -4.263 3.937 -2.226 966 2HB PHE 134 2HB PHE 134 -3.070 3.347 -1.076 967 HD1 PHE 134 HD1 PHE 134 -5.586 5.333 -0.902 968 HD2 PHE 134 HD2 PHE 134 -1.354 5.782 -0.856 969 HE1 PHE 134 HE1 PHE 134 -5.822 7.400 0.410 970 HE2 PHE 134 HE2 PHE 134 -1.584 7.849 0.457 971 HZ PHE 134 HZ PHE 134 -3.820 8.660 1.091 972 H ALA 135 H ALA 135 -0.718 2.195 -2.595 973 HA ALA 135 HA ALA 135 -1.560 0.906 -5.063 974 1HB ALA 135 1HB ALA 135 0.731 0.752 -4.860 975 2HB ALA 135 2HB ALA 135 0.215 -0.811 -4.226 976 3HB ALA 135 3HB ALA 135 0.667 0.485 -3.119 977 H ASP 136 H ASP 136 -3.280 -0.369 -5.054 978 HA ASP 136 HA ASP 136 -4.400 -1.424 -2.646 979 1HB ASP 136 1HB ASP 136 -5.995 -2.565 -4.250 980 2HB ASP 136 2HB ASP 136 -5.941 -0.809 -4.343 981 H VAL 137 H VAL 137 -4.458 -3.481 -1.876 982 HA VAL 137 HA VAL 137 -2.422 -5.306 -2.885 983 HB VAL 137 HB VAL 137 -4.189 -5.571 -0.443 984 1HG1 VAL 137 1HG1 VAL 137 -3.455 -7.726 -0.860 985 2HG1 VAL 137 2HG1 VAL 137 -2.206 -7.107 0.221 986 3HG1 VAL 137 3HG1 VAL 137 -1.910 -7.183 -1.514 987 1HG2 VAL 137 1HG2 VAL 137 -2.809 -4.245 0.696 988 2HG2 VAL 137 2HG2 VAL 137 -2.140 -3.750 -0.859 989 3HG2 VAL 137 3HG2 VAL 137 -1.382 -5.056 0.051 990 H ARG 138 H ARG 138 -5.356 -4.703 -3.916 991 HA ARG 138 HA ARG 138 -6.702 -7.198 -3.783 992 1HB ARG 138 1HB ARG 138 -7.060 -4.954 -5.776 993 2HB ARG 138 2HB ARG 138 -8.206 -6.246 -5.448 994 1HG ARG 138 1HG ARG 138 -7.373 -4.580 -3.147 995 2HG ARG 138 2HG ARG 138 -8.405 -3.823 -4.362 996 1HD ARG 138 1HD ARG 138 -9.000 -6.424 -2.962 997 2HD ARG 138 2HD ARG 138 -9.681 -4.862 -2.515 998 HE ARG 138 HE ARG 138 -10.572 -4.883 -4.908 999 1HH1 ARG 138 1HH1 ARG 138 -10.142 -7.767 -2.974 1000 2HH1 ARG 138 2HH1 ARG 138 -11.373 -8.651 -3.809 1001 1HH2 ARG 138 1HH2 ARG 138 -12.190 -6.053 -5.991 1002 2HH2 ARG 138 2HH2 ARG 138 -12.535 -7.681 -5.515 1003 H ASP 139 H ASP 139 -3.935 -6.322 -5.451 1004 HA ASP 139 HA ASP 139 -4.482 -8.038 -7.749 1005 1HB ASP 139 1HB ASP 139 -3.252 -5.738 -7.807 1006 2HB ASP 139 2HB ASP 139 -1.860 -6.665 -7.256 1007 H LEU 140 H LEU 140 -3.816 -8.749 -4.747 1008 HA LEU 140 HA LEU 140 -2.707 -11.256 -5.255 1009 1HB LEU 140 1HB LEU 140 -0.480 -11.030 -4.259 1010 2HB LEU 140 2HB LEU 140 -0.637 -10.106 -5.735 1011 HG LEU 140 HG LEU 140 0.428 -8.516 -4.550 1012 1HD1 LEU 140 1HD1 LEU 140 -1.036 -6.991 -3.289 1013 2HD1 LEU 140 2HD1 LEU 140 -2.315 -8.204 -3.357 1014 3HD1 LEU 140 3HD1 LEU 140 -1.718 -7.470 -4.845 1015 1HD2 LEU 140 1HD2 LEU 140 1.061 -8.760 -2.423 1016 2HD2 LEU 140 2HD2 LEU 140 0.299 -10.346 -2.552 1017 3HD2 LEU 140 3HD2 LEU 140 -0.590 -8.993 -1.851 1018 H LEU 141 H LEU 141 -4.799 -10.983 -3.927 1019 HA LEU 141 HA LEU 141 -4.482 -10.367 -1.151 1020 1HB LEU 141 1HB LEU 141 -6.630 -10.714 -2.925 1021 2HB LEU 141 2HB LEU 141 -6.826 -11.933 -1.681 1022 HG LEU 141 HG LEU 141 -8.023 -10.129 -0.850 1023 1HD1 LEU 141 1HD1 LEU 141 -7.095 -10.184 1.147 1024 2HD1 LEU 141 2HD1 LEU 141 -5.840 -9.062 0.622 1025 3HD1 LEU 141 3HD1 LEU 141 -5.609 -10.798 0.431 1026 1HD2 LEU 141 1HD2 LEU 141 -6.544 -7.840 -0.796 1027 2HD2 LEU 141 2HD2 LEU 141 -7.766 -8.231 -2.004 1028 3HD2 LEU 141 3HD2 LEU 141 -6.064 -8.554 -2.335 1029 H TRP 142 H TRP 142 -3.844 -13.133 -3.018 1030 HA TRP 142 HA TRP 142 -4.514 -15.215 -1.310 1031 1HB TRP 142 1HB TRP 142 -2.663 -16.481 -2.424 1032 2HB TRP 142 2HB TRP 142 -3.785 -15.711 -3.541 1033 HD1 TRP 142 HD1 TRP 142 -2.821 -13.261 -4.593 1034 HE1 TRP 142 HE1 TRP 142 -0.425 -12.713 -5.347 1035 HE3 TRP 142 HE3 TRP 142 -0.320 -16.959 -2.107 1036 HZ2 TRP 142 HZ2 TRP 142 2.175 -13.719 -4.945 1037 HZ3 TRP 142 HZ3 TRP 142 2.127 -17.097 -2.344 1038 HH2 TRP 142 HH2 TRP 142 3.348 -15.506 -3.735 1039 H LEU 143 H LEU 143 -4.125 -14.289 0.788 1040 HA LEU 143 HA LEU 143 -1.461 -14.953 1.776 1041 1HB LEU 143 1HB LEU 143 -2.857 -12.357 2.443 1042 2HB LEU 143 2HB LEU 143 -1.371 -12.929 3.171 1043 HG LEU 143 HG LEU 143 -0.581 -12.908 0.606 1044 1HD1 LEU 143 1HD1 LEU 143 -3.047 -11.352 0.693 1045 2HD1 LEU 143 2HD1 LEU 143 -2.158 -12.005 -0.684 1046 3HD1 LEU 143 3HD1 LEU 143 -1.671 -10.469 0.032 1047 1HD2 LEU 143 1HD2 LEU 143 -0.654 -10.282 2.019 1048 2HD2 LEU 143 2HD2 LEU 143 0.672 -11.058 1.152 1049 3HD2 LEU 143 3HD2 LEU 143 0.204 -11.637 2.752 1050 H GLU 144 H GLU 144 -4.750 -13.918 2.600 1051 HA GLU 144 HA GLU 144 -4.949 -16.069 4.529 1052 1HB GLU 144 1HB GLU 144 -5.477 -14.730 6.420 1053 2HB GLU 144 2HB GLU 144 -3.986 -14.079 5.755 1054 1HG GLU 144 1HG GLU 144 -5.179 -12.253 4.740 1055 2HG GLU 144 2HG GLU 144 -6.724 -12.939 5.243 1056 H ASP 145 H ASP 145 -7.304 -15.208 5.790 1057 HA ASP 145 HA ASP 145 -9.232 -15.903 3.846 1058 1HB ASP 145 1HB ASP 145 -9.302 -15.055 6.705 1059 2HB ASP 145 2HB ASP 145 -10.804 -14.994 5.787 1060 H ASP 146 H ASP 146 -10.756 -14.708 2.771 1061 HA ASP 146 HA ASP 146 -10.134 -11.896 2.411 1062 1HB ASP 146 1HB ASP 146 -11.809 -13.909 0.962 1063 2HB ASP 146 2HB ASP 146 -12.129 -12.196 0.711 1064 H ALA 147 H ALA 147 -11.726 -10.215 2.537 1065 HA ALA 147 HA ALA 147 -13.640 -10.689 4.698 1066 1HB ALA 147 1HB ALA 147 -13.449 -8.484 5.256 1067 2HB ALA 147 2HB ALA 147 -13.178 -7.970 3.591 1068 3HB ALA 147 3HB ALA 147 -11.874 -8.732 4.502 1069 H MET 148 H MET 148 -15.705 -11.029 4.251 1070 HA MET 148 HA MET 148 -16.756 -10.653 1.612 1071 1HB MET 148 1HB MET 148 -18.223 -11.366 4.158 1072 2HB MET 148 2HB MET 148 -18.823 -11.566 2.518 1073 1HG MET 148 1HG MET 148 -16.552 -12.987 2.352 1074 2HG MET 148 2HG MET 148 -16.930 -13.209 4.059 1075 1HE MET 148 1HE MET 148 -16.514 -15.193 1.898 1076 2HE MET 148 2HE MET 148 -17.914 -16.099 1.324 1077 3HE MET 148 3HE MET 148 -17.376 -16.274 2.995 1078 H GLU 149 H GLU 149 -19.203 -9.719 1.704 1079 HA GLU 149 HA GLU 149 -19.356 -7.257 3.223 1080 1HB GLU 149 1HB GLU 149 -19.748 -5.918 1.105 1081 2HB GLU 149 2HB GLU 149 -18.085 -6.397 1.419 1082 1HG GLU 149 1HG GLU 149 -18.085 -7.090 -0.695 1083 2HG GLU 149 2HG GLU 149 -18.987 -8.478 -0.089 1084 H GLN 150 H GLN 150 -21.413 -5.997 2.417 1085 HA GLN 150 HA GLN 150 -23.508 -7.659 1.349 1086 1HB GLN 150 1HB GLN 150 -24.946 -7.288 3.435 1087 2HB GLN 150 2HB GLN 150 -23.705 -8.532 3.521 1088 1HG GLN 150 1HG GLN 150 -22.301 -7.179 4.845 1089 2HG GLN 150 2HG GLN 150 -23.260 -5.736 4.519 1090 1HE2 GLN 150 1HE2 GLN 150 -23.781 -5.222 6.582 1091 2HE2 GLN 150 2HE2 GLN 150 -24.758 -6.212 7.608 Start of MODEL 13 1 1H GLY 1 1H GLY 1 12.539 12.419 12.995 2 2H GLY 1 2H GLY 1 13.008 12.742 14.588 3 3H GLY 1 3H GLY 1 11.388 12.909 14.135 4 1HA GLY 1 1HA GLY 1 11.335 10.491 13.628 5 2HA GLY 1 2HA GLY 1 12.943 10.391 14.329 6 HA PRO 2 HA PRO 2 9.589 11.644 17.791 7 1HB PRO 2 1HB PRO 2 7.518 9.838 16.637 8 2HB PRO 2 2HB PRO 2 7.322 11.360 17.512 9 1HG PRO 2 1HG PRO 2 7.006 11.266 14.871 10 2HG PRO 2 2HG PRO 2 7.803 12.649 15.644 11 1HD PRO 2 1HD PRO 2 8.997 10.383 14.113 12 2HD PRO 2 2HD PRO 2 9.490 12.088 14.177 13 H TYR 3 H TYR 3 8.962 10.227 19.571 14 HA TYR 3 HA TYR 3 10.529 7.781 19.547 15 1HB TYR 3 1HB TYR 3 8.976 8.963 21.854 16 2HB TYR 3 2HB TYR 3 10.277 7.781 21.936 17 HD1 TYR 3 HD1 TYR 3 12.397 8.839 20.347 18 HD2 TYR 3 HD2 TYR 3 9.651 10.943 22.824 19 HE1 TYR 3 HE1 TYR 3 14.034 10.655 20.611 20 HE2 TYR 3 HE2 TYR 3 11.279 12.764 23.093 21 HH TYR 3 HH TYR 3 14.523 12.470 22.255 22 H GLY 4 H GLY 4 9.670 5.875 19.078 23 1HA GLY 4 1HA GLY 4 7.622 4.553 20.186 24 2HA GLY 4 2HA GLY 4 6.783 5.559 19.015 25 H HIS 5 H HIS 5 6.160 4.219 17.440 26 HA HIS 5 HA HIS 5 8.120 2.294 16.391 27 1HB HIS 5 1HB HIS 5 5.716 1.648 17.263 28 2HB HIS 5 2HB HIS 5 5.222 2.192 15.663 29 HD1 HIS 5 HD1 HIS 5 7.921 -0.131 17.031 30 HD2 HIS 5 HD2 HIS 5 5.176 0.137 13.923 31 HE1 HIS 5 HE1 HIS 5 8.182 -2.259 15.717 32 HE2 HIS 5 HE2 HIS 5 6.451 -2.113 13.893 33 H GLN 6 H GLN 6 7.674 1.807 13.963 34 HA GLN 6 HA GLN 6 6.742 3.961 12.341 35 1HB GLN 6 1HB GLN 6 9.013 4.746 13.226 36 2HB GLN 6 2HB GLN 6 9.714 3.488 12.218 37 1HG GLN 6 1HG GLN 6 8.031 4.808 10.490 38 2HG GLN 6 2HG GLN 6 8.679 6.103 11.495 39 1HE2 GLN 6 1HE2 GLN 6 9.942 3.110 10.055 40 2HE2 GLN 6 2HE2 GLN 6 11.339 3.839 9.347 41 H SER 7 H SER 7 5.768 2.806 10.816 42 HA SER 7 HA SER 7 7.305 0.988 9.185 43 1HB SER 7 1HB SER 7 5.848 -0.940 9.481 44 2HB SER 7 2HB SER 7 6.525 -0.469 11.041 45 HG SER 7 HG SER 7 4.266 -0.887 11.141 46 H GLY 8 H GLY 8 5.895 0.087 7.373 47 1HA GLY 8 1HA GLY 8 3.481 1.557 6.784 48 2HA GLY 8 2HA GLY 8 4.858 2.040 5.805 49 H ALA 9 H ALA 9 4.492 -1.247 6.900 50 HA ALA 9 HA ALA 9 3.943 -2.047 4.119 51 1HB ALA 9 1HB ALA 9 5.388 -3.779 4.317 52 2HB ALA 9 2HB ALA 9 5.015 -4.040 6.021 53 3HB ALA 9 3HB ALA 9 6.101 -2.734 5.545 54 H VAL 10 H VAL 10 3.058 -4.491 4.217 55 HA VAL 10 HA VAL 10 0.829 -4.553 6.139 56 HB VAL 10 HB VAL 10 0.604 -5.265 3.210 57 1HG1 VAL 10 1HG1 VAL 10 -1.129 -5.661 5.547 58 2HG1 VAL 10 2HG1 VAL 10 -1.082 -6.519 4.007 59 3HG1 VAL 10 3HG1 VAL 10 -1.929 -4.978 4.133 60 1HG2 VAL 10 1HG2 VAL 10 -0.879 -3.000 4.447 61 2HG2 VAL 10 2HG2 VAL 10 -0.367 -3.237 2.775 62 3HG2 VAL 10 3HG2 VAL 10 0.810 -2.763 4.000 63 H TYR 11 H TYR 11 1.198 -6.282 7.386 64 HA TYR 11 HA TYR 11 2.421 -8.672 6.219 65 1HB TYR 11 1HB TYR 11 3.397 -7.840 8.293 66 2HB TYR 11 2HB TYR 11 1.830 -7.905 9.089 67 HD1 TYR 11 HD1 TYR 11 4.868 -9.593 8.577 68 HD2 TYR 11 HD2 TYR 11 0.710 -10.297 9.143 69 HE1 TYR 11 HE1 TYR 11 5.364 -11.877 9.337 70 HE2 TYR 11 HE2 TYR 11 1.195 -12.584 9.900 71 HH TYR 11 HH TYR 11 3.587 -14.243 9.335 72 H VAL 12 H VAL 12 1.112 -10.192 5.445 73 HA VAL 12 HA VAL 12 -1.470 -10.629 6.792 74 HB VAL 12 HB VAL 12 -0.940 -11.101 3.858 75 1HG1 VAL 12 1HG1 VAL 12 -3.285 -11.452 5.659 76 2HG1 VAL 12 2HG1 VAL 12 -2.701 -12.484 4.354 77 3HG1 VAL 12 3HG1 VAL 12 -3.558 -10.989 3.979 78 1HG2 VAL 12 1HG2 VAL 12 -2.837 -9.015 4.406 79 2HG2 VAL 12 2HG2 VAL 12 -1.363 -8.961 3.436 80 3HG2 VAL 12 3HG2 VAL 12 -1.289 -8.645 5.169 81 H GLY 13 H GLY 13 -1.304 -12.432 7.962 82 1HA GLY 13 1HA GLY 13 -0.801 -14.589 8.577 83 2HA GLY 13 2HA GLY 13 -1.150 -14.969 6.900 84 H ASN 14 H ASN 14 0.393 -16.205 6.083 85 HA ASN 14 HA ASN 14 3.114 -16.025 7.087 86 1HB ASN 14 1HB ASN 14 1.841 -17.921 5.106 87 2HB ASN 14 2HB ASN 14 3.503 -18.033 5.677 88 1HD2 ASN 14 1HD2 ASN 14 3.869 -18.491 7.900 89 2HD2 ASN 14 2HD2 ASN 14 2.680 -19.333 8.828 90 H TYR 15 H TYR 15 1.690 -14.076 5.123 91 HA TYR 15 HA TYR 15 3.960 -13.885 3.253 92 1HB TYR 15 1HB TYR 15 1.013 -13.633 2.674 93 2HB TYR 15 2HB TYR 15 2.204 -12.826 1.667 94 HD1 TYR 15 HD1 TYR 15 4.250 -15.243 2.013 95 HD2 TYR 15 HD2 TYR 15 0.188 -14.914 0.818 96 HE1 TYR 15 HE1 TYR 15 4.473 -17.293 0.682 97 HE2 TYR 15 HE2 TYR 15 0.396 -16.963 -0.510 98 HH TYR 15 HH TYR 15 2.596 -19.164 -0.153 99 H LYS 16 H LYS 16 4.622 -11.747 2.799 100 HA LYS 16 HA LYS 16 3.203 -9.594 4.197 101 1HB LYS 16 1HB LYS 16 5.253 -10.595 5.476 102 2HB LYS 16 2HB LYS 16 6.197 -9.685 4.305 103 1HG LYS 16 1HG LYS 16 4.502 -7.765 5.102 104 2HG LYS 16 2HG LYS 16 4.564 -8.743 6.570 105 1HD LYS 16 1HD LYS 16 6.680 -8.138 7.025 106 2HD LYS 16 2HD LYS 16 7.179 -8.261 5.337 107 1HE LYS 16 1HE LYS 16 6.163 -6.093 4.870 108 2HE LYS 16 2HE LYS 16 5.627 -5.973 6.546 109 1HZ LYS 16 1HZ LYS 16 7.670 -4.716 6.105 110 2HZ LYS 16 2HZ LYS 16 8.465 -6.149 5.686 111 3HZ LYS 16 3HZ LYS 16 7.907 -5.922 7.266 112 H VAL 17 H VAL 17 2.699 -8.125 2.684 113 HA VAL 17 HA VAL 17 4.492 -7.854 0.389 114 HB VAL 17 HB VAL 17 2.741 -7.317 -0.926 115 1HG1 VAL 17 1HG1 VAL 17 2.080 -9.301 0.712 116 2HG1 VAL 17 2HG1 VAL 17 0.995 -8.711 -0.547 117 3HG1 VAL 17 3HG1 VAL 17 0.783 -8.178 1.121 118 1HG2 VAL 17 1HG2 VAL 17 1.470 -5.856 1.385 119 2HG2 VAL 17 2HG2 VAL 17 0.781 -5.970 -0.235 120 3HG2 VAL 17 3HG2 VAL 17 2.318 -5.142 0.014 121 H VAL 18 H VAL 18 5.859 -6.244 0.265 122 HA VAL 18 HA VAL 18 5.195 -3.674 1.508 123 HB VAL 18 HB VAL 18 6.671 -4.879 3.076 124 1HG1 VAL 18 1HG1 VAL 18 7.948 -6.314 1.734 125 2HG1 VAL 18 2HG1 VAL 18 9.098 -5.121 2.338 126 3HG1 VAL 18 3HG1 VAL 18 8.486 -4.999 0.689 127 1HG2 VAL 18 1HG2 VAL 18 8.222 -3.100 3.445 128 2HG2 VAL 18 2HG2 VAL 18 6.734 -2.395 2.815 129 3HG2 VAL 18 3HG2 VAL 18 8.130 -2.598 1.757 130 H ASN 19 H ASN 19 6.544 -1.879 0.677 131 HA ASN 19 HA ASN 19 6.654 -1.865 -2.125 132 1HB ASN 19 1HB ASN 19 6.635 0.088 -0.323 133 2HB ASN 19 2HB ASN 19 8.377 0.018 -0.575 134 1HD2 ASN 19 1HD2 ASN 19 5.985 1.844 -1.356 135 2HD2 ASN 19 2HD2 ASN 19 6.327 2.225 -3.006 136 H ARG 20 H ARG 20 8.324 -2.124 -3.584 137 HA ARG 20 HA ARG 20 10.349 -3.939 -2.994 138 1HB ARG 20 1HB ARG 20 10.001 -1.977 -5.250 139 2HB ARG 20 2HB ARG 20 11.386 -3.056 -5.173 140 1HG ARG 20 1HG ARG 20 9.948 -4.986 -5.259 141 2HG ARG 20 2HG ARG 20 8.515 -3.962 -5.180 142 1HD ARG 20 1HD ARG 20 8.555 -4.139 -7.421 143 2HD ARG 20 2HD ARG 20 9.788 -2.885 -7.309 144 HE ARG 20 HE ARG 20 10.738 -5.623 -7.188 145 1HH1 ARG 20 1HH1 ARG 20 10.139 -2.816 -9.179 146 2HH1 ARG 20 2HH1 ARG 20 11.248 -3.305 -10.416 147 1HH2 ARG 20 1HH2 ARG 20 12.193 -6.264 -8.818 148 2HH2 ARG 20 2HH2 ARG 20 12.412 -5.260 -10.213 149 H HIS 21 H HIS 21 10.526 -0.403 -3.293 150 HA HIS 21 HA HIS 21 13.297 -0.236 -2.739 151 1HB HIS 21 1HB HIS 21 11.139 1.579 -3.289 152 2HB HIS 21 2HB HIS 21 12.071 2.175 -1.920 153 HD1 HIS 21 HD1 HIS 21 12.808 0.832 -5.409 154 HD2 HIS 21 HD2 HIS 21 14.189 3.657 -2.693 155 HE1 HIS 21 HE1 HIS 21 14.670 2.043 -6.588 156 HE2 HIS 21 HE2 HIS 21 15.421 3.815 -4.962 157 H LEU 22 H LEU 22 10.746 -1.096 -0.734 158 HA LEU 22 HA LEU 22 12.201 -0.189 1.655 159 1HB LEU 22 1HB LEU 22 9.619 0.348 1.017 160 2HB LEU 22 2HB LEU 22 9.423 -1.109 1.974 161 HG LEU 22 HG LEU 22 11.045 0.253 3.619 162 1HD1 LEU 22 1HD1 LEU 22 9.839 2.247 1.793 163 2HD1 LEU 22 2HD1 LEU 22 11.366 2.290 2.674 164 3HD1 LEU 22 3HD1 LEU 22 9.853 2.628 3.515 165 1HD2 LEU 22 1HD2 LEU 22 8.986 -0.672 4.353 166 2HD2 LEU 22 2HD2 LEU 22 8.054 0.445 3.357 167 3HD2 LEU 22 3HD2 LEU 22 8.947 1.045 4.754 168 H ALA 23 H ALA 23 11.706 -2.933 -0.175 169 HA ALA 23 HA ALA 23 11.424 -4.736 2.091 170 1HB ALA 23 1HB ALA 23 11.893 -6.392 0.025 171 2HB ALA 23 2HB ALA 23 11.266 -4.989 -0.840 172 3HB ALA 23 3HB ALA 23 10.301 -5.751 0.424 173 H THR 24 H THR 24 13.046 -5.705 3.122 174 HA THR 24 HA THR 24 15.753 -5.025 2.491 175 HB THR 24 HB THR 24 16.341 -6.310 4.464 176 HG1 THR 24 HG1 THR 24 13.679 -7.258 4.302 177 1HG2 THR 24 1HG2 THR 24 13.860 -4.659 4.775 178 2HG2 THR 24 2HG2 THR 24 15.532 -4.218 5.124 179 3HG2 THR 24 3HG2 THR 24 14.694 -5.381 6.151 180 H HIS 25 H HIS 25 17.478 -6.690 2.289 181 HA HIS 25 HA HIS 25 17.131 -8.271 0.044 182 1HB HIS 25 1HB HIS 25 19.251 -9.412 0.757 183 2HB HIS 25 2HB HIS 25 19.344 -7.654 0.742 184 HD1 HIS 25 HD1 HIS 25 19.138 -10.565 3.125 185 HD2 HIS 25 HD2 HIS 25 19.910 -6.483 3.176 186 HE1 HIS 25 HE1 HIS 25 19.985 -10.070 5.441 187 HE2 HIS 25 HE2 HIS 25 20.519 -7.608 5.424 188 H VAL 26 H VAL 26 16.505 -9.006 3.389 189 HA VAL 26 HA VAL 26 16.340 -11.831 3.102 190 HB VAL 26 HB VAL 26 14.938 -10.138 5.173 191 1HG1 VAL 26 1HG1 VAL 26 14.799 -12.071 6.482 192 2HG1 VAL 26 2HG1 VAL 26 15.985 -12.931 5.500 193 3HG1 VAL 26 3HG1 VAL 26 14.373 -12.616 4.860 194 1HG2 VAL 26 1HG2 VAL 26 17.748 -11.235 5.179 195 2HG2 VAL 26 2HG2 VAL 26 16.937 -10.522 6.573 196 3HG2 VAL 26 3HG2 VAL 26 17.279 -9.536 5.152 197 H ASP 27 H ASP 27 14.089 -9.186 2.629 198 HA ASP 27 HA ASP 27 11.724 -10.741 2.562 199 1HB ASP 27 1HB ASP 27 12.497 -7.963 1.868 200 2HB ASP 27 2HB ASP 27 11.086 -8.602 1.032 201 H TRP 28 H TRP 28 13.970 -9.550 0.117 202 HA TRP 28 HA TRP 28 12.545 -10.697 -2.048 203 1HB TRP 28 1HB TRP 28 15.417 -9.766 -1.982 204 2HB TRP 28 2HB TRP 28 14.460 -10.076 -3.427 205 HD1 TRP 28 HD1 TRP 28 14.287 -7.739 -0.346 206 HE1 TRP 28 HE1 TRP 28 13.347 -5.479 -1.099 207 HE3 TRP 28 HE3 TRP 28 13.379 -8.846 -5.247 208 HZ2 TRP 28 HZ2 TRP 28 12.331 -4.318 -3.437 209 HZ3 TRP 28 HZ3 TRP 28 12.416 -7.093 -6.682 210 HH2 TRP 28 HH2 TRP 28 11.906 -4.874 -5.796 211 H GLN 29 H GLN 29 15.251 -11.693 -0.052 212 HA GLN 29 HA GLN 29 16.176 -13.868 -1.517 213 1HB GLN 29 1HB GLN 29 16.407 -12.890 1.209 214 2HB GLN 29 2HB GLN 29 16.398 -14.647 1.152 215 1HG GLN 29 1HG GLN 29 18.659 -13.664 1.064 216 2HG GLN 29 2HG GLN 29 18.275 -14.672 -0.330 217 1HE2 GLN 29 1HE2 GLN 29 18.044 -13.733 -2.340 218 2HE2 GLN 29 2HE2 GLN 29 18.537 -12.110 -2.673 219 H ASN 30 H ASN 30 13.573 -13.713 0.882 220 HA ASN 30 HA ASN 30 12.774 -16.438 0.102 221 1HB ASN 30 1HB ASN 30 12.915 -15.077 2.669 222 2HB ASN 30 2HB ASN 30 11.310 -15.741 2.376 223 1HD2 ASN 30 1HD2 ASN 30 14.676 -16.460 2.827 224 2HD2 ASN 30 2HD2 ASN 30 14.487 -18.159 3.085 225 H CYS 31 H CYS 31 12.199 -14.051 -1.417 226 HA CYS 31 HA CYS 31 9.458 -13.344 -0.925 227 1HB CYS 31 1HB CYS 31 10.993 -11.704 -1.878 228 2HB CYS 31 2HB CYS 31 11.251 -12.735 -3.280 229 HG CYS 31 HG CYS 31 8.911 -12.177 -4.118 230 H VAL 32 H VAL 32 7.688 -13.779 -2.237 231 HA VAL 32 HA VAL 32 7.924 -16.245 -3.812 232 HB VAL 32 HB VAL 32 5.444 -16.442 -3.460 233 1HG1 VAL 32 1HG1 VAL 32 5.688 -17.012 -0.974 234 2HG1 VAL 32 2HG1 VAL 32 7.367 -16.503 -1.157 235 3HG1 VAL 32 3HG1 VAL 32 6.742 -17.846 -2.116 236 1HG2 VAL 32 1HG2 VAL 32 5.089 -14.033 -2.939 237 2HG2 VAL 32 2HG2 VAL 32 5.875 -14.303 -1.385 238 3HG2 VAL 32 3HG2 VAL 32 4.367 -15.131 -1.765 239 H TRP 33 H TRP 33 6.523 -12.980 -3.795 240 HA TRP 33 HA TRP 33 6.365 -13.141 -6.719 241 1HB TRP 33 1HB TRP 33 4.127 -13.484 -6.434 242 2HB TRP 33 2HB TRP 33 4.103 -12.723 -4.849 243 HD1 TRP 33 HD1 TRP 33 3.584 -11.961 -8.539 244 HE1 TRP 33 HE1 TRP 33 2.637 -9.576 -8.770 245 HE3 TRP 33 HE3 TRP 33 4.143 -10.399 -3.716 246 HZ2 TRP 33 HZ2 TRP 33 2.188 -7.322 -7.104 247 HZ3 TRP 33 HZ3 TRP 33 3.439 -8.123 -3.114 248 HH2 TRP 33 HH2 TRP 33 2.485 -6.624 -4.783 249 H GLU 34 H GLU 34 6.478 -11.155 -7.823 250 HA GLU 34 HA GLU 34 6.950 -8.727 -6.282 251 1HB GLU 34 1HB GLU 34 8.996 -9.710 -8.278 252 2HB GLU 34 2HB GLU 34 9.093 -8.259 -7.289 253 1HG GLU 34 1HG GLU 34 10.405 -9.584 -6.034 254 2HG GLU 34 2HG GLU 34 8.853 -10.056 -5.350 255 H ASP 35 H ASP 35 5.762 -7.197 -7.217 256 HA ASP 35 HA ASP 35 5.258 -7.375 -10.110 257 1HB ASP 35 1HB ASP 35 3.239 -7.458 -8.735 258 2HB ASP 35 2HB ASP 35 3.684 -5.942 -7.959 259 H TYR 36 H TYR 36 6.723 -6.186 -11.158 260 HA TYR 36 HA TYR 36 8.040 -3.926 -10.115 261 1HB TYR 36 1HB TYR 36 8.897 -3.604 -12.375 262 2HB TYR 36 2HB TYR 36 8.950 -5.309 -11.938 263 HD1 TYR 36 HD1 TYR 36 7.537 -2.829 -14.180 264 HD2 TYR 36 HD2 TYR 36 7.329 -6.892 -12.937 265 HE1 TYR 36 HE1 TYR 36 6.274 -3.381 -16.217 266 HE2 TYR 36 HE2 TYR 36 6.067 -7.456 -14.970 267 HH TYR 36 HH TYR 36 4.765 -5.061 -17.050 268 H ASN 37 H ASN 37 5.045 -4.279 -11.883 269 HA ASN 37 HA ASN 37 4.789 -1.580 -12.691 270 1HB ASN 37 1HB ASN 37 2.776 -3.799 -12.327 271 2HB ASN 37 2HB ASN 37 2.339 -2.200 -12.921 272 1HD2 ASN 37 1HD2 ASN 37 3.393 -1.455 -14.876 273 2HD2 ASN 37 2HD2 ASN 37 3.856 -2.608 -16.076 274 H ARG 38 H ARG 38 4.131 -3.269 -9.717 275 HA ARG 38 HA ARG 38 2.926 -0.804 -8.642 276 1HB ARG 38 1HB ARG 38 1.414 -2.735 -8.584 277 2HB ARG 38 2HB ARG 38 2.600 -3.642 -7.656 278 1HG ARG 38 1HG ARG 38 2.209 -2.458 -5.734 279 2HG ARG 38 2HG ARG 38 1.646 -1.027 -6.601 280 1HD ARG 38 1HD ARG 38 -0.327 -1.842 -5.742 281 2HD ARG 38 2HD ARG 38 -0.309 -2.594 -7.335 282 HE ARG 38 HE ARG 38 0.076 -3.910 -4.768 283 1HH1 ARG 38 1HH1 ARG 38 0.133 -4.164 -8.255 284 2HH1 ARG 38 2HH1 ARG 38 0.063 -5.893 -8.249 285 1HH2 ARG 38 1HH2 ARG 38 -0.012 -6.180 -4.769 286 2HH2 ARG 38 2HH2 ARG 38 -0.022 -7.036 -6.276 287 H ASP 39 H ASP 39 5.815 -2.218 -8.783 288 HA ASP 39 HA ASP 39 7.667 -2.356 -7.450 289 1HB ASP 39 1HB ASP 39 6.333 0.214 -6.678 290 2HB ASP 39 2HB ASP 39 7.791 -0.297 -5.832 291 H LEU 40 H LEU 40 5.556 -3.973 -6.561 292 HA LEU 40 HA LEU 40 6.034 -3.956 -3.656 293 1HB LEU 40 1HB LEU 40 3.766 -3.187 -4.107 294 2HB LEU 40 2HB LEU 40 3.461 -4.601 -5.098 295 HG LEU 40 HG LEU 40 3.875 -5.979 -2.986 296 1HD1 LEU 40 1HD1 LEU 40 4.058 -5.002 -0.952 297 2HD1 LEU 40 2HD1 LEU 40 3.090 -3.603 -1.413 298 3HD1 LEU 40 3HD1 LEU 40 4.779 -3.708 -1.908 299 1HD2 LEU 40 1HD2 LEU 40 1.632 -6.025 -2.603 300 2HD2 LEU 40 2HD2 LEU 40 1.630 -5.112 -4.113 301 3HD2 LEU 40 3HD2 LEU 40 1.488 -4.268 -2.569 302 H LEU 41 H LEU 41 6.146 -5.998 -2.650 303 HA LEU 41 HA LEU 41 6.044 -8.356 -4.343 304 1HB LEU 41 1HB LEU 41 8.234 -9.170 -3.727 305 2HB LEU 41 2HB LEU 41 8.351 -7.655 -4.584 306 HG LEU 41 HG LEU 41 9.647 -8.369 -2.214 307 1HD1 LEU 41 1HD1 LEU 41 10.310 -6.785 -4.036 308 2HD1 LEU 41 2HD1 LEU 41 10.663 -6.237 -2.396 309 3HD1 LEU 41 3HD1 LEU 41 9.281 -5.575 -3.269 310 1HD2 LEU 41 1HD2 LEU 41 7.391 -6.483 -1.628 311 2HD2 LEU 41 2HD2 LEU 41 8.897 -6.440 -0.726 312 3HD2 LEU 41 3HD2 LEU 41 7.914 -7.900 -0.726 313 H VAL 42 H VAL 42 6.030 -10.369 -3.176 314 HA VAL 42 HA VAL 42 5.191 -10.001 -0.382 315 HB VAL 42 HB VAL 42 4.135 -11.911 -2.468 316 1HG1 VAL 42 1HG1 VAL 42 3.581 -12.088 0.494 317 2HG1 VAL 42 2HG1 VAL 42 4.616 -13.198 -0.398 318 3HG1 VAL 42 3HG1 VAL 42 2.898 -13.107 -0.771 319 1HG2 VAL 42 1HG2 VAL 42 3.222 -9.469 -1.362 320 2HG2 VAL 42 2HG2 VAL 42 2.140 -10.747 -0.802 321 3HG2 VAL 42 3HG2 VAL 42 2.412 -10.516 -2.529 322 H SER 43 H SER 43 6.231 -11.064 1.124 323 HA SER 43 HA SER 43 8.058 -13.230 0.335 324 1HB SER 43 1HB SER 43 9.714 -12.447 1.793 325 2HB SER 43 2HB SER 43 9.068 -10.955 1.112 326 HG SER 43 HG SER 43 7.647 -10.964 3.033 327 H THR 44 H THR 44 8.427 -14.857 2.004 328 HA THR 44 HA THR 44 5.980 -15.270 3.542 329 HB THR 44 HB THR 44 6.512 -17.585 3.562 330 HG1 THR 44 HG1 THR 44 9.043 -16.931 2.466 331 1HG2 THR 44 1HG2 THR 44 6.225 -18.053 1.393 332 2HG2 THR 44 2HG2 THR 44 7.593 -17.060 0.884 333 3HG2 THR 44 3HG2 THR 44 6.044 -16.300 1.270 334 H THR 45 H THR 45 5.875 -15.235 5.659 335 HA THR 45 HA THR 45 8.374 -15.166 7.211 336 HB THR 45 HB THR 45 7.760 -12.953 7.382 337 HG1 THR 45 HG1 THR 45 6.056 -14.012 9.377 338 1HG2 THR 45 1HG2 THR 45 5.629 -12.010 7.256 339 2HG2 THR 45 2HG2 THR 45 4.829 -13.540 7.619 340 3HG2 THR 45 3HG2 THR 45 5.612 -13.302 6.057 341 H THR 46 H THR 46 8.105 -15.771 9.492 342 HA THR 46 HA THR 46 5.904 -17.698 9.850 343 HB THR 46 HB THR 46 8.494 -17.997 11.314 344 HG1 THR 46 HG1 THR 46 8.033 -18.761 8.625 345 1HG2 THR 46 1HG2 THR 46 6.573 -20.011 10.172 346 2HG2 THR 46 2HG2 THR 46 6.663 -19.508 11.860 347 3HG2 THR 46 3HG2 THR 46 8.015 -20.367 11.123 348 H ALA 47 H ALA 47 5.129 -15.361 10.608 349 HA ALA 47 HA ALA 47 5.380 -15.387 13.535 350 1HB ALA 47 1HB ALA 47 5.064 -12.728 12.297 351 2HB ALA 47 2HB ALA 47 6.642 -13.492 12.106 352 3HB ALA 47 3HB ALA 47 5.983 -13.219 13.719 353 H HIS 48 H HIS 48 3.663 -13.486 14.270 354 HA HIS 48 HA HIS 48 1.111 -14.457 13.199 355 1HB HIS 48 1HB HIS 48 1.927 -14.358 15.771 356 2HB HIS 48 2HB HIS 48 1.144 -12.786 15.645 357 HD1 HIS 48 HD1 HIS 48 0.211 -15.535 17.185 358 HD2 HIS 48 HD2 HIS 48 -1.425 -13.781 13.792 359 HE1 HIS 48 HE1 HIS 48 -2.159 -16.368 17.074 360 HE2 HIS 48 HE2 HIS 48 -3.102 -15.362 14.965 361 H GLY 49 H GLY 49 -0.001 -13.191 11.874 362 1HA GLY 49 1HA GLY 49 0.768 -10.439 11.478 363 2HA GLY 49 2HA GLY 49 -0.479 -11.312 10.599 364 H CYS 50 H CYS 50 -1.476 -9.097 10.901 365 HA CYS 50 HA CYS 50 -3.376 -9.277 13.069 366 1HB CYS 50 1HB CYS 50 -1.146 -7.842 13.640 367 2HB CYS 50 2HB CYS 50 -2.154 -6.589 12.924 368 HG CYS 50 HG CYS 50 -3.080 -8.217 15.411 369 H ASP 51 H ASP 51 -2.110 -7.267 10.429 370 HA ASP 51 HA ASP 51 -4.502 -5.863 9.927 371 1HB ASP 51 1HB ASP 51 -2.243 -6.501 8.017 372 2HB ASP 51 2HB ASP 51 -3.475 -5.266 7.776 373 H THR 52 H THR 52 -6.180 -6.219 8.523 374 HA THR 52 HA THR 52 -6.257 -8.854 7.206 375 HB THR 52 HB THR 52 -8.547 -7.448 8.594 376 HG1 THR 52 HG1 THR 52 -8.396 -9.241 10.017 377 1HG2 THR 52 1HG2 THR 52 -9.551 -8.670 6.877 378 2HG2 THR 52 2HG2 THR 52 -9.648 -9.714 8.295 379 3HG2 THR 52 3HG2 THR 52 -8.427 -10.016 7.059 380 H ILE 53 H ILE 53 -6.389 -8.660 5.081 381 HA ILE 53 HA ILE 53 -7.158 -6.170 3.848 382 HB ILE 53 HB ILE 53 -6.838 -8.614 2.202 383 1HG1 ILE 53 1HG1 ILE 53 -4.796 -7.609 4.082 384 2HG1 ILE 53 2HG1 ILE 53 -4.958 -9.193 3.335 385 1HG2 ILE 53 1HG2 ILE 53 -5.723 -5.836 1.892 386 2HG2 ILE 53 2HG2 ILE 53 -7.282 -6.366 1.263 387 3HG2 ILE 53 3HG2 ILE 53 -5.796 -7.099 0.664 388 1HD1 ILE 53 1HD1 ILE 53 -3.498 -6.787 2.397 389 2HD1 ILE 53 2HD1 ILE 53 -4.159 -7.895 1.193 390 3HD1 ILE 53 3HD1 ILE 53 -3.013 -8.482 2.396 391 H ALA 54 H ALA 54 -8.980 -5.713 2.718 392 HA ALA 54 HA ALA 54 -11.210 -7.570 3.082 393 1HB ALA 54 1HB ALA 54 -11.425 -5.250 3.906 394 2HB ALA 54 2HB ALA 54 -12.654 -5.676 2.715 395 3HB ALA 54 3HB ALA 54 -11.279 -4.675 2.245 396 H ARG 55 H ARG 55 -12.304 -8.490 1.437 397 HA ARG 55 HA ARG 55 -11.236 -8.144 -1.261 398 1HB ARG 55 1HB ARG 55 -12.238 -10.352 0.199 399 2HB ARG 55 2HB ARG 55 -13.378 -10.065 -1.107 400 1HG ARG 55 1HG ARG 55 -11.328 -10.011 -2.636 401 2HG ARG 55 2HG ARG 55 -10.465 -10.738 -1.280 402 1HD ARG 55 1HD ARG 55 -11.859 -12.651 -1.301 403 2HD ARG 55 2HD ARG 55 -13.015 -11.884 -2.388 404 HE ARG 55 HE ARG 55 -10.683 -13.316 -3.130 405 1HH1 ARG 55 1HH1 ARG 55 -12.636 -10.571 -4.038 406 2HH1 ARG 55 2HH1 ARG 55 -12.185 -10.644 -5.708 407 1HH2 ARG 55 1HH2 ARG 55 -10.088 -13.415 -5.328 408 2HH2 ARG 55 2HH2 ARG 55 -10.740 -12.259 -6.441 409 H CYS 56 H CYS 56 -12.589 -5.976 -0.308 410 HA CYS 56 HA CYS 56 -15.279 -6.040 -1.458 411 1HB CYS 56 1HB CYS 56 -15.479 -3.788 -0.384 412 2HB CYS 56 2HB CYS 56 -15.131 -5.086 0.756 413 H GLN 57 H GLN 57 -15.952 -4.056 -2.655 414 HA GLN 57 HA GLN 57 -13.798 -3.097 -4.421 415 1HB GLN 57 1HB GLN 57 -15.854 -4.685 -5.218 416 2HB GLN 57 2HB GLN 57 -16.557 -3.095 -5.478 417 1HG GLN 57 1HG GLN 57 -14.686 -2.481 -6.901 418 2HG GLN 57 2HG GLN 57 -13.941 -4.053 -6.615 419 1HE2 GLN 57 1HE2 GLN 57 -15.936 -5.800 -6.875 420 2HE2 GLN 57 2HE2 GLN 57 -16.621 -5.736 -8.460 421 H CYS 58 H CYS 58 -14.988 -1.988 -1.915 422 HA CYS 58 HA CYS 58 -16.679 0.179 -2.517 423 1HB CYS 58 1HB CYS 58 -16.249 0.946 -0.298 424 2HB CYS 58 2HB CYS 58 -16.258 -0.811 -0.233 425 H THR 59 H THR 59 -16.298 2.283 -3.035 426 HA THR 59 HA THR 59 -13.650 2.881 -4.088 427 HB THR 59 HB THR 59 -16.012 4.725 -4.262 428 HG1 THR 59 HG1 THR 59 -16.793 2.720 -4.917 429 1HG2 THR 59 1HG2 THR 59 -15.015 4.950 -6.623 430 2HG2 THR 59 2HG2 THR 59 -13.577 4.217 -5.912 431 3HG2 THR 59 3HG2 THR 59 -14.201 5.738 -5.272 432 H THR 60 H THR 60 -14.661 2.995 -1.119 433 HA THR 60 HA THR 60 -13.452 5.622 -0.565 434 HB THR 60 HB THR 60 -14.927 5.904 1.333 435 HG1 THR 60 HG1 THR 60 -16.246 4.367 2.030 436 1HG2 THR 60 1HG2 THR 60 -16.810 5.022 -0.806 437 2HG2 THR 60 2HG2 THR 60 -15.771 6.426 -1.046 438 3HG2 THR 60 3HG2 THR 60 -16.922 6.399 0.290 439 H GLY 61 H GLY 61 -12.416 5.776 1.570 440 1HA GLY 61 1HA GLY 61 -11.897 3.603 3.242 441 2HA GLY 61 2HA GLY 61 -10.646 3.617 2.009 442 H VAL 62 H VAL 62 -10.353 4.026 4.864 443 HA VAL 62 HA VAL 62 -9.563 6.851 4.991 444 HB VAL 62 HB VAL 62 -11.008 6.117 6.811 445 1HG1 VAL 62 1HG1 VAL 62 -10.144 4.450 8.457 446 2HG1 VAL 62 2HG1 VAL 62 -8.860 4.062 7.311 447 3HG1 VAL 62 3HG1 VAL 62 -10.546 3.772 6.879 448 1HG2 VAL 62 1HG2 VAL 62 -9.887 7.629 7.985 449 2HG2 VAL 62 2HG2 VAL 62 -8.381 7.231 7.158 450 3HG2 VAL 62 3HG2 VAL 62 -8.860 6.331 8.595 451 H TYR 63 H TYR 63 -7.466 7.466 5.265 452 HA TYR 63 HA TYR 63 -5.453 5.341 5.566 453 1HB TYR 63 1HB TYR 63 -4.038 6.410 3.897 454 2HB TYR 63 2HB TYR 63 -5.599 6.009 3.196 455 HD1 TYR 63 HD1 TYR 63 -3.805 8.873 4.794 456 HD2 TYR 63 HD2 TYR 63 -6.732 7.624 1.974 457 HE1 TYR 63 HE1 TYR 63 -4.050 11.193 4.033 458 HE2 TYR 63 HE2 TYR 63 -6.982 9.941 1.202 459 HH TYR 63 HH TYR 63 -5.616 12.602 2.894 460 H PHE 64 H PHE 64 -3.176 6.780 5.597 461 HA PHE 64 HA PHE 64 -1.827 8.149 6.800 462 1HB PHE 64 1HB PHE 64 -4.359 9.603 6.834 463 2HB PHE 64 2HB PHE 64 -3.392 9.901 8.272 464 HD1 PHE 64 HD1 PHE 64 -3.060 12.220 7.700 465 HD2 PHE 64 HD2 PHE 64 -1.798 9.121 5.071 466 HE1 PHE 64 HE1 PHE 64 -1.696 13.840 6.450 467 HE2 PHE 64 HE2 PHE 64 -0.430 10.735 3.817 468 HZ PHE 64 HZ PHE 64 -0.377 13.098 4.507 469 H CYS 65 H CYS 65 -4.409 8.542 9.175 470 HA CYS 65 HA CYS 65 -4.688 7.701 11.272 471 1HB CYS 65 1HB CYS 65 -3.582 5.494 9.787 472 2HB CYS 65 2HB CYS 65 -2.965 5.475 11.435 473 HG CYS 65 HG CYS 65 -5.646 5.611 12.083 474 H ALA 66 H ALA 66 -1.295 6.912 10.475 475 HA ALA 66 HA ALA 66 -0.406 7.938 13.022 476 1HB ALA 66 1HB ALA 66 1.537 7.222 10.896 477 2HB ALA 66 2HB ALA 66 0.516 5.941 11.548 478 3HB ALA 66 3HB ALA 66 1.563 6.867 12.624 479 H SER 67 H SER 67 -0.016 8.854 9.609 480 HA SER 67 HA SER 67 1.746 10.945 9.829 481 1HB SER 67 1HB SER 67 -0.299 11.759 8.005 482 2HB SER 67 2HB SER 67 1.289 11.086 7.644 483 HG SER 67 HG SER 67 0.171 9.466 6.908 484 H LYS 68 H LYS 68 -1.763 11.532 9.594 485 HA LYS 68 HA LYS 68 -1.484 14.104 10.848 486 1HB LYS 68 1HB LYS 68 -3.637 12.579 9.524 487 2HB LYS 68 2HB LYS 68 -4.164 13.696 10.775 488 1HG LYS 68 1HG LYS 68 -2.232 14.753 8.813 489 2HG LYS 68 2HG LYS 68 -3.851 14.390 8.212 490 1HD LYS 68 1HD LYS 68 -4.816 15.789 9.977 491 2HD LYS 68 2HD LYS 68 -3.196 16.152 10.574 492 1HE LYS 68 1HE LYS 68 -2.746 17.590 8.882 493 2HE LYS 68 2HE LYS 68 -3.694 16.678 7.709 494 1HZ LYS 68 1HZ LYS 68 -5.683 17.626 8.506 495 2HZ LYS 68 2HZ LYS 68 -4.597 18.914 8.349 496 3HZ LYS 68 3HZ LYS 68 -4.932 18.274 9.877 497 H SER 69 H SER 69 -1.507 11.067 12.112 498 HA SER 69 HA SER 69 -1.615 10.334 14.269 499 1HB SER 69 1HB SER 69 -1.114 12.865 14.757 500 2HB SER 69 2HB SER 69 -2.812 12.909 15.231 501 HG SER 69 HG SER 69 -1.354 12.414 16.970 502 H LYS 70 H LYS 70 -4.091 11.114 12.311 503 HA LYS 70 HA LYS 70 -6.009 9.693 13.993 504 1HB LYS 70 1HB LYS 70 -6.801 12.166 12.452 505 2HB LYS 70 2HB LYS 70 -7.795 11.230 13.557 506 1HG LYS 70 1HG LYS 70 -7.232 12.651 15.154 507 2HG LYS 70 2HG LYS 70 -5.586 12.027 15.064 508 1HD LYS 70 1HD LYS 70 -5.181 14.247 14.694 509 2HD LYS 70 2HD LYS 70 -5.436 13.708 13.033 510 1HE LYS 70 1HE LYS 70 -6.736 15.646 13.225 511 2HE LYS 70 2HE LYS 70 -7.887 14.321 13.394 512 1HZ LYS 70 1HZ LYS 70 -7.100 16.329 15.308 513 2HZ LYS 70 2HZ LYS 70 -7.145 14.763 15.942 514 3HZ LYS 70 3HZ LYS 70 -8.524 15.420 15.216 515 H HIS 71 H HIS 71 -7.976 9.077 12.661 516 HA HIS 71 HA HIS 71 -7.028 7.907 10.183 517 1HB HIS 71 1HB HIS 71 -9.520 7.008 10.251 518 2HB HIS 71 2HB HIS 71 -8.270 6.304 11.270 519 HD1 HIS 71 HD1 HIS 71 -9.391 5.719 13.395 520 HD2 HIS 71 HD2 HIS 71 -10.550 9.465 12.019 521 HE1 HIS 71 HE1 HIS 71 -10.886 6.661 15.185 522 HE2 HIS 71 HE2 HIS 71 -11.641 8.892 14.292 523 H TYR 72 H TYR 72 -7.201 8.945 8.308 524 HA TYR 72 HA TYR 72 -9.282 10.995 8.019 525 1HB TYR 72 1HB TYR 72 -6.540 10.695 7.060 526 2HB TYR 72 2HB TYR 72 -7.656 11.146 5.777 527 HD1 TYR 72 HD1 TYR 72 -8.288 13.380 5.505 528 HD2 TYR 72 HD2 TYR 72 -6.563 12.132 9.195 529 HE1 TYR 72 HE1 TYR 72 -8.178 15.723 6.245 530 HE2 TYR 72 HE2 TYR 72 -6.449 14.471 9.941 531 HH TYR 72 HH TYR 72 -8.011 16.751 9.096 532 HA PRO 73 HA PRO 73 -11.194 7.935 5.298 533 1HB PRO 73 1HB PRO 73 -13.587 9.532 5.352 534 2HB PRO 73 2HB PRO 73 -13.280 7.993 6.159 535 1HG PRO 73 1HG PRO 73 -13.635 10.372 7.479 536 2HG PRO 73 2HG PRO 73 -12.737 8.990 8.133 537 1HD PRO 73 1HD PRO 73 -11.695 11.474 6.814 538 2HD PRO 73 2HD PRO 73 -11.079 10.607 8.242 539 H VAL 74 H VAL 74 -10.752 8.018 3.189 540 HA VAL 74 HA VAL 74 -11.494 10.438 1.694 541 HB VAL 74 HB VAL 74 -8.860 8.975 1.593 542 1HG1 VAL 74 1HG1 VAL 74 -10.043 10.864 -0.413 543 2HG1 VAL 74 2HG1 VAL 74 -9.397 9.242 -0.676 544 3HG1 VAL 74 3HG1 VAL 74 -8.308 10.571 -0.270 545 1HG2 VAL 74 1HG2 VAL 74 -9.763 11.709 2.365 546 2HG2 VAL 74 2HG2 VAL 74 -8.141 11.486 1.707 547 3HG2 VAL 74 3HG2 VAL 74 -8.625 10.628 3.171 548 H SER 75 H SER 75 -12.092 10.155 -0.439 549 HA SER 75 HA SER 75 -12.775 7.402 -1.194 550 1HB SER 75 1HB SER 75 -13.829 10.068 -2.175 551 2HB SER 75 2HB SER 75 -14.301 8.511 -2.854 552 HG SER 75 HG SER 75 -15.806 9.086 -1.313 553 H PHE 76 H PHE 76 -11.734 6.433 -2.845 554 HA PHE 76 HA PHE 76 -10.195 8.129 -4.693 555 1HB PHE 76 1HB PHE 76 -8.742 5.735 -4.408 556 2HB PHE 76 2HB PHE 76 -8.276 7.339 -3.856 557 HD1 PHE 76 HD1 PHE 76 -10.427 4.486 -2.787 558 HD2 PHE 76 HD2 PHE 76 -7.771 7.604 -1.644 559 HE1 PHE 76 HE1 PHE 76 -10.543 3.723 -0.451 560 HE2 PHE 76 HE2 PHE 76 -7.880 6.850 0.687 561 HZ PHE 76 HZ PHE 76 -9.268 4.906 1.289 562 H GLU 77 H GLU 77 -9.372 6.865 -6.579 563 HA GLU 77 HA GLU 77 -11.443 5.001 -7.524 564 1HB GLU 77 1HB GLU 77 -11.170 7.259 -8.702 565 2HB GLU 77 2HB GLU 77 -9.622 6.654 -9.274 566 1HG GLU 77 1HG GLU 77 -10.806 4.754 -10.328 567 2HG GLU 77 2HG GLU 77 -12.335 5.485 -9.842 568 H GLY 78 H GLY 78 -10.664 3.286 -8.982 569 1HA GLY 78 1HA GLY 78 -7.975 2.418 -8.151 570 2HA GLY 78 2HA GLY 78 -9.275 1.349 -8.652 571 HA PRO 79 HA PRO 79 -7.649 3.297 -12.759 572 1HB PRO 79 1HB PRO 79 -5.362 4.769 -12.613 573 2HB PRO 79 2HB PRO 79 -6.979 5.476 -12.519 574 1HG PRO 79 1HG PRO 79 -5.070 4.808 -10.318 575 2HG PRO 79 2HG PRO 79 -6.100 6.238 -10.513 576 1HD PRO 79 1HD PRO 79 -6.753 4.192 -8.868 577 2HD PRO 79 2HD PRO 79 -7.972 5.155 -9.724 578 H GLY 80 H GLY 80 -6.598 1.893 -13.998 579 1HA GLY 80 1HA GLY 80 -4.989 -0.142 -12.957 580 2HA GLY 80 2HA GLY 80 -5.147 0.250 -14.664 581 H LEU 81 H LEU 81 -3.665 1.715 -15.620 582 HA LEU 81 HA LEU 81 -1.108 1.754 -14.221 583 1HB LEU 81 1HB LEU 81 -1.684 1.097 -16.759 584 2HB LEU 81 2HB LEU 81 -1.280 2.791 -16.970 585 HG LEU 81 HG LEU 81 0.754 1.772 -17.307 586 1HD1 LEU 81 1HD1 LEU 81 0.678 2.336 -14.360 587 2HD1 LEU 81 2HD1 LEU 81 1.079 3.468 -15.649 588 3HD1 LEU 81 3HD1 LEU 81 2.148 2.110 -15.303 589 1HD2 LEU 81 1HD2 LEU 81 0.614 -0.451 -16.959 590 2HD2 LEU 81 2HD2 LEU 81 -0.285 -0.266 -15.452 591 3HD2 LEU 81 3HD2 LEU 81 1.464 -0.033 -15.472 592 H VAL 82 H VAL 82 -0.449 3.475 -13.176 593 HA VAL 82 HA VAL 82 -1.305 6.131 -14.113 594 HB VAL 82 HB VAL 82 -0.821 5.349 -11.219 595 1HG1 VAL 82 1HG1 VAL 82 -2.194 7.862 -11.919 596 2HG1 VAL 82 2HG1 VAL 82 -0.471 7.801 -12.290 597 3HG1 VAL 82 3HG1 VAL 82 -1.030 7.520 -10.640 598 1HG2 VAL 82 1HG2 VAL 82 -2.882 4.364 -11.952 599 2HG2 VAL 82 2HG2 VAL 82 -3.375 5.860 -12.744 600 3HG2 VAL 82 3HG2 VAL 82 -3.270 5.788 -10.986 601 H GLU 83 H GLU 83 0.345 7.360 -14.748 602 HA GLU 83 HA GLU 83 3.032 6.468 -14.446 603 1HB GLU 83 1HB GLU 83 1.799 8.032 -16.260 604 2HB GLU 83 2HB GLU 83 2.529 9.276 -15.254 605 1HG GLU 83 1HG GLU 83 4.712 8.020 -15.539 606 2HG GLU 83 2HG GLU 83 3.893 7.096 -16.797 607 H VAL 84 H VAL 84 3.997 6.539 -12.537 608 HA VAL 84 HA VAL 84 3.383 8.487 -10.541 609 HB VAL 84 HB VAL 84 5.533 6.376 -10.725 610 1HG1 VAL 84 1HG1 VAL 84 5.544 6.995 -8.114 611 2HG1 VAL 84 2HG1 VAL 84 5.217 8.589 -8.795 612 3HG1 VAL 84 3HG1 VAL 84 6.661 7.704 -9.281 613 1HG2 VAL 84 1HG2 VAL 84 3.021 5.866 -10.346 614 2HG2 VAL 84 2HG2 VAL 84 3.316 6.487 -8.722 615 3HG2 VAL 84 3HG2 VAL 84 4.222 5.093 -9.312 616 H GLN 85 H GLN 85 4.042 10.513 -10.619 617 HA GLN 85 HA GLN 85 6.220 11.395 -12.249 618 1HB GLN 85 1HB GLN 85 4.849 12.977 -10.074 619 2HB GLN 85 2HB GLN 85 5.688 13.597 -11.490 620 1HG GLN 85 1HG GLN 85 3.725 12.001 -12.572 621 2HG GLN 85 2HG GLN 85 2.933 12.736 -11.179 622 1HE2 GLN 85 1HE2 GLN 85 2.718 14.987 -11.091 623 2HE2 GLN 85 2HE2 GLN 85 2.851 15.967 -12.508 624 H GLU 86 H GLU 86 8.220 12.314 -11.522 625 HA GLU 86 HA GLU 86 9.381 10.890 -9.368 626 1HB GLU 86 1HB GLU 86 10.460 12.019 -11.497 627 2HB GLU 86 2HB GLU 86 10.634 13.392 -10.414 628 1HG GLU 86 1HG GLU 86 11.549 11.160 -8.988 629 2HG GLU 86 2HG GLU 86 12.222 11.019 -10.611 630 H SER 87 H SER 87 8.546 11.244 -7.414 631 HA SER 87 HA SER 87 8.949 13.880 -6.233 632 1HB SER 87 1HB SER 87 6.342 12.429 -5.792 633 2HB SER 87 2HB SER 87 6.752 14.090 -5.364 634 HG SER 87 HG SER 87 6.888 14.515 -7.638 635 H GLU 88 H GLU 88 8.554 13.755 -3.797 636 HA GLU 88 HA GLU 88 9.393 12.934 -1.838 637 1HB GLU 88 1HB GLU 88 7.104 11.740 -2.380 638 2HB GLU 88 2HB GLU 88 8.112 10.308 -2.480 639 1HG GLU 88 1HG GLU 88 8.564 10.288 -0.256 640 2HG GLU 88 2HG GLU 88 8.439 12.040 -0.102 641 H TYR 89 H TYR 89 9.407 9.758 -3.394 642 HA TYR 89 HA TYR 89 12.276 9.767 -3.717 643 1HB TYR 89 1HB TYR 89 12.409 7.609 -2.296 644 2HB TYR 89 2HB TYR 89 12.369 9.157 -1.457 645 HD1 TYR 89 HD1 TYR 89 11.104 9.141 0.463 646 HD2 TYR 89 HD2 TYR 89 9.831 6.773 -2.834 647 HE1 TYR 89 HE1 TYR 89 9.156 8.390 1.761 648 HE2 TYR 89 HE2 TYR 89 7.878 6.018 -1.548 649 HH TYR 89 HH TYR 89 7.176 5.795 0.774 650 H TYR 90 H TYR 90 9.755 9.373 -5.270 651 HA TYR 90 HA TYR 90 10.301 6.672 -6.309 652 1HB TYR 90 1HB TYR 90 7.840 7.912 -5.522 653 2HB TYR 90 2HB TYR 90 7.786 7.588 -7.250 654 HD1 TYR 90 HD1 TYR 90 7.309 5.441 -8.033 655 HD2 TYR 90 HD2 TYR 90 8.464 5.964 -3.972 656 HE1 TYR 90 HE1 TYR 90 6.756 3.089 -7.579 657 HE2 TYR 90 HE2 TYR 90 7.917 3.612 -3.508 658 HH TYR 90 HH TYR 90 6.080 1.827 -4.973 659 HA PRO 91 HA PRO 91 11.814 9.041 -9.835 660 1HB PRO 91 1HB PRO 91 11.901 6.359 -11.082 661 2HB PRO 91 2HB PRO 91 13.193 7.546 -10.876 662 1HG PRO 91 1HG PRO 91 13.117 5.311 -9.411 663 2HG PRO 91 2HG PRO 91 13.671 6.849 -8.723 664 1HD PRO 91 1HD PRO 91 11.034 5.467 -8.399 665 2HD PRO 91 2HD PRO 91 12.005 6.342 -7.197 666 H LYS 92 H LYS 92 10.965 9.700 -11.798 667 HA LYS 92 HA LYS 92 8.214 9.451 -12.208 668 1HB LYS 92 1HB LYS 92 9.505 11.339 -13.061 669 2HB LYS 92 2HB LYS 92 10.362 10.275 -14.167 670 1HG LYS 92 1HG LYS 92 8.833 10.810 -15.681 671 2HG LYS 92 2HG LYS 92 7.698 9.826 -14.754 672 1HD LYS 92 1HD LYS 92 6.486 11.643 -14.341 673 2HD LYS 92 2HD LYS 92 7.855 12.348 -13.480 674 1HE LYS 92 1HE LYS 92 7.507 12.504 -16.468 675 2HE LYS 92 2HE LYS 92 6.923 13.740 -15.356 676 1HZ LYS 92 1HZ LYS 92 9.353 13.723 -14.525 677 2HZ LYS 92 2HZ LYS 92 8.981 14.537 -15.960 678 3HZ LYS 92 3HZ LYS 92 9.695 13.005 -16.019 679 H ARG 93 H ARG 93 7.922 7.113 -12.108 680 HA ARG 93 HA ARG 93 8.440 5.833 -14.714 681 1HB ARG 93 1HB ARG 93 9.617 5.024 -12.444 682 2HB ARG 93 2HB ARG 93 8.122 4.106 -12.327 683 1HG ARG 93 1HG ARG 93 8.708 2.700 -13.968 684 2HG ARG 93 2HG ARG 93 9.415 3.983 -14.953 685 1HD ARG 93 1HD ARG 93 10.885 3.326 -12.490 686 2HD ARG 93 2HD ARG 93 10.841 2.048 -13.705 687 HE ARG 93 HE ARG 93 11.555 4.624 -14.761 688 1HH1 ARG 93 1HH1 ARG 93 12.758 1.724 -13.238 689 2HH1 ARG 93 2HH1 ARG 93 14.367 1.922 -13.846 690 1HH2 ARG 93 1HH2 ARG 93 13.671 4.887 -15.563 691 2HH2 ARG 93 2HH2 ARG 93 14.886 3.717 -15.166 692 H TYR 94 H TYR 94 7.008 3.706 -14.787 693 HA TYR 94 HA TYR 94 4.250 4.633 -14.556 694 1HB TYR 94 1HB TYR 94 5.676 2.595 -16.200 695 2HB TYR 94 2HB TYR 94 3.968 2.334 -15.868 696 HD1 TYR 94 HD1 TYR 94 6.324 4.909 -17.166 697 HD2 TYR 94 HD2 TYR 94 2.368 3.352 -17.213 698 HE1 TYR 94 HE1 TYR 94 5.744 6.454 -18.984 699 HE2 TYR 94 HE2 TYR 94 1.773 4.892 -19.030 700 HH TYR 94 HH TYR 94 3.817 7.481 -19.988 701 H GLN 95 H GLN 95 2.792 3.782 -13.173 702 HA GLN 95 HA GLN 95 3.533 1.334 -11.723 703 1HB GLN 95 1HB GLN 95 3.938 3.430 -10.383 704 2HB GLN 95 2HB GLN 95 2.203 3.716 -10.436 705 1HG GLN 95 1HG GLN 95 2.514 1.081 -9.549 706 2HG GLN 95 2HG GLN 95 3.722 2.030 -8.686 707 1HE2 GLN 95 1HE2 GLN 95 1.528 0.785 -7.471 708 2HE2 GLN 95 2HE2 GLN 95 0.495 2.009 -6.827 709 H SER 96 H SER 96 2.012 -0.208 -11.867 710 HA SER 96 HA SER 96 -0.670 0.582 -12.744 711 1HB SER 96 1HB SER 96 0.737 -1.222 -13.916 712 2HB SER 96 2HB SER 96 0.334 -2.248 -12.539 713 HG SER 96 HG SER 96 -1.410 -2.644 -13.640 714 H HIS 97 H HIS 97 -2.543 -0.557 -11.862 715 HA HIS 97 HA HIS 97 -3.948 -1.008 -10.136 716 1HB HIS 97 1HB HIS 97 -1.577 -2.461 -8.951 717 2HB HIS 97 2HB HIS 97 -3.279 -2.754 -8.608 718 HD1 HIS 97 HD1 HIS 97 -3.606 -2.385 -11.979 719 HD2 HIS 97 HD2 HIS 97 -1.659 -5.276 -9.716 720 HE1 HIS 97 HE1 HIS 97 -3.431 -4.402 -13.471 721 HE2 HIS 97 HE2 HIS 97 -2.176 -6.109 -12.109 722 H VAL 98 H VAL 98 -3.236 1.499 -9.853 723 HA VAL 98 HA VAL 98 -2.557 1.745 -6.991 724 HB VAL 98 HB VAL 98 -0.738 2.602 -8.444 725 1HG1 VAL 98 1HG1 VAL 98 -2.937 3.952 -9.737 726 2HG1 VAL 98 2HG1 VAL 98 -1.278 3.708 -10.284 727 3HG1 VAL 98 3HG1 VAL 98 -1.672 5.083 -9.247 728 1HG2 VAL 98 1HG2 VAL 98 -0.912 5.047 -7.427 729 2HG2 VAL 98 2HG2 VAL 98 -0.549 3.633 -6.434 730 3HG2 VAL 98 3HG2 VAL 98 -2.191 4.277 -6.485 731 H LEU 99 H LEU 99 -3.804 3.057 -5.741 732 HA LEU 99 HA LEU 99 -6.229 4.120 -7.002 733 1HB LEU 99 1HB LEU 99 -5.576 3.107 -4.271 734 2HB LEU 99 2HB LEU 99 -6.859 4.289 -4.442 735 HG LEU 99 HG LEU 99 -8.007 2.766 -6.030 736 1HD1 LEU 99 1HD1 LEU 99 -5.917 1.575 -6.723 737 2HD1 LEU 99 2HD1 LEU 99 -7.282 0.523 -6.346 738 3HD1 LEU 99 3HD1 LEU 99 -5.971 0.720 -5.183 739 1HD2 LEU 99 1HD2 LEU 99 -8.737 1.142 -4.340 740 2HD2 LEU 99 2HD2 LEU 99 -8.637 2.777 -3.686 741 3HD2 LEU 99 3HD2 LEU 99 -7.373 1.603 -3.322 742 H LEU 100 H LEU 100 -6.811 6.272 -6.799 743 HA LEU 100 HA LEU 100 -4.962 7.975 -5.280 744 1HB LEU 100 1HB LEU 100 -5.420 7.953 -8.158 745 2HB LEU 100 2HB LEU 100 -5.617 9.543 -7.444 746 HG LEU 100 HG LEU 100 -3.158 7.804 -7.191 747 1HD1 LEU 100 1HD1 LEU 100 -3.713 8.900 -9.446 748 2HD1 LEU 100 2HD1 LEU 100 -2.111 9.161 -8.754 749 3HD1 LEU 100 3HD1 LEU 100 -3.340 10.421 -8.633 750 1HD2 LEU 100 1HD2 LEU 100 -4.017 9.722 -5.439 751 2HD2 LEU 100 2HD2 LEU 100 -2.985 10.646 -6.528 752 3HD2 LEU 100 3HD2 LEU 100 -2.338 9.241 -5.682 753 H ALA 101 H ALA 101 -5.773 9.769 -4.327 754 HA ALA 101 HA ALA 101 -8.490 10.646 -4.837 755 1HB ALA 101 1HB ALA 101 -8.958 8.922 -3.245 756 2HB ALA 101 2HB ALA 101 -9.116 10.475 -2.438 757 3HB ALA 101 3HB ALA 101 -7.676 9.489 -2.172 758 H THR 102 H THR 102 -8.893 12.749 -4.086 759 HA THR 102 HA THR 102 -6.474 14.183 -3.267 760 HB THR 102 HB THR 102 -7.313 15.170 -5.210 761 HG1 THR 102 HG1 THR 102 -6.966 16.702 -3.522 762 1HG2 THR 102 1HG2 THR 102 -9.868 16.027 -4.937 763 2HG2 THR 102 2HG2 THR 102 -9.944 14.454 -4.144 764 3HG2 THR 102 3HG2 THR 102 -9.381 14.576 -5.811 765 H GLY 103 H GLY 103 -6.235 14.703 -1.221 766 1HA GLY 103 1HA GLY 103 -8.499 14.613 0.602 767 2HA GLY 103 2HA GLY 103 -6.809 14.806 1.038 768 H PHE 104 H PHE 104 -7.135 16.995 -1.311 769 HA PHE 104 HA PHE 104 -7.434 19.245 -1.423 770 1HB PHE 104 1HB PHE 104 -9.272 18.876 0.953 771 2HB PHE 104 2HB PHE 104 -9.173 20.305 -0.070 772 HD1 PHE 104 HD1 PHE 104 -9.901 20.165 -2.445 773 HD2 PHE 104 HD2 PHE 104 -10.559 17.002 0.325 774 HE1 PHE 104 HE1 PHE 104 -11.609 19.215 -3.940 775 HE2 PHE 104 HE2 PHE 104 -12.267 16.046 -1.165 776 HZ PHE 104 HZ PHE 104 -12.794 17.153 -3.302 777 H SER 105 H SER 105 -7.638 18.669 2.090 778 HA SER 105 HA SER 105 -5.344 20.482 2.420 779 1HB SER 105 1HB SER 105 -7.784 20.732 3.554 780 2HB SER 105 2HB SER 105 -6.977 19.760 4.784 781 HG SER 105 HG SER 105 -5.930 22.166 3.707 782 H GLU 106 H GLU 106 -3.727 18.928 2.116 783 HA GLU 106 HA GLU 106 -3.550 16.898 4.245 784 1HB GLU 106 1HB GLU 106 -2.656 16.809 1.372 785 2HB GLU 106 2HB GLU 106 -1.984 15.721 2.580 786 1HG GLU 106 1HG GLU 106 -3.780 14.410 2.556 787 2HG GLU 106 2HG GLU 106 -4.887 15.780 2.619 788 HA PRO 107 HA PRO 107 0.055 18.920 5.804 789 1HB PRO 107 1HB PRO 107 1.172 16.192 6.178 790 2HB PRO 107 2HB PRO 107 0.941 17.486 7.359 791 1HG PRO 107 1HG PRO 107 -0.660 15.353 7.333 792 2HG PRO 107 2HG PRO 107 -1.294 16.971 7.684 793 1HD PRO 107 1HD PRO 107 -1.494 15.358 5.176 794 2HD PRO 107 2HD PRO 107 -2.694 16.429 5.930 795 H GLY 108 H GLY 108 1.103 15.902 4.207 796 1HA GLY 108 1HA GLY 108 2.121 16.576 1.877 797 2HA GLY 108 2HA GLY 108 3.272 17.390 2.926 798 H ASP 109 H ASP 109 3.035 15.237 4.963 799 HA ASP 109 HA ASP 109 4.821 13.324 3.632 800 1HB ASP 109 1HB ASP 109 5.573 12.751 5.927 801 2HB ASP 109 2HB ASP 109 5.813 14.452 5.539 802 H ALA 110 H ALA 110 4.451 11.147 3.664 803 HA ALA 110 HA ALA 110 2.105 10.145 5.099 804 1HB ALA 110 1HB ALA 110 1.516 10.797 2.711 805 2HB ALA 110 2HB ALA 110 1.106 9.157 3.213 806 3HB ALA 110 3HB ALA 110 2.527 9.443 2.208 807 H GLY 111 H GLY 111 2.017 7.746 5.119 808 1HA GLY 111 1HA GLY 111 4.002 6.030 4.270 809 2HA GLY 111 2HA GLY 111 4.581 6.685 5.794 810 H GLY 112 H GLY 112 1.614 5.263 4.410 811 1HA GLY 112 1HA GLY 112 1.542 3.295 6.524 812 2HA GLY 112 2HA GLY 112 0.269 4.501 6.633 813 H ILE 113 H ILE 113 -0.662 2.081 6.419 814 HA ILE 113 HA ILE 113 -1.104 1.460 3.595 815 HB ILE 113 HB ILE 113 -2.095 -0.629 4.352 816 1HG1 ILE 113 1HG1 ILE 113 -1.589 -0.961 6.994 817 2HG1 ILE 113 2HG1 ILE 113 -2.012 0.748 6.971 818 1HG2 ILE 113 1HG2 ILE 113 -0.065 -1.559 5.559 819 2HG2 ILE 113 2HG2 ILE 113 0.579 0.082 5.520 820 3HG2 ILE 113 3HG2 ILE 113 0.229 -0.763 4.013 821 1HD1 ILE 113 1HD1 ILE 113 -3.689 -1.615 6.232 822 2HD1 ILE 113 2HD1 ILE 113 -4.087 0.006 5.662 823 3HD1 ILE 113 3HD1 ILE 113 -4.023 -0.329 7.392 824 H LEU 114 H LEU 114 -3.161 1.365 2.667 825 HA LEU 114 HA LEU 114 -5.108 3.111 3.931 826 1HB LEU 114 1HB LEU 114 -4.697 3.529 1.615 827 2HB LEU 114 2HB LEU 114 -4.949 1.843 1.201 828 HG LEU 114 HG LEU 114 -7.339 2.084 1.846 829 1HD1 LEU 114 1HD1 LEU 114 -7.197 5.019 1.715 830 2HD1 LEU 114 2HD1 LEU 114 -6.577 4.287 3.195 831 3HD1 LEU 114 3HD1 LEU 114 -8.233 3.969 2.681 832 1HD2 LEU 114 1HD2 LEU 114 -6.138 2.706 -0.492 833 2HD2 LEU 114 2HD2 LEU 114 -6.986 4.214 -0.150 834 3HD2 LEU 114 3HD2 LEU 114 -7.884 2.699 -0.246 835 H ARG 115 H ARG 115 -6.525 2.289 5.291 836 HA ARG 115 HA ARG 115 -7.657 -0.371 4.726 837 1HB ARG 115 1HB ARG 115 -8.036 -0.535 7.202 838 2HB ARG 115 2HB ARG 115 -6.347 -0.550 6.712 839 1HG ARG 115 1HG ARG 115 -5.947 1.569 7.548 840 2HG ARG 115 2HG ARG 115 -7.654 2.014 7.512 841 1HD ARG 115 1HD ARG 115 -7.656 1.560 9.699 842 2HD ARG 115 2HD ARG 115 -7.618 -0.137 9.221 843 HE ARG 115 HE ARG 115 -4.991 0.725 9.262 844 1HH1 ARG 115 1HH1 ARG 115 -7.614 0.404 11.542 845 2HH1 ARG 115 2HH1 ARG 115 -6.570 0.135 12.897 846 1HH2 ARG 115 1HH2 ARG 115 -3.615 0.372 11.043 847 2HH2 ARG 115 2HH2 ARG 115 -4.300 0.117 12.615 848 H CYS 116 H CYS 116 -9.839 -0.602 4.745 849 HA CYS 116 HA CYS 116 -11.434 1.821 5.250 850 1HB CYS 116 1HB CYS 116 -13.099 0.892 3.691 851 2HB CYS 116 2HB CYS 116 -11.535 1.085 2.907 852 H GLU 117 H GLU 117 -13.853 1.080 5.706 853 HA GLU 117 HA GLU 117 -13.890 -0.068 8.242 854 1HB GLU 117 1HB GLU 117 -16.120 0.187 6.221 855 2HB GLU 117 2HB GLU 117 -16.357 -0.250 7.907 856 1HG GLU 117 1HG GLU 117 -14.801 2.168 7.657 857 2HG GLU 117 2HG GLU 117 -16.348 2.302 6.821 858 H HIS 118 H HIS 118 -13.766 -1.582 5.164 859 HA HIS 118 HA HIS 118 -14.784 -4.119 6.145 860 1HB HIS 118 1HB HIS 118 -13.610 -3.522 3.428 861 2HB HIS 118 2HB HIS 118 -14.632 -4.883 3.878 862 HD2 HIS 118 HD2 HIS 118 -17.343 -3.905 4.721 863 HE1 HIS 118 HE1 HIS 118 -17.091 -0.685 1.966 864 HE2 HIS 118 HE2 HIS 118 -18.602 -2.011 3.488 865 H GLY 119 H GLY 119 -11.688 -2.642 5.303 866 1HA GLY 119 1HA GLY 119 -10.072 -4.120 6.899 867 2HA GLY 119 2HA GLY 119 -10.257 -5.153 5.492 868 H VAL 120 H VAL 120 -8.069 -5.027 4.987 869 HA VAL 120 HA VAL 120 -6.821 -2.464 4.496 870 HB VAL 120 HB VAL 120 -5.680 -5.149 3.748 871 1HG1 VAL 120 1HG1 VAL 120 -3.735 -4.092 3.417 872 2HG1 VAL 120 2HG1 VAL 120 -3.980 -2.986 4.769 873 3HG1 VAL 120 3HG1 VAL 120 -4.759 -2.672 3.218 874 1HG2 VAL 120 1HG2 VAL 120 -6.454 -4.477 6.318 875 2HG2 VAL 120 2HG2 VAL 120 -4.737 -4.081 6.275 876 3HG2 VAL 120 3HG2 VAL 120 -5.277 -5.709 5.865 877 H ILE 121 H ILE 121 -6.472 -1.494 2.567 878 HA ILE 121 HA ILE 121 -7.560 -2.838 0.182 879 HB ILE 121 HB ILE 121 -7.236 0.117 0.722 880 1HG1 ILE 121 1HG1 ILE 121 -9.766 0.031 0.473 881 2HG1 ILE 121 2HG1 ILE 121 -9.624 -1.722 0.596 882 1HG2 ILE 121 1HG2 ILE 121 -7.060 0.238 -1.515 883 2HG2 ILE 121 2HG2 ILE 121 -8.801 -0.046 -1.484 884 3HG2 ILE 121 3HG2 ILE 121 -7.693 -1.391 -1.757 885 1HD1 ILE 121 1HD1 ILE 121 -9.501 -1.613 2.790 886 2HD1 ILE 121 2HD1 ILE 121 -9.848 0.113 2.672 887 3HD1 ILE 121 3HD1 ILE 121 -8.179 -0.450 2.717 888 H GLY 122 H GLY 122 -4.932 -0.669 1.253 889 1HA GLY 122 1HA GLY 122 -3.037 -2.052 -0.387 890 2HA GLY 122 2HA GLY 122 -3.491 -0.508 -1.086 891 H LEU 123 H LEU 123 -1.062 -0.331 -0.763 892 HA LEU 123 HA LEU 123 -0.514 0.772 1.913 893 1HB LEU 123 1HB LEU 123 1.908 0.290 1.358 894 2HB LEU 123 2HB LEU 123 0.891 -1.097 1.694 895 HG LEU 123 HG LEU 123 1.221 -0.284 -1.149 896 1HD1 LEU 123 1HD1 LEU 123 3.367 -0.943 -1.395 897 2HD1 LEU 123 2HD1 LEU 123 3.273 -2.118 -0.083 898 3HD1 LEU 123 3HD1 LEU 123 3.484 -0.406 0.281 899 1HD2 LEU 123 1HD2 LEU 123 -0.259 -2.142 -0.410 900 2HD2 LEU 123 2HD2 LEU 123 1.171 -2.983 0.189 901 3HD2 LEU 123 3HD2 LEU 123 1.007 -2.639 -1.533 902 H VAL 124 H VAL 124 1.165 2.504 1.917 903 HA VAL 124 HA VAL 124 0.413 4.617 0.243 904 HB VAL 124 HB VAL 124 1.418 4.962 2.454 905 1HG1 VAL 124 1HG1 VAL 124 3.264 3.120 1.738 906 2HG1 VAL 124 2HG1 VAL 124 3.463 4.254 3.073 907 3HG1 VAL 124 3HG1 VAL 124 4.178 4.609 1.501 908 1HG2 VAL 124 1HG2 VAL 124 3.326 6.292 0.600 909 2HG2 VAL 124 2HG2 VAL 124 2.386 6.968 1.930 910 3HG2 VAL 124 3HG2 VAL 124 1.602 6.598 0.394 911 H THR 125 H THR 125 0.895 5.029 -1.807 912 HA THR 125 HA THR 125 3.394 3.925 -2.906 913 HB THR 125 HB THR 125 0.692 4.286 -4.200 914 HG1 THR 125 HG1 THR 125 2.408 2.100 -3.713 915 1HG2 THR 125 1HG2 THR 125 1.576 4.546 -6.205 916 2HG2 THR 125 2HG2 THR 125 2.469 3.038 -5.997 917 3HG2 THR 125 3HG2 THR 125 3.198 4.567 -5.510 918 H MET 126 H MET 126 1.416 6.143 -4.780 919 HA MET 126 HA MET 126 3.637 8.021 -4.749 920 1HB MET 126 1HB MET 126 1.592 7.310 -6.610 921 2HB MET 126 2HB MET 126 1.457 9.031 -6.275 922 1HG MET 126 1HG MET 126 4.045 7.710 -7.037 923 2HG MET 126 2HG MET 126 2.921 8.380 -8.216 924 1HE MET 126 1HE MET 126 6.387 10.042 -7.069 925 2HE MET 126 2HE MET 126 5.737 8.579 -6.329 926 3HE MET 126 3HE MET 126 5.810 10.080 -5.400 927 H GLY 127 H GLY 127 3.209 10.368 -4.509 928 1HA GLY 127 1HA GLY 127 0.902 11.025 -2.836 929 2HA GLY 127 2HA GLY 127 2.499 11.259 -2.140 930 H GLY 128 H GLY 128 0.156 12.425 -4.422 931 1HA GLY 128 1HA GLY 128 1.846 14.421 -5.597 932 2HA GLY 128 2HA GLY 128 0.098 14.319 -5.742 933 H GLU 129 H GLU 129 0.751 16.769 -5.573 934 HA GLU 129 HA GLU 129 1.278 17.777 -2.958 935 1HB GLU 129 1HB GLU 129 0.025 19.293 -5.246 936 2HB GLU 129 2HB GLU 129 0.941 19.950 -3.897 937 1HG GLU 129 1HG GLU 129 2.964 18.893 -4.732 938 2HG GLU 129 2HG GLU 129 2.054 18.182 -6.065 939 H GLY 130 H GLY 130 -1.552 16.678 -4.556 940 1HA GLY 130 1HA GLY 130 -3.144 17.534 -2.245 941 2HA GLY 130 2HA GLY 130 -3.718 17.943 -3.852 942 H VAL 131 H VAL 131 -2.316 15.076 -4.401 943 HA VAL 131 HA VAL 131 -4.766 13.590 -3.730 944 HB VAL 131 HB VAL 131 -3.047 12.589 -5.926 945 1HG1 VAL 131 1HG1 VAL 131 -5.199 11.964 -6.878 946 2HG1 VAL 131 2HG1 VAL 131 -6.031 12.826 -5.583 947 3HG1 VAL 131 3HG1 VAL 131 -5.059 11.403 -5.213 948 1HG2 VAL 131 1HG2 VAL 131 -3.155 15.029 -6.356 949 2HG2 VAL 131 2HG2 VAL 131 -4.915 14.914 -6.359 950 3HG2 VAL 131 3HG2 VAL 131 -3.973 14.066 -7.586 951 H VAL 132 H VAL 132 -4.530 11.300 -3.321 952 HA VAL 132 HA VAL 132 -1.919 10.662 -2.115 953 HB VAL 132 HB VAL 132 -3.068 9.264 -0.518 954 1HG1 VAL 132 1HG1 VAL 132 -3.654 10.971 0.813 955 2HG1 VAL 132 2HG1 VAL 132 -4.873 11.561 -0.317 956 3HG1 VAL 132 3HG1 VAL 132 -3.177 11.985 -0.548 957 1HG2 VAL 132 1HG2 VAL 132 -4.865 8.280 -1.606 958 2HG2 VAL 132 2HG2 VAL 132 -5.461 9.819 -2.230 959 3HG2 VAL 132 3HG2 VAL 132 -5.658 9.424 -0.521 960 H GLY 133 H GLY 133 -0.791 9.151 -3.152 961 1HA GLY 133 1HA GLY 133 -2.183 7.297 -4.950 962 2HA GLY 133 2HA GLY 133 -0.454 7.614 -4.930 963 H PHE 134 H PHE 134 -2.706 5.330 -4.259 964 HA PHE 134 HA PHE 134 -0.963 4.048 -2.257 965 1HB PHE 134 1HB PHE 134 -3.969 3.775 -2.459 966 2HB PHE 134 2HB PHE 134 -2.933 2.990 -1.273 967 HD1 PHE 134 HD1 PHE 134 -1.142 5.327 -0.644 968 HD2 PHE 134 HD2 PHE 134 -5.367 5.032 -1.064 969 HE1 PHE 134 HE1 PHE 134 -1.424 7.238 0.878 970 HE2 PHE 134 HE2 PHE 134 -5.655 6.944 0.454 971 HZ PHE 134 HZ PHE 134 -3.683 8.050 1.429 972 H ALA 135 H ALA 135 -0.546 1.872 -2.489 973 HA ALA 135 HA ALA 135 -1.120 0.758 -5.127 974 1HB ALA 135 1HB ALA 135 0.929 0.266 -3.032 975 2HB ALA 135 2HB ALA 135 1.113 0.440 -4.776 976 3HB ALA 135 3HB ALA 135 0.500 -1.071 -4.101 977 H ASP 136 H ASP 136 -2.899 -0.430 -5.319 978 HA ASP 136 HA ASP 136 -4.334 -1.471 -3.118 979 1HB ASP 136 1HB ASP 136 -4.946 -0.911 -5.708 980 2HB ASP 136 2HB ASP 136 -4.891 -2.671 -5.750 981 H VAL 137 H VAL 137 -4.378 -3.398 -2.166 982 HA VAL 137 HA VAL 137 -2.435 -5.416 -3.018 983 HB VAL 137 HB VAL 137 -4.015 -5.272 -0.442 984 1HG1 VAL 137 1HG1 VAL 137 -3.434 -7.504 -0.662 985 2HG1 VAL 137 2HG1 VAL 137 -2.081 -6.849 0.262 986 3HG1 VAL 137 3HG1 VAL 137 -1.911 -7.135 -1.470 987 1HG2 VAL 137 1HG2 VAL 137 -1.970 -3.603 -1.194 988 2HG2 VAL 137 2HG2 VAL 137 -1.130 -4.868 -0.297 989 3HG2 VAL 137 3HG2 VAL 137 -2.442 -3.969 0.466 990 H ARG 138 H ARG 138 -5.537 -4.726 -3.664 991 HA ARG 138 HA ARG 138 -6.823 -7.225 -3.220 992 1HB ARG 138 1HB ARG 138 -7.522 -4.881 -4.990 993 2HB ARG 138 2HB ARG 138 -8.557 -6.284 -4.774 994 1HG ARG 138 1HG ARG 138 -8.130 -5.593 -2.195 995 2HG ARG 138 2HG ARG 138 -8.051 -4.012 -2.974 996 1HD ARG 138 1HD ARG 138 -10.280 -5.887 -3.642 997 2HD ARG 138 2HD ARG 138 -10.337 -4.961 -2.145 998 HE ARG 138 HE ARG 138 -10.519 -2.986 -3.386 999 1HH1 ARG 138 1HH1 ARG 138 -10.295 -5.787 -5.470 1000 2HH1 ARG 138 2HH1 ARG 138 -10.858 -4.939 -6.868 1001 1HH2 ARG 138 1HH2 ARG 138 -11.257 -1.882 -5.229 1002 2HH2 ARG 138 2HH2 ARG 138 -11.403 -2.727 -6.734 1003 H ASP 139 H ASP 139 -4.405 -6.368 -5.354 1004 HA ASP 139 HA ASP 139 -5.337 -8.101 -7.513 1005 1HB ASP 139 1HB ASP 139 -3.732 -5.788 -7.419 1006 2HB ASP 139 2HB ASP 139 -2.661 -7.101 -7.899 1007 H LEU 140 H LEU 140 -3.961 -8.636 -4.640 1008 HA LEU 140 HA LEU 140 -2.931 -11.181 -5.399 1009 1HB LEU 140 1HB LEU 140 -0.644 -10.884 -4.591 1010 2HB LEU 140 2HB LEU 140 -0.971 -9.880 -5.984 1011 HG LEU 140 HG LEU 140 0.122 -8.320 -4.778 1012 1HD1 LEU 140 1HD1 LEU 140 -2.106 -7.386 -4.840 1013 2HD1 LEU 140 2HD1 LEU 140 -1.295 -6.941 -3.338 1014 3HD1 LEU 140 3HD1 LEU 140 -2.513 -8.214 -3.338 1015 1HD2 LEU 140 1HD2 LEU 140 -0.667 -9.016 -2.051 1016 2HD2 LEU 140 2HD2 LEU 140 0.925 -8.664 -2.724 1017 3HD2 LEU 140 3HD2 LEU 140 0.229 -10.274 -2.903 1018 H LEU 141 H LEU 141 -4.958 -10.901 -3.885 1019 HA LEU 141 HA LEU 141 -4.444 -10.449 -1.130 1020 1HB LEU 141 1HB LEU 141 -6.700 -10.757 -2.745 1021 2HB LEU 141 2HB LEU 141 -6.776 -12.072 -1.588 1022 HG LEU 141 HG LEU 141 -7.951 -10.398 -0.513 1023 1HD1 LEU 141 1HD1 LEU 141 -5.476 -11.078 0.539 1024 2HD1 LEU 141 2HD1 LEU 141 -6.845 -10.391 1.404 1025 3HD1 LEU 141 3HD1 LEU 141 -5.592 -9.333 0.752 1026 1HD2 LEU 141 1HD2 LEU 141 -7.616 -8.600 -2.043 1027 2HD2 LEU 141 2HD2 LEU 141 -5.918 -8.459 -1.587 1028 3HD2 LEU 141 3HD2 LEU 141 -7.179 -8.027 -0.433 1029 H TRP 142 H TRP 142 -3.829 -13.149 -3.122 1030 HA TRP 142 HA TRP 142 -4.352 -15.300 -1.466 1031 1HB TRP 142 1HB TRP 142 -2.485 -16.470 -2.618 1032 2HB TRP 142 2HB TRP 142 -3.594 -15.666 -3.727 1033 HD1 TRP 142 HD1 TRP 142 -2.635 -13.155 -4.641 1034 HE1 TRP 142 HE1 TRP 142 -0.228 -12.567 -5.339 1035 HE3 TRP 142 HE3 TRP 142 -0.153 -16.947 -2.285 1036 HZ2 TRP 142 HZ2 TRP 142 2.376 -13.574 -4.938 1037 HZ3 TRP 142 HZ3 TRP 142 2.296 -17.065 -2.488 1038 HH2 TRP 142 HH2 TRP 142 3.535 -15.413 -3.788 1039 H LEU 143 H LEU 143 -4.014 -14.504 0.661 1040 HA LEU 143 HA LEU 143 -1.365 -15.101 1.669 1041 1HB LEU 143 1HB LEU 143 -2.691 -12.452 2.262 1042 2HB LEU 143 2HB LEU 143 -1.218 -13.043 3.002 1043 HG LEU 143 HG LEU 143 -0.408 -13.109 0.458 1044 1HD1 LEU 143 1HD1 LEU 143 -1.466 -10.708 -0.266 1045 2HD1 LEU 143 2HD1 LEU 143 -2.861 -11.516 0.448 1046 3HD1 LEU 143 3HD1 LEU 143 -1.990 -12.274 -0.885 1047 1HD2 LEU 143 1HD2 LEU 143 -0.498 -10.425 1.761 1048 2HD2 LEU 143 2HD2 LEU 143 0.833 -11.226 0.927 1049 3HD2 LEU 143 3HD2 LEU 143 0.363 -11.748 2.544 1050 H GLU 144 H GLU 144 -4.639 -13.983 2.431 1051 HA GLU 144 HA GLU 144 -4.957 -16.095 4.361 1052 1HB GLU 144 1HB GLU 144 -4.280 -13.390 5.203 1053 2HB GLU 144 2HB GLU 144 -5.800 -13.937 5.895 1054 1HG GLU 144 1HG GLU 144 -3.346 -15.644 6.007 1055 2HG GLU 144 2HG GLU 144 -3.629 -14.367 7.189 1056 H ASP 145 H ASP 145 -7.202 -15.292 5.666 1057 HA ASP 145 HA ASP 145 -9.216 -15.686 3.769 1058 1HB ASP 145 1HB ASP 145 -9.312 -14.676 6.612 1059 2HB ASP 145 2HB ASP 145 -10.763 -14.967 5.656 1060 H ASP 146 H ASP 146 -10.732 -14.343 2.835 1061 HA ASP 146 HA ASP 146 -9.975 -11.508 2.727 1062 1HB ASP 146 1HB ASP 146 -11.940 -12.646 0.799 1063 2HB ASP 146 2HB ASP 146 -10.686 -11.437 0.546 1064 H ALA 147 H ALA 147 -11.641 -9.877 2.739 1065 HA ALA 147 HA ALA 147 -13.641 -10.397 4.713 1066 1HB ALA 147 1HB ALA 147 -12.440 -8.232 4.477 1067 2HB ALA 147 2HB ALA 147 -14.196 -8.073 4.535 1068 3HB ALA 147 3HB ALA 147 -13.349 -7.939 2.995 1069 H MET 148 H MET 148 -15.711 -10.930 4.480 1070 HA MET 148 HA MET 148 -17.040 -10.514 1.907 1071 1HB MET 148 1HB MET 148 -16.423 -13.128 3.167 1072 2HB MET 148 2HB MET 148 -18.036 -12.945 2.488 1073 1HG MET 148 1HG MET 148 -17.229 -12.642 0.330 1074 2HG MET 148 2HG MET 148 -15.606 -12.246 0.891 1075 1HE MET 148 1HE MET 148 -14.238 -14.953 -0.732 1076 2HE MET 148 2HE MET 148 -13.605 -14.782 0.905 1077 3HE MET 148 3HE MET 148 -14.130 -13.356 0.008 1078 H GLU 149 H GLU 149 -19.447 -11.544 2.291 1079 HA GLU 149 HA GLU 149 -20.441 -10.917 4.940 1080 1HB GLU 149 1HB GLU 149 -20.280 -8.785 3.389 1081 2HB GLU 149 2HB GLU 149 -21.762 -9.440 2.706 1082 1HG GLU 149 1HG GLU 149 -22.897 -9.278 4.772 1083 2HG GLU 149 2HG GLU 149 -21.400 -8.956 5.646 1084 H GLN 150 H GLN 150 -21.306 -11.626 1.569 1085 HA GLN 150 HA GLN 150 -22.795 -13.082 0.654 1086 1HB GLN 150 1HB GLN 150 -22.058 -14.327 3.225 1087 2HB GLN 150 2HB GLN 150 -23.565 -14.900 2.524 1088 1HG GLN 150 1HG GLN 150 -21.927 -14.962 0.365 1089 2HG GLN 150 2HG GLN 150 -20.799 -15.334 1.669 1090 1HE2 GLN 150 1HE2 GLN 150 -23.034 -16.586 -0.456 1091 2HE2 GLN 150 2HE2 GLN 150 -23.282 -18.126 0.288 Start of MODEL 14 1 1H GLY 1 1H GLY 1 1.496 4.361 18.714 2 2H GLY 1 2H GLY 1 0.973 2.798 19.093 3 3H GLY 1 3H GLY 1 1.330 3.204 17.491 4 1HA GLY 1 1HA GLY 1 3.027 1.937 19.113 5 2HA GLY 1 2HA GLY 1 3.519 2.906 17.733 6 HA PRO 2 HA PRO 2 3.954 5.406 22.030 7 1HB PRO 2 1HB PRO 2 5.174 3.034 23.363 8 2HB PRO 2 2HB PRO 2 4.187 4.330 24.052 9 1HG PRO 2 1HG PRO 2 3.147 1.919 23.621 10 2HG PRO 2 2HG PRO 2 2.199 3.387 23.317 11 1HD PRO 2 1HD PRO 2 3.527 1.550 21.377 12 2HD PRO 2 2HD PRO 2 1.999 2.441 21.226 13 H TYR 3 H TYR 3 6.025 2.787 20.852 14 HA TYR 3 HA TYR 3 8.090 4.613 20.112 15 1HB TYR 3 1HB TYR 3 8.473 4.398 22.577 16 2HB TYR 3 2HB TYR 3 8.749 2.675 22.338 17 HD1 TYR 3 HD1 TYR 3 10.714 1.926 20.985 18 HD2 TYR 3 HD2 TYR 3 10.175 5.988 22.129 19 HE1 TYR 3 HE1 TYR 3 13.087 2.367 20.514 20 HE2 TYR 3 HE2 TYR 3 12.546 6.441 21.661 21 HH TYR 3 HH TYR 3 14.376 5.539 20.376 22 H GLY 4 H GLY 4 8.037 1.208 21.185 23 1HA GLY 4 1HA GLY 4 9.403 0.407 18.757 24 2HA GLY 4 2HA GLY 4 8.966 -0.635 20.103 25 H HIS 5 H HIS 5 7.719 1.002 17.240 26 HA HIS 5 HA HIS 5 5.550 -0.992 17.144 27 1HB HIS 5 1HB HIS 5 4.216 0.664 15.910 28 2HB HIS 5 2HB HIS 5 4.671 1.264 17.500 29 HD1 HIS 5 HD1 HIS 5 6.059 1.502 13.957 30 HD2 HIS 5 HD2 HIS 5 5.599 3.795 17.393 31 HE1 HIS 5 HE1 HIS 5 6.949 3.779 13.369 32 HE2 HIS 5 HE2 HIS 5 6.590 5.171 15.439 33 H GLN 6 H GLN 6 4.765 -1.428 14.889 34 HA GLN 6 HA GLN 6 6.931 -1.241 12.911 35 1HB GLN 6 1HB GLN 6 5.940 -3.626 14.183 36 2HB GLN 6 2HB GLN 6 5.602 -3.691 12.459 37 1HG GLN 6 1HG GLN 6 8.074 -3.008 12.183 38 2HG GLN 6 2HG GLN 6 8.236 -3.532 13.858 39 1HE2 GLN 6 1HE2 GLN 6 9.470 -5.308 13.519 40 2HE2 GLN 6 2HE2 GLN 6 8.941 -6.700 12.644 41 H SER 7 H SER 7 5.667 0.489 12.023 42 HA SER 7 HA SER 7 3.297 -0.453 10.545 43 1HB SER 7 1HB SER 7 2.712 1.227 12.250 44 2HB SER 7 2HB SER 7 3.867 2.352 11.537 45 HG SER 7 HG SER 7 2.343 2.906 10.219 46 H GLY 8 H GLY 8 3.066 0.177 8.394 47 1HA GLY 8 1HA GLY 8 4.142 1.915 6.770 48 2HA GLY 8 2HA GLY 8 5.587 0.978 7.121 49 H ALA 9 H ALA 9 4.421 -1.586 7.206 50 HA ALA 9 HA ALA 9 3.621 -1.915 4.388 51 1HB ALA 9 1HB ALA 9 5.895 -2.768 4.978 52 2HB ALA 9 2HB ALA 9 4.805 -3.987 4.320 53 3HB ALA 9 3HB ALA 9 5.119 -3.929 6.055 54 H VAL 10 H VAL 10 2.643 -4.273 4.134 55 HA VAL 10 HA VAL 10 0.532 -4.518 6.178 56 HB VAL 10 HB VAL 10 0.360 -5.281 3.258 57 1HG1 VAL 10 1HG1 VAL 10 -2.164 -5.202 3.972 58 2HG1 VAL 10 2HG1 VAL 10 -1.499 -5.519 5.574 59 3HG1 VAL 10 3HG1 VAL 10 -1.192 -6.646 4.253 60 1HG2 VAL 10 1HG2 VAL 10 0.454 -2.757 4.049 61 2HG2 VAL 10 2HG2 VAL 10 -1.242 -3.066 4.423 62 3HG2 VAL 10 3HG2 VAL 10 -0.646 -3.290 2.778 63 H TYR 11 H TYR 11 1.049 -6.190 7.471 64 HA TYR 11 HA TYR 11 2.283 -8.578 6.310 65 1HB TYR 11 1HB TYR 11 3.340 -7.663 8.308 66 2HB TYR 11 2HB TYR 11 1.818 -7.745 9.184 67 HD1 TYR 11 HD1 TYR 11 4.870 -9.369 8.564 68 HD2 TYR 11 HD2 TYR 11 0.767 -10.163 9.360 69 HE1 TYR 11 HE1 TYR 11 5.465 -11.617 9.361 70 HE2 TYR 11 HE2 TYR 11 1.351 -12.415 10.154 71 HH TYR 11 HH TYR 11 4.492 -13.761 9.717 72 H VAL 12 H VAL 12 0.980 -10.158 5.648 73 HA VAL 12 HA VAL 12 -1.517 -10.620 7.138 74 HB VAL 12 HB VAL 12 -1.118 -11.138 4.188 75 1HG1 VAL 12 1HG1 VAL 12 -2.738 -12.624 5.239 76 2HG1 VAL 12 2HG1 VAL 12 -3.544 -11.468 4.179 77 3HG1 VAL 12 3HG1 VAL 12 -3.580 -11.235 5.926 78 1HG2 VAL 12 1HG2 VAL 12 -1.805 -8.721 5.640 79 2HG2 VAL 12 2HG2 VAL 12 -3.059 -9.192 4.494 80 3HG2 VAL 12 3HG2 VAL 12 -1.405 -8.942 3.938 81 H GLY 13 H GLY 13 -1.332 -12.407 8.313 82 1HA GLY 13 1HA GLY 13 -0.761 -14.534 8.969 83 2HA GLY 13 2HA GLY 13 -1.111 -14.958 7.303 84 H ASN 14 H ASN 14 0.459 -16.173 6.508 85 HA ASN 14 HA ASN 14 3.185 -15.874 7.477 86 1HB ASN 14 1HB ASN 14 3.597 -17.909 6.044 87 2HB ASN 14 2HB ASN 14 2.424 -18.131 7.338 88 1HD2 ASN 14 1HD2 ASN 14 1.002 -19.547 6.613 89 2HD2 ASN 14 2HD2 ASN 14 0.176 -19.465 5.098 90 H TYR 15 H TYR 15 1.733 -13.992 5.528 91 HA TYR 15 HA TYR 15 3.928 -13.860 3.564 92 1HB TYR 15 1HB TYR 15 0.960 -13.569 3.101 93 2HB TYR 15 2HB TYR 15 2.126 -12.810 2.027 94 HD1 TYR 15 HD1 TYR 15 4.149 -15.227 2.315 95 HD2 TYR 15 HD2 TYR 15 0.023 -14.907 1.345 96 HE1 TYR 15 HE1 TYR 15 4.288 -17.311 1.030 97 HE2 TYR 15 HE2 TYR 15 0.153 -16.994 0.064 98 HH TYR 15 HH TYR 15 1.517 -18.973 -0.101 99 H LYS 16 H LYS 16 4.624 -11.747 3.086 100 HA LYS 16 HA LYS 16 3.270 -9.551 4.485 101 1HB LYS 16 1HB LYS 16 5.210 -10.441 5.845 102 2HB LYS 16 2HB LYS 16 6.268 -9.905 4.547 103 1HG LYS 16 1HG LYS 16 4.422 -7.850 5.514 104 2HG LYS 16 2HG LYS 16 5.575 -8.424 6.720 105 1HD LYS 16 1HD LYS 16 7.329 -8.097 4.839 106 2HD LYS 16 2HD LYS 16 6.095 -7.077 4.096 107 1HE LYS 16 1HE LYS 16 7.148 -5.485 5.323 108 2HE LYS 16 2HE LYS 16 6.027 -6.061 6.556 109 1HZ LYS 16 1HZ LYS 16 7.842 -7.607 7.272 110 2HZ LYS 16 2HZ LYS 16 8.153 -5.967 7.544 111 3HZ LYS 16 3HZ LYS 16 8.889 -6.763 6.245 112 H VAL 17 H VAL 17 2.742 -8.102 2.963 113 HA VAL 17 HA VAL 17 4.501 -7.872 0.635 114 HB VAL 17 HB VAL 17 2.733 -7.391 -0.679 115 1HG1 VAL 17 1HG1 VAL 17 2.130 -9.360 0.988 116 2HG1 VAL 17 2HG1 VAL 17 1.008 -8.805 -0.254 117 3HG1 VAL 17 3HG1 VAL 17 0.819 -8.257 1.412 118 1HG2 VAL 17 1HG2 VAL 17 2.283 -5.202 0.254 119 2HG2 VAL 17 2HG2 VAL 17 1.411 -5.928 1.604 120 3HG2 VAL 17 3HG2 VAL 17 0.767 -6.057 -0.034 121 H VAL 18 H VAL 18 5.843 -6.253 0.473 122 HA VAL 18 HA VAL 18 5.168 -3.668 1.681 123 HB VAL 18 HB VAL 18 6.663 -4.843 3.251 124 1HG1 VAL 18 1HG1 VAL 18 8.656 -5.779 2.704 125 2HG1 VAL 18 2HG1 VAL 18 8.966 -4.630 1.403 126 3HG1 VAL 18 3HG1 VAL 18 7.846 -5.969 1.149 127 1HG2 VAL 18 1HG2 VAL 18 8.063 -3.027 3.677 128 2HG2 VAL 18 2HG2 VAL 18 6.721 -2.319 2.779 129 3HG2 VAL 18 3HG2 VAL 18 8.250 -2.649 1.965 130 H ASN 19 H ASN 19 6.501 -1.876 0.814 131 HA ASN 19 HA ASN 19 6.576 -1.884 -1.985 132 1HB ASN 19 1HB ASN 19 6.746 0.047 -0.055 133 2HB ASN 19 2HB ASN 19 8.395 0.030 -0.676 134 1HD2 ASN 19 1HD2 ASN 19 8.689 1.527 -2.143 135 2HD2 ASN 19 2HD2 ASN 19 7.552 2.022 -3.345 136 H ARG 20 H ARG 20 8.215 -2.166 -3.471 137 HA ARG 20 HA ARG 20 10.229 -3.998 -2.899 138 1HB ARG 20 1HB ARG 20 11.146 -3.447 -5.107 139 2HB ARG 20 2HB ARG 20 9.401 -3.634 -5.161 140 1HG ARG 20 1HG ARG 20 9.574 -1.748 -6.390 141 2HG ARG 20 2HG ARG 20 9.511 -1.000 -4.794 142 1HD ARG 20 1HD ARG 20 11.365 0.051 -5.576 143 2HD ARG 20 2HD ARG 20 12.140 -1.403 -4.951 144 HE ARG 20 HE ARG 20 11.304 -1.550 -7.714 145 1HH1 ARG 20 1HH1 ARG 20 13.893 -0.773 -5.504 146 2HH1 ARG 20 2HH1 ARG 20 15.136 -0.989 -6.689 147 1HH2 ARG 20 1HH2 ARG 20 12.939 -1.833 -9.272 148 2HH2 ARG 20 2HH2 ARG 20 14.596 -1.589 -8.829 149 H HIS 21 H HIS 21 10.472 -0.463 -3.243 150 HA HIS 21 HA HIS 21 13.260 -0.371 -2.749 151 1HB HIS 21 1HB HIS 21 11.492 1.429 -3.685 152 2HB HIS 21 2HB HIS 21 11.610 1.982 -2.017 153 HD1 HIS 21 HD1 HIS 21 14.749 1.132 -1.889 154 HD2 HIS 21 HD2 HIS 21 12.902 3.673 -4.610 155 HE1 HIS 21 HE1 HIS 21 16.578 2.616 -2.771 156 HE2 HIS 21 HE2 HIS 21 15.453 4.080 -4.485 157 H LEU 22 H LEU 22 10.697 -1.081 -0.686 158 HA LEU 22 HA LEU 22 12.248 -0.212 1.656 159 1HB LEU 22 1HB LEU 22 9.723 0.510 1.079 160 2HB LEU 22 2HB LEU 22 9.408 -0.953 1.993 161 HG LEU 22 HG LEU 22 11.263 0.419 3.547 162 1HD1 LEU 22 1HD1 LEU 22 10.394 2.323 1.848 163 2HD1 LEU 22 2HD1 LEU 22 10.888 2.637 3.512 164 3HD1 LEU 22 3HD1 LEU 22 9.178 2.451 3.120 165 1HD2 LEU 22 1HD2 LEU 22 9.668 0.237 5.150 166 2HD2 LEU 22 2HD2 LEU 22 8.954 -0.846 3.954 167 3HD2 LEU 22 3HD2 LEU 22 8.380 0.816 4.094 168 H ALA 23 H ALA 23 11.723 -2.964 -0.097 169 HA ALA 23 HA ALA 23 11.247 -4.701 2.189 170 1HB ALA 23 1HB ALA 23 11.175 -4.986 -0.716 171 2HB ALA 23 2HB ALA 23 10.254 -5.822 0.534 172 3HB ALA 23 3HB ALA 23 11.875 -6.372 0.121 173 H THR 24 H THR 24 12.752 -5.770 3.312 174 HA THR 24 HA THR 24 15.512 -5.123 2.921 175 HB THR 24 HB THR 24 15.917 -6.449 4.908 176 HG1 THR 24 HG1 THR 24 13.213 -7.275 4.754 177 1HG2 THR 24 1HG2 THR 24 14.315 -5.489 6.510 178 2HG2 THR 24 2HG2 THR 24 13.343 -4.914 5.155 179 3HG2 THR 24 3HG2 THR 24 14.978 -4.294 5.394 180 H HIS 25 H HIS 25 17.222 -6.813 2.840 181 HA HIS 25 HA HIS 25 17.055 -8.335 0.535 182 1HB HIS 25 1HB HIS 25 19.105 -9.480 1.339 183 2HB HIS 25 2HB HIS 25 19.195 -7.730 1.507 184 HD1 HIS 25 HD1 HIS 25 19.035 -6.774 3.948 185 HD2 HIS 25 HD2 HIS 25 19.272 -10.915 3.697 186 HE1 HIS 25 HE1 HIS 25 19.601 -7.557 6.269 187 HE2 HIS 25 HE2 HIS 25 19.825 -10.059 6.075 188 H VAL 26 H VAL 26 16.129 -9.144 3.794 189 HA VAL 26 HA VAL 26 15.968 -11.955 3.439 190 HB VAL 26 HB VAL 26 14.380 -10.271 5.380 191 1HG1 VAL 26 1HG1 VAL 26 14.283 -12.293 6.719 192 2HG1 VAL 26 2HG1 VAL 26 15.230 -13.161 5.510 193 3HG1 VAL 26 3HG1 VAL 26 13.608 -12.589 5.117 194 1HG2 VAL 26 1HG2 VAL 26 16.800 -11.630 6.335 195 2HG2 VAL 26 2HG2 VAL 26 16.173 -10.025 6.712 196 3HG2 VAL 26 3HG2 VAL 26 17.092 -10.285 5.231 197 H ASP 27 H ASP 27 13.768 -9.290 2.815 198 HA ASP 27 HA ASP 27 11.432 -10.850 2.449 199 1HB ASP 27 1HB ASP 27 12.258 -8.048 1.816 200 2HB ASP 27 2HB ASP 27 10.850 -8.702 0.984 201 H TRP 28 H TRP 28 13.916 -9.567 0.298 202 HA TRP 28 HA TRP 28 12.733 -10.659 -2.037 203 1HB TRP 28 1HB TRP 28 15.546 -9.650 -1.623 204 2HB TRP 28 2HB TRP 28 14.796 -9.985 -3.182 205 HD1 TRP 28 HD1 TRP 28 14.274 -7.646 -0.155 206 HE1 TRP 28 HE1 TRP 28 13.263 -5.446 -0.993 207 HE3 TRP 28 HE3 TRP 28 13.675 -8.866 -5.075 208 HZ2 TRP 28 HZ2 TRP 28 12.306 -4.371 -3.394 209 HZ3 TRP 28 HZ3 TRP 28 12.694 -7.188 -6.586 210 HH2 TRP 28 HH2 TRP 28 12.028 -4.987 -5.767 211 H GLN 29 H GLN 29 15.025 -11.778 0.318 212 HA GLN 29 HA GLN 29 16.210 -13.870 -1.128 213 1HB GLN 29 1HB GLN 29 16.256 -12.909 1.535 214 2HB GLN 29 2HB GLN 29 15.861 -14.620 1.625 215 1HG GLN 29 1HG GLN 29 18.274 -14.163 1.778 216 2HG GLN 29 2HG GLN 29 17.848 -15.203 0.420 217 1HE2 GLN 29 1HE2 GLN 29 18.762 -11.947 1.348 218 2HE2 GLN 29 2HE2 GLN 29 19.380 -11.477 -0.196 219 H ASN 30 H ASN 30 13.289 -13.770 0.869 220 HA ASN 30 HA ASN 30 12.545 -16.409 -0.211 221 1HB ASN 30 1HB ASN 30 12.704 -15.551 2.470 222 2HB ASN 30 2HB ASN 30 10.986 -15.662 2.099 223 1HD2 ASN 30 1HD2 ASN 30 13.477 -17.321 3.330 224 2HD2 ASN 30 2HD2 ASN 30 12.982 -18.936 2.970 225 H CYS 31 H CYS 31 12.117 -13.895 -1.540 226 HA CYS 31 HA CYS 31 9.421 -13.047 -1.157 227 1HB CYS 31 1HB CYS 31 9.737 -11.746 -3.196 228 2HB CYS 31 2HB CYS 31 11.124 -11.566 -2.132 229 HG CYS 31 HG CYS 31 12.177 -13.509 -3.840 230 H VAL 32 H VAL 32 7.636 -13.994 -1.813 231 HA VAL 32 HA VAL 32 7.764 -16.264 -3.609 232 HB VAL 32 HB VAL 32 5.286 -16.413 -3.129 233 1HG1 VAL 32 1HG1 VAL 32 5.810 -16.852 -0.553 234 2HG1 VAL 32 2HG1 VAL 32 7.466 -16.702 -1.145 235 3HG1 VAL 32 3HG1 VAL 32 6.389 -17.918 -1.835 236 1HG2 VAL 32 1HG2 VAL 32 4.326 -15.105 -1.389 237 2HG2 VAL 32 2HG2 VAL 32 5.065 -13.984 -2.529 238 3HG2 VAL 32 3HG2 VAL 32 5.878 -14.360 -1.009 239 H TRP 33 H TRP 33 6.377 -13.004 -3.532 240 HA TRP 33 HA TRP 33 6.100 -13.137 -6.445 241 1HB TRP 33 1HB TRP 33 3.878 -13.532 -6.022 242 2HB TRP 33 2HB TRP 33 3.912 -12.706 -4.472 243 HD1 TRP 33 HD1 TRP 33 3.040 -12.181 -8.098 244 HE1 TRP 33 HE1 TRP 33 2.115 -9.799 -8.414 245 HE3 TRP 33 HE3 TRP 33 4.222 -10.247 -3.532 246 HZ2 TRP 33 HZ2 TRP 33 1.921 -7.401 -6.904 247 HZ3 TRP 33 HZ3 TRP 33 3.645 -7.910 -3.043 248 HH2 TRP 33 HH2 TRP 33 2.519 -6.524 -4.704 249 H GLU 34 H GLU 34 6.174 -11.105 -7.516 250 HA GLU 34 HA GLU 34 6.607 -8.695 -5.971 251 1HB GLU 34 1HB GLU 34 8.826 -9.369 -7.856 252 2HB GLU 34 2HB GLU 34 8.831 -8.298 -6.464 253 1HG GLU 34 1HG GLU 34 8.914 -10.152 -4.956 254 2HG GLU 34 2HG GLU 34 8.684 -11.296 -6.277 255 H ASP 35 H ASP 35 5.449 -7.211 -7.021 256 HA ASP 35 HA ASP 35 5.274 -7.370 -9.957 257 1HB ASP 35 1HB ASP 35 3.379 -6.473 -7.843 258 2HB ASP 35 2HB ASP 35 3.320 -5.647 -9.396 259 H TYR 36 H TYR 36 6.685 -6.063 -10.918 260 HA TYR 36 HA TYR 36 7.892 -3.822 -9.702 261 1HB TYR 36 1HB TYR 36 8.913 -5.118 -11.552 262 2HB TYR 36 2HB TYR 36 7.699 -4.471 -12.651 263 HD1 TYR 36 HD1 TYR 36 10.726 -3.723 -10.736 264 HD2 TYR 36 HD2 TYR 36 7.794 -2.157 -13.389 265 HE1 TYR 36 HE1 TYR 36 12.171 -1.782 -11.175 266 HE2 TYR 36 HE2 TYR 36 9.230 -0.211 -13.837 267 HH TYR 36 HH TYR 36 12.475 -0.093 -13.012 268 H ASN 37 H ASN 37 5.005 -4.177 -11.641 269 HA ASN 37 HA ASN 37 4.690 -1.498 -12.421 270 1HB ASN 37 1HB ASN 37 3.096 -3.935 -12.443 271 2HB ASN 37 2HB ASN 37 2.115 -2.502 -12.145 272 1HD2 ASN 37 1HD2 ASN 37 3.326 -0.601 -13.621 273 2HD2 ASN 37 2HD2 ASN 37 3.271 -1.008 -15.298 274 H ARG 38 H ARG 38 4.056 -3.141 -9.415 275 HA ARG 38 HA ARG 38 2.901 -0.639 -8.368 276 1HB ARG 38 1HB ARG 38 1.892 -2.135 -6.570 277 2HB ARG 38 2HB ARG 38 1.187 -2.232 -8.176 278 1HG ARG 38 1HG ARG 38 3.202 -4.172 -8.123 279 2HG ARG 38 2HG ARG 38 2.376 -4.293 -6.571 280 1HD ARG 38 1HD ARG 38 1.191 -5.729 -7.999 281 2HD ARG 38 2HD ARG 38 0.208 -4.269 -7.902 282 HE ARG 38 HE ARG 38 2.043 -4.352 -10.132 283 1HH1 ARG 38 1HH1 ARG 38 -1.180 -5.070 -9.000 284 2HH1 ARG 38 2HH1 ARG 38 -1.865 -5.098 -10.589 285 1HH2 ARG 38 1HH2 ARG 38 1.140 -4.393 -12.221 286 2HH2 ARG 38 2HH2 ARG 38 -0.550 -4.713 -12.416 287 H ASP 39 H ASP 39 5.727 -2.145 -8.466 288 HA ASP 39 HA ASP 39 7.558 -2.342 -7.110 289 1HB ASP 39 1HB ASP 39 6.261 0.216 -6.197 290 2HB ASP 39 2HB ASP 39 7.776 -0.337 -5.492 291 H LEU 40 H LEU 40 5.585 -4.049 -6.299 292 HA LEU 40 HA LEU 40 5.935 -4.038 -3.380 293 1HB LEU 40 1HB LEU 40 3.656 -3.297 -3.959 294 2HB LEU 40 2HB LEU 40 3.410 -4.780 -4.857 295 HG LEU 40 HG LEU 40 3.838 -5.998 -2.645 296 1HD1 LEU 40 1HD1 LEU 40 2.896 -3.606 -1.216 297 2HD1 LEU 40 2HD1 LEU 40 4.582 -3.570 -1.734 298 3HD1 LEU 40 3HD1 LEU 40 4.005 -4.878 -0.702 299 1HD2 LEU 40 1HD2 LEU 40 1.607 -6.180 -2.426 300 2HD2 LEU 40 2HD2 LEU 40 1.566 -5.170 -3.872 301 3HD2 LEU 40 3HD2 LEU 40 1.375 -4.438 -2.278 302 H LEU 41 H LEU 41 6.011 -6.092 -2.389 303 HA LEU 41 HA LEU 41 5.985 -8.448 -4.078 304 1HB LEU 41 1HB LEU 41 8.196 -9.220 -3.439 305 2HB LEU 41 2HB LEU 41 8.276 -7.732 -4.345 306 HG LEU 41 HG LEU 41 9.602 -8.339 -1.968 307 1HD1 LEU 41 1HD1 LEU 41 10.502 -6.123 -2.178 308 2HD1 LEU 41 2HD1 LEU 41 9.142 -5.622 -3.183 309 3HD1 LEU 41 3HD1 LEU 41 10.287 -6.821 -3.784 310 1HD2 LEU 41 1HD2 LEU 41 8.808 -6.381 -0.534 311 2HD2 LEU 41 2HD2 LEU 41 7.880 -7.876 -0.472 312 3HD2 LEU 41 3HD2 LEU 41 7.293 -6.511 -1.413 313 H VAL 42 H VAL 42 6.018 -10.455 -2.897 314 HA VAL 42 HA VAL 42 5.221 -10.092 -0.089 315 HB VAL 42 HB VAL 42 4.120 -12.015 -2.146 316 1HG1 VAL 42 1HG1 VAL 42 2.909 -13.188 -0.437 317 2HG1 VAL 42 2HG1 VAL 42 3.526 -12.107 0.812 318 3HG1 VAL 42 3HG1 VAL 42 4.616 -13.223 -0.004 319 1HG2 VAL 42 1HG2 VAL 42 3.199 -9.576 -0.887 320 2HG2 VAL 42 2HG2 VAL 42 2.056 -10.905 -0.659 321 3HG2 VAL 42 3HG2 VAL 42 2.558 -10.438 -2.285 322 H SER 43 H SER 43 6.232 -11.228 1.395 323 HA SER 43 HA SER 43 8.024 -13.402 0.551 324 1HB SER 43 1HB SER 43 9.591 -11.795 1.134 325 2HB SER 43 2HB SER 43 8.530 -11.052 2.329 326 HG SER 43 HG SER 43 9.094 -12.541 3.788 327 H THR 44 H THR 44 8.385 -15.038 2.218 328 HA THR 44 HA THR 44 5.973 -15.356 3.833 329 HB THR 44 HB THR 44 6.416 -17.691 3.848 330 HG1 THR 44 HG1 THR 44 8.662 -17.635 4.193 331 1HG2 THR 44 1HG2 THR 44 5.902 -16.386 1.580 332 2HG2 THR 44 2HG2 THR 44 6.019 -18.147 1.696 333 3HG2 THR 44 3HG2 THR 44 7.399 -17.206 1.125 334 H THR 45 H THR 45 5.937 -15.250 5.941 335 HA THR 45 HA THR 45 8.490 -15.230 7.406 336 HB THR 45 HB THR 45 7.908 -13.052 7.731 337 HG1 THR 45 HG1 THR 45 7.709 -13.465 9.795 338 1HG2 THR 45 1HG2 THR 45 4.955 -13.543 7.785 339 2HG2 THR 45 2HG2 THR 45 5.825 -13.315 6.268 340 3HG2 THR 45 3HG2 THR 45 5.830 -12.042 7.484 341 H THR 46 H THR 46 8.186 -15.702 9.784 342 HA THR 46 HA THR 46 6.195 -17.851 10.107 343 HB THR 46 HB THR 46 8.774 -17.657 11.650 344 HG1 THR 46 HG1 THR 46 9.715 -18.962 10.112 345 1HG2 THR 46 1HG2 THR 46 8.520 -19.960 12.070 346 2HG2 THR 46 2HG2 THR 46 7.209 -20.104 10.898 347 3HG2 THR 46 3HG2 THR 46 6.954 -19.220 12.403 348 H ALA 47 H ALA 47 5.572 -15.157 10.645 349 HA ALA 47 HA ALA 47 5.459 -15.122 13.590 350 1HB ALA 47 1HB ALA 47 4.814 -12.644 12.133 351 2HB ALA 47 2HB ALA 47 6.489 -13.186 12.022 352 3HB ALA 47 3HB ALA 47 5.762 -12.888 13.601 353 H HIS 48 H HIS 48 3.455 -13.314 13.986 354 HA HIS 48 HA HIS 48 1.116 -14.811 13.040 355 1HB HIS 48 1HB HIS 48 1.613 -13.076 15.449 356 2HB HIS 48 2HB HIS 48 -0.021 -13.488 14.941 357 HD1 HIS 48 HD1 HIS 48 2.635 -14.653 17.051 358 HD2 HIS 48 HD2 HIS 48 -0.354 -16.456 14.798 359 HE1 HIS 48 HE1 HIS 48 2.416 -16.984 17.968 360 HE2 HIS 48 HE2 HIS 48 0.556 -18.035 16.633 361 H GLY 49 H GLY 49 -0.649 -13.798 12.108 362 1HA GLY 49 1HA GLY 49 -0.093 -11.092 11.080 363 2HA GLY 49 2HA GLY 49 -1.117 -12.281 10.291 364 H CYS 50 H CYS 50 -1.323 -9.424 11.640 365 HA CYS 50 HA CYS 50 -3.849 -9.983 13.051 366 1HB CYS 50 1HB CYS 50 -1.887 -7.709 13.370 367 2HB CYS 50 2HB CYS 50 -3.491 -7.710 14.096 368 HG CYS 50 HG CYS 50 -1.308 -9.787 14.883 369 H ASP 51 H ASP 51 -2.284 -8.088 10.561 370 HA ASP 51 HA ASP 51 -4.472 -6.352 10.038 371 1HB ASP 51 1HB ASP 51 -2.264 -7.160 8.137 372 2HB ASP 51 2HB ASP 51 -3.268 -5.717 8.039 373 H THR 52 H THR 52 -6.212 -6.587 8.762 374 HA THR 52 HA THR 52 -6.455 -9.097 7.236 375 HB THR 52 HB THR 52 -8.655 -7.554 8.627 376 HG1 THR 52 HG1 THR 52 -7.321 -9.963 9.272 377 1HG2 THR 52 1HG2 THR 52 -10.199 -9.043 7.884 378 2HG2 THR 52 2HG2 THR 52 -9.015 -10.328 7.648 379 3HG2 THR 52 3HG2 THR 52 -9.124 -9.006 6.486 380 H ILE 53 H ILE 53 -6.474 -8.757 5.120 381 HA ILE 53 HA ILE 53 -6.921 -6.146 4.023 382 HB ILE 53 HB ILE 53 -6.870 -8.563 2.283 383 1HG1 ILE 53 1HG1 ILE 53 -4.830 -7.950 4.246 384 2HG1 ILE 53 2HG1 ILE 53 -4.954 -9.327 3.158 385 1HG2 ILE 53 1HG2 ILE 53 -5.633 -5.828 2.043 386 2HG2 ILE 53 2HG2 ILE 53 -7.150 -6.349 1.310 387 3HG2 ILE 53 3HG2 ILE 53 -5.630 -7.080 0.800 388 1HD1 ILE 53 1HD1 ILE 53 -3.569 -6.708 2.711 389 2HD1 ILE 53 2HD1 ILE 53 -3.969 -7.795 1.380 390 3HD1 ILE 53 3HD1 ILE 53 -2.899 -8.339 2.668 391 H ALA 54 H ALA 54 -8.608 -5.372 2.895 392 HA ALA 54 HA ALA 54 -11.106 -6.873 3.108 393 1HB ALA 54 1HB ALA 54 -11.201 -4.128 2.080 394 2HB ALA 54 2HB ALA 54 -10.528 -4.290 3.697 395 3HB ALA 54 3HB ALA 54 -12.145 -4.900 3.353 396 H ARG 55 H ARG 55 -11.290 -8.227 1.393 397 HA ARG 55 HA ARG 55 -10.519 -7.422 -1.269 398 1HB ARG 55 1HB ARG 55 -10.359 -9.787 -0.368 399 2HB ARG 55 2HB ARG 55 -12.111 -9.866 -0.487 400 1HG ARG 55 1HG ARG 55 -11.278 -10.892 -2.430 401 2HG ARG 55 2HG ARG 55 -11.848 -9.298 -2.931 402 1HD ARG 55 1HD ARG 55 -9.437 -8.526 -2.590 403 2HD ARG 55 2HD ARG 55 -9.022 -10.239 -2.533 404 HE ARG 55 HE ARG 55 -9.694 -8.702 -4.854 405 1HH1 ARG 55 1HH1 ARG 55 -9.742 -11.907 -3.472 406 2HH1 ARG 55 2HH1 ARG 55 -9.725 -12.705 -5.008 407 1HH2 ARG 55 1HH2 ARG 55 -9.670 -9.751 -6.875 408 2HH2 ARG 55 2HH2 ARG 55 -9.683 -11.481 -6.942 409 H CYS 56 H CYS 56 -12.106 -5.516 -0.724 410 HA CYS 56 HA CYS 56 -14.732 -6.178 -1.887 411 1HB CYS 56 1HB CYS 56 -15.194 -3.808 -0.625 412 2HB CYS 56 2HB CYS 56 -15.517 -5.385 0.086 413 H GLN 57 H GLN 57 -15.736 -4.474 -3.155 414 HA GLN 57 HA GLN 57 -13.736 -3.001 -4.702 415 1HB GLN 57 1HB GLN 57 -15.981 -4.496 -5.436 416 2HB GLN 57 2HB GLN 57 -16.456 -2.824 -5.703 417 1HG GLN 57 1HG GLN 57 -13.940 -4.057 -6.795 418 2HG GLN 57 2HG GLN 57 -15.460 -3.945 -7.682 419 1HE2 GLN 57 1HE2 GLN 57 -12.644 -2.693 -7.837 420 2HE2 GLN 57 2HE2 GLN 57 -12.976 -1.022 -8.121 421 H CYS 58 H CYS 58 -14.979 -2.274 -2.006 422 HA CYS 58 HA CYS 58 -16.691 -0.093 -2.240 423 1HB CYS 58 1HB CYS 58 -15.915 0.534 -0.002 424 2HB CYS 58 2HB CYS 58 -16.175 -1.205 -0.106 425 H THR 59 H THR 59 -16.438 1.944 -2.912 426 HA THR 59 HA THR 59 -13.793 2.795 -3.791 427 HB THR 59 HB THR 59 -16.347 4.345 -4.150 428 HG1 THR 59 HG1 THR 59 -16.946 2.494 -5.062 429 1HG2 THR 59 1HG2 THR 59 -13.902 4.113 -5.885 430 2HG2 THR 59 2HG2 THR 59 -14.275 5.462 -4.812 431 3HG2 THR 59 3HG2 THR 59 -15.317 5.118 -6.192 432 H THR 60 H THR 60 -15.044 2.816 -0.906 433 HA THR 60 HA THR 60 -14.061 5.512 -0.271 434 HB THR 60 HB THR 60 -15.774 5.820 1.379 435 HG1 THR 60 HG1 THR 60 -16.678 4.163 2.252 436 1HG2 THR 60 1HG2 THR 60 -17.101 4.727 -1.089 437 2HG2 THR 60 2HG2 THR 60 -16.484 6.367 -0.894 438 3HG2 THR 60 3HG2 THR 60 -17.826 5.807 0.103 439 H GLY 61 H GLY 61 -12.554 5.589 1.273 440 1HA GLY 61 1HA GLY 61 -12.394 3.512 3.300 441 2HA GLY 61 2HA GLY 61 -11.044 3.578 2.176 442 H VAL 62 H VAL 62 -9.772 3.994 4.129 443 HA VAL 62 HA VAL 62 -9.670 6.869 4.659 444 HB VAL 62 HB VAL 62 -10.903 5.930 6.542 445 1HG1 VAL 62 1HG1 VAL 62 -9.654 4.378 8.103 446 2HG1 VAL 62 2HG1 VAL 62 -8.536 4.093 6.769 447 3HG1 VAL 62 3HG1 VAL 62 -10.239 3.670 6.598 448 1HG2 VAL 62 1HG2 VAL 62 -9.854 7.631 7.541 449 2HG2 VAL 62 2HG2 VAL 62 -8.304 7.229 6.803 450 3HG2 VAL 62 3HG2 VAL 62 -8.826 6.396 8.266 451 H TYR 63 H TYR 63 -7.671 7.694 4.750 452 HA TYR 63 HA TYR 63 -5.430 5.798 4.566 453 1HB TYR 63 1HB TYR 63 -4.243 7.424 3.270 454 2HB TYR 63 2HB TYR 63 -5.849 7.264 2.574 455 HD1 TYR 63 HD1 TYR 63 -3.691 9.428 4.655 456 HD2 TYR 63 HD2 TYR 63 -7.317 9.140 2.444 457 HE1 TYR 63 HE1 TYR 63 -3.981 11.863 4.822 458 HE2 TYR 63 HE2 TYR 63 -7.617 11.573 2.610 459 HH TYR 63 HH TYR 63 -6.760 13.421 4.348 460 H PHE 64 H PHE 64 -3.993 5.766 6.160 461 HA PHE 64 HA PHE 64 -3.965 8.027 8.048 462 1HB PHE 64 1HB PHE 64 -4.780 6.099 9.190 463 2HB PHE 64 2HB PHE 64 -3.530 5.073 8.495 464 HD1 PHE 64 HD1 PHE 64 -1.172 5.336 9.252 465 HD2 PHE 64 HD2 PHE 64 -4.411 7.305 11.185 466 HE1 PHE 64 HE1 PHE 64 0.243 5.714 11.229 467 HE2 PHE 64 HE2 PHE 64 -3.002 7.687 13.165 468 HZ PHE 64 HZ PHE 64 -0.673 6.892 13.189 469 H CYS 65 H CYS 65 -2.091 9.030 8.486 470 HA CYS 65 HA CYS 65 0.107 9.614 8.391 471 1HB CYS 65 1HB CYS 65 0.151 6.696 8.519 472 2HB CYS 65 2HB CYS 65 1.571 7.369 7.727 473 HG CYS 65 HG CYS 65 1.704 8.881 10.047 474 H ALA 66 H ALA 66 -1.649 9.297 5.899 475 HA ALA 66 HA ALA 66 0.384 8.941 3.836 476 1HB ALA 66 1HB ALA 66 -1.300 8.528 2.391 477 2HB ALA 66 2HB ALA 66 -2.331 9.792 3.062 478 3HB ALA 66 3HB ALA 66 -2.212 8.229 3.869 479 H SER 67 H SER 67 -1.832 11.437 5.026 480 HA SER 67 HA SER 67 -0.222 13.451 3.598 481 1HB SER 67 1HB SER 67 -2.657 13.218 2.915 482 2HB SER 67 2HB SER 67 -3.077 13.806 4.523 483 HG SER 67 HG SER 67 -2.373 15.761 4.015 484 H LYS 68 H LYS 68 -1.868 12.613 6.581 485 HA LYS 68 HA LYS 68 -0.233 14.609 7.995 486 1HB LYS 68 1HB LYS 68 -3.162 14.062 8.176 487 2HB LYS 68 2HB LYS 68 -2.310 14.512 9.645 488 1HG LYS 68 1HG LYS 68 -1.727 16.234 7.354 489 2HG LYS 68 2HG LYS 68 -3.414 16.254 7.870 490 1HD LYS 68 1HD LYS 68 -2.926 17.190 9.895 491 2HD LYS 68 2HD LYS 68 -1.327 16.447 9.974 492 1HE LYS 68 1HE LYS 68 -0.335 18.150 8.858 493 2HE LYS 68 2HE LYS 68 -1.739 18.438 7.833 494 1HZ LYS 68 1HZ LYS 68 -1.887 19.111 10.689 495 2HZ LYS 68 2HZ LYS 68 -2.700 19.808 9.380 496 3HZ LYS 68 3HZ LYS 68 -1.065 20.155 9.641 497 H SER 69 H SER 69 -0.690 13.957 10.572 498 HA SER 69 HA SER 69 0.433 11.265 10.729 499 1HB SER 69 1HB SER 69 0.102 12.999 13.141 500 2HB SER 69 2HB SER 69 1.407 11.886 12.730 501 HG SER 69 HG SER 69 1.627 14.371 12.539 502 H LYS 70 H LYS 70 -2.408 11.710 10.189 503 HA LYS 70 HA LYS 70 -3.496 10.052 12.331 504 1HB LYS 70 1HB LYS 70 -4.945 12.487 11.281 505 2HB LYS 70 2HB LYS 70 -5.517 11.378 12.517 506 1HG LYS 70 1HG LYS 70 -4.616 12.678 14.058 507 2HG LYS 70 2HG LYS 70 -3.020 12.330 13.397 508 1HD LYS 70 1HD LYS 70 -4.374 14.281 11.771 509 2HD LYS 70 2HD LYS 70 -4.351 14.800 13.456 510 1HE LYS 70 1HE LYS 70 -1.789 13.777 12.898 511 2HE LYS 70 2HE LYS 70 -2.234 14.790 11.526 512 1HZ LYS 70 1HZ LYS 70 -1.740 15.532 14.300 513 2HZ LYS 70 2HZ LYS 70 -2.970 16.374 13.500 514 3HZ LYS 70 3HZ LYS 70 -1.399 16.378 12.875 515 H HIS 71 H HIS 71 -5.772 9.289 11.678 516 HA HIS 71 HA HIS 71 -5.581 8.212 8.994 517 1HB HIS 71 1HB HIS 71 -7.520 6.852 9.631 518 2HB HIS 71 2HB HIS 71 -6.269 6.755 10.864 519 HD1 HIS 71 HD1 HIS 71 -6.718 8.215 13.067 520 HD2 HIS 71 HD2 HIS 71 -9.961 7.705 10.520 521 HE1 HIS 71 HE1 HIS 71 -8.744 8.817 14.430 522 HE2 HIS 71 HE2 HIS 71 -10.701 8.427 12.891 523 H TYR 72 H TYR 72 -6.843 8.794 7.276 524 HA TYR 72 HA TYR 72 -8.883 10.868 7.753 525 1HB TYR 72 1HB TYR 72 -6.563 10.850 5.883 526 2HB TYR 72 2HB TYR 72 -8.046 11.635 5.359 527 HD1 TYR 72 HD1 TYR 72 -5.669 11.587 8.244 528 HD2 TYR 72 HD2 TYR 72 -8.377 13.858 5.875 529 HE1 TYR 72 HE1 TYR 72 -5.003 13.627 9.452 530 HE2 TYR 72 HE2 TYR 72 -7.725 15.901 7.073 531 HH TYR 72 HH TYR 72 -6.187 15.943 9.938 532 HA PRO 73 HA PRO 73 -11.228 7.862 5.306 533 1HB PRO 73 1HB PRO 73 -13.485 9.670 5.740 534 2HB PRO 73 2HB PRO 73 -13.274 8.007 6.292 535 1HG PRO 73 1HG PRO 73 -13.249 10.124 7.982 536 2HG PRO 73 2HG PRO 73 -12.311 8.649 8.276 537 1HD PRO 73 1HD PRO 73 -11.402 11.292 7.199 538 2HD PRO 73 2HD PRO 73 -10.598 10.206 8.352 539 H VAL 74 H VAL 74 -11.037 7.985 3.130 540 HA VAL 74 HA VAL 74 -12.026 10.389 1.783 541 HB VAL 74 HB VAL 74 -9.470 10.446 2.201 542 1HG1 VAL 74 1HG1 VAL 74 -9.027 8.143 1.475 543 2HG1 VAL 74 2HG1 VAL 74 -8.105 9.325 0.545 544 3HG1 VAL 74 3HG1 VAL 74 -9.537 8.571 -0.159 545 1HG2 VAL 74 1HG2 VAL 74 -10.543 12.052 0.793 546 2HG2 VAL 74 2HG2 VAL 74 -10.675 10.883 -0.521 547 3HG2 VAL 74 3HG2 VAL 74 -9.089 11.477 -0.025 548 H SER 75 H SER 75 -12.514 10.130 -0.431 549 HA SER 75 HA SER 75 -13.141 7.368 -1.163 550 1HB SER 75 1HB SER 75 -13.984 9.794 -2.735 551 2HB SER 75 2HB SER 75 -14.780 8.225 -2.612 552 HG SER 75 HG SER 75 -15.082 8.838 -0.310 553 H PHE 76 H PHE 76 -12.111 6.340 -2.813 554 HA PHE 76 HA PHE 76 -10.381 7.952 -4.552 555 1HB PHE 76 1HB PHE 76 -9.020 5.510 -4.149 556 2HB PHE 76 2HB PHE 76 -8.516 7.118 -3.657 557 HD1 PHE 76 HD1 PHE 76 -11.088 4.706 -2.407 558 HD2 PHE 76 HD2 PHE 76 -7.697 7.121 -1.538 559 HE1 PHE 76 HE1 PHE 76 -11.219 4.033 -0.045 560 HE2 PHE 76 HE2 PHE 76 -7.820 6.459 0.824 561 HZ PHE 76 HZ PHE 76 -9.586 4.913 1.576 562 H GLU 77 H GLU 77 -9.595 6.786 -6.445 563 HA GLU 77 HA GLU 77 -11.604 4.875 -7.433 564 1HB GLU 77 1HB GLU 77 -10.766 5.696 -9.723 565 2HB GLU 77 2HB GLU 77 -11.788 6.784 -8.794 566 1HG GLU 77 1HG GLU 77 -9.836 8.024 -8.058 567 2HG GLU 77 2HG GLU 77 -8.783 6.910 -8.931 568 H GLY 78 H GLY 78 -10.781 3.221 -8.936 569 1HA GLY 78 1HA GLY 78 -8.063 2.418 -8.137 570 2HA GLY 78 2HA GLY 78 -9.333 1.319 -8.642 571 HA PRO 79 HA PRO 79 -7.779 3.352 -12.736 572 1HB PRO 79 1HB PRO 79 -5.525 4.882 -12.572 573 2HB PRO 79 2HB PRO 79 -7.162 5.546 -12.496 574 1HG PRO 79 1HG PRO 79 -5.249 4.954 -10.283 575 2HG PRO 79 2HG PRO 79 -6.345 6.331 -10.479 576 1HD PRO 79 1HD PRO 79 -6.895 4.238 -8.845 577 2HD PRO 79 2HD PRO 79 -8.156 5.168 -9.673 578 H GLY 80 H GLY 80 -6.688 1.971 -13.978 579 1HA GLY 80 1HA GLY 80 -5.040 -0.026 -12.941 580 2HA GLY 80 2HA GLY 80 -5.189 0.374 -14.645 581 H LEU 81 H LEU 81 -3.765 1.968 -15.540 582 HA LEU 81 HA LEU 81 -1.195 1.992 -14.152 583 1HB LEU 81 1HB LEU 81 -1.764 1.355 -16.695 584 2HB LEU 81 2HB LEU 81 -1.397 3.060 -16.889 585 HG LEU 81 HG LEU 81 0.659 2.103 -17.245 586 1HD1 LEU 81 1HD1 LEU 81 0.561 2.609 -14.287 587 2HD1 LEU 81 2HD1 LEU 81 0.978 3.758 -15.557 588 3HD1 LEU 81 3HD1 LEU 81 2.042 2.397 -15.213 589 1HD2 LEU 81 1HD2 LEU 81 -0.330 -0.004 -15.440 590 2HD2 LEU 81 2HD2 LEU 81 1.413 0.265 -15.461 591 3HD2 LEU 81 3HD2 LEU 81 0.564 -0.131 -16.955 592 H VAL 82 H VAL 82 -0.544 3.726 -13.094 593 HA VAL 82 HA VAL 82 -1.469 6.369 -14.011 594 HB VAL 82 HB VAL 82 -0.980 5.577 -11.123 595 1HG1 VAL 82 1HG1 VAL 82 -1.678 8.154 -12.479 596 2HG1 VAL 82 2HG1 VAL 82 -0.481 7.839 -11.224 597 3HG1 VAL 82 3HG1 VAL 82 -2.198 7.844 -10.823 598 1HG2 VAL 82 1HG2 VAL 82 -3.422 5.891 -10.876 599 2HG2 VAL 82 2HG2 VAL 82 -3.010 4.546 -11.939 600 3HG2 VAL 82 3HG2 VAL 82 -3.552 6.077 -12.625 601 H GLU 83 H GLU 83 0.144 7.646 -14.635 602 HA GLU 83 HA GLU 83 2.867 6.874 -14.295 603 1HB GLU 83 1HB GLU 83 1.581 8.375 -16.133 604 2HB GLU 83 2HB GLU 83 2.258 9.650 -15.129 605 1HG GLU 83 1HG GLU 83 4.479 8.385 -15.388 606 2HG GLU 83 2HG GLU 83 3.680 7.555 -16.722 607 H VAL 84 H VAL 84 3.805 7.013 -12.367 608 HA VAL 84 HA VAL 84 3.041 8.965 -10.421 609 HB VAL 84 HB VAL 84 4.704 7.988 -8.990 610 1HG1 VAL 84 1HG1 VAL 84 2.853 6.653 -8.863 611 2HG1 VAL 84 2HG1 VAL 84 4.057 5.474 -9.382 612 3HG1 VAL 84 3HG1 VAL 84 2.946 6.177 -10.559 613 1HG2 VAL 84 1HG2 VAL 84 5.907 7.166 -11.506 614 2HG2 VAL 84 2HG2 VAL 84 5.857 5.875 -10.308 615 3HG2 VAL 84 3HG2 VAL 84 6.646 7.405 -9.923 616 H GLN 85 H GLN 85 3.764 10.934 -10.195 617 HA GLN 85 HA GLN 85 5.765 12.054 -11.876 618 1HB GLN 85 1HB GLN 85 4.849 13.433 -9.385 619 2HB GLN 85 2HB GLN 85 5.189 14.109 -10.971 620 1HG GLN 85 1HG GLN 85 3.112 12.734 -11.709 621 2HG GLN 85 2HG GLN 85 2.734 12.734 -9.987 622 1HE2 GLN 85 1HE2 GLN 85 3.407 15.153 -9.129 623 2HE2 GLN 85 2HE2 GLN 85 2.517 16.386 -9.949 624 H GLU 86 H GLU 86 7.794 12.950 -11.286 625 HA GLU 86 HA GLU 86 9.289 11.336 -9.503 626 1HB GLU 86 1HB GLU 86 10.343 12.349 -11.447 627 2HB GLU 86 2HB GLU 86 9.990 13.958 -10.836 628 1HG GLU 86 1HG GLU 86 11.447 13.460 -8.881 629 2HG GLU 86 2HG GLU 86 11.894 11.946 -9.666 630 H SER 87 H SER 87 8.780 11.419 -7.396 631 HA SER 87 HA SER 87 9.192 13.964 -6.019 632 1HB SER 87 1HB SER 87 6.868 12.354 -5.082 633 2HB SER 87 2HB SER 87 7.128 14.098 -5.023 634 HG SER 87 HG SER 87 5.577 13.718 -6.558 635 H GLU 88 H GLU 88 9.294 13.665 -3.624 636 HA GLU 88 HA GLU 88 10.349 12.758 -1.834 637 1HB GLU 88 1HB GLU 88 8.252 11.293 -2.133 638 2HB GLU 88 2HB GLU 88 9.351 10.073 -2.752 639 1HG GLU 88 1HG GLU 88 9.634 9.412 -0.660 640 2HG GLU 88 2HG GLU 88 10.538 10.902 -0.397 641 H TYR 89 H TYR 89 10.692 9.847 -3.826 642 HA TYR 89 HA TYR 89 13.481 10.387 -4.356 643 1HB TYR 89 1HB TYR 89 14.095 8.124 -3.267 644 2HB TYR 89 2HB TYR 89 13.883 9.521 -2.218 645 HD1 TYR 89 HD1 TYR 89 12.897 8.961 -0.215 646 HD2 TYR 89 HD2 TYR 89 11.570 7.003 -3.754 647 HE1 TYR 89 HE1 TYR 89 11.229 7.724 1.101 648 HE2 TYR 89 HE2 TYR 89 9.897 5.764 -2.447 649 HH TYR 89 HH TYR 89 9.965 5.507 0.855 650 H TYR 90 H TYR 90 10.879 9.698 -5.739 651 HA TYR 90 HA TYR 90 11.890 7.377 -7.239 652 1HB TYR 90 1HB TYR 90 9.630 7.286 -5.808 653 2HB TYR 90 2HB TYR 90 8.979 7.975 -7.292 654 HD1 TYR 90 HD1 TYR 90 8.430 6.583 -9.082 655 HD2 TYR 90 HD2 TYR 90 11.002 5.114 -6.028 656 HE1 TYR 90 HE1 TYR 90 8.328 4.341 -10.084 657 HE2 TYR 90 HE2 TYR 90 10.908 2.866 -7.023 658 HH TYR 90 HH TYR 90 8.666 2.038 -9.485 659 HA PRO 91 HA PRO 91 11.747 10.249 -10.651 660 1HB PRO 91 1HB PRO 91 12.702 8.633 -12.550 661 2HB PRO 91 2HB PRO 91 13.727 9.182 -11.217 662 1HG PRO 91 1HG PRO 91 12.353 6.554 -11.596 663 2HG PRO 91 2HG PRO 91 13.979 6.889 -10.974 664 1HD PRO 91 1HD PRO 91 11.760 6.371 -9.403 665 2HD PRO 91 2HD PRO 91 13.214 7.224 -8.852 666 H LYS 92 H LYS 92 10.449 10.719 -12.414 667 HA LYS 92 HA LYS 92 7.882 9.912 -12.584 668 1HB LYS 92 1HB LYS 92 9.664 10.721 -14.884 669 2HB LYS 92 2HB LYS 92 7.911 10.630 -14.980 670 1HG LYS 92 1HG LYS 92 8.890 12.242 -12.749 671 2HG LYS 92 2HG LYS 92 9.350 12.855 -14.338 672 1HD LYS 92 1HD LYS 92 6.542 11.984 -14.021 673 2HD LYS 92 2HD LYS 92 7.016 13.443 -13.150 674 1HE LYS 92 1HE LYS 92 6.446 14.418 -15.115 675 2HE LYS 92 2HE LYS 92 8.111 13.999 -15.518 676 1HZ LYS 92 1HZ LYS 92 7.461 12.371 -16.929 677 2HZ LYS 92 2HZ LYS 92 6.085 13.348 -17.059 678 3HZ LYS 92 3HZ LYS 92 6.065 11.989 -16.052 679 H ARG 93 H ARG 93 7.526 7.724 -12.308 680 HA ARG 93 HA ARG 93 8.252 6.029 -14.609 681 1HB ARG 93 1HB ARG 93 9.116 5.682 -12.013 682 2HB ARG 93 2HB ARG 93 7.747 4.585 -12.117 683 1HG ARG 93 1HG ARG 93 9.878 3.499 -12.667 684 2HG ARG 93 2HG ARG 93 8.735 3.464 -14.012 685 1HD ARG 93 1HD ARG 93 9.998 4.835 -15.298 686 2HD ARG 93 2HD ARG 93 10.579 5.769 -13.920 687 HE ARG 93 HE ARG 93 11.791 3.342 -13.650 688 1HH1 ARG 93 1HH1 ARG 93 11.630 5.730 -16.191 689 2HH1 ARG 93 2HH1 ARG 93 13.195 5.346 -16.823 690 1HH2 ARG 93 1HH2 ARG 93 13.851 2.837 -14.479 691 2HH2 ARG 93 2HH2 ARG 93 14.457 3.704 -15.851 692 H TYR 94 H TYR 94 6.841 3.883 -14.392 693 HA TYR 94 HA TYR 94 4.047 4.787 -14.340 694 1HB TYR 94 1HB TYR 94 5.539 2.761 -15.959 695 2HB TYR 94 2HB TYR 94 3.810 2.551 -15.709 696 HD1 TYR 94 HD1 TYR 94 2.285 3.688 -17.061 697 HD2 TYR 94 HD2 TYR 94 6.322 5.007 -16.911 698 HE1 TYR 94 HE1 TYR 94 1.820 5.277 -18.869 699 HE2 TYR 94 HE2 TYR 94 5.877 6.600 -18.722 700 HH TYR 94 HH TYR 94 2.701 7.325 -19.797 701 H GLN 95 H GLN 95 2.608 3.886 -12.983 702 HA GLN 95 HA GLN 95 3.400 1.446 -11.542 703 1HB GLN 95 1HB GLN 95 2.964 4.070 -10.462 704 2HB GLN 95 2HB GLN 95 1.746 2.973 -9.828 705 1HG GLN 95 1HG GLN 95 3.412 2.751 -8.276 706 2HG GLN 95 2HG GLN 95 3.778 1.417 -9.369 707 1HE2 GLN 95 1HE2 GLN 95 5.416 1.821 -11.021 708 2HE2 GLN 95 2HE2 GLN 95 6.735 2.872 -10.646 709 H SER 96 H SER 96 1.941 -0.150 -11.718 710 HA SER 96 HA SER 96 -0.724 0.528 -12.728 711 1HB SER 96 1HB SER 96 0.933 -1.337 -13.638 712 2HB SER 96 2HB SER 96 0.150 -2.303 -12.388 713 HG SER 96 HG SER 96 -1.620 -2.344 -13.534 714 H HIS 97 H HIS 97 -2.621 -0.486 -11.868 715 HA HIS 97 HA HIS 97 -4.082 -0.925 -10.188 716 1HB HIS 97 1HB HIS 97 -2.181 -2.917 -10.150 717 2HB HIS 97 2HB HIS 97 -2.209 -2.386 -8.472 718 HD1 HIS 97 HD1 HIS 97 -3.813 -4.689 -10.667 719 HD2 HIS 97 HD2 HIS 97 -5.064 -2.325 -7.487 720 HE1 HIS 97 HE1 HIS 97 -5.976 -5.706 -9.884 721 HE2 HIS 97 HE2 HIS 97 -6.756 -4.209 -8.013 722 H VAL 98 H VAL 98 -3.350 1.550 -9.870 723 HA VAL 98 HA VAL 98 -2.714 1.787 -6.999 724 HB VAL 98 HB VAL 98 -0.877 2.637 -8.462 725 1HG1 VAL 98 1HG1 VAL 98 -1.302 3.923 -10.208 726 2HG1 VAL 98 2HG1 VAL 98 -1.956 5.165 -9.140 727 3HG1 VAL 98 3HG1 VAL 98 -3.019 3.923 -9.808 728 1HG2 VAL 98 1HG2 VAL 98 -1.034 5.060 -7.370 729 2HG2 VAL 98 2HG2 VAL 98 -0.648 3.613 -6.435 730 3HG2 VAL 98 3HG2 VAL 98 -2.292 4.252 -6.433 731 H LEU 99 H LEU 99 -4.050 2.983 -5.768 732 HA LEU 99 HA LEU 99 -6.390 4.153 -7.080 733 1HB LEU 99 1HB LEU 99 -6.059 3.561 -4.146 734 2HB LEU 99 2HB LEU 99 -7.547 3.916 -5.001 735 HG LEU 99 HG LEU 99 -6.882 1.715 -6.334 736 1HD1 LEU 99 1HD1 LEU 99 -5.178 1.711 -3.942 737 2HD1 LEU 99 2HD1 LEU 99 -5.006 0.840 -5.465 738 3HD1 LEU 99 3HD1 LEU 99 -6.089 0.227 -4.216 739 1HD2 LEU 99 1HD2 LEU 99 -8.587 0.701 -5.213 740 2HD2 LEU 99 2HD2 LEU 99 -8.843 2.361 -4.675 741 3HD2 LEU 99 3HD2 LEU 99 -8.003 1.214 -3.630 742 H LEU 100 H LEU 100 -7.075 6.277 -6.583 743 HA LEU 100 HA LEU 100 -5.149 7.853 -5.025 744 1HB LEU 100 1HB LEU 100 -5.817 8.119 -7.860 745 2HB LEU 100 2HB LEU 100 -5.896 9.625 -6.963 746 HG LEU 100 HG LEU 100 -3.492 7.797 -7.054 747 1HD1 LEU 100 1HD1 LEU 100 -3.693 10.511 -8.305 748 2HD1 LEU 100 2HD1 LEU 100 -4.163 9.056 -9.187 749 3HD1 LEU 100 3HD1 LEU 100 -2.511 9.235 -8.594 750 1HD2 LEU 100 1HD2 LEU 100 -2.482 9.136 -5.557 751 2HD2 LEU 100 2HD2 LEU 100 -4.130 9.563 -5.097 752 3HD2 LEU 100 3HD2 LEU 100 -3.228 10.596 -6.205 753 H ALA 101 H ALA 101 -5.908 9.479 -3.816 754 HA ALA 101 HA ALA 101 -8.701 10.308 -4.043 755 1HB ALA 101 1HB ALA 101 -8.937 10.063 -1.542 756 2HB ALA 101 2HB ALA 101 -7.484 9.066 -1.588 757 3HB ALA 101 3HB ALA 101 -8.933 8.559 -2.461 758 H THR 102 H THR 102 -9.122 12.340 -3.058 759 HA THR 102 HA THR 102 -6.673 13.858 -2.448 760 HB THR 102 HB THR 102 -7.606 14.788 -4.388 761 HG1 THR 102 HG1 THR 102 -7.266 16.297 -2.576 762 1HG2 THR 102 1HG2 THR 102 -9.687 14.194 -4.908 763 2HG2 THR 102 2HG2 THR 102 -10.177 15.604 -3.968 764 3HG2 THR 102 3HG2 THR 102 -10.158 14.006 -3.219 765 H GLY 103 H GLY 103 -6.544 15.098 -0.632 766 1HA GLY 103 1HA GLY 103 -8.900 15.126 1.147 767 2HA GLY 103 2HA GLY 103 -7.320 14.656 1.755 768 H PHE 104 H PHE 104 -5.617 16.262 1.744 769 HA PHE 104 HA PHE 104 -6.651 19.020 1.784 770 1HB PHE 104 1HB PHE 104 -5.492 17.488 3.921 771 2HB PHE 104 2HB PHE 104 -4.448 18.858 3.553 772 HD1 PHE 104 HD1 PHE 104 -8.147 18.353 3.667 773 HD2 PHE 104 HD2 PHE 104 -4.783 20.589 5.008 774 HE1 PHE 104 HE1 PHE 104 -9.643 19.830 4.944 775 HE2 PHE 104 HE2 PHE 104 -6.274 22.070 6.289 776 HZ PHE 104 HZ PHE 104 -8.707 21.691 6.258 777 H SER 105 H SER 105 -5.057 20.690 1.385 778 HA SER 105 HA SER 105 -3.251 19.930 -0.725 779 1HB SER 105 1HB SER 105 -4.721 22.148 -0.334 780 2HB SER 105 2HB SER 105 -3.191 22.697 0.352 781 HG SER 105 HG SER 105 -3.832 22.628 -2.171 782 H GLU 106 H GLU 106 -1.576 18.759 0.150 783 HA GLU 106 HA GLU 106 0.586 20.213 1.246 784 1HB GLU 106 1HB GLU 106 -1.278 19.050 3.135 785 2HB GLU 106 2HB GLU 106 0.322 18.347 3.320 786 1HG GLU 106 1HG GLU 106 1.255 20.632 3.498 787 2HG GLU 106 2HG GLU 106 -0.389 21.267 3.445 788 HA PRO 107 HA PRO 107 2.947 16.959 -0.539 789 1HB PRO 107 1HB PRO 107 4.543 16.955 1.978 790 2HB PRO 107 2HB PRO 107 5.084 17.100 0.302 791 1HG PRO 107 1HG PRO 107 5.011 19.234 1.891 792 2HG PRO 107 2HG PRO 107 4.547 19.354 0.184 793 1HD PRO 107 1HD PRO 107 2.825 19.300 2.621 794 2HD PRO 107 2HD PRO 107 2.607 20.194 1.102 795 H GLY 108 H GLY 108 2.859 16.389 2.989 796 1HA GLY 108 1HA GLY 108 1.378 14.603 3.823 797 2HA GLY 108 2HA GLY 108 1.847 13.673 2.409 798 H ASP 109 H ASP 109 4.427 13.604 2.262 799 HA ASP 109 HA ASP 109 6.324 12.673 3.102 800 1HB ASP 109 1HB ASP 109 6.029 14.814 4.584 801 2HB ASP 109 2HB ASP 109 5.631 13.655 5.850 802 H ALA 110 H ALA 110 7.155 11.115 4.841 803 HA ALA 110 HA ALA 110 7.003 9.089 5.862 804 1HB ALA 110 1HB ALA 110 5.275 10.661 7.201 805 2HB ALA 110 2HB ALA 110 5.587 8.975 7.615 806 3HB ALA 110 3HB ALA 110 4.177 9.397 6.643 807 H GLY 111 H GLY 111 5.139 7.168 6.104 808 1HA GLY 111 1HA GLY 111 3.694 6.838 3.611 809 2HA GLY 111 2HA GLY 111 5.079 5.774 3.809 810 H GLY 112 H GLY 112 1.956 5.576 3.861 811 1HA GLY 112 1HA GLY 112 1.939 3.638 6.074 812 2HA GLY 112 2HA GLY 112 0.653 4.830 5.963 813 H ILE 113 H ILE 113 -0.760 2.947 5.872 814 HA ILE 113 HA ILE 113 -0.938 1.880 3.132 815 HB ILE 113 HB ILE 113 -1.908 -0.192 4.064 816 1HG1 ILE 113 1HG1 ILE 113 -1.043 0.975 6.719 817 2HG1 ILE 113 2HG1 ILE 113 -2.706 0.719 6.200 818 1HG2 ILE 113 1HG2 ILE 113 0.365 -0.329 3.466 819 2HG2 ILE 113 2HG2 ILE 113 0.256 -1.055 5.070 820 3HG2 ILE 113 3HG2 ILE 113 0.876 0.587 4.884 821 1HD1 ILE 113 1HD1 ILE 113 -2.537 -1.202 7.315 822 2HD1 ILE 113 2HD1 ILE 113 -0.774 -1.158 7.316 823 3HD1 ILE 113 3HD1 ILE 113 -1.639 -1.769 5.906 824 H LEU 114 H LEU 114 -2.993 1.661 2.248 825 HA LEU 114 HA LEU 114 -5.018 3.346 3.480 826 1HB LEU 114 1HB LEU 114 -4.750 3.785 1.192 827 2HB LEU 114 2HB LEU 114 -4.678 2.085 0.778 828 HG LEU 114 HG LEU 114 -7.042 1.832 1.066 829 1HD1 LEU 114 1HD1 LEU 114 -8.489 3.382 1.990 830 2HD1 LEU 114 2HD1 LEU 114 -7.347 4.714 1.799 831 3HD1 LEU 114 3HD1 LEU 114 -7.072 3.486 3.035 832 1HD2 LEU 114 1HD2 LEU 114 -6.105 2.941 -1.024 833 2HD2 LEU 114 2HD2 LEU 114 -6.726 4.452 -0.362 834 3HD2 LEU 114 3HD2 LEU 114 -7.832 3.126 -0.723 835 H ARG 115 H ARG 115 -6.386 2.477 4.885 836 HA ARG 115 HA ARG 115 -7.308 -0.282 4.405 837 1HB ARG 115 1HB ARG 115 -7.655 -0.433 6.868 838 2HB ARG 115 2HB ARG 115 -5.971 -0.245 6.401 839 1HG ARG 115 1HG ARG 115 -6.970 2.351 6.788 840 2HG ARG 115 2HG ARG 115 -7.567 1.379 8.135 841 1HD ARG 115 1HD ARG 115 -4.913 0.603 7.831 842 2HD ARG 115 2HD ARG 115 -4.894 2.350 7.593 843 HE ARG 115 HE ARG 115 -5.389 0.942 10.042 844 1HH1 ARG 115 1HH1 ARG 115 -5.974 3.908 8.297 845 2HH1 ARG 115 2HH1 ARG 115 -6.234 4.845 9.729 846 1HH2 ARG 115 1HH2 ARG 115 -5.732 2.173 11.927 847 2HH2 ARG 115 2HH2 ARG 115 -6.096 3.862 11.790 848 H CYS 116 H CYS 116 -9.467 -0.705 4.476 849 HA CYS 116 HA CYS 116 -11.224 1.633 4.757 850 1HB CYS 116 1HB CYS 116 -12.814 0.505 3.341 851 2HB CYS 116 2HB CYS 116 -11.243 0.463 2.552 852 H GLU 117 H GLU 117 -13.464 1.088 5.591 853 HA GLU 117 HA GLU 117 -13.306 0.157 8.203 854 1HB GLU 117 1HB GLU 117 -15.658 0.507 6.353 855 2HB GLU 117 2HB GLU 117 -15.848 0.011 8.029 856 1HG GLU 117 1HG GLU 117 -14.639 2.581 7.038 857 2HG GLU 117 2HG GLU 117 -16.202 2.381 7.830 858 H HIS 118 H HIS 118 -13.595 -1.628 5.283 859 HA HIS 118 HA HIS 118 -14.631 -3.996 6.610 860 1HB HIS 118 1HB HIS 118 -13.724 -3.825 3.745 861 2HB HIS 118 2HB HIS 118 -14.882 -4.942 4.459 862 HD2 HIS 118 HD2 HIS 118 -17.334 -3.474 5.356 863 HE1 HIS 118 HE1 HIS 118 -16.858 -0.637 2.235 864 HE2 HIS 118 HE2 HIS 118 -18.399 -1.535 4.016 865 H GLY 119 H GLY 119 -11.567 -2.669 5.670 866 1HA GLY 119 1HA GLY 119 -9.987 -4.366 7.112 867 2HA GLY 119 2HA GLY 119 -10.174 -5.195 5.574 868 H VAL 120 H VAL 120 -8.111 -5.051 4.897 869 HA VAL 120 HA VAL 120 -6.861 -2.407 4.689 870 HB VAL 120 HB VAL 120 -5.513 -5.002 3.994 871 1HG1 VAL 120 1HG1 VAL 120 -4.713 -2.204 4.415 872 2HG1 VAL 120 2HG1 VAL 120 -4.032 -3.441 3.358 873 3HG1 VAL 120 3HG1 VAL 120 -3.629 -3.429 5.075 874 1HG2 VAL 120 1HG2 VAL 120 -4.781 -4.117 6.613 875 2HG2 VAL 120 2HG2 VAL 120 -5.417 -5.679 6.103 876 3HG2 VAL 120 3HG2 VAL 120 -6.523 -4.380 6.549 877 H ILE 121 H ILE 121 -6.453 -1.440 2.766 878 HA ILE 121 HA ILE 121 -7.527 -2.747 0.375 879 HB ILE 121 HB ILE 121 -6.613 0.108 0.664 880 1HG1 ILE 121 1HG1 ILE 121 -8.712 -0.959 2.035 881 2HG1 ILE 121 2HG1 ILE 121 -8.615 0.721 1.527 882 1HG2 ILE 121 1HG2 ILE 121 -7.960 -1.453 -1.488 883 2HG2 ILE 121 2HG2 ILE 121 -6.654 -0.272 -1.596 884 3HG2 ILE 121 3HG2 ILE 121 -8.310 0.268 -1.319 885 1HD1 ILE 121 1HD1 ILE 121 -9.810 -1.264 -0.335 886 2HD1 ILE 121 2HD1 ILE 121 -10.166 0.450 -0.125 887 3HD1 ILE 121 3HD1 ILE 121 -10.744 -0.723 1.058 888 H GLY 122 H GLY 122 -4.780 -0.546 0.987 889 1HA GLY 122 1HA GLY 122 -2.956 -2.408 -0.294 890 2HA GLY 122 2HA GLY 122 -3.257 -0.921 -1.177 891 H LEU 123 H LEU 123 -1.044 -0.368 -0.984 892 HA LEU 123 HA LEU 123 -0.384 0.730 1.657 893 1HB LEU 123 1HB LEU 123 1.832 -0.022 1.596 894 2HB LEU 123 2HB LEU 123 0.865 -1.407 1.135 895 HG LEU 123 HG LEU 123 2.716 -1.470 -0.294 896 1HD1 LEU 123 1HD1 LEU 123 0.666 0.001 -1.928 897 2HD1 LEU 123 2HD1 LEU 123 0.500 -1.682 -1.427 898 3HD1 LEU 123 3HD1 LEU 123 1.831 -1.203 -2.480 899 1HD2 LEU 123 1HD2 LEU 123 3.028 1.169 0.245 900 2HD2 LEU 123 2HD2 LEU 123 2.509 1.222 -1.439 901 3HD2 LEU 123 3HD2 LEU 123 3.930 0.283 -0.984 902 H VAL 124 H VAL 124 1.323 2.414 1.564 903 HA VAL 124 HA VAL 124 0.586 4.495 -0.125 904 HB VAL 124 HB VAL 124 1.725 4.820 2.027 905 1HG1 VAL 124 1HG1 VAL 124 4.413 4.444 0.900 906 2HG1 VAL 124 2HG1 VAL 124 3.504 2.961 1.190 907 3HG1 VAL 124 3HG1 VAL 124 3.797 4.090 2.514 908 1HG2 VAL 124 1HG2 VAL 124 2.728 6.103 -0.468 909 2HG2 VAL 124 2HG2 VAL 124 3.488 6.513 1.069 910 3HG2 VAL 124 3HG2 VAL 124 1.761 6.782 0.840 911 H THR 125 H THR 125 0.847 4.691 -2.236 912 HA THR 125 HA THR 125 3.213 3.499 -3.500 913 HB THR 125 HB THR 125 0.469 4.180 -4.499 914 HG1 THR 125 HG1 THR 125 0.733 2.092 -5.411 915 1HG2 THR 125 1HG2 THR 125 1.676 3.393 -6.784 916 2HG2 THR 125 2HG2 THR 125 2.924 4.429 -6.088 917 3HG2 THR 125 3HG2 THR 125 1.306 5.069 -6.380 918 H MET 126 H MET 126 1.300 6.218 -4.753 919 HA MET 126 HA MET 126 3.592 7.985 -4.250 920 1HB MET 126 1HB MET 126 2.762 6.980 -6.819 921 2HB MET 126 2HB MET 126 2.614 8.732 -6.771 922 1HG MET 126 1HG MET 126 5.098 7.789 -5.611 923 2HG MET 126 2HG MET 126 4.901 7.300 -7.292 924 1HE MET 126 1HE MET 126 7.014 10.836 -6.380 925 2HE MET 126 2HE MET 126 7.281 9.094 -6.439 926 3HE MET 126 3HE MET 126 6.379 9.802 -5.099 927 H GLY 127 H GLY 127 3.050 9.936 -3.521 928 1HA GLY 127 1HA GLY 127 0.200 10.684 -3.648 929 2HA GLY 127 2HA GLY 127 1.305 11.167 -2.372 930 H GLY 128 H GLY 128 -0.421 12.795 -4.117 931 1HA GLY 128 1HA GLY 128 1.607 14.317 -5.617 932 2HA GLY 128 2HA GLY 128 -0.129 14.418 -5.869 933 H GLU 129 H GLU 129 0.079 16.707 -5.720 934 HA GLU 129 HA GLU 129 1.036 17.974 -3.353 935 1HB GLU 129 1HB GLU 129 -0.041 20.006 -4.309 936 2HB GLU 129 2HB GLU 129 1.049 19.197 -5.427 937 1HG GLU 129 1HG GLU 129 -1.184 18.008 -6.185 938 2HG GLU 129 2HG GLU 129 -1.903 19.471 -5.512 939 H GLY 130 H GLY 130 -1.929 16.462 -4.200 940 1HA GLY 130 1HA GLY 130 -3.002 17.049 -1.579 941 2HA GLY 130 2HA GLY 130 -3.915 17.753 -2.903 942 H VAL 131 H VAL 131 -2.376 14.778 -3.635 943 HA VAL 131 HA VAL 131 -4.879 13.324 -3.122 944 HB VAL 131 HB VAL 131 -3.251 12.495 -5.462 945 1HG1 VAL 131 1HG1 VAL 131 -5.198 11.211 -4.788 946 2HG1 VAL 131 2HG1 VAL 131 -5.462 11.951 -6.367 947 3HG1 VAL 131 3HG1 VAL 131 -6.212 12.647 -4.931 948 1HG2 VAL 131 1HG2 VAL 131 -5.166 14.814 -5.644 949 2HG2 VAL 131 2HG2 VAL 131 -4.250 14.082 -6.962 950 3HG2 VAL 131 3HG2 VAL 131 -3.409 14.964 -5.686 951 H VAL 132 H VAL 132 -4.642 11.001 -2.901 952 HA VAL 132 HA VAL 132 -1.967 10.244 -1.914 953 HB VAL 132 HB VAL 132 -3.069 8.738 -0.340 954 1HG1 VAL 132 1HG1 VAL 132 -4.641 11.080 0.334 955 2HG1 VAL 132 2HG1 VAL 132 -3.006 11.501 -0.181 956 3HG1 VAL 132 3HG1 VAL 132 -3.248 10.380 1.159 957 1HG2 VAL 132 1HG2 VAL 132 -5.609 9.079 -0.061 958 2HG2 VAL 132 2HG2 VAL 132 -5.044 8.041 -1.369 959 3HG2 VAL 132 3HG2 VAL 132 -5.559 9.691 -1.715 960 H GLY 133 H GLY 133 -0.988 8.753 -3.149 961 1HA GLY 133 1HA GLY 133 -2.655 7.003 -4.821 962 2HA GLY 133 2HA GLY 133 -0.949 7.324 -5.070 963 H PHE 134 H PHE 134 -3.143 5.085 -3.981 964 HA PHE 134 HA PHE 134 -1.096 3.719 -2.356 965 1HB PHE 134 1HB PHE 134 -4.108 3.488 -2.167 966 2HB PHE 134 2HB PHE 134 -2.951 2.588 -1.190 967 HD1 PHE 134 HD1 PHE 134 -1.129 4.220 -0.059 968 HD2 PHE 134 HD2 PHE 134 -5.105 5.281 -1.132 969 HE1 PHE 134 HE1 PHE 134 -1.077 6.051 1.583 970 HE2 PHE 134 HE2 PHE 134 -5.063 7.110 0.510 971 HZ PHE 134 HZ PHE 134 -3.044 7.500 1.865 972 H ALA 135 H ALA 135 -0.558 1.644 -2.846 973 HA ALA 135 HA ALA 135 -1.550 0.601 -5.378 974 1HB ALA 135 1HB ALA 135 0.300 -1.205 -4.278 975 2HB ALA 135 2HB ALA 135 0.902 0.409 -3.896 976 3HB ALA 135 3HB ALA 135 0.574 -0.035 -5.569 977 H ASP 136 H ASP 136 -3.277 -0.658 -5.381 978 HA ASP 136 HA ASP 136 -4.399 -1.765 -3.040 979 1HB ASP 136 1HB ASP 136 -5.341 -1.199 -5.525 980 2HB ASP 136 2HB ASP 136 -5.238 -2.955 -5.602 981 H VAL 137 H VAL 137 -4.514 -3.789 -2.243 982 HA VAL 137 HA VAL 137 -2.425 -5.648 -3.065 983 HB VAL 137 HB VAL 137 -4.338 -5.802 -0.724 984 1HG1 VAL 137 1HG1 VAL 137 -2.428 -7.335 0.124 985 2HG1 VAL 137 2HG1 VAL 137 -2.019 -7.483 -1.582 986 3HG1 VAL 137 3HG1 VAL 137 -3.611 -7.981 -1.011 987 1HG2 VAL 137 1HG2 VAL 137 -3.031 -4.410 0.410 988 2HG2 VAL 137 2HG2 VAL 137 -2.199 -4.050 -1.103 989 3HG2 VAL 137 3HG2 VAL 137 -1.582 -5.313 -0.037 990 H ARG 138 H ARG 138 -5.298 -5.072 -4.279 991 HA ARG 138 HA ARG 138 -6.666 -7.554 -4.144 992 1HB ARG 138 1HB ARG 138 -6.915 -5.456 -6.297 993 2HB ARG 138 2HB ARG 138 -8.116 -6.650 -5.825 994 1HG ARG 138 1HG ARG 138 -7.247 -4.880 -3.655 995 2HG ARG 138 2HG ARG 138 -8.073 -4.069 -4.985 996 1HD ARG 138 1HD ARG 138 -9.166 -6.534 -3.654 997 2HD ARG 138 2HD ARG 138 -9.531 -4.905 -3.086 998 HE ARG 138 HE ARG 138 -10.177 -4.783 -5.700 999 1HH1 ARG 138 1HH1 ARG 138 -11.031 -7.018 -3.159 1000 2HH1 ARG 138 2HH1 ARG 138 -12.576 -7.397 -3.841 1001 1HH2 ARG 138 1HH2 ARG 138 -12.210 -5.281 -6.597 1002 2HH2 ARG 138 2HH2 ARG 138 -13.246 -6.412 -5.792 1003 H ASP 139 H ASP 139 -3.802 -6.754 -5.675 1004 HA ASP 139 HA ASP 139 -4.238 -8.582 -7.917 1005 1HB ASP 139 1HB ASP 139 -2.094 -7.748 -8.767 1006 2HB ASP 139 2HB ASP 139 -3.198 -6.419 -8.423 1007 H LEU 140 H LEU 140 -3.623 -9.112 -4.857 1008 HA LEU 140 HA LEU 140 -2.383 -11.590 -5.230 1009 1HB LEU 140 1HB LEU 140 -0.200 -11.227 -4.223 1010 2HB LEU 140 2HB LEU 140 -0.373 -10.292 -5.691 1011 HG LEU 140 HG LEU 140 0.606 -8.694 -4.427 1012 1HD1 LEU 140 1HD1 LEU 140 -0.975 -7.196 -3.313 1013 2HD1 LEU 140 2HD1 LEU 140 -2.210 -8.454 -3.395 1014 3HD1 LEU 140 3HD1 LEU 140 -1.575 -7.746 -4.880 1015 1HD2 LEU 140 1HD2 LEU 140 -0.602 -9.232 -1.811 1016 2HD2 LEU 140 2HD2 LEU 140 1.072 -8.888 -2.247 1017 3HD2 LEU 140 3HD2 LEU 140 0.424 -10.518 -2.447 1018 H LEU 141 H LEU 141 -4.616 -10.859 -3.927 1019 HA LEU 141 HA LEU 141 -4.303 -10.336 -1.173 1020 1HB LEU 141 1HB LEU 141 -6.433 -10.633 -2.959 1021 2HB LEU 141 2HB LEU 141 -6.682 -11.857 -1.728 1022 HG LEU 141 HG LEU 141 -7.844 -10.029 -0.899 1023 1HD1 LEU 141 1HD1 LEU 141 -5.656 -9.023 0.610 1024 2HD1 LEU 141 2HD1 LEU 141 -5.465 -10.762 0.413 1025 3HD1 LEU 141 3HD1 LEU 141 -6.945 -10.115 1.113 1026 1HD2 LEU 141 1HD2 LEU 141 -7.539 -7.934 -1.576 1027 2HD2 LEU 141 2HD2 LEU 141 -6.245 -8.546 -2.604 1028 3HD2 LEU 141 3HD2 LEU 141 -5.873 -7.920 -0.998 1029 H TRP 142 H TRP 142 -3.708 -13.171 -2.955 1030 HA TRP 142 HA TRP 142 -4.474 -15.192 -1.227 1031 1HB TRP 142 1HB TRP 142 -2.562 -16.507 -2.213 1032 2HB TRP 142 2HB TRP 142 -3.673 -15.802 -3.382 1033 HD1 TRP 142 HD1 TRP 142 -2.730 -13.426 -4.566 1034 HE1 TRP 142 HE1 TRP 142 -0.329 -12.874 -5.305 1035 HE3 TRP 142 HE3 TRP 142 -0.203 -16.895 -1.787 1036 HZ2 TRP 142 HZ2 TRP 142 2.281 -13.789 -4.783 1037 HZ3 TRP 142 HZ3 TRP 142 2.251 -16.990 -1.970 1038 HH2 TRP 142 HH2 TRP 142 3.466 -15.467 -3.437 1039 H LEU 143 H LEU 143 -4.184 -14.329 0.872 1040 HA LEU 143 HA LEU 143 -1.625 -15.048 2.035 1041 1HB LEU 143 1HB LEU 143 -2.848 -12.329 2.528 1042 2HB LEU 143 2HB LEU 143 -1.435 -12.977 3.333 1043 HG LEU 143 HG LEU 143 -0.502 -13.100 0.845 1044 1HD1 LEU 143 1HD1 LEU 143 -2.905 -11.430 0.681 1045 2HD1 LEU 143 2HD1 LEU 143 -2.020 -12.287 -0.583 1046 3HD1 LEU 143 3HD1 LEU 143 -1.451 -10.717 -0.018 1047 1HD2 LEU 143 1HD2 LEU 143 0.721 -11.180 1.301 1048 2HD2 LEU 143 2HD2 LEU 143 0.240 -11.732 2.905 1049 3HD2 LEU 143 3HD2 LEU 143 -0.623 -10.401 2.136 1050 H GLU 144 H GLU 144 -4.893 -13.802 2.544 1051 HA GLU 144 HA GLU 144 -5.357 -15.799 4.590 1052 1HB GLU 144 1HB GLU 144 -5.020 -12.922 5.181 1053 2HB GLU 144 2HB GLU 144 -6.420 -13.684 5.918 1054 1HG GLU 144 1HG GLU 144 -4.756 -15.483 6.702 1055 2HG GLU 144 2HG GLU 144 -3.520 -14.284 6.322 1056 H ASP 145 H ASP 145 -7.761 -14.977 5.567 1057 HA ASP 145 HA ASP 145 -9.547 -15.618 3.517 1058 1HB ASP 145 1HB ASP 145 -9.741 -14.758 6.325 1059 2HB ASP 145 2HB ASP 145 -11.145 -14.350 5.343 1060 H ASP 146 H ASP 146 -10.624 -14.461 2.036 1061 HA ASP 146 HA ASP 146 -10.064 -11.599 1.873 1062 1HB ASP 146 1HB ASP 146 -11.083 -11.848 -0.432 1063 2HB ASP 146 2HB ASP 146 -9.604 -12.763 -0.156 1064 H ALA 147 H ALA 147 -11.738 -10.059 1.439 1065 HA ALA 147 HA ALA 147 -14.069 -10.477 3.035 1066 1HB ALA 147 1HB ALA 147 -12.840 -8.297 2.765 1067 2HB ALA 147 2HB ALA 147 -14.593 -8.204 2.599 1068 3HB ALA 147 3HB ALA 147 -13.568 -8.174 1.164 1069 H MET 148 H MET 148 -16.232 -10.529 2.390 1070 HA MET 148 HA MET 148 -16.717 -11.023 -0.469 1071 1HB MET 148 1HB MET 148 -17.094 -12.842 1.772 1072 2HB MET 148 2HB MET 148 -18.581 -12.599 0.867 1073 1HG MET 148 1HG MET 148 -16.111 -13.139 -0.676 1074 2HG MET 148 2HG MET 148 -16.817 -14.471 0.238 1075 1HE MET 148 1HE MET 148 -16.351 -15.019 -2.324 1076 2HE MET 148 2HE MET 148 -16.893 -13.839 -3.517 1077 3HE MET 148 3HE MET 148 -17.790 -15.340 -3.292 1078 H GLU 149 H GLU 149 -18.130 -9.610 -1.233 1079 HA GLU 149 HA GLU 149 -20.195 -8.556 0.587 1080 1HB GLU 149 1HB GLU 149 -18.287 -7.061 -0.554 1081 2HB GLU 149 2HB GLU 149 -19.462 -7.041 -1.862 1082 1HG GLU 149 1HG GLU 149 -20.172 -5.213 -0.745 1083 2HG GLU 149 2HG GLU 149 -21.097 -6.428 0.137 1084 H GLN 150 H GLN 150 -20.361 -10.965 -1.045 1085 HA GLN 150 HA GLN 150 -21.838 -12.032 -2.406 1086 1HB GLN 150 1HB GLN 150 -23.406 -10.688 -0.876 1087 2HB GLN 150 2HB GLN 150 -23.600 -9.598 -2.242 1088 1HG GLN 150 1HG GLN 150 -24.939 -11.010 -3.341 1089 2HG GLN 150 2HG GLN 150 -23.982 -12.422 -2.897 1090 1HE2 GLN 150 1HE2 GLN 150 -25.315 -13.824 -1.998 1091 2HE2 GLN 150 2HE2 GLN 150 -26.460 -13.477 -0.751 Start of MODEL 15 1 1H GLY 1 1H GLY 1 12.066 2.788 24.427 2 2H GLY 1 2H GLY 1 11.318 1.278 24.566 3 3H GLY 1 3H GLY 1 11.072 2.455 25.755 4 1HA GLY 1 1HA GLY 1 9.712 3.748 24.424 5 2HA GLY 1 2HA GLY 1 10.317 2.990 22.959 6 HA PRO 2 HA PRO 2 7.081 0.036 25.088 7 1HB PRO 2 1HB PRO 2 5.144 1.350 26.461 8 2HB PRO 2 2HB PRO 2 6.615 0.739 27.226 9 1HG PRO 2 1HG PRO 2 5.970 3.515 26.310 10 2HG PRO 2 2HG PRO 2 6.757 2.986 27.809 11 1HD PRO 2 1HD PRO 2 8.147 3.947 25.694 12 2HD PRO 2 2HD PRO 2 8.804 2.711 26.785 13 H TYR 3 H TYR 3 6.220 3.288 24.017 14 HA TYR 3 HA TYR 3 4.117 2.115 22.318 15 1HB TYR 3 1HB TYR 3 3.100 4.387 22.301 16 2HB TYR 3 2HB TYR 3 3.162 3.668 23.906 17 HD1 TYR 3 HD1 TYR 3 4.448 4.664 25.656 18 HD2 TYR 3 HD2 TYR 3 4.657 6.220 21.702 19 HE1 TYR 3 HE1 TYR 3 5.611 6.655 26.508 20 HE2 TYR 3 HE2 TYR 3 5.821 8.216 22.543 21 HH TYR 3 HH TYR 3 7.286 8.417 25.420 22 H GLY 4 H GLY 4 3.686 3.662 20.352 23 1HA GLY 4 1HA GLY 4 4.521 4.871 18.533 24 2HA GLY 4 2HA GLY 4 6.112 4.854 19.281 25 H HIS 5 H HIS 5 4.078 2.039 18.679 26 HA HIS 5 HA HIS 5 6.173 0.567 17.505 27 1HB HIS 5 1HB HIS 5 3.468 0.102 18.291 28 2HB HIS 5 2HB HIS 5 3.676 -0.506 16.652 29 HD1 HIS 5 HD1 HIS 5 5.442 -0.797 20.012 30 HD2 HIS 5 HD2 HIS 5 4.704 -3.006 16.570 31 HE1 HIS 5 HE1 HIS 5 6.410 -3.076 20.455 32 HE2 HIS 5 HE2 HIS 5 6.033 -4.366 18.324 33 H GLN 6 H GLN 6 3.179 1.744 15.954 34 HA GLN 6 HA GLN 6 2.720 2.376 13.820 35 1HB GLN 6 1HB GLN 6 5.281 3.492 14.451 36 2HB GLN 6 2HB GLN 6 5.279 3.006 12.761 37 1HG GLN 6 1HG GLN 6 2.999 4.253 12.687 38 2HG GLN 6 2HG GLN 6 3.593 5.034 14.151 39 1HE2 GLN 6 1HE2 GLN 6 3.101 5.917 11.290 40 2HE2 GLN 6 2HE2 GLN 6 4.556 6.738 10.852 41 H SER 7 H SER 7 3.612 2.038 11.416 42 HA SER 7 HA SER 7 4.954 -0.506 11.074 43 1HB SER 7 1HB SER 7 2.029 -0.118 10.469 44 2HB SER 7 2HB SER 7 2.993 -1.315 9.606 45 HG SER 7 HG SER 7 3.493 -2.254 11.634 46 H GLY 8 H GLY 8 5.462 -0.968 8.834 47 1HA GLY 8 1HA GLY 8 5.162 1.347 7.035 48 2HA GLY 8 2HA GLY 8 6.750 0.651 7.316 49 H ALA 9 H ALA 9 3.916 -1.363 7.158 50 HA ALA 9 HA ALA 9 3.923 -1.925 4.403 51 1HB ALA 9 1HB ALA 9 5.982 -2.952 4.448 52 2HB ALA 9 2HB ALA 9 4.911 -4.321 4.748 53 3HB ALA 9 3HB ALA 9 5.763 -3.558 6.091 54 H VAL 10 H VAL 10 2.973 -4.323 4.098 55 HA VAL 10 HA VAL 10 0.819 -4.589 6.096 56 HB VAL 10 HB VAL 10 0.662 -5.295 3.162 57 1HG1 VAL 10 1HG1 VAL 10 -0.910 -6.643 4.178 58 2HG1 VAL 10 2HG1 VAL 10 -1.856 -5.198 3.823 59 3HG1 VAL 10 3HG1 VAL 10 -1.245 -5.472 5.454 60 1HG2 VAL 10 1HG2 VAL 10 -0.665 -3.318 2.856 61 2HG2 VAL 10 2HG2 VAL 10 0.872 -2.854 3.585 62 3HG2 VAL 10 3HG2 VAL 10 -0.584 -2.943 4.578 63 H TYR 11 H TYR 11 1.276 -6.307 7.342 64 HA TYR 11 HA TYR 11 2.498 -8.679 6.124 65 1HB TYR 11 1HB TYR 11 3.610 -7.817 8.108 66 2HB TYR 11 2HB TYR 11 2.104 -7.874 9.016 67 HD1 TYR 11 HD1 TYR 11 1.010 -10.262 9.217 68 HD2 TYR 11 HD2 TYR 11 5.106 -9.563 8.298 69 HE1 TYR 11 HE1 TYR 11 1.565 -12.529 9.988 70 HE2 TYR 11 HE2 TYR 11 5.670 -11.830 9.065 71 HH TYR 11 HH TYR 11 3.603 -14.230 9.392 72 H VAL 12 H VAL 12 1.167 -10.239 5.465 73 HA VAL 12 HA VAL 12 -1.312 -10.692 6.990 74 HB VAL 12 HB VAL 12 -0.966 -11.194 4.030 75 1HG1 VAL 12 1HG1 VAL 12 -3.437 -11.195 5.760 76 2HG1 VAL 12 2HG1 VAL 12 -2.603 -12.636 5.179 77 3HG1 VAL 12 3HG1 VAL 12 -3.363 -11.533 4.030 78 1HG2 VAL 12 1HG2 VAL 12 -1.247 -9.003 3.761 79 2HG2 VAL 12 2HG2 VAL 12 -1.528 -8.762 5.485 80 3HG2 VAL 12 3HG2 VAL 12 -2.869 -9.200 4.427 81 H GLY 13 H GLY 13 -1.048 -12.467 8.177 82 1HA GLY 13 1HA GLY 13 -0.476 -14.603 8.801 83 2HA GLY 13 2HA GLY 13 -0.938 -15.021 7.160 84 H ASN 14 H ASN 14 0.555 -16.271 6.277 85 HA ASN 14 HA ASN 14 3.337 -16.043 7.078 86 1HB ASN 14 1HB ASN 14 3.647 -18.080 5.693 87 2HB ASN 14 2HB ASN 14 2.405 -18.272 6.925 88 1HD2 ASN 14 1HD2 ASN 14 3.028 -17.872 3.521 89 2HD2 ASN 14 2HD2 ASN 14 1.478 -18.402 2.973 90 H TYR 15 H TYR 15 1.736 -14.171 5.147 91 HA TYR 15 HA TYR 15 3.892 -13.993 3.143 92 1HB TYR 15 1HB TYR 15 0.912 -13.841 2.728 93 2HB TYR 15 2HB TYR 15 2.012 -13.016 1.636 94 HD1 TYR 15 HD1 TYR 15 0.031 -15.165 0.923 95 HD2 TYR 15 HD2 TYR 15 4.153 -15.376 1.932 96 HE1 TYR 15 HE1 TYR 15 0.231 -17.232 -0.380 97 HE2 TYR 15 HE2 TYR 15 4.363 -17.443 0.629 98 HH TYR 15 HH TYR 15 3.263 -18.617 -1.163 99 H LYS 16 H LYS 16 4.819 -12.001 3.119 100 HA LYS 16 HA LYS 16 3.294 -9.776 4.317 101 1HB LYS 16 1HB LYS 16 5.204 -10.561 5.720 102 2HB LYS 16 2HB LYS 16 6.292 -10.151 4.402 103 1HG LYS 16 1HG LYS 16 5.116 -7.799 4.630 104 2HG LYS 16 2HG LYS 16 4.816 -8.380 6.268 105 1HD LYS 16 1HD LYS 16 7.260 -8.876 6.452 106 2HD LYS 16 2HD LYS 16 7.482 -8.082 4.892 107 1HE LYS 16 1HE LYS 16 7.205 -6.016 5.759 108 2HE LYS 16 2HE LYS 16 5.968 -6.546 6.897 109 1HZ LYS 16 1HZ LYS 16 8.780 -7.320 7.307 110 2HZ LYS 16 2HZ LYS 16 7.538 -7.169 8.445 111 3HZ LYS 16 3HZ LYS 16 8.248 -5.785 7.781 112 H VAL 17 H VAL 17 2.735 -8.331 2.801 113 HA VAL 17 HA VAL 17 4.466 -8.065 0.458 114 HB VAL 17 HB VAL 17 2.679 -7.533 -0.820 115 1HG1 VAL 17 1HG1 VAL 17 2.111 -9.558 0.780 116 2HG1 VAL 17 2HG1 VAL 17 0.954 -8.954 -0.407 117 3HG1 VAL 17 3HG1 VAL 17 0.813 -8.476 1.285 118 1HG2 VAL 17 1HG2 VAL 17 1.414 -6.136 1.534 119 2HG2 VAL 17 2HG2 VAL 17 0.714 -6.230 -0.084 120 3HG2 VAL 17 3HG2 VAL 17 2.237 -5.377 0.171 121 H VAL 18 H VAL 18 5.812 -6.442 0.289 122 HA VAL 18 HA VAL 18 5.164 -3.873 1.544 123 HB VAL 18 HB VAL 18 6.676 -5.062 3.078 124 1HG1 VAL 18 1HG1 VAL 18 8.716 -5.936 2.503 125 2HG1 VAL 18 2HG1 VAL 18 8.903 -4.870 1.111 126 3HG1 VAL 18 3HG1 VAL 18 7.805 -6.247 1.026 127 1HG2 VAL 18 1HG2 VAL 18 8.238 -2.860 1.766 128 2HG2 VAL 18 2HG2 VAL 18 8.126 -3.267 3.478 129 3HG2 VAL 18 3HG2 VAL 18 6.746 -2.543 2.651 130 H ASN 19 H ASN 19 6.487 -2.071 0.688 131 HA ASN 19 HA ASN 19 6.534 -2.041 -2.118 132 1HB ASN 19 1HB ASN 19 8.042 -0.212 -0.233 133 2HB ASN 19 2HB ASN 19 7.635 0.128 -1.913 134 1HD2 ASN 19 1HD2 ASN 19 5.224 -0.076 -2.380 135 2HD2 ASN 19 2HD2 ASN 19 4.167 0.656 -1.227 136 H ARG 20 H ARG 20 8.177 -2.288 -3.614 137 HA ARG 20 HA ARG 20 10.216 -4.096 -3.058 138 1HB ARG 20 1HB ARG 20 11.125 -3.538 -5.254 139 2HB ARG 20 2HB ARG 20 9.378 -3.714 -5.319 140 1HG ARG 20 1HG ARG 20 9.476 -1.808 -6.481 141 2HG ARG 20 2HG ARG 20 9.605 -1.053 -4.893 142 1HD ARG 20 1HD ARG 20 11.308 -0.260 -6.519 143 2HD ARG 20 2HD ARG 20 11.997 -0.972 -5.062 144 HE ARG 20 HE ARG 20 11.704 -2.823 -7.247 145 1HH1 ARG 20 1HH1 ARG 20 13.783 -0.449 -5.752 146 2HH1 ARG 20 2HH1 ARG 20 15.230 -1.098 -6.446 147 1HH2 ARG 20 1HH2 ARG 20 13.609 -3.676 -8.159 148 2HH2 ARG 20 2HH2 ARG 20 15.132 -2.929 -7.812 149 H HIS 21 H HIS 21 10.358 -0.558 -3.258 150 HA HIS 21 HA HIS 21 13.155 -0.389 -2.843 151 1HB HIS 21 1HB HIS 21 11.326 1.391 -3.647 152 2HB HIS 21 2HB HIS 21 11.408 1.845 -1.948 153 HD1 HIS 21 HD1 HIS 21 13.724 1.418 -4.926 154 HD2 HIS 21 HD2 HIS 21 13.490 3.482 -1.327 155 HE1 HIS 21 HE1 HIS 21 15.700 2.973 -4.913 156 HE2 HIS 21 HE2 HIS 21 15.590 4.142 -2.685 157 H LEU 22 H LEU 22 10.655 -1.265 -0.752 158 HA LEU 22 HA LEU 22 12.262 -0.506 1.591 159 1HB LEU 22 1HB LEU 22 9.719 0.222 1.128 160 2HB LEU 22 2HB LEU 22 9.437 -1.297 1.957 161 HG LEU 22 HG LEU 22 11.129 -0.273 3.711 162 1HD1 LEU 22 1HD1 LEU 22 11.784 1.763 2.983 163 2HD1 LEU 22 2HD1 LEU 22 10.285 2.263 3.764 164 3HD1 LEU 22 3HD1 LEU 22 10.329 2.011 2.019 165 1HD2 LEU 22 1HD2 LEU 22 9.151 0.728 4.882 166 2HD2 LEU 22 2HD2 LEU 22 8.923 -0.928 4.317 167 3HD2 LEU 22 3HD2 LEU 22 8.214 0.415 3.421 168 H ALA 23 H ALA 23 11.664 -3.168 -0.298 169 HA ALA 23 HA ALA 23 11.304 -5.035 1.905 170 1HB ALA 23 1HB ALA 23 11.225 -5.196 -1.036 171 2HB ALA 23 2HB ALA 23 10.212 -5.975 0.178 172 3HB ALA 23 3HB ALA 23 11.801 -6.636 -0.195 173 H THR 24 H THR 24 12.864 -5.999 2.976 174 HA THR 24 HA THR 24 15.602 -5.381 2.444 175 HB THR 24 HB THR 24 15.013 -5.530 4.720 176 HG1 THR 24 HG1 THR 24 16.152 -8.056 4.576 177 1HG2 THR 24 1HG2 THR 24 13.777 -8.182 4.069 178 2HG2 THR 24 2HG2 THR 24 13.011 -6.753 4.765 179 3HG2 THR 24 3HG2 THR 24 14.168 -7.688 5.716 180 H HIS 25 H HIS 25 17.295 -7.121 2.401 181 HA HIS 25 HA HIS 25 17.088 -8.641 0.106 182 1HB HIS 25 1HB HIS 25 18.967 -8.516 2.383 183 2HB HIS 25 2HB HIS 25 19.013 -10.003 1.442 184 HD1 HIS 25 HD1 HIS 25 20.961 -7.253 1.620 185 HD2 HIS 25 HD2 HIS 25 18.802 -8.833 -1.559 186 HE1 HIS 25 HE1 HIS 25 22.061 -6.351 -0.455 187 HE2 HIS 25 HE2 HIS 25 20.794 -7.394 -2.366 188 H VAL 26 H VAL 26 16.156 -9.497 3.365 189 HA VAL 26 HA VAL 26 15.966 -12.299 2.882 190 HB VAL 26 HB VAL 26 16.192 -11.412 5.159 191 1HG1 VAL 26 1HG1 VAL 26 13.598 -10.105 4.497 192 2HG1 VAL 26 2HG1 VAL 26 15.003 -9.461 5.343 193 3HG1 VAL 26 3HG1 VAL 26 13.921 -10.584 6.162 194 1HG2 VAL 26 1HG2 VAL 26 13.885 -12.646 5.945 195 2HG2 VAL 26 2HG2 VAL 26 15.387 -13.469 5.525 196 3HG2 VAL 26 3HG2 VAL 26 14.113 -13.289 4.318 197 H ASP 27 H ASP 27 13.802 -9.577 2.459 198 HA ASP 27 HA ASP 27 11.414 -11.071 2.156 199 1HB ASP 27 1HB ASP 27 12.001 -8.400 2.362 200 2HB ASP 27 2HB ASP 27 11.600 -8.542 0.653 201 H TRP 28 H TRP 28 13.832 -9.791 -0.076 202 HA TRP 28 HA TRP 28 12.508 -10.789 -2.379 203 1HB TRP 28 1HB TRP 28 15.358 -9.848 -2.067 204 2HB TRP 28 2HB TRP 28 14.545 -10.148 -3.601 205 HD1 TRP 28 HD1 TRP 28 14.230 -7.821 -0.542 206 HE1 TRP 28 HE1 TRP 28 13.219 -5.596 -1.312 207 HE3 TRP 28 HE3 TRP 28 13.302 -9.013 -5.416 208 HZ2 TRP 28 HZ2 TRP 28 12.137 -4.494 -3.645 209 HZ3 TRP 28 HZ3 TRP 28 12.266 -7.310 -6.861 210 HH2 TRP 28 HH2 TRP 28 11.698 -5.099 -5.999 211 H GLN 29 H GLN 29 15.032 -11.961 -0.262 212 HA GLN 29 HA GLN 29 16.022 -14.060 -1.808 213 1HB GLN 29 1HB GLN 29 16.103 -13.252 0.982 214 2HB GLN 29 2HB GLN 29 16.056 -15.002 0.818 215 1HG GLN 29 1HG GLN 29 17.952 -13.548 -0.920 216 2HG GLN 29 2HG GLN 29 18.317 -13.599 0.804 217 1HE2 GLN 29 1HE2 GLN 29 17.649 -15.993 1.637 218 2HE2 GLN 29 2HE2 GLN 29 18.483 -17.239 0.779 219 H ASN 30 H ASN 30 13.220 -13.916 0.338 220 HA ASN 30 HA ASN 30 12.402 -16.563 -0.669 221 1HB ASN 30 1HB ASN 30 12.847 -15.941 1.937 222 2HB ASN 30 2HB ASN 30 11.132 -15.560 1.804 223 1HD2 ASN 30 1HD2 ASN 30 10.107 -17.395 0.209 224 2HD2 ASN 30 2HD2 ASN 30 10.345 -18.990 0.832 225 H CYS 31 H CYS 31 11.912 -14.069 -2.005 226 HA CYS 31 HA CYS 31 9.209 -13.265 -1.470 227 1HB CYS 31 1HB CYS 31 9.434 -11.834 -3.413 228 2HB CYS 31 2HB CYS 31 10.886 -11.714 -2.430 229 HG CYS 31 HG CYS 31 11.417 -11.950 -5.034 230 H VAL 32 H VAL 32 7.411 -14.165 -2.180 231 HA VAL 32 HA VAL 32 7.561 -16.389 -4.039 232 HB VAL 32 HB VAL 32 5.110 -16.623 -3.532 233 1HG1 VAL 32 1HG1 VAL 32 5.604 -17.918 -1.758 234 2HG1 VAL 32 2HG1 VAL 32 6.344 -16.587 -0.864 235 3HG1 VAL 32 3HG1 VAL 32 7.267 -17.441 -2.103 236 1HG2 VAL 32 1HG2 VAL 32 5.620 -14.564 -1.401 237 2HG2 VAL 32 2HG2 VAL 32 4.092 -15.339 -1.816 238 3HG2 VAL 32 3HG2 VAL 32 4.828 -14.191 -2.932 239 H TRP 33 H TRP 33 6.193 -13.140 -3.861 240 HA TRP 33 HA TRP 33 5.848 -13.190 -6.769 241 1HB TRP 33 1HB TRP 33 3.622 -13.566 -6.259 242 2HB TRP 33 2HB TRP 33 3.711 -12.686 -4.738 243 HD1 TRP 33 HD1 TRP 33 2.872 -12.233 -8.399 244 HE1 TRP 33 HE1 TRP 33 2.014 -9.833 -8.778 245 HE3 TRP 33 HE3 TRP 33 4.029 -10.236 -3.849 246 HZ2 TRP 33 HZ2 TRP 33 1.854 -7.406 -7.321 247 HZ3 TRP 33 HZ3 TRP 33 3.498 -7.874 -3.420 248 HH2 TRP 33 HH2 TRP 33 2.435 -6.497 -5.129 249 H GLU 34 H GLU 34 5.875 -11.088 -7.766 250 HA GLU 34 HA GLU 34 6.337 -8.742 -6.188 251 1HB GLU 34 1HB GLU 34 8.530 -9.786 -5.961 252 2HB GLU 34 2HB GLU 34 8.660 -9.933 -7.708 253 1HG GLU 34 1HG GLU 34 8.142 -7.207 -6.840 254 2HG GLU 34 2HG GLU 34 9.631 -7.875 -6.171 255 H ASP 35 H ASP 35 5.416 -7.152 -7.281 256 HA ASP 35 HA ASP 35 5.345 -7.306 -10.219 257 1HB ASP 35 1HB ASP 35 3.401 -6.447 -8.186 258 2HB ASP 35 2HB ASP 35 3.541 -5.349 -9.556 259 H TYR 36 H TYR 36 7.166 -6.288 -10.847 260 HA TYR 36 HA TYR 36 8.403 -4.116 -9.639 261 1HB TYR 36 1HB TYR 36 9.061 -5.731 -11.674 262 2HB TYR 36 2HB TYR 36 8.578 -4.311 -12.594 263 HD1 TYR 36 HD1 TYR 36 11.282 -5.902 -11.094 264 HD2 TYR 36 HD2 TYR 36 9.598 -2.029 -11.607 265 HE1 TYR 36 HE1 TYR 36 13.487 -4.894 -10.676 266 HE2 TYR 36 HE2 TYR 36 11.797 -1.011 -11.191 267 HH TYR 36 HH TYR 36 14.491 -2.259 -11.503 268 H ASN 37 H ASN 37 5.681 -4.174 -11.839 269 HA ASN 37 HA ASN 37 5.798 -1.500 -12.683 270 1HB ASN 37 1HB ASN 37 4.298 -3.586 -13.422 271 2HB ASN 37 2HB ASN 37 3.145 -2.802 -12.347 272 1HD2 ASN 37 1HD2 ASN 37 3.144 -3.169 -15.268 273 2HD2 ASN 37 2HD2 ASN 37 2.977 -1.583 -15.933 274 H ARG 38 H ARG 38 4.244 -3.053 -9.907 275 HA ARG 38 HA ARG 38 3.371 -0.421 -8.960 276 1HB ARG 38 1HB ARG 38 1.934 -1.580 -7.424 277 2HB ARG 38 2HB ARG 38 1.728 -2.291 -9.019 278 1HG ARG 38 1HG ARG 38 3.553 -3.970 -8.141 279 2HG ARG 38 2HG ARG 38 2.951 -3.442 -6.569 280 1HD ARG 38 1HD ARG 38 1.774 -5.436 -7.330 281 2HD ARG 38 2HD ARG 38 0.681 -4.057 -7.226 282 HE ARG 38 HE ARG 38 1.573 -4.105 -9.828 283 1HH1 ARG 38 1HH1 ARG 38 -0.138 -6.292 -7.714 284 2HH1 ARG 38 2HH1 ARG 38 -1.018 -7.046 -9.001 285 1HH2 ARG 38 1HH2 ARG 38 0.416 -5.094 -11.522 286 2HH2 ARG 38 2HH2 ARG 38 -0.703 -6.367 -11.163 287 H ASP 39 H ASP 39 6.017 -2.390 -8.651 288 HA ASP 39 HA ASP 39 7.767 -2.475 -7.202 289 1HB ASP 39 1HB ASP 39 6.496 0.148 -6.477 290 2HB ASP 39 2HB ASP 39 7.876 -0.452 -5.566 291 H LEU 40 H LEU 40 5.771 -4.153 -6.552 292 HA LEU 40 HA LEU 40 5.850 -4.129 -3.618 293 1HB LEU 40 1HB LEU 40 3.638 -3.317 -4.424 294 2HB LEU 40 2HB LEU 40 3.416 -4.843 -5.254 295 HG LEU 40 HG LEU 40 3.655 -5.947 -2.959 296 1HD1 LEU 40 1HD1 LEU 40 2.680 -4.071 -1.275 297 2HD1 LEU 40 2HD1 LEU 40 3.781 -3.098 -2.249 298 3HD1 LEU 40 3HD1 LEU 40 4.383 -4.514 -1.388 299 1HD2 LEU 40 1HD2 LEU 40 1.489 -5.081 -4.373 300 2HD2 LEU 40 2HD2 LEU 40 1.221 -4.323 -2.802 301 3HD2 LEU 40 3HD2 LEU 40 1.415 -6.073 -2.916 302 H LEU 41 H LEU 41 5.951 -6.168 -2.648 303 HA LEU 41 HA LEU 41 5.885 -8.518 -4.348 304 1HB LEU 41 1HB LEU 41 8.077 -9.332 -3.710 305 2HB LEU 41 2HB LEU 41 8.189 -7.823 -4.581 306 HG LEU 41 HG LEU 41 9.487 -8.497 -2.210 307 1HD1 LEU 41 1HD1 LEU 41 9.086 -5.685 -3.172 308 2HD1 LEU 41 2HD1 LEU 41 10.045 -6.862 -4.069 309 3HD1 LEU 41 3HD1 LEU 41 10.513 -6.409 -2.430 310 1HD2 LEU 41 1HD2 LEU 41 8.694 -6.585 -0.722 311 2HD2 LEU 41 2HD2 LEU 41 7.748 -8.070 -0.719 312 3HD2 LEU 41 3HD2 LEU 41 7.188 -6.668 -1.622 313 H VAL 42 H VAL 42 5.879 -10.535 -3.205 314 HA VAL 42 HA VAL 42 5.047 -10.219 -0.404 315 HB VAL 42 HB VAL 42 3.967 -12.088 -2.520 316 1HG1 VAL 42 1HG1 VAL 42 2.721 -13.293 -0.850 317 2HG1 VAL 42 2HG1 VAL 42 3.363 -12.267 0.432 318 3HG1 VAL 42 3HG1 VAL 42 4.429 -13.372 -0.428 319 1HG2 VAL 42 1HG2 VAL 42 3.041 -9.679 -1.222 320 2HG2 VAL 42 2HG2 VAL 42 1.896 -11.007 -1.008 321 3HG2 VAL 42 3HG2 VAL 42 2.394 -10.521 -2.630 322 H SER 43 H SER 43 6.219 -11.216 1.036 323 HA SER 43 HA SER 43 7.941 -13.447 0.187 324 1HB SER 43 1HB SER 43 9.688 -12.673 1.502 325 2HB SER 43 2HB SER 43 8.989 -11.154 0.942 326 HG SER 43 HG SER 43 9.191 -12.129 3.462 327 H THR 44 H THR 44 8.347 -15.075 1.854 328 HA THR 44 HA THR 44 5.957 -15.423 3.490 329 HB THR 44 HB THR 44 6.424 -17.745 3.505 330 HG1 THR 44 HG1 THR 44 8.389 -18.581 2.812 331 1HG2 THR 44 1HG2 THR 44 7.468 -17.270 0.803 332 2HG2 THR 44 2HG2 THR 44 5.943 -16.479 1.213 333 3HG2 THR 44 3HG2 THR 44 6.095 -18.235 1.347 334 H THR 45 H THR 45 5.961 -15.782 5.644 335 HA THR 45 HA THR 45 8.509 -15.608 7.082 336 HB THR 45 HB THR 45 7.851 -13.372 7.215 337 HG1 THR 45 HG1 THR 45 7.216 -13.096 9.342 338 1HG2 THR 45 1HG2 THR 45 5.418 -14.037 6.363 339 2HG2 THR 45 2HG2 THR 45 5.771 -12.496 7.141 340 3HG2 THR 45 3HG2 THR 45 5.059 -13.812 8.074 341 H THR 46 H THR 46 8.076 -15.961 9.519 342 HA THR 46 HA THR 46 6.028 -18.057 9.834 343 HB THR 46 HB THR 46 7.820 -18.850 11.648 344 HG1 THR 46 HG1 THR 46 9.269 -17.138 11.057 345 1HG2 THR 46 1HG2 THR 46 8.468 -19.550 8.824 346 2HG2 THR 46 2HG2 THR 46 6.932 -20.045 9.534 347 3HG2 THR 46 3HG2 THR 46 8.450 -20.572 10.261 348 H ALA 47 H ALA 47 5.683 -15.290 10.420 349 HA ALA 47 HA ALA 47 5.679 -15.263 13.361 350 1HB ALA 47 1HB ALA 47 6.100 -13.057 13.316 351 2HB ALA 47 2HB ALA 47 4.998 -12.772 11.969 352 3HB ALA 47 3HB ALA 47 6.630 -13.367 11.663 353 H HIS 48 H HIS 48 3.755 -13.373 13.835 354 HA HIS 48 HA HIS 48 1.320 -14.817 13.061 355 1HB HIS 48 1HB HIS 48 2.263 -13.773 15.538 356 2HB HIS 48 2HB HIS 48 0.806 -12.887 15.103 357 HD1 HIS 48 HD1 HIS 48 -1.386 -14.347 14.766 358 HD2 HIS 48 HD2 HIS 48 1.855 -16.337 16.442 359 HE1 HIS 48 HE1 HIS 48 -2.333 -16.448 15.771 360 HE2 HIS 48 HE2 HIS 48 -0.365 -17.605 16.836 361 H GLY 49 H GLY 49 -0.520 -13.719 12.332 362 1HA GLY 49 1HA GLY 49 -0.107 -11.625 10.539 363 2HA GLY 49 2HA GLY 49 -1.674 -12.124 11.155 364 H CYS 50 H CYS 50 -1.846 -9.665 10.763 365 HA CYS 50 HA CYS 50 -1.727 -8.414 13.366 366 1HB CYS 50 1HB CYS 50 0.455 -7.987 11.846 367 2HB CYS 50 2HB CYS 50 -0.580 -6.702 11.234 368 HG CYS 50 HG CYS 50 -0.711 -5.804 13.731 369 H ASP 51 H ASP 51 -2.387 -7.949 9.909 370 HA ASP 51 HA ASP 51 -4.890 -6.596 10.666 371 1HB ASP 51 1HB ASP 51 -3.022 -5.848 8.408 372 2HB ASP 51 2HB ASP 51 -4.632 -5.172 8.634 373 H THR 52 H THR 52 -6.435 -6.524 8.732 374 HA THR 52 HA THR 52 -6.274 -9.053 7.229 375 HB THR 52 HB THR 52 -8.787 -7.826 8.379 376 HG1 THR 52 HG1 THR 52 -7.143 -9.937 9.282 377 1HG2 THR 52 1HG2 THR 52 -8.399 -9.853 6.411 378 2HG2 THR 52 2HG2 THR 52 -9.902 -9.204 7.067 379 3HG2 THR 52 3HG2 THR 52 -9.107 -10.563 7.862 380 H ILE 53 H ILE 53 -6.338 -8.778 5.098 381 HA ILE 53 HA ILE 53 -6.774 -6.200 3.954 382 HB ILE 53 HB ILE 53 -6.790 -8.662 2.277 383 1HG1 ILE 53 1HG1 ILE 53 -4.724 -8.030 4.193 384 2HG1 ILE 53 2HG1 ILE 53 -4.846 -9.407 3.106 385 1HG2 ILE 53 1HG2 ILE 53 -5.612 -7.244 0.710 386 2HG2 ILE 53 2HG2 ILE 53 -5.506 -5.963 1.919 387 3HG2 ILE 53 3HG2 ILE 53 -7.077 -6.444 1.277 388 1HD1 ILE 53 1HD1 ILE 53 -3.480 -6.779 2.658 389 2HD1 ILE 53 2HD1 ILE 53 -3.897 -7.851 1.320 390 3HD1 ILE 53 3HD1 ILE 53 -2.809 -8.407 2.585 391 H ALA 54 H ALA 54 -8.478 -5.411 2.817 392 HA ALA 54 HA ALA 54 -11.016 -6.775 3.179 393 1HB ALA 54 1HB ALA 54 -10.540 -4.262 3.564 394 2HB ALA 54 2HB ALA 54 -12.046 -4.737 2.784 395 3HB ALA 54 3HB ALA 54 -10.704 -4.131 1.815 396 H ARG 55 H ARG 55 -11.931 -7.990 1.670 397 HA ARG 55 HA ARG 55 -10.905 -7.887 -1.065 398 1HB ARG 55 1HB ARG 55 -11.119 -10.076 0.145 399 2HB ARG 55 2HB ARG 55 -12.861 -9.850 0.148 400 1HG ARG 55 1HG ARG 55 -11.965 -11.362 -1.639 401 2HG ARG 55 2HG ARG 55 -12.986 -10.041 -2.207 402 1HD ARG 55 1HD ARG 55 -11.010 -8.762 -2.829 403 2HD ARG 55 2HD ARG 55 -9.969 -10.043 -2.212 404 HE ARG 55 HE ARG 55 -11.476 -11.327 -4.042 405 1HH1 ARG 55 1HH1 ARG 55 -9.592 -8.391 -4.171 406 2HH1 ARG 55 2HH1 ARG 55 -9.223 -8.555 -5.855 407 1HH2 ARG 55 1HH2 ARG 55 -10.989 -11.543 -6.257 408 2HH2 ARG 55 2HH2 ARG 55 -10.015 -10.343 -7.039 409 H CYS 56 H CYS 56 -12.605 -5.798 0.066 410 HA CYS 56 HA CYS 56 -15.104 -6.112 -1.421 411 1HB CYS 56 1HB CYS 56 -15.794 -4.056 -0.198 412 2HB CYS 56 2HB CYS 56 -15.370 -5.390 0.869 413 H GLN 57 H GLN 57 -15.897 -4.097 -2.547 414 HA GLN 57 HA GLN 57 -13.658 -2.811 -3.967 415 1HB GLN 57 1HB GLN 57 -16.193 -4.015 -4.940 416 2HB GLN 57 2HB GLN 57 -15.634 -2.561 -5.754 417 1HG GLN 57 1HG GLN 57 -13.389 -4.216 -5.524 418 2HG GLN 57 2HG GLN 57 -14.720 -5.263 -6.016 419 1HE2 GLN 57 1HE2 GLN 57 -13.268 -2.120 -6.780 420 2HE2 GLN 57 2HE2 GLN 57 -13.504 -2.232 -8.488 421 H CYS 58 H CYS 58 -15.063 -1.867 -1.545 422 HA CYS 58 HA CYS 58 -16.927 0.141 -2.122 423 1HB CYS 58 1HB CYS 58 -14.869 0.240 0.090 424 2HB CYS 58 2HB CYS 58 -16.425 1.059 0.052 425 H THR 59 H THR 59 -16.767 2.134 -2.960 426 HA THR 59 HA THR 59 -14.228 2.983 -4.032 427 HB THR 59 HB THR 59 -16.607 4.765 -4.140 428 HG1 THR 59 HG1 THR 59 -16.464 2.212 -5.343 429 1HG2 THR 59 1HG2 THR 59 -15.902 4.592 -6.640 430 2HG2 THR 59 2HG2 THR 59 -14.393 3.982 -5.964 431 3HG2 THR 59 3HG2 THR 59 -14.974 5.584 -5.516 432 H THR 60 H THR 60 -15.543 3.270 -1.033 433 HA THR 60 HA THR 60 -14.123 5.802 -0.551 434 HB THR 60 HB THR 60 -15.777 6.518 0.998 435 HG1 THR 60 HG1 THR 60 -16.289 4.588 1.997 436 1HG2 THR 60 1HG2 THR 60 -17.829 6.635 -0.264 437 2HG2 THR 60 2HG2 THR 60 -17.288 5.324 -1.311 438 3HG2 THR 60 3HG2 THR 60 -16.445 6.872 -1.330 439 H GLY 61 H GLY 61 -12.517 5.627 0.843 440 1HA GLY 61 1HA GLY 61 -12.701 3.685 3.038 441 2HA GLY 61 2HA GLY 61 -11.311 3.603 1.962 442 H VAL 62 H VAL 62 -10.232 3.961 4.151 443 HA VAL 62 HA VAL 62 -9.767 6.838 4.425 444 HB VAL 62 HB VAL 62 -11.322 6.364 6.209 445 1HG1 VAL 62 1HG1 VAL 62 -9.756 3.927 6.452 446 2HG1 VAL 62 2HG1 VAL 62 -11.407 4.269 6.968 447 3HG1 VAL 62 3HG1 VAL 62 -10.050 4.707 8.005 448 1HG2 VAL 62 1HG2 VAL 62 -8.710 7.378 6.590 449 2HG2 VAL 62 2HG2 VAL 62 -9.145 6.471 8.038 450 3HG2 VAL 62 3HG2 VAL 62 -10.183 7.781 7.472 451 H TYR 63 H TYR 63 -7.685 7.370 4.620 452 HA TYR 63 HA TYR 63 -5.765 5.210 5.188 453 1HB TYR 63 1HB TYR 63 -4.232 6.150 3.604 454 2HB TYR 63 2HB TYR 63 -5.787 5.978 2.799 455 HD1 TYR 63 HD1 TYR 63 -3.289 8.320 4.053 456 HD2 TYR 63 HD2 TYR 63 -7.107 7.964 2.201 457 HE1 TYR 63 HE1 TYR 63 -3.193 10.689 3.409 458 HE2 TYR 63 HE2 TYR 63 -7.018 10.333 1.557 459 HH TYR 63 HH TYR 63 -5.890 12.401 2.289 460 H PHE 64 H PHE 64 -4.318 5.559 6.757 461 HA PHE 64 HA PHE 64 -4.597 7.855 8.427 462 1HB PHE 64 1HB PHE 64 -3.823 5.313 8.888 463 2HB PHE 64 2HB PHE 64 -2.247 6.093 8.798 464 HD1 PHE 64 HD1 PHE 64 -5.147 5.486 10.805 465 HD2 PHE 64 HD2 PHE 64 -1.789 8.054 10.319 466 HE1 PHE 64 HE1 PHE 64 -5.401 6.251 13.129 467 HE2 PHE 64 HE2 PHE 64 -2.036 8.823 12.644 468 HZ PHE 64 HZ PHE 64 -3.844 7.921 14.052 469 H CYS 65 H CYS 65 -2.894 9.292 9.077 470 HA CYS 65 HA CYS 65 -1.223 10.786 8.718 471 1HB CYS 65 1HB CYS 65 -0.233 8.341 7.389 472 2HB CYS 65 2HB CYS 65 0.523 9.841 6.865 473 HG CYS 65 HG CYS 65 1.940 9.569 8.836 474 H ALA 66 H ALA 66 -3.318 11.662 7.569 475 HA ALA 66 HA ALA 66 -2.903 12.031 4.706 476 1HB ALA 66 1HB ALA 66 -5.137 11.773 4.890 477 2HB ALA 66 2HB ALA 66 -5.099 13.502 5.236 478 3HB ALA 66 3HB ALA 66 -5.171 12.339 6.560 479 H SER 67 H SER 67 -3.141 13.967 7.665 480 HA SER 67 HA SER 67 -1.163 15.789 7.007 481 1HB SER 67 1HB SER 67 -2.478 16.599 5.176 482 2HB SER 67 2HB SER 67 -3.927 16.689 6.175 483 HG SER 67 HG SER 67 -2.629 18.700 5.737 484 H LYS 68 H LYS 68 -2.203 14.406 9.277 485 HA LYS 68 HA LYS 68 -2.013 16.421 11.221 486 1HB LYS 68 1HB LYS 68 -4.380 16.766 10.273 487 2HB LYS 68 2HB LYS 68 -4.791 15.283 11.121 488 1HG LYS 68 1HG LYS 68 -5.234 16.565 12.880 489 2HG LYS 68 2HG LYS 68 -3.490 16.781 13.041 490 1HD LYS 68 1HD LYS 68 -4.754 18.547 11.071 491 2HD LYS 68 2HD LYS 68 -5.301 18.797 12.729 492 1HE LYS 68 1HE LYS 68 -3.492 20.135 12.846 493 2HE LYS 68 2HE LYS 68 -2.643 18.616 13.126 494 1HZ LYS 68 1HZ LYS 68 -2.667 20.325 10.760 495 2HZ LYS 68 2HZ LYS 68 -2.586 18.655 10.498 496 3HZ LYS 68 3HZ LYS 68 -1.402 19.423 11.430 497 H SER 69 H SER 69 -1.003 13.746 10.618 498 HA SER 69 HA SER 69 -0.590 11.716 11.597 499 1HB SER 69 1HB SER 69 0.131 13.695 13.290 500 2HB SER 69 2HB SER 69 -1.012 12.825 14.314 501 HG SER 69 HG SER 69 1.504 12.153 13.614 502 H LYS 70 H LYS 70 -3.366 12.261 10.988 503 HA LYS 70 HA LYS 70 -4.617 10.377 12.858 504 1HB LYS 70 1HB LYS 70 -5.861 12.917 11.798 505 2HB LYS 70 2HB LYS 70 -6.744 11.658 12.651 506 1HG LYS 70 1HG LYS 70 -6.051 12.366 14.647 507 2HG LYS 70 2HG LYS 70 -4.392 12.604 14.091 508 1HD LYS 70 1HD LYS 70 -5.139 14.755 14.642 509 2HD LYS 70 2HD LYS 70 -5.282 14.667 12.887 510 1HE LYS 70 1HE LYS 70 -7.561 14.656 12.928 511 2HE LYS 70 2HE LYS 70 -7.636 13.864 14.501 512 1HZ LYS 70 1HZ LYS 70 -8.216 15.915 15.173 513 2HZ LYS 70 2HZ LYS 70 -7.494 16.689 13.855 514 3HZ LYS 70 3HZ LYS 70 -6.548 16.199 15.169 515 H HIS 71 H HIS 71 -6.764 9.583 11.900 516 HA HIS 71 HA HIS 71 -6.181 8.600 9.239 517 1HB HIS 71 1HB HIS 71 -8.360 7.329 9.598 518 2HB HIS 71 2HB HIS 71 -7.054 6.955 10.719 519 HD1 HIS 71 HD1 HIS 71 -9.916 9.482 10.698 520 HD2 HIS 71 HD2 HIS 71 -8.029 6.771 13.220 521 HE1 HIS 71 HE1 HIS 71 -11.145 9.632 12.888 522 HE2 HIS 71 HE2 HIS 71 -9.940 8.036 14.419 523 H TYR 72 H TYR 72 -7.264 9.124 7.384 524 HA TYR 72 HA TYR 72 -9.306 11.240 7.603 525 1HB TYR 72 1HB TYR 72 -6.776 11.142 6.099 526 2HB TYR 72 2HB TYR 72 -8.158 11.697 5.167 527 HD1 TYR 72 HD1 TYR 72 -6.716 12.287 8.578 528 HD2 TYR 72 HD2 TYR 72 -8.440 13.969 5.067 529 HE1 TYR 72 HE1 TYR 72 -6.433 14.542 9.529 530 HE2 TYR 72 HE2 TYR 72 -8.169 16.223 6.006 531 HH TYR 72 HH TYR 72 -7.942 17.282 8.221 532 HA PRO 73 HA PRO 73 -11.524 8.147 5.154 533 1HB PRO 73 1HB PRO 73 -13.740 10.064 5.267 534 2HB PRO 73 2HB PRO 73 -13.656 8.421 5.908 535 1HG PRO 73 1HG PRO 73 -13.702 10.594 7.510 536 2HG PRO 73 2HG PRO 73 -12.835 9.108 7.941 537 1HD PRO 73 1HD PRO 73 -11.762 11.681 6.840 538 2HD PRO 73 2HD PRO 73 -11.091 10.626 8.106 539 H VAL 74 H VAL 74 -11.114 8.121 3.021 540 HA VAL 74 HA VAL 74 -11.801 10.490 1.434 541 HB VAL 74 HB VAL 74 -9.131 9.093 1.468 542 1HG1 VAL 74 1HG1 VAL 74 -10.311 10.836 -0.659 543 2HG1 VAL 74 2HG1 VAL 74 -9.542 9.255 -0.821 544 3HG1 VAL 74 3HG1 VAL 74 -8.568 10.675 -0.427 545 1HG2 VAL 74 1HG2 VAL 74 -10.138 11.802 2.154 546 2HG2 VAL 74 2HG2 VAL 74 -8.509 11.651 1.495 547 3HG2 VAL 74 3HG2 VAL 74 -8.944 10.797 2.976 548 H SER 75 H SER 75 -12.502 10.110 -0.607 549 HA SER 75 HA SER 75 -13.055 7.327 -1.314 550 1HB SER 75 1HB SER 75 -14.581 8.276 -3.000 551 2HB SER 75 2HB SER 75 -14.930 8.940 -1.403 552 HG SER 75 HG SER 75 -13.824 10.814 -1.990 553 H PHE 76 H PHE 76 -12.037 6.313 -2.988 554 HA PHE 76 HA PHE 76 -10.379 7.964 -4.765 555 1HB PHE 76 1HB PHE 76 -8.975 5.533 -4.283 556 2HB PHE 76 2HB PHE 76 -8.471 7.177 -3.916 557 HD1 PHE 76 HD1 PHE 76 -7.831 7.568 -1.765 558 HD2 PHE 76 HD2 PHE 76 -10.818 4.631 -2.510 559 HE1 PHE 76 HE1 PHE 76 -7.946 7.080 0.641 560 HE2 PHE 76 HE2 PHE 76 -10.937 4.136 -0.104 561 HZ PHE 76 HZ PHE 76 -9.501 5.363 1.477 562 H GLU 77 H GLU 77 -9.512 6.738 -6.615 563 HA GLU 77 HA GLU 77 -11.491 4.793 -7.597 564 1HB GLU 77 1HB GLU 77 -10.664 7.226 -8.716 565 2HB GLU 77 2HB GLU 77 -9.841 5.994 -9.662 566 1HG GLU 77 1HG GLU 77 -11.897 6.481 -10.739 567 2HG GLU 77 2HG GLU 77 -12.045 4.885 -10.005 568 H GLY 78 H GLY 78 -10.620 3.102 -9.034 569 1HA GLY 78 1HA GLY 78 -7.929 2.326 -8.130 570 2HA GLY 78 2HA GLY 78 -9.175 1.217 -8.669 571 HA PRO 79 HA PRO 79 -7.446 3.208 -12.719 572 1HB PRO 79 1HB PRO 79 -5.162 4.682 -12.474 573 2HB PRO 79 2HB PRO 79 -6.781 5.388 -12.460 574 1HG PRO 79 1HG PRO 79 -4.971 4.744 -10.174 575 2HG PRO 79 2HG PRO 79 -6.015 6.156 -10.415 576 1HD PRO 79 1HD PRO 79 -6.700 4.095 -8.798 577 2HD PRO 79 2HD PRO 79 -7.896 5.048 -9.691 578 H GLY 80 H GLY 80 -6.347 1.801 -13.916 579 1HA GLY 80 1HA GLY 80 -4.835 -0.269 -12.862 580 2HA GLY 80 2HA GLY 80 -4.833 0.205 -14.553 581 H LEU 81 H LEU 81 -3.290 1.807 -15.251 582 HA LEU 81 HA LEU 81 -0.869 1.727 -13.595 583 1HB LEU 81 1HB LEU 81 -1.207 1.011 -16.197 584 2HB LEU 81 2HB LEU 81 -0.606 2.652 -16.358 585 HG LEU 81 HG LEU 81 1.309 1.331 -16.429 586 1HD1 LEU 81 1HD1 LEU 81 0.894 2.418 -13.675 587 2HD1 LEU 81 2HD1 LEU 81 1.845 3.085 -14.999 588 3HD1 LEU 81 3HD1 LEU 81 2.405 1.648 -14.143 589 1HD2 LEU 81 1HD2 LEU 81 0.908 -0.809 -15.870 590 2HD2 LEU 81 2HD2 LEU 81 -0.163 -0.370 -14.539 591 3HD2 LEU 81 3HD2 LEU 81 1.585 -0.307 -14.320 592 H VAL 82 H VAL 82 -0.282 3.506 -12.566 593 HA VAL 82 HA VAL 82 -1.012 6.111 -13.738 594 HB VAL 82 HB VAL 82 -0.741 5.507 -10.781 595 1HG1 VAL 82 1HG1 VAL 82 -0.974 7.704 -10.374 596 2HG1 VAL 82 2HG1 VAL 82 -2.139 7.927 -11.680 597 3HG1 VAL 82 3HG1 VAL 82 -0.411 7.900 -12.035 598 1HG2 VAL 82 1HG2 VAL 82 -3.218 5.926 -12.457 599 2HG2 VAL 82 2HG2 VAL 82 -3.183 5.810 -10.698 600 3HG2 VAL 82 3HG2 VAL 82 -2.720 4.422 -11.683 601 H GLU 83 H GLU 83 0.686 7.283 -14.322 602 HA GLU 83 HA GLU 83 3.350 6.479 -13.643 603 1HB GLU 83 1HB GLU 83 3.965 8.563 -14.966 604 2HB GLU 83 2HB GLU 83 3.080 7.316 -15.834 605 1HG GLU 83 1HG GLU 83 1.115 8.560 -15.868 606 2HG GLU 83 2HG GLU 83 1.653 9.619 -14.565 607 H VAL 84 H VAL 84 4.109 6.868 -11.669 608 HA VAL 84 HA VAL 84 3.236 9.070 -10.068 609 HB VAL 84 HB VAL 84 4.912 8.332 -8.451 610 1HG1 VAL 84 1HG1 VAL 84 3.973 6.168 -7.961 611 2HG1 VAL 84 2HG1 VAL 84 3.423 5.992 -9.627 612 3HG1 VAL 84 3HG1 VAL 84 2.707 7.224 -8.588 613 1HG2 VAL 84 1HG2 VAL 84 6.781 7.358 -9.145 614 2HG2 VAL 84 2HG2 VAL 84 6.117 7.149 -10.764 615 3HG2 VAL 84 3HG2 VAL 84 5.842 5.917 -9.536 616 H GLN 85 H GLN 85 3.963 11.067 -10.066 617 HA GLN 85 HA GLN 85 6.057 11.931 -11.779 618 1HB GLN 85 1HB GLN 85 5.632 14.149 -10.864 619 2HB GLN 85 2HB GLN 85 4.116 13.342 -11.237 620 1HG GLN 85 1HG GLN 85 3.953 12.717 -8.824 621 2HG GLN 85 2HG GLN 85 5.355 13.743 -8.527 622 1HE2 GLN 85 1HE2 GLN 85 2.004 13.616 -8.813 623 2HE2 GLN 85 2HE2 GLN 85 1.685 15.314 -8.799 624 H GLU 86 H GLU 86 8.073 12.869 -11.225 625 HA GLU 86 HA GLU 86 9.447 11.500 -9.166 626 1HB GLU 86 1HB GLU 86 10.571 12.227 -11.216 627 2HB GLU 86 2HB GLU 86 10.295 13.908 -10.782 628 1HG GLU 86 1HG GLU 86 11.659 13.474 -8.710 629 2HG GLU 86 2HG GLU 86 12.092 11.923 -9.425 630 H SER 87 H SER 87 8.848 11.887 -7.118 631 HA SER 87 HA SER 87 9.285 14.583 -6.084 632 1HB SER 87 1HB SER 87 6.739 13.872 -6.618 633 2HB SER 87 2HB SER 87 6.892 13.225 -4.985 634 HG SER 87 HG SER 87 6.995 15.192 -4.206 635 H GLU 88 H GLU 88 9.463 14.650 -3.734 636 HA GLU 88 HA GLU 88 10.432 13.964 -1.802 637 1HB GLU 88 1HB GLU 88 8.189 12.580 -2.017 638 2HB GLU 88 2HB GLU 88 9.294 11.223 -2.134 639 1HG GLU 88 1HG GLU 88 10.067 11.488 0.018 640 2HG GLU 88 2HG GLU 88 9.606 13.188 0.085 641 H TYR 89 H TYR 89 10.485 10.745 -3.296 642 HA TYR 89 HA TYR 89 13.307 10.918 -3.873 643 1HB TYR 89 1HB TYR 89 13.797 8.895 -2.410 644 2HB TYR 89 2HB TYR 89 13.554 10.420 -1.566 645 HD1 TYR 89 HD1 TYR 89 11.524 7.505 -2.743 646 HD2 TYR 89 HD2 TYR 89 12.224 10.378 0.315 647 HE1 TYR 89 HE1 TYR 89 9.774 6.459 -1.368 648 HE2 TYR 89 HE2 TYR 89 10.478 9.339 1.700 649 HH TYR 89 HH TYR 89 9.431 6.919 1.832 650 H TYR 90 H TYR 90 10.718 10.316 -5.204 651 HA TYR 90 HA TYR 90 11.400 7.645 -6.240 652 1HB TYR 90 1HB TYR 90 9.141 8.090 -4.920 653 2HB TYR 90 2HB TYR 90 8.622 8.704 -6.484 654 HD1 TYR 90 HD1 TYR 90 9.509 6.996 -8.481 655 HD2 TYR 90 HD2 TYR 90 8.445 5.944 -4.499 656 HE1 TYR 90 HE1 TYR 90 9.018 4.705 -9.223 657 HE2 TYR 90 HE2 TYR 90 7.951 3.649 -5.231 658 HH TYR 90 HH TYR 90 7.691 2.785 -8.512 659 HA PRO 91 HA PRO 91 11.911 10.028 -10.005 660 1HB PRO 91 1HB PRO 91 12.737 8.019 -11.588 661 2HB PRO 91 2HB PRO 91 13.775 8.702 -10.330 662 1HG PRO 91 1HG PRO 91 12.133 6.198 -10.278 663 2HG PRO 91 2HG PRO 91 13.791 6.460 -9.706 664 1HD PRO 91 1HD PRO 91 11.617 6.438 -8.055 665 2HD PRO 91 2HD PRO 91 13.091 7.364 -7.715 666 H LYS 92 H LYS 92 10.772 10.382 -11.896 667 HA LYS 92 HA LYS 92 8.128 9.739 -12.095 668 1HB LYS 92 1HB LYS 92 10.108 10.940 -13.806 669 2HB LYS 92 2HB LYS 92 9.007 9.959 -14.762 670 1HG LYS 92 1HG LYS 92 7.736 11.712 -12.774 671 2HG LYS 92 2HG LYS 92 8.559 12.528 -14.104 672 1HD LYS 92 1HD LYS 92 7.239 10.663 -15.495 673 2HD LYS 92 2HD LYS 92 6.143 10.817 -14.120 674 1HE LYS 92 1HE LYS 92 7.003 12.929 -16.076 675 2HE LYS 92 2HE LYS 92 5.372 12.362 -15.723 676 1HZ LYS 92 1HZ LYS 92 7.023 14.276 -14.282 677 2HZ LYS 92 2HZ LYS 92 6.077 13.245 -13.333 678 3HZ LYS 92 3HZ LYS 92 5.345 14.235 -14.492 679 H ARG 93 H ARG 93 7.739 7.552 -11.649 680 HA ARG 93 HA ARG 93 8.416 5.719 -13.858 681 1HB ARG 93 1HB ARG 93 8.132 4.972 -10.948 682 2HB ARG 93 2HB ARG 93 8.571 3.895 -12.265 683 1HG ARG 93 1HG ARG 93 10.350 6.150 -12.187 684 2HG ARG 93 2HG ARG 93 10.283 5.359 -10.611 685 1HD ARG 93 1HD ARG 93 10.470 3.540 -12.912 686 2HD ARG 93 2HD ARG 93 11.874 4.576 -12.667 687 HE ARG 93 HE ARG 93 11.121 3.406 -10.218 688 1HH1 ARG 93 1HH1 ARG 93 12.576 2.573 -13.279 689 2HH1 ARG 93 2HH1 ARG 93 13.499 1.261 -12.625 690 1HH2 ARG 93 1HH2 ARG 93 12.334 1.682 -9.356 691 2HH2 ARG 93 2HH2 ARG 93 13.361 0.754 -10.399 692 H TYR 94 H TYR 94 6.979 3.687 -13.735 693 HA TYR 94 HA TYR 94 4.195 4.590 -13.659 694 1HB TYR 94 1HB TYR 94 5.711 2.558 -15.215 695 2HB TYR 94 2HB TYR 94 4.011 2.235 -14.897 696 HD1 TYR 94 HD1 TYR 94 2.679 2.752 -16.700 697 HD2 TYR 94 HD2 TYR 94 5.984 5.266 -15.802 698 HE1 TYR 94 HE1 TYR 94 2.047 4.225 -18.553 699 HE2 TYR 94 HE2 TYR 94 5.371 6.749 -17.653 700 HH TYR 94 HH TYR 94 2.568 6.949 -19.004 701 H GLN 95 H GLN 95 2.732 3.756 -12.280 702 HA GLN 95 HA GLN 95 3.571 1.485 -10.599 703 1HB GLN 95 1HB GLN 95 2.230 4.056 -9.920 704 2HB GLN 95 2HB GLN 95 1.804 2.625 -8.991 705 1HG GLN 95 1HG GLN 95 4.681 3.255 -9.375 706 2HG GLN 95 2HG GLN 95 3.746 4.231 -8.244 707 1HE2 GLN 95 1HE2 GLN 95 5.664 3.002 -7.061 708 2HE2 GLN 95 2HE2 GLN 95 5.156 1.581 -6.220 709 H SER 96 H SER 96 2.421 -0.316 -11.008 710 HA SER 96 HA SER 96 -0.142 -0.119 -12.341 711 1HB SER 96 1HB SER 96 1.406 -1.866 -13.028 712 2HB SER 96 2HB SER 96 1.425 -2.527 -11.393 713 HG SER 96 HG SER 96 -0.015 -3.608 -12.893 714 H HIS 97 H HIS 97 -2.117 -0.809 -11.578 715 HA HIS 97 HA HIS 97 -3.808 -0.950 -10.068 716 1HB HIS 97 1HB HIS 97 -2.381 -3.182 -9.854 717 2HB HIS 97 2HB HIS 97 -2.114 -2.566 -8.225 718 HD1 HIS 97 HD1 HIS 97 -3.630 -3.863 -6.760 719 HD2 HIS 97 HD2 HIS 97 -5.510 -2.675 -10.270 720 HE1 HIS 97 HE1 HIS 97 -6.024 -4.592 -6.520 721 HE2 HIS 97 HE2 HIS 97 -7.161 -3.785 -8.618 722 H VAL 98 H VAL 98 -3.139 1.432 -9.656 723 HA VAL 98 HA VAL 98 -2.621 1.688 -6.764 724 HB VAL 98 HB VAL 98 -0.711 2.534 -8.114 725 1HG1 VAL 98 1HG1 VAL 98 -1.237 3.582 -10.016 726 2HG1 VAL 98 2HG1 VAL 98 -1.452 5.002 -8.991 727 3HG1 VAL 98 3HG1 VAL 98 -2.847 4.022 -9.446 728 1HG2 VAL 98 1HG2 VAL 98 -2.259 4.163 -6.201 729 2HG2 VAL 98 2HG2 VAL 98 -0.964 4.984 -7.077 730 3HG2 VAL 98 3HG2 VAL 98 -0.606 3.555 -6.103 731 H LEU 99 H LEU 99 -3.895 3.082 -5.606 732 HA LEU 99 HA LEU 99 -6.271 4.079 -7.001 733 1HB LEU 99 1HB LEU 99 -5.730 3.308 -4.149 734 2HB LEU 99 2HB LEU 99 -7.112 4.303 -4.566 735 HG LEU 99 HG LEU 99 -7.835 2.463 -6.138 736 1HD1 LEU 99 1HD1 LEU 99 -5.657 1.351 -6.322 737 2HD1 LEU 99 2HD1 LEU 99 -6.918 0.246 -5.776 738 3HD1 LEU 99 3HD1 LEU 99 -5.754 0.894 -4.622 739 1HD2 LEU 99 1HD2 LEU 99 -7.810 2.377 -3.185 740 2HD2 LEU 99 2HD2 LEU 99 -8.321 0.908 -4.016 741 3HD2 LEU 99 3HD2 LEU 99 -9.167 2.426 -4.310 742 H LEU 100 H LEU 100 -6.909 6.238 -6.842 743 HA LEU 100 HA LEU 100 -5.080 7.997 -5.362 744 1HB LEU 100 1HB LEU 100 -5.534 7.903 -8.239 745 2HB LEU 100 2HB LEU 100 -5.735 9.508 -7.559 746 HG LEU 100 HG LEU 100 -3.276 7.783 -7.240 747 1HD1 LEU 100 1HD1 LEU 100 -2.233 9.038 -8.878 748 2HD1 LEU 100 2HD1 LEU 100 -3.419 10.340 -8.782 749 3HD1 LEU 100 3HD1 LEU 100 -3.851 8.809 -9.543 750 1HD2 LEU 100 1HD2 LEU 100 -3.149 10.662 -6.696 751 2HD2 LEU 100 2HD2 LEU 100 -2.440 9.306 -5.820 752 3HD2 LEU 100 3HD2 LEU 100 -4.129 9.739 -5.556 753 H ALA 101 H ALA 101 -5.905 9.805 -4.454 754 HA ALA 101 HA ALA 101 -8.632 10.643 -4.985 755 1HB ALA 101 1HB ALA 101 -9.384 10.420 -2.698 756 2HB ALA 101 2HB ALA 101 -7.835 9.716 -2.225 757 3HB ALA 101 3HB ALA 101 -8.905 8.846 -3.325 758 H THR 102 H THR 102 -9.042 12.769 -4.313 759 HA THR 102 HA THR 102 -6.642 14.236 -3.499 760 HB THR 102 HB THR 102 -7.478 15.161 -5.480 761 HG1 THR 102 HG1 THR 102 -7.109 16.854 -4.145 762 1HG2 THR 102 1HG2 THR 102 -10.104 14.465 -4.403 763 2HG2 THR 102 2HG2 THR 102 -9.545 14.567 -6.073 764 3HG2 THR 102 3HG2 THR 102 -10.037 16.029 -5.217 765 H GLY 103 H GLY 103 -6.452 15.177 -1.581 766 1HA GLY 103 1HA GLY 103 -8.826 15.188 0.182 767 2HA GLY 103 2HA GLY 103 -7.166 15.037 0.738 768 H PHE 104 H PHE 104 -6.320 16.794 1.603 769 HA PHE 104 HA PHE 104 -6.929 19.415 0.497 770 1HB PHE 104 1HB PHE 104 -8.042 18.427 3.003 771 2HB PHE 104 2HB PHE 104 -7.109 19.902 3.230 772 HD1 PHE 104 HD1 PHE 104 -9.970 18.414 1.448 773 HD2 PHE 104 HD2 PHE 104 -7.914 21.995 2.479 774 HE1 PHE 104 HE1 PHE 104 -11.880 19.738 0.638 775 HE2 PHE 104 HE2 PHE 104 -9.820 23.326 1.671 776 HZ PHE 104 HZ PHE 104 -11.806 22.198 0.750 777 H SER 105 H SER 105 -4.589 17.672 0.651 778 HA SER 105 HA SER 105 -2.828 19.138 2.477 779 1HB SER 105 1HB SER 105 -2.074 16.753 0.785 780 2HB SER 105 2HB SER 105 -1.267 17.361 2.231 781 HG SER 105 HG SER 105 -2.611 15.487 2.581 782 H GLU 106 H GLU 106 -0.414 18.775 1.104 783 HA GLU 106 HA GLU 106 -0.611 19.878 -1.537 784 1HB GLU 106 1HB GLU 106 -0.397 21.657 0.735 785 2HB GLU 106 2HB GLU 106 1.008 21.812 -0.310 786 1HG GLU 106 1HG GLU 106 -0.156 22.801 -1.945 787 2HG GLU 106 2HG GLU 106 -1.556 21.752 -1.723 788 HA PRO 107 HA PRO 107 4.050 19.352 -0.523 789 1HB PRO 107 1HB PRO 107 4.802 18.870 2.038 790 2HB PRO 107 2HB PRO 107 4.630 20.501 1.382 791 1HG PRO 107 1HG PRO 107 2.719 18.926 3.064 792 2HG PRO 107 2HG PRO 107 3.178 20.634 3.194 793 1HD PRO 107 1HD PRO 107 0.874 19.833 2.025 794 2HD PRO 107 2HD PRO 107 1.761 21.276 1.493 795 H GLY 108 H GLY 108 2.032 17.455 1.710 796 1HA GLY 108 1HA GLY 108 1.557 15.157 1.452 797 2HA GLY 108 2HA GLY 108 2.938 15.016 0.376 798 H ASP 109 H ASP 109 1.983 13.631 2.948 799 HA ASP 109 HA ASP 109 4.503 13.910 4.449 800 1HB ASP 109 1HB ASP 109 2.165 14.379 5.542 801 2HB ASP 109 2HB ASP 109 2.064 12.623 5.619 802 H ALA 110 H ALA 110 2.197 11.648 3.058 803 HA ALA 110 HA ALA 110 2.367 9.462 2.454 804 1HB ALA 110 1HB ALA 110 4.165 9.679 1.095 805 2HB ALA 110 2HB ALA 110 4.925 8.689 2.341 806 3HB ALA 110 3HB ALA 110 5.155 10.438 2.342 807 H GLY 111 H GLY 111 3.343 7.272 3.185 808 1HA GLY 111 1HA GLY 111 4.062 5.852 4.909 809 2HA GLY 111 2HA GLY 111 4.093 7.229 6.001 810 H GLY 112 H GLY 112 2.406 4.471 5.056 811 1HA GLY 112 1HA GLY 112 0.719 4.010 6.972 812 2HA GLY 112 2HA GLY 112 -0.100 5.401 6.278 813 H ILE 113 H ILE 113 -1.202 2.793 6.529 814 HA ILE 113 HA ILE 113 -1.335 1.908 3.725 815 HB ILE 113 HB ILE 113 -2.326 -0.192 4.635 816 1HG1 ILE 113 1HG1 ILE 113 -1.489 0.975 7.300 817 2HG1 ILE 113 2HG1 ILE 113 -3.150 0.743 6.763 818 1HG2 ILE 113 1HG2 ILE 113 -0.234 -1.144 5.372 819 2HG2 ILE 113 2HG2 ILE 113 0.396 0.458 5.757 820 3HG2 ILE 113 3HG2 ILE 113 0.072 0.018 4.080 821 1HD1 ILE 113 1HD1 ILE 113 -2.164 -0.984 8.346 822 2HD1 ILE 113 2HD1 ILE 113 -1.227 -1.544 6.962 823 3HD1 ILE 113 3HD1 ILE 113 -2.990 -1.581 6.907 824 H LEU 114 H LEU 114 -3.325 1.631 2.718 825 HA LEU 114 HA LEU 114 -5.483 3.227 3.835 826 1HB LEU 114 1HB LEU 114 -5.002 3.641 1.537 827 2HB LEU 114 2HB LEU 114 -5.046 1.932 1.150 828 HG LEU 114 HG LEU 114 -7.465 1.891 1.555 829 1HD1 LEU 114 1HD1 LEU 114 -7.247 3.889 3.197 830 2HD1 LEU 114 2HD1 LEU 114 -8.712 3.706 2.232 831 3HD1 LEU 114 3HD1 LEU 114 -7.478 4.870 1.750 832 1HD2 LEU 114 1HD2 LEU 114 -6.177 2.895 -0.626 833 2HD2 LEU 114 2HD2 LEU 114 -7.316 4.190 -0.254 834 3HD2 LEU 114 3HD2 LEU 114 -7.905 2.552 -0.541 835 H ARG 115 H ARG 115 -6.991 2.325 5.070 836 HA ARG 115 HA ARG 115 -7.681 -0.498 4.590 837 1HB ARG 115 1HB ARG 115 -7.910 0.957 7.221 838 2HB ARG 115 2HB ARG 115 -8.109 -0.766 6.933 839 1HG ARG 115 1HG ARG 115 -5.689 -0.777 6.184 840 2HG ARG 115 2HG ARG 115 -5.580 0.848 6.861 841 1HD ARG 115 1HD ARG 115 -6.801 -0.631 8.860 842 2HD ARG 115 2HD ARG 115 -5.590 -1.728 8.197 843 HE ARG 115 HE ARG 115 -4.282 0.655 8.547 844 1HH1 ARG 115 1HH1 ARG 115 -6.049 -1.542 10.604 845 2HH1 ARG 115 2HH1 ARG 115 -5.130 -1.152 12.020 846 1HH2 ARG 115 1HH2 ARG 115 -3.073 1.169 10.407 847 2HH2 ARG 115 2HH2 ARG 115 -3.441 0.388 11.909 848 H CYS 116 H CYS 116 -9.807 -1.130 4.665 849 HA CYS 116 HA CYS 116 -11.800 1.036 4.517 850 1HB CYS 116 1HB CYS 116 -11.465 -0.495 2.492 851 2HB CYS 116 2HB CYS 116 -12.132 -1.788 3.476 852 H GLU 117 H GLU 117 -14.013 0.371 5.332 853 HA GLU 117 HA GLU 117 -13.900 -0.385 8.008 854 1HB GLU 117 1HB GLU 117 -15.975 0.203 6.056 855 2HB GLU 117 2HB GLU 117 -16.481 -1.045 7.185 856 1HG GLU 117 1HG GLU 117 -15.379 0.783 8.865 857 2HG GLU 117 2HG GLU 117 -16.048 1.817 7.604 858 H HIS 118 H HIS 118 -13.771 -2.317 5.194 859 HA HIS 118 HA HIS 118 -14.646 -4.731 6.561 860 1HB HIS 118 1HB HIS 118 -13.705 -4.341 3.714 861 2HB HIS 118 2HB HIS 118 -14.423 -5.807 4.375 862 HD2 HIS 118 HD2 HIS 118 -17.128 -5.922 4.134 863 HE1 HIS 118 HE1 HIS 118 -17.796 -1.833 3.209 864 HE2 HIS 118 HE2 HIS 118 -18.826 -4.128 3.362 865 H GLY 119 H GLY 119 -11.675 -3.272 5.268 866 1HA GLY 119 1HA GLY 119 -10.013 -4.699 7.029 867 2HA GLY 119 2HA GLY 119 -10.032 -5.555 5.498 868 H VAL 120 H VAL 120 -8.064 -5.212 4.732 869 HA VAL 120 HA VAL 120 -6.960 -2.491 4.665 870 HB VAL 120 HB VAL 120 -5.409 -4.951 3.932 871 1HG1 VAL 120 1HG1 VAL 120 -4.818 -2.269 3.898 872 2HG1 VAL 120 2HG1 VAL 120 -3.661 -3.597 3.858 873 3HG1 VAL 120 3HG1 VAL 120 -4.074 -2.836 5.394 874 1HG2 VAL 120 1HG2 VAL 120 -5.402 -5.748 5.991 875 2HG2 VAL 120 2HG2 VAL 120 -6.541 -4.496 6.489 876 3HG2 VAL 120 3HG2 VAL 120 -4.806 -4.207 6.602 877 H ILE 121 H ILE 121 -6.503 -1.457 2.794 878 HA ILE 121 HA ILE 121 -7.331 -2.751 0.297 879 HB ILE 121 HB ILE 121 -6.749 0.149 0.935 880 1HG1 ILE 121 1HG1 ILE 121 -9.157 0.416 0.311 881 2HG1 ILE 121 2HG1 ILE 121 -9.278 -1.338 0.204 882 1HG2 ILE 121 1HG2 ILE 121 -7.447 -1.131 -1.705 883 2HG2 ILE 121 2HG2 ILE 121 -5.981 -0.236 -1.303 884 3HG2 ILE 121 3HG2 ILE 121 -7.530 0.603 -1.389 885 1HD1 ILE 121 1HD1 ILE 121 -9.713 0.229 2.435 886 2HD1 ILE 121 2HD1 ILE 121 -8.141 -0.507 2.716 887 3HD1 ILE 121 3HD1 ILE 121 -9.540 -1.526 2.388 888 H GLY 122 H GLY 122 -4.588 -1.139 1.828 889 1HA GLY 122 1HA GLY 122 -2.578 -2.633 0.792 890 2HA GLY 122 2HA GLY 122 -2.887 -1.459 -0.474 891 H LEU 123 H LEU 123 -0.733 -0.694 -0.164 892 HA LEU 123 HA LEU 123 -0.410 0.948 2.263 893 1HB LEU 123 1HB LEU 123 2.093 0.798 1.560 894 2HB LEU 123 2HB LEU 123 1.345 -0.530 2.426 895 HG LEU 123 HG LEU 123 1.450 -0.564 -0.569 896 1HD1 LEU 123 1HD1 LEU 123 3.615 -1.813 1.064 897 2HD1 LEU 123 2HD1 LEU 123 3.742 -0.125 0.569 898 3HD1 LEU 123 3HD1 LEU 123 3.601 -1.393 -0.648 899 1HD2 LEU 123 1HD2 LEU 123 0.819 -2.711 -0.367 900 2HD2 LEU 123 2HD2 LEU 123 0.278 -2.217 1.236 901 3HD2 LEU 123 3HD2 LEU 123 1.849 -2.990 1.036 902 H VAL 124 H VAL 124 0.949 2.909 1.939 903 HA VAL 124 HA VAL 124 -0.115 4.481 -0.162 904 HB VAL 124 HB VAL 124 0.497 5.444 2.011 905 1HG1 VAL 124 1HG1 VAL 124 3.378 5.510 1.333 906 2HG1 VAL 124 2HG1 VAL 124 2.726 3.984 1.930 907 3HG1 VAL 124 3HG1 VAL 124 2.581 5.446 2.905 908 1HG2 VAL 124 1HG2 VAL 124 2.331 6.903 0.223 909 2HG2 VAL 124 2HG2 VAL 124 0.928 7.475 1.126 910 3HG2 VAL 124 3HG2 VAL 124 0.705 6.627 -0.403 911 H THR 125 H THR 125 0.641 4.958 -2.133 912 HA THR 125 HA THR 125 3.231 3.813 -2.905 913 HB THR 125 HB THR 125 0.702 4.385 -4.412 914 HG1 THR 125 HG1 THR 125 1.046 2.271 -5.087 915 1HG2 THR 125 1HG2 THR 125 2.319 3.529 -6.397 916 2HG2 THR 125 2HG2 THR 125 3.407 4.613 -5.529 917 3HG2 THR 125 3HG2 THR 125 1.863 5.214 -6.140 918 H MET 126 H MET 126 1.514 6.417 -4.594 919 HA MET 126 HA MET 126 3.692 8.246 -3.823 920 1HB MET 126 1HB MET 126 3.234 7.146 -6.411 921 2HB MET 126 2HB MET 126 2.887 8.868 -6.478 922 1HG MET 126 1HG MET 126 5.326 8.237 -5.030 923 2HG MET 126 2HG MET 126 5.350 7.718 -6.715 924 1HE MET 126 1HE MET 126 6.864 11.155 -5.177 925 2HE MET 126 2HE MET 126 7.567 10.444 -6.631 926 3HE MET 126 3HE MET 126 7.120 9.412 -5.272 927 H GLY 127 H GLY 127 3.189 10.549 -4.234 928 1HA GLY 127 1HA GLY 127 0.289 11.083 -4.192 929 2HA GLY 127 2HA GLY 127 1.339 11.775 -2.966 930 H GLY 128 H GLY 128 -0.376 13.126 -4.909 931 1HA GLY 128 1HA GLY 128 1.626 14.470 -6.600 932 2HA GLY 128 2HA GLY 128 -0.112 14.512 -6.855 933 H GLU 129 H GLU 129 -0.065 16.786 -6.973 934 HA GLU 129 HA GLU 129 0.953 18.394 -4.851 935 1HB GLU 129 1HB GLU 129 -0.327 20.226 -5.993 936 2HB GLU 129 2HB GLU 129 0.808 19.368 -7.027 937 1HG GLU 129 1HG GLU 129 -0.847 19.089 -8.467 938 2HG GLU 129 2HG GLU 129 -1.578 17.977 -7.310 939 H GLY 130 H GLY 130 -1.970 16.653 -5.314 940 1HA GLY 130 1HA GLY 130 -2.912 17.439 -2.715 941 2HA GLY 130 2HA GLY 130 -3.908 18.068 -4.016 942 H VAL 131 H VAL 131 -2.411 15.045 -4.652 943 HA VAL 131 HA VAL 131 -4.930 13.661 -4.011 944 HB VAL 131 HB VAL 131 -3.212 12.578 -6.178 945 1HG1 VAL 131 1HG1 VAL 131 -5.211 11.396 -5.439 946 2HG1 VAL 131 2HG1 VAL 131 -5.376 11.935 -7.109 947 3HG1 VAL 131 3HG1 VAL 131 -6.195 12.811 -5.816 948 1HG2 VAL 131 1HG2 VAL 131 -3.327 15.003 -6.672 949 2HG2 VAL 131 2HG2 VAL 131 -5.087 14.885 -6.671 950 3HG2 VAL 131 3HG2 VAL 131 -4.145 14.006 -7.875 951 H VAL 132 H VAL 132 -4.735 11.379 -3.529 952 HA VAL 132 HA VAL 132 -2.121 10.724 -2.340 953 HB VAL 132 HB VAL 132 -3.257 9.467 -0.636 954 1HG1 VAL 132 1HG1 VAL 132 -3.580 11.302 0.563 955 2HG1 VAL 132 2HG1 VAL 132 -5.037 11.704 -0.347 956 3HG1 VAL 132 3HG1 VAL 132 -3.458 12.233 -0.929 957 1HG2 VAL 132 1HG2 VAL 132 -5.715 10.018 -2.266 958 2HG2 VAL 132 2HG2 VAL 132 -5.819 9.622 -0.549 959 3HG2 VAL 132 3HG2 VAL 132 -5.100 8.473 -1.678 960 H GLY 133 H GLY 133 -1.083 9.128 -3.335 961 1HA GLY 133 1HA GLY 133 -2.630 7.206 -4.931 962 2HA GLY 133 2HA GLY 133 -0.912 7.523 -5.100 963 H PHE 134 H PHE 134 -3.002 5.231 -4.175 964 HA PHE 134 HA PHE 134 -1.127 4.125 -2.189 965 1HB PHE 134 1HB PHE 134 -4.104 3.621 -2.245 966 2HB PHE 134 2HB PHE 134 -2.962 3.121 -1.003 967 HD1 PHE 134 HD1 PHE 134 -1.417 5.712 -0.801 968 HD2 PHE 134 HD2 PHE 134 -5.594 4.906 -0.949 969 HE1 PHE 134 HE1 PHE 134 -1.857 7.779 0.452 970 HE2 PHE 134 HE2 PHE 134 -6.037 6.972 0.303 971 HZ PHE 134 HZ PHE 134 -4.170 8.413 1.003 972 H ALA 135 H ALA 135 -0.523 2.014 -2.411 973 HA ALA 135 HA ALA 135 -1.169 0.743 -4.951 974 1HB ALA 135 1HB ALA 135 0.965 0.132 -4.825 975 2HB ALA 135 2HB ALA 135 0.565 -0.898 -3.450 976 3HB ALA 135 3HB ALA 135 1.083 0.767 -3.184 977 H ASP 136 H ASP 136 -2.884 -0.546 -5.055 978 HA ASP 136 HA ASP 136 -4.166 -1.588 -2.737 979 1HB ASP 136 1HB ASP 136 -5.011 -0.987 -5.229 980 2HB ASP 136 2HB ASP 136 -4.871 -2.737 -5.367 981 H VAL 137 H VAL 137 -4.447 -3.677 -2.048 982 HA VAL 137 HA VAL 137 -2.402 -5.604 -2.925 983 HB VAL 137 HB VAL 137 -3.990 -5.576 -0.346 984 1HG1 VAL 137 1HG1 VAL 137 -3.438 -7.802 -0.654 985 2HG1 VAL 137 2HG1 VAL 137 -2.073 -7.204 0.288 986 3HG1 VAL 137 3HG1 VAL 137 -1.915 -7.421 -1.454 987 1HG2 VAL 137 1HG2 VAL 137 -1.051 -5.118 -0.458 988 2HG2 VAL 137 2HG2 VAL 137 -2.236 -4.582 0.736 989 3HG2 VAL 137 3HG2 VAL 137 -2.139 -3.781 -0.834 990 H ARG 138 H ARG 138 -5.445 -4.894 -3.655 991 HA ARG 138 HA ARG 138 -6.803 -7.365 -3.283 992 1HB ARG 138 1HB ARG 138 -7.356 -4.993 -5.066 993 2HB ARG 138 2HB ARG 138 -8.430 -6.379 -4.937 994 1HG ARG 138 1HG ARG 138 -7.994 -5.616 -2.304 995 2HG ARG 138 2HG ARG 138 -8.138 -4.094 -3.184 996 1HD ARG 138 1HD ARG 138 -10.121 -6.347 -3.012 997 2HD ARG 138 2HD ARG 138 -10.327 -4.668 -2.515 998 HE ARG 138 HE ARG 138 -10.727 -5.746 -5.126 999 1HH1 ARG 138 1HH1 ARG 138 -9.759 -2.872 -3.400 1000 2HH1 ARG 138 2HH1 ARG 138 -10.229 -1.797 -4.673 1001 1HH2 ARG 138 1HH2 ARG 138 -11.347 -4.335 -6.802 1002 2HH2 ARG 138 2HH2 ARG 138 -11.132 -2.627 -6.605 1003 H ASP 139 H ASP 139 -4.271 -6.552 -5.305 1004 HA ASP 139 HA ASP 139 -5.135 -8.277 -7.500 1005 1HB ASP 139 1HB ASP 139 -3.686 -5.965 -7.503 1006 2HB ASP 139 2HB ASP 139 -2.404 -7.171 -7.567 1007 H LEU 140 H LEU 140 -4.006 -8.898 -4.578 1008 HA LEU 140 HA LEU 140 -2.989 -11.445 -5.247 1009 1HB LEU 140 1HB LEU 140 -0.707 -11.214 -4.390 1010 2HB LEU 140 2HB LEU 140 -0.966 -10.252 -5.826 1011 HG LEU 140 HG LEU 140 0.161 -8.688 -4.660 1012 1HD1 LEU 140 1HD1 LEU 140 -2.023 -7.670 -4.797 1013 2HD1 LEU 140 2HD1 LEU 140 -1.228 -7.205 -3.291 1014 3HD1 LEU 140 3HD1 LEU 140 -2.494 -8.432 -3.278 1015 1HD2 LEU 140 1HD2 LEU 140 -0.696 -9.256 -1.923 1016 2HD2 LEU 140 2HD2 LEU 140 0.917 -8.983 -2.580 1017 3HD2 LEU 140 3HD2 LEU 140 0.167 -10.574 -2.715 1018 H LEU 141 H LEU 141 -5.015 -11.139 -3.796 1019 HA LEU 141 HA LEU 141 -4.573 -10.601 -1.035 1020 1HB LEU 141 1HB LEU 141 -6.781 -10.936 -2.717 1021 2HB LEU 141 2HB LEU 141 -6.909 -12.209 -1.518 1022 HG LEU 141 HG LEU 141 -8.104 -10.464 -0.568 1023 1HD1 LEU 141 1HD1 LEU 141 -5.728 -9.493 0.771 1024 2HD1 LEU 141 2HD1 LEU 141 -5.766 -11.250 0.645 1025 3HD1 LEU 141 3HD1 LEU 141 -7.102 -10.396 1.411 1026 1HD2 LEU 141 1HD2 LEU 141 -6.980 -8.121 -0.442 1027 2HD2 LEU 141 2HD2 LEU 141 -7.797 -8.627 -1.920 1028 3HD2 LEU 141 3HD2 LEU 141 -6.039 -8.712 -1.812 1029 H TRP 142 H TRP 142 -3.968 -13.352 -2.956 1030 HA TRP 142 HA TRP 142 -4.545 -15.451 -1.244 1031 1HB TRP 142 1HB TRP 142 -2.696 -16.683 -2.393 1032 2HB TRP 142 2HB TRP 142 -3.849 -15.927 -3.488 1033 HD1 TRP 142 HD1 TRP 142 -2.937 -13.458 -4.548 1034 HE1 TRP 142 HE1 TRP 142 -0.562 -12.885 -5.354 1035 HE3 TRP 142 HE3 TRP 142 -0.347 -17.133 -2.123 1036 HZ2 TRP 142 HZ2 TRP 142 2.059 -13.861 -5.005 1037 HZ3 TRP 142 HZ3 TRP 142 2.095 -17.245 -2.412 1038 HH2 TRP 142 HH2 TRP 142 3.273 -15.640 -3.825 1039 H LEU 143 H LEU 143 -4.153 -14.626 0.859 1040 HA LEU 143 HA LEU 143 -1.499 -15.266 1.836 1041 1HB LEU 143 1HB LEU 143 -2.782 -12.597 2.437 1042 2HB LEU 143 2HB LEU 143 -1.307 -13.206 3.160 1043 HG LEU 143 HG LEU 143 -0.516 -13.278 0.614 1044 1HD1 LEU 143 1HD1 LEU 143 -2.957 -11.650 0.629 1045 2HD1 LEU 143 2HD1 LEU 143 -2.139 -12.465 -0.704 1046 3HD1 LEU 143 3HD1 LEU 143 -1.562 -10.897 -0.142 1047 1HD2 LEU 143 1HD2 LEU 143 0.716 -11.375 1.059 1048 2HD2 LEU 143 2HD2 LEU 143 0.281 -11.914 2.681 1049 3HD2 LEU 143 3HD2 LEU 143 -0.606 -10.593 1.923 1050 H GLU 144 H GLU 144 -4.728 -14.055 2.649 1051 HA GLU 144 HA GLU 144 -5.048 -16.148 4.619 1052 1HB GLU 144 1HB GLU 144 -4.494 -13.355 5.356 1053 2HB GLU 144 2HB GLU 144 -5.902 -14.044 6.148 1054 1HG GLU 144 1HG GLU 144 -3.179 -15.321 6.145 1055 2HG GLU 144 2HG GLU 144 -3.780 -14.265 7.422 1056 H ASP 145 H ASP 145 -7.312 -15.314 5.890 1057 HA ASP 145 HA ASP 145 -9.315 -15.786 4.003 1058 1HB ASP 145 1HB ASP 145 -9.160 -15.559 6.793 1059 2HB ASP 145 2HB ASP 145 -10.340 -14.348 6.298 1060 H ASP 146 H ASP 146 -10.700 -14.503 2.869 1061 HA ASP 146 HA ASP 146 -9.943 -11.698 2.611 1062 1HB ASP 146 1HB ASP 146 -11.490 -13.628 0.918 1063 2HB ASP 146 2HB ASP 146 -11.698 -11.897 0.672 1064 H ALA 147 H ALA 147 -11.526 -9.999 2.600 1065 HA ALA 147 HA ALA 147 -13.493 -10.336 4.673 1066 1HB ALA 147 1HB ALA 147 -13.586 -8.054 4.777 1067 2HB ALA 147 2HB ALA 147 -13.368 -7.855 3.038 1068 3HB ALA 147 3HB ALA 147 -11.988 -8.260 4.061 1069 H MET 148 H MET 148 -15.730 -10.036 4.490 1070 HA MET 148 HA MET 148 -17.128 -9.470 2.139 1071 1HB MET 148 1HB MET 148 -18.020 -11.880 1.796 1072 2HB MET 148 2HB MET 148 -16.473 -11.440 1.089 1073 1HG MET 148 1HG MET 148 -15.300 -12.811 2.448 1074 2HG MET 148 2HG MET 148 -16.404 -12.595 3.805 1075 1HE MET 148 1HE MET 148 -15.789 -16.191 1.634 1076 2HE MET 148 2HE MET 148 -15.639 -15.925 3.371 1077 3HE MET 148 3HE MET 148 -14.793 -14.869 2.241 1078 H GLU 149 H GLU 149 -17.083 -11.320 5.139 1079 HA GLU 149 HA GLU 149 -19.775 -10.290 5.722 1080 1HB GLU 149 1HB GLU 149 -19.492 -12.851 5.104 1081 2HB GLU 149 2HB GLU 149 -18.981 -12.964 6.783 1082 1HG GLU 149 1HG GLU 149 -21.261 -11.495 7.000 1083 2HG GLU 149 2HG GLU 149 -21.641 -12.557 5.645 1084 H GLN 150 H GLN 150 -17.138 -9.313 6.479 1085 HA GLN 150 HA GLN 150 -16.860 -9.991 9.289 1086 1HB GLN 150 1HB GLN 150 -15.314 -8.249 7.388 1087 2HB GLN 150 2HB GLN 150 -15.033 -8.167 9.122 1088 1HG GLN 150 1HG GLN 150 -14.871 -10.822 8.757 1089 2HG GLN 150 2HG GLN 150 -14.319 -10.260 7.179 1090 1HE2 GLN 150 1HE2 GLN 150 -13.124 -11.399 9.842 1091 2HE2 GLN 150 2HE2 GLN 150 -11.695 -10.448 10.037 Start of MODEL 16 1 1H GLY 1 1H GLY 1 3.758 -8.789 17.002 2 2H GLY 1 2H GLY 1 5.018 -9.386 17.959 3 3H GLY 1 3H GLY 1 4.103 -10.445 17.011 4 1HA GLY 1 1HA GLY 1 6.052 -10.204 15.796 5 2HA GLY 1 2HA GLY 1 4.906 -9.121 15.018 6 HA PRO 2 HA PRO 2 8.688 -6.610 15.798 7 1HB PRO 2 1HB PRO 2 8.456 -5.111 13.548 8 2HB PRO 2 2HB PRO 2 9.229 -6.699 13.565 9 1HG PRO 2 1HG PRO 2 6.452 -5.952 12.731 10 2HG PRO 2 2HG PRO 2 7.598 -7.057 11.947 11 1HD PRO 2 1HD PRO 2 5.560 -7.932 13.501 12 2HD PRO 2 2HD PRO 2 7.112 -8.786 13.392 13 H TYR 3 H TYR 3 8.830 -4.559 16.632 14 HA TYR 3 HA TYR 3 6.576 -2.736 16.365 15 1HB TYR 3 1HB TYR 3 6.430 -4.370 18.454 16 2HB TYR 3 2HB TYR 3 7.547 -3.199 19.147 17 HD1 TYR 3 HD1 TYR 3 4.172 -3.609 17.691 18 HD2 TYR 3 HD2 TYR 3 6.788 -1.081 19.896 19 HE1 TYR 3 HE1 TYR 3 2.275 -2.148 18.255 20 HE2 TYR 3 HE2 TYR 3 4.900 0.386 20.468 21 HH TYR 3 HH TYR 3 2.666 0.943 19.577 22 H GLY 4 H GLY 4 7.429 -0.844 15.832 23 1HA GLY 4 1HA GLY 4 9.867 0.038 17.229 24 2HA GLY 4 2HA GLY 4 9.783 0.128 15.476 25 H HIS 5 H HIS 5 9.916 2.323 15.268 26 HA HIS 5 HA HIS 5 7.824 3.918 16.586 27 1HB HIS 5 1HB HIS 5 10.639 4.374 16.094 28 2HB HIS 5 2HB HIS 5 9.668 5.667 15.397 29 HD1 HIS 5 HD1 HIS 5 10.850 4.291 18.619 30 HD2 HIS 5 HD2 HIS 5 8.148 7.158 17.297 31 HE1 HIS 5 HE1 HIS 5 10.288 5.671 20.645 32 HE2 HIS 5 HE2 HIS 5 8.590 7.347 19.838 33 H GLN 6 H GLN 6 9.524 3.509 13.491 34 HA GLN 6 HA GLN 6 7.199 4.724 12.148 35 1HB GLN 6 1HB GLN 6 8.823 5.108 10.242 36 2HB GLN 6 2HB GLN 6 9.094 6.071 11.689 37 1HG GLN 6 1HG GLN 6 10.902 4.637 12.362 38 2HG GLN 6 2HG GLN 6 10.580 3.541 11.020 39 1HE2 GLN 6 1HE2 GLN 6 13.047 4.311 11.099 40 2HE2 GLN 6 2HE2 GLN 6 13.407 5.549 9.950 41 H SER 7 H SER 7 6.409 3.757 10.246 42 HA SER 7 HA SER 7 7.488 1.373 9.149 43 1HB SER 7 1HB SER 7 5.807 -0.226 9.884 44 2HB SER 7 2HB SER 7 6.619 0.459 11.291 45 HG SER 7 HG SER 7 4.778 1.987 11.315 46 H GLY 8 H GLY 8 5.577 0.221 7.824 47 1HA GLY 8 1HA GLY 8 3.342 1.582 6.959 48 2HA GLY 8 2HA GLY 8 4.668 2.217 5.996 49 H ALA 9 H ALA 9 4.118 -1.084 7.178 50 HA ALA 9 HA ALA 9 3.855 -1.961 4.379 51 1HB ALA 9 1HB ALA 9 6.082 -2.420 5.893 52 2HB ALA 9 2HB ALA 9 5.572 -3.392 4.514 53 3HB ALA 9 3HB ALA 9 5.150 -3.894 6.151 54 H VAL 10 H VAL 10 2.721 -3.974 4.080 55 HA VAL 10 HA VAL 10 0.725 -4.427 6.189 56 HB VAL 10 HB VAL 10 0.548 -5.268 3.296 57 1HG1 VAL 10 1HG1 VAL 10 -1.178 -5.543 5.659 58 2HG1 VAL 10 2HG1 VAL 10 -1.090 -6.521 4.194 59 3HG1 VAL 10 3HG1 VAL 10 -1.991 -5.005 4.189 60 1HG2 VAL 10 1HG2 VAL 10 -0.384 -2.752 4.657 61 2HG2 VAL 10 2HG2 VAL 10 -1.068 -3.325 3.135 62 3HG2 VAL 10 3HG2 VAL 10 0.644 -2.908 3.232 63 H TYR 11 H TYR 11 0.989 -6.185 7.398 64 HA TYR 11 HA TYR 11 2.447 -8.481 6.268 65 1HB TYR 11 1HB TYR 11 3.478 -7.564 8.265 66 2HB TYR 11 2HB TYR 11 1.950 -7.639 9.134 67 HD1 TYR 11 HD1 TYR 11 0.914 -10.043 9.372 68 HD2 TYR 11 HD2 TYR 11 5.013 -9.272 8.533 69 HE1 TYR 11 HE1 TYR 11 1.501 -12.273 10.218 70 HE2 TYR 11 HE2 TYR 11 5.609 -11.504 9.379 71 HH TYR 11 HH TYR 11 4.754 -13.225 10.798 72 H VAL 12 H VAL 12 1.201 -10.109 5.598 73 HA VAL 12 HA VAL 12 -1.292 -10.643 7.071 74 HB VAL 12 HB VAL 12 -0.875 -11.203 4.132 75 1HG1 VAL 12 1HG1 VAL 12 -2.622 -12.551 4.524 76 2HG1 VAL 12 2HG1 VAL 12 -3.560 -11.062 4.626 77 3HG1 VAL 12 3HG1 VAL 12 -2.951 -11.824 6.095 78 1HG2 VAL 12 1HG2 VAL 12 -2.825 -9.236 4.438 79 2HG2 VAL 12 2HG2 VAL 12 -1.199 -9.029 3.785 80 3HG2 VAL 12 3HG2 VAL 12 -1.506 -8.737 5.497 81 H GLY 13 H GLY 13 -1.156 -12.446 8.206 82 1HA GLY 13 1HA GLY 13 -0.488 -14.536 8.902 83 2HA GLY 13 2HA GLY 13 -0.839 -14.982 7.242 84 H ASN 14 H ASN 14 0.751 -16.120 6.385 85 HA ASN 14 HA ASN 14 3.471 -15.814 7.369 86 1HB ASN 14 1HB ASN 14 2.392 -17.767 5.328 87 2HB ASN 14 2HB ASN 14 3.957 -17.844 6.129 88 1HD2 ASN 14 1HD2 ASN 14 1.311 -19.465 6.050 89 2HD2 ASN 14 2HD2 ASN 14 1.066 -19.868 7.712 90 H TYR 15 H TYR 15 1.963 -13.923 5.432 91 HA TYR 15 HA TYR 15 4.182 -13.684 3.509 92 1HB TYR 15 1HB TYR 15 1.220 -13.510 2.991 93 2HB TYR 15 2HB TYR 15 2.372 -12.685 1.951 94 HD1 TYR 15 HD1 TYR 15 0.391 -14.839 1.161 95 HD2 TYR 15 HD2 TYR 15 4.485 -15.038 2.292 96 HE1 TYR 15 HE1 TYR 15 0.642 -16.904 -0.138 97 HE2 TYR 15 HE2 TYR 15 4.746 -17.099 0.993 98 HH TYR 15 HH TYR 15 2.079 -18.840 -0.263 99 H LYS 16 H LYS 16 4.747 -11.538 2.973 100 HA LYS 16 HA LYS 16 3.337 -9.403 4.399 101 1HB LYS 16 1HB LYS 16 5.359 -10.265 5.713 102 2HB LYS 16 2HB LYS 16 6.346 -9.569 4.434 103 1HG LYS 16 1HG LYS 16 4.307 -7.842 5.732 104 2HG LYS 16 2HG LYS 16 5.776 -8.232 6.629 105 1HD LYS 16 1HD LYS 16 6.145 -7.382 3.825 106 2HD LYS 16 2HD LYS 16 5.571 -6.145 4.944 107 1HE LYS 16 1HE LYS 16 7.823 -7.827 5.864 108 2HE LYS 16 2HE LYS 16 8.168 -6.693 4.557 109 1HZ LYS 16 1HZ LYS 16 8.589 -5.484 6.472 110 2HZ LYS 16 2HZ LYS 16 7.260 -6.116 7.304 111 3HZ LYS 16 3HZ LYS 16 7.023 -4.993 6.063 112 H VAL 17 H VAL 17 2.753 -7.979 2.883 113 HA VAL 17 HA VAL 17 4.478 -7.683 0.538 114 HB VAL 17 HB VAL 17 2.677 -7.228 -0.748 115 1HG1 VAL 17 1HG1 VAL 17 0.999 -8.701 -0.317 116 2HG1 VAL 17 2HG1 VAL 17 0.836 -8.200 1.366 117 3HG1 VAL 17 3HG1 VAL 17 2.170 -9.248 0.882 118 1HG2 VAL 17 1HG2 VAL 17 1.370 -5.839 1.588 119 2HG2 VAL 17 2HG2 VAL 17 0.668 -5.980 -0.025 120 3HG2 VAL 17 3HG2 VAL 17 2.163 -5.075 0.211 121 H VAL 18 H VAL 18 5.767 -6.004 0.357 122 HA VAL 18 HA VAL 18 5.025 -3.471 1.638 123 HB VAL 18 HB VAL 18 6.610 -4.611 3.136 124 1HG1 VAL 18 1HG1 VAL 18 7.748 -5.853 1.237 125 2HG1 VAL 18 2HG1 VAL 18 8.794 -5.218 2.508 126 3HG1 VAL 18 3HG1 VAL 18 8.670 -4.375 0.964 127 1HG2 VAL 18 1HG2 VAL 18 8.089 -2.359 1.826 128 2HG2 VAL 18 2HG2 VAL 18 7.979 -2.764 3.539 129 3HG2 VAL 18 3HG2 VAL 18 6.584 -2.080 2.702 130 H ASN 19 H ASN 19 6.244 -1.611 0.793 131 HA ASN 19 HA ASN 19 6.268 -1.552 -2.015 132 1HB ASN 19 1HB ASN 19 6.971 0.306 0.173 133 2HB ASN 19 2HB ASN 19 7.776 0.615 -1.363 134 1HD2 ASN 19 1HD2 ASN 19 5.584 1.980 0.207 135 2HD2 ASN 19 2HD2 ASN 19 4.330 2.231 -0.955 136 H ARG 20 H ARG 20 7.912 -1.645 -3.513 137 HA ARG 20 HA ARG 20 10.090 -3.305 -3.018 138 1HB ARG 20 1HB ARG 20 8.953 -2.370 -5.253 139 2HB ARG 20 2HB ARG 20 10.342 -1.295 -5.193 140 1HG ARG 20 1HG ARG 20 11.863 -3.096 -5.330 141 2HG ARG 20 2HG ARG 20 10.594 -4.283 -5.021 142 1HD ARG 20 1HD ARG 20 9.639 -3.973 -7.145 143 2HD ARG 20 2HD ARG 20 10.526 -2.474 -7.416 144 HE ARG 20 HE ARG 20 11.462 -5.151 -7.879 145 1HH1 ARG 20 1HH1 ARG 20 12.419 -1.855 -7.242 146 2HH1 ARG 20 2HH1 ARG 20 13.988 -2.042 -7.951 147 1HH2 ARG 20 1HH2 ARG 20 13.526 -5.398 -8.810 148 2HH2 ARG 20 2HH2 ARG 20 14.616 -4.053 -8.841 149 H HIS 21 H HIS 21 9.973 0.240 -3.248 150 HA HIS 21 HA HIS 21 12.740 0.607 -2.727 151 1HB HIS 21 1HB HIS 21 10.696 2.230 -3.576 152 2HB HIS 21 2HB HIS 21 10.971 2.815 -1.938 153 HD1 HIS 21 HD1 HIS 21 12.353 2.907 -5.340 154 HD2 HIS 21 HD2 HIS 21 13.646 3.801 -1.494 155 HE1 HIS 21 HE1 HIS 21 14.423 4.304 -5.635 156 HE2 HIS 21 HE2 HIS 21 15.147 4.895 -3.294 157 H LEU 22 H LEU 22 10.198 -0.354 -0.736 158 HA LEU 22 HA LEU 22 11.545 0.647 1.675 159 1HB LEU 22 1HB LEU 22 8.951 0.910 1.033 160 2HB LEU 22 2HB LEU 22 8.882 -0.630 1.869 161 HG LEU 22 HG LEU 22 10.330 0.827 3.642 162 1HD1 LEU 22 1HD1 LEU 22 10.273 2.959 2.885 163 2HD1 LEU 22 2HD1 LEU 22 8.715 2.950 3.714 164 3HD1 LEU 22 3HD1 LEU 22 8.787 2.713 1.968 165 1HD2 LEU 22 1HD2 LEU 22 8.261 -0.577 3.965 166 2HD2 LEU 22 2HD2 LEU 22 7.322 0.864 3.572 167 3HD2 LEU 22 3HD2 LEU 22 8.379 0.858 4.984 168 H ALA 23 H ALA 23 11.102 -2.173 -0.177 169 HA ALA 23 HA ALA 23 11.034 -4.085 1.920 170 1HB ALA 23 1HB ALA 23 10.480 -5.293 0.137 171 2HB ALA 23 2HB ALA 23 12.195 -5.335 -0.271 172 3HB ALA 23 3HB ALA 23 11.153 -4.096 -0.970 173 H THR 24 H THR 24 12.716 -5.424 2.674 174 HA THR 24 HA THR 24 15.363 -4.156 2.531 175 HB THR 24 HB THR 24 15.845 -5.102 4.662 176 HG1 THR 24 HG1 THR 24 13.506 -6.649 4.274 177 1HG2 THR 24 1HG2 THR 24 12.941 -4.367 4.875 178 2HG2 THR 24 2HG2 THR 24 14.241 -3.186 4.706 179 3HG2 THR 24 3HG2 THR 24 14.186 -4.243 6.117 180 H HIS 25 H HIS 25 17.220 -5.767 2.807 181 HA HIS 25 HA HIS 25 17.338 -7.454 0.608 182 1HB HIS 25 1HB HIS 25 19.425 -8.253 1.476 183 2HB HIS 25 2HB HIS 25 19.294 -6.551 1.904 184 HD1 HIS 25 HD1 HIS 25 17.955 -6.427 4.490 185 HD2 HIS 25 HD2 HIS 25 20.485 -9.587 3.555 186 HE1 HIS 25 HE1 HIS 25 18.669 -7.390 6.698 187 HE2 HIS 25 HE2 HIS 25 20.272 -9.243 6.109 188 H VAL 26 H VAL 26 16.192 -8.048 3.833 189 HA VAL 26 HA VAL 26 16.155 -10.899 3.647 190 HB VAL 26 HB VAL 26 14.537 -9.169 5.518 191 1HG1 VAL 26 1HG1 VAL 26 14.841 -11.218 6.992 192 2HG1 VAL 26 2HG1 VAL 26 15.366 -12.058 5.534 193 3HG1 VAL 26 3HG1 VAL 26 13.740 -11.380 5.624 194 1HG2 VAL 26 1HG2 VAL 26 16.576 -8.428 6.157 195 2HG2 VAL 26 2HG2 VAL 26 17.419 -9.809 5.456 196 3HG2 VAL 26 3HG2 VAL 26 16.618 -9.966 7.019 197 H ASP 27 H ASP 27 13.902 -8.328 2.852 198 HA ASP 27 HA ASP 27 11.582 -9.934 2.677 199 1HB ASP 27 1HB ASP 27 12.369 -7.193 1.835 200 2HB ASP 27 2HB ASP 27 11.033 -7.924 0.953 201 H TRP 28 H TRP 28 14.011 -8.866 0.351 202 HA TRP 28 HA TRP 28 12.786 -10.235 -1.811 203 1HB TRP 28 1HB TRP 28 15.462 -8.903 -1.503 204 2HB TRP 28 2HB TRP 28 14.995 -9.741 -2.984 205 HD1 TRP 28 HD1 TRP 28 12.600 -8.772 -4.124 206 HE1 TRP 28 HE1 TRP 28 11.808 -6.330 -4.304 207 HE3 TRP 28 HE3 TRP 28 15.576 -6.689 -0.535 208 HZ2 TRP 28 HZ2 TRP 28 12.360 -3.848 -3.070 209 HZ3 TRP 28 HZ3 TRP 28 15.384 -4.281 -0.100 210 HH2 TRP 28 HH2 TRP 28 13.817 -2.887 -1.344 211 H GLN 29 H GLN 29 15.208 -11.013 0.556 212 HA GLN 29 HA GLN 29 16.405 -13.226 -0.656 213 1HB GLN 29 1HB GLN 29 16.017 -12.315 2.155 214 2HB GLN 29 2HB GLN 29 16.535 -13.976 1.898 215 1HG GLN 29 1HG GLN 29 18.117 -12.276 0.259 216 2HG GLN 29 2HG GLN 29 18.094 -11.619 1.895 217 1HE2 GLN 29 1HE2 GLN 29 18.788 -14.483 -0.016 218 2HE2 GLN 29 2HE2 GLN 29 19.897 -15.190 1.103 219 H ASN 30 H ASN 30 13.468 -12.970 1.293 220 HA ASN 30 HA ASN 30 12.801 -15.738 0.529 221 1HB ASN 30 1HB ASN 30 11.821 -14.194 2.941 222 2HB ASN 30 2HB ASN 30 11.420 -15.862 2.545 223 1HD2 ASN 30 1HD2 ASN 30 13.597 -13.787 4.093 224 2HD2 ASN 30 2HD2 ASN 30 14.776 -14.965 4.544 225 H CYS 31 H CYS 31 12.348 -13.411 -1.091 226 HA CYS 31 HA CYS 31 9.573 -12.688 -0.854 227 1HB CYS 31 1HB CYS 31 11.067 -11.027 -1.723 228 2HB CYS 31 2HB CYS 31 11.657 -12.122 -2.967 229 HG CYS 31 HG CYS 31 8.803 -10.876 -3.025 230 H VAL 32 H VAL 32 7.882 -13.626 -1.765 231 HA VAL 32 HA VAL 32 8.304 -15.961 -3.457 232 HB VAL 32 HB VAL 32 5.818 -16.276 -3.169 233 1HG1 VAL 32 1HG1 VAL 32 6.054 -16.768 -0.636 234 2HG1 VAL 32 2HG1 VAL 32 7.735 -16.286 -0.876 235 3HG1 VAL 32 3HG1 VAL 32 7.068 -17.642 -1.786 236 1HG2 VAL 32 1HG2 VAL 32 5.297 -13.911 -2.671 237 2HG2 VAL 32 2HG2 VAL 32 6.115 -14.089 -1.120 238 3HG2 VAL 32 3HG2 VAL 32 4.662 -15.024 -1.462 239 H TRP 33 H TRP 33 6.675 -12.811 -3.500 240 HA TRP 33 HA TRP 33 6.612 -12.974 -6.425 241 1HB TRP 33 1HB TRP 33 4.404 -13.510 -6.184 242 2HB TRP 33 2HB TRP 33 4.280 -12.742 -4.608 243 HD1 TRP 33 HD1 TRP 33 3.557 -12.156 -8.249 244 HE1 TRP 33 HE1 TRP 33 2.512 -9.822 -8.551 245 HE3 TRP 33 HE3 TRP 33 4.414 -10.283 -3.585 246 HZ2 TRP 33 HZ2 TRP 33 2.108 -7.484 -6.995 247 HZ3 TRP 33 HZ3 TRP 33 3.679 -7.995 -3.069 248 HH2 TRP 33 HH2 TRP 33 2.552 -6.631 -4.747 249 H GLU 34 H GLU 34 6.509 -10.954 -7.512 250 HA GLU 34 HA GLU 34 6.682 -8.502 -5.994 251 1HB GLU 34 1HB GLU 34 8.986 -9.210 -5.832 252 2HB GLU 34 2HB GLU 34 9.050 -9.546 -7.558 253 1HG GLU 34 1HG GLU 34 8.663 -7.116 -7.966 254 2HG GLU 34 2HG GLU 34 8.819 -6.858 -6.228 255 H ASP 35 H ASP 35 5.513 -7.072 -7.095 256 HA ASP 35 HA ASP 35 5.170 -7.445 -9.983 257 1HB ASP 35 1HB ASP 35 3.491 -6.365 -7.808 258 2HB ASP 35 2HB ASP 35 3.387 -5.501 -9.338 259 H TYR 36 H TYR 36 6.361 -6.256 -11.292 260 HA TYR 36 HA TYR 36 7.899 -4.035 -10.461 261 1HB TYR 36 1HB TYR 36 8.093 -5.694 -12.540 262 2HB TYR 36 2HB TYR 36 7.237 -4.384 -13.345 263 HD1 TYR 36 HD1 TYR 36 8.379 -2.449 -14.044 264 HD2 TYR 36 HD2 TYR 36 10.295 -5.175 -11.399 265 HE1 TYR 36 HE1 TYR 36 10.500 -1.245 -14.350 266 HE2 TYR 36 HE2 TYR 36 12.422 -3.978 -11.698 267 HH TYR 36 HH TYR 36 12.872 -1.608 -14.132 268 H ASN 37 H ASN 37 4.860 -4.302 -12.273 269 HA ASN 37 HA ASN 37 4.590 -1.505 -12.716 270 1HB ASN 37 1HB ASN 37 2.675 -3.826 -12.904 271 2HB ASN 37 2HB ASN 37 2.166 -2.168 -13.210 272 1HD2 ASN 37 1HD2 ASN 37 2.304 -1.482 -15.217 273 2HD2 ASN 37 2HD2 ASN 37 3.290 -2.166 -16.461 274 H ARG 38 H ARG 38 4.239 -3.392 -9.941 275 HA ARG 38 HA ARG 38 2.485 -1.360 -8.734 276 1HB ARG 38 1HB ARG 38 1.600 -3.736 -8.853 277 2HB ARG 38 2HB ARG 38 2.861 -4.171 -7.709 278 1HG ARG 38 1HG ARG 38 0.635 -3.758 -6.682 279 2HG ARG 38 2HG ARG 38 1.933 -2.756 -6.029 280 1HD ARG 38 1HD ARG 38 0.258 -1.736 -8.280 281 2HD ARG 38 2HD ARG 38 -0.373 -1.691 -6.636 282 HE ARG 38 HE ARG 38 1.898 -0.488 -6.210 283 1HH1 ARG 38 1HH1 ARG 38 -0.183 -0.112 -8.992 284 2HH1 ARG 38 2HH1 ARG 38 0.333 1.508 -9.309 285 1HH2 ARG 38 1HH2 ARG 38 2.563 1.645 -6.626 286 2HH2 ARG 38 2HH2 ARG 38 1.886 2.507 -7.966 287 H ASP 39 H ASP 39 5.633 -2.418 -8.869 288 HA ASP 39 HA ASP 39 7.461 -2.250 -7.507 289 1HB ASP 39 1HB ASP 39 5.855 0.215 -7.120 290 2HB ASP 39 2HB ASP 39 7.143 -0.069 -5.952 291 H LEU 40 H LEU 40 5.372 -3.947 -6.557 292 HA LEU 40 HA LEU 40 5.843 -3.758 -3.654 293 1HB LEU 40 1HB LEU 40 3.544 -3.174 -4.093 294 2HB LEU 40 2HB LEU 40 3.332 -4.587 -5.106 295 HG LEU 40 HG LEU 40 3.744 -5.995 -3.046 296 1HD1 LEU 40 1HD1 LEU 40 2.933 -3.830 -1.269 297 2HD1 LEU 40 2HD1 LEU 40 4.554 -3.625 -1.933 298 3HD1 LEU 40 3HD1 LEU 40 4.145 -5.093 -1.045 299 1HD2 LEU 40 1HD2 LEU 40 1.361 -4.238 -2.635 300 2HD2 LEU 40 2HD2 LEU 40 1.501 -5.990 -2.495 301 3HD2 LEU 40 3HD2 LEU 40 1.485 -5.232 -4.088 302 H LEU 41 H LEU 41 5.977 -5.777 -2.530 303 HA LEU 41 HA LEU 41 6.118 -8.185 -4.141 304 1HB LEU 41 1HB LEU 41 8.344 -8.809 -3.483 305 2HB LEU 41 2HB LEU 41 8.370 -7.286 -4.333 306 HG LEU 41 HG LEU 41 9.640 -7.912 -1.930 307 1HD1 LEU 41 1HD1 LEU 41 9.255 -5.067 -2.626 308 2HD1 LEU 41 2HD1 LEU 41 9.930 -6.120 -3.869 309 3HD1 LEU 41 3HD1 LEU 41 10.734 -5.973 -2.303 310 1HD2 LEU 41 1HD2 LEU 41 7.257 -6.171 -1.414 311 2HD2 LEU 41 2HD2 LEU 41 8.732 -6.043 -0.464 312 3HD2 LEU 41 3HD2 LEU 41 7.834 -7.559 -0.496 313 H VAL 42 H VAL 42 6.219 -10.156 -2.920 314 HA VAL 42 HA VAL 42 5.302 -9.799 -0.145 315 HB VAL 42 HB VAL 42 4.338 -11.750 -2.238 316 1HG1 VAL 42 1HG1 VAL 42 3.735 -11.946 0.714 317 2HG1 VAL 42 2HG1 VAL 42 4.856 -13.002 -0.139 318 3HG1 VAL 42 3HG1 VAL 42 3.147 -13.007 -0.564 319 1HG2 VAL 42 1HG2 VAL 42 3.309 -9.363 -1.037 320 2HG2 VAL 42 2HG2 VAL 42 2.245 -10.723 -0.668 321 3HG2 VAL 42 3HG2 VAL 42 2.635 -10.336 -2.344 322 H SER 43 H SER 43 6.381 -10.821 1.373 323 HA SER 43 HA SER 43 8.271 -12.938 0.593 324 1HB SER 43 1HB SER 43 9.908 -12.099 2.037 325 2HB SER 43 2HB SER 43 9.216 -10.627 1.356 326 HG SER 43 HG SER 43 8.218 -10.205 3.228 327 H THR 44 H THR 44 8.679 -14.547 2.271 328 HA THR 44 HA THR 44 6.251 -15.001 3.827 329 HB THR 44 HB THR 44 6.822 -17.306 3.857 330 HG1 THR 44 HG1 THR 44 9.369 -16.468 2.940 331 1HG2 THR 44 1HG2 THR 44 6.546 -17.805 1.689 332 2HG2 THR 44 2HG2 THR 44 7.875 -16.770 1.165 333 3HG2 THR 44 3HG2 THR 44 6.306 -16.061 1.560 334 H THR 45 H THR 45 6.167 -14.881 5.940 335 HA THR 45 HA THR 45 8.658 -14.407 7.413 336 HB THR 45 HB THR 45 7.536 -12.922 8.711 337 HG1 THR 45 HG1 THR 45 5.192 -14.499 8.495 338 1HG2 THR 45 1HG2 THR 45 6.179 -11.573 7.520 339 2HG2 THR 45 2HG2 THR 45 5.148 -12.900 6.978 340 3HG2 THR 45 3HG2 THR 45 6.701 -12.611 6.194 341 H THR 46 H THR 46 5.788 -16.415 7.316 342 HA THR 46 HA THR 46 5.315 -18.433 8.252 343 HB THR 46 HB THR 46 8.091 -18.522 9.414 344 HG1 THR 46 HG1 THR 46 7.303 -18.982 6.733 345 1HG2 THR 46 1HG2 THR 46 6.700 -20.797 8.096 346 2HG2 THR 46 2HG2 THR 46 6.263 -20.347 9.744 347 3HG2 THR 46 3HG2 THR 46 7.925 -20.803 9.365 348 H ALA 47 H ALA 47 4.199 -16.561 9.596 349 HA ALA 47 HA ALA 47 4.430 -17.395 12.365 350 1HB ALA 47 1HB ALA 47 4.289 -14.493 12.261 351 2HB ALA 47 2HB ALA 47 5.795 -15.126 11.597 352 3HB ALA 47 3HB ALA 47 5.312 -15.543 13.241 353 H HIS 48 H HIS 48 2.808 -15.534 13.559 354 HA HIS 48 HA HIS 48 0.236 -16.266 12.474 355 1HB HIS 48 1HB HIS 48 -0.659 -15.141 14.503 356 2HB HIS 48 2HB HIS 48 0.540 -16.376 14.875 357 HD1 HIS 48 HD1 HIS 48 2.944 -15.483 15.581 358 HD2 HIS 48 HD2 HIS 48 -0.059 -12.617 15.403 359 HE1 HIS 48 HE1 HIS 48 3.837 -13.495 16.835 360 HE2 HIS 48 HE2 HIS 48 1.971 -11.804 16.783 361 H GLY 49 H GLY 49 -1.394 -14.845 11.803 362 1HA GLY 49 1HA GLY 49 -0.368 -12.360 10.654 363 2HA GLY 49 2HA GLY 49 -1.879 -13.151 10.234 364 H CYS 50 H CYS 50 -1.438 -10.362 10.843 365 HA CYS 50 HA CYS 50 -3.206 -10.126 13.188 366 1HB CYS 50 1HB CYS 50 -0.694 -8.685 12.533 367 2HB CYS 50 2HB CYS 50 -2.005 -7.717 13.199 368 HG CYS 50 HG CYS 50 -1.325 -10.188 14.862 369 H ASP 51 H ASP 51 -2.000 -8.122 10.487 370 HA ASP 51 HA ASP 51 -4.407 -6.624 10.288 371 1HB ASP 51 1HB ASP 51 -2.171 -6.958 8.274 372 2HB ASP 51 2HB ASP 51 -3.429 -5.728 8.208 373 H THR 52 H THR 52 -6.039 -6.709 8.731 374 HA THR 52 HA THR 52 -6.186 -9.221 7.197 375 HB THR 52 HB THR 52 -8.469 -7.786 8.564 376 HG1 THR 52 HG1 THR 52 -8.482 -9.674 9.874 377 1HG2 THR 52 1HG2 THR 52 -8.469 -10.439 7.148 378 2HG2 THR 52 2HG2 THR 52 -9.184 -8.949 6.531 379 3HG2 THR 52 3HG2 THR 52 -9.826 -9.696 7.994 380 H ILE 53 H ILE 53 -6.179 -8.850 5.085 381 HA ILE 53 HA ILE 53 -6.651 -6.249 3.996 382 HB ILE 53 HB ILE 53 -6.676 -8.662 2.250 383 1HG1 ILE 53 1HG1 ILE 53 -4.583 -8.103 4.164 384 2HG1 ILE 53 2HG1 ILE 53 -4.743 -9.455 3.051 385 1HG2 ILE 53 1HG2 ILE 53 -5.485 -7.199 0.728 386 2HG2 ILE 53 2HG2 ILE 53 -5.380 -5.957 1.975 387 3HG2 ILE 53 3HG2 ILE 53 -6.950 -6.417 1.317 388 1HD1 ILE 53 1HD1 ILE 53 -3.784 -7.891 1.284 389 2HD1 ILE 53 2HD1 ILE 53 -2.692 -8.477 2.535 390 3HD1 ILE 53 3HD1 ILE 53 -3.344 -6.841 2.631 391 H ALA 54 H ALA 54 -8.395 -5.467 2.913 392 HA ALA 54 HA ALA 54 -10.866 -7.004 3.187 393 1HB ALA 54 1HB ALA 54 -11.358 -4.404 2.155 394 2HB ALA 54 2HB ALA 54 -10.198 -4.263 3.475 395 3HB ALA 54 3HB ALA 54 -11.752 -5.050 3.747 396 H ARG 55 H ARG 55 -11.777 -7.984 1.506 397 HA ARG 55 HA ARG 55 -10.712 -7.517 -1.165 398 1HB ARG 55 1HB ARG 55 -11.522 -9.798 0.169 399 2HB ARG 55 2HB ARG 55 -12.862 -9.485 -0.923 400 1HG ARG 55 1HG ARG 55 -10.286 -9.218 -2.233 401 2HG ARG 55 2HG ARG 55 -10.529 -10.818 -1.531 402 1HD ARG 55 1HD ARG 55 -12.512 -9.439 -3.334 403 2HD ARG 55 2HD ARG 55 -11.304 -10.592 -3.894 404 HE ARG 55 HE ARG 55 -12.452 -12.313 -2.769 405 1HH1 ARG 55 1HH1 ARG 55 -14.097 -9.237 -2.511 406 2HH1 ARG 55 2HH1 ARG 55 -15.603 -9.949 -2.044 407 1HH2 ARG 55 1HH2 ARG 55 -14.433 -13.237 -2.152 408 2HH2 ARG 55 2HH2 ARG 55 -15.796 -12.213 -1.838 409 H CYS 56 H CYS 56 -12.319 -5.474 0.037 410 HA CYS 56 HA CYS 56 -14.830 -5.589 -1.462 411 1HB CYS 56 1HB CYS 56 -15.461 -3.606 -0.132 412 2HB CYS 56 2HB CYS 56 -15.019 -4.972 0.888 413 H GLN 57 H GLN 57 -15.519 -3.484 -2.492 414 HA GLN 57 HA GLN 57 -13.211 -2.172 -3.770 415 1HB GLN 57 1HB GLN 57 -14.889 -3.837 -5.075 416 2HB GLN 57 2HB GLN 57 -15.749 -2.317 -5.288 417 1HG GLN 57 1HG GLN 57 -14.119 -1.416 -6.606 418 2HG GLN 57 2HG GLN 57 -12.838 -2.382 -5.874 419 1HE2 GLN 57 1HE2 GLN 57 -13.060 -2.068 -8.606 420 2HE2 GLN 57 2HE2 GLN 57 -13.484 -3.583 -9.320 421 H CYS 58 H CYS 58 -14.451 -1.178 -1.448 422 HA CYS 58 HA CYS 58 -16.435 0.767 -2.048 423 1HB CYS 58 1HB CYS 58 -14.493 0.876 0.261 424 2HB CYS 58 2HB CYS 58 -16.095 1.597 0.169 425 H THR 59 H THR 59 -16.258 2.793 -2.800 426 HA THR 59 HA THR 59 -13.714 3.698 -3.777 427 HB THR 59 HB THR 59 -15.590 4.187 -5.151 428 HG1 THR 59 HG1 THR 59 -15.370 6.368 -5.377 429 1HG2 THR 59 1HG2 THR 59 -17.615 4.498 -4.333 430 2HG2 THR 59 2HG2 THR 59 -17.109 6.079 -3.736 431 3HG2 THR 59 3HG2 THR 59 -16.966 4.658 -2.701 432 H THR 60 H THR 60 -15.185 3.854 -0.789 433 HA THR 60 HA THR 60 -13.714 6.304 -0.083 434 HB THR 60 HB THR 60 -15.329 6.791 1.589 435 HG1 THR 60 HG1 THR 60 -15.723 4.757 2.413 436 1HG2 THR 60 1HG2 THR 60 -16.661 5.875 -0.935 437 2HG2 THR 60 2HG2 THR 60 -16.239 7.515 -0.445 438 3HG2 THR 60 3HG2 THR 60 -17.544 6.658 0.375 439 H GLY 61 H GLY 61 -12.047 6.046 1.217 440 1HA GLY 61 1HA GLY 61 -12.079 3.973 3.272 441 2HA GLY 61 2HA GLY 61 -10.797 3.875 2.071 442 H VAL 62 H VAL 62 -10.243 4.197 4.796 443 HA VAL 62 HA VAL 62 -9.553 7.032 5.057 444 HB VAL 62 HB VAL 62 -10.711 6.005 6.964 445 1HG1 VAL 62 1HG1 VAL 62 -9.208 3.792 6.456 446 2HG1 VAL 62 2HG1 VAL 62 -10.101 4.081 7.949 447 3HG1 VAL 62 3HG1 VAL 62 -8.382 4.463 7.862 448 1HG2 VAL 62 1HG2 VAL 62 -9.615 7.667 7.962 449 2HG2 VAL 62 2HG2 VAL 62 -8.121 7.328 7.086 450 3HG2 VAL 62 3HG2 VAL 62 -8.506 6.428 8.551 451 H TYR 63 H TYR 63 -7.541 7.786 5.019 452 HA TYR 63 HA TYR 63 -5.341 5.847 4.765 453 1HB TYR 63 1HB TYR 63 -4.293 7.249 3.142 454 2HB TYR 63 2HB TYR 63 -5.971 7.075 2.649 455 HD1 TYR 63 HD1 TYR 63 -7.483 8.986 2.680 456 HD2 TYR 63 HD2 TYR 63 -3.448 9.379 3.977 457 HE1 TYR 63 HE1 TYR 63 -7.693 11.434 2.589 458 HE2 TYR 63 HE2 TYR 63 -3.655 11.828 3.888 459 HH TYR 63 HH TYR 63 -5.765 13.505 4.073 460 H PHE 64 H PHE 64 -3.192 7.484 4.848 461 HA PHE 64 HA PHE 64 -1.789 8.637 6.207 462 1HB PHE 64 1HB PHE 64 -4.376 9.926 6.654 463 2HB PHE 64 2HB PHE 64 -3.300 10.057 8.040 464 HD1 PHE 64 HD1 PHE 64 -3.371 12.501 7.674 465 HD2 PHE 64 HD2 PHE 64 -1.723 9.846 4.781 466 HE1 PHE 64 HE1 PHE 64 -2.215 14.389 6.602 467 HE2 PHE 64 HE2 PHE 64 -0.564 11.730 3.709 468 HZ PHE 64 HZ PHE 64 -0.807 14.004 4.618 469 H CYS 65 H CYS 65 -4.196 8.545 8.782 470 HA CYS 65 HA CYS 65 -4.315 7.353 10.718 471 1HB CYS 65 1HB CYS 65 -3.334 5.471 8.827 472 2HB CYS 65 2HB CYS 65 -2.422 5.248 10.316 473 HG CYS 65 HG CYS 65 -4.742 4.869 11.536 474 H ALA 66 H ALA 66 -0.944 6.943 9.593 475 HA ALA 66 HA ALA 66 0.011 7.680 12.241 476 1HB ALA 66 1HB ALA 66 2.279 7.187 11.073 477 2HB ALA 66 2HB ALA 66 1.269 6.465 9.821 478 3HB ALA 66 3HB ALA 66 1.196 5.855 11.474 479 H SER 67 H SER 67 0.133 8.901 8.926 480 HA SER 67 HA SER 67 1.996 10.892 9.095 481 1HB SER 67 1HB SER 67 -0.665 11.359 7.756 482 2HB SER 67 2HB SER 67 0.920 11.958 7.272 483 HG SER 67 HG SER 67 -0.153 9.369 7.027 484 H LYS 68 H LYS 68 -1.477 11.591 9.540 485 HA LYS 68 HA LYS 68 -0.792 13.953 11.088 486 1HB LYS 68 1HB LYS 68 -3.106 13.011 9.577 487 2HB LYS 68 2HB LYS 68 -3.550 13.735 11.117 488 1HG LYS 68 1HG LYS 68 -1.604 15.201 9.431 489 2HG LYS 68 2HG LYS 68 -3.285 15.156 8.896 490 1HD LYS 68 1HD LYS 68 -4.028 16.380 10.680 491 2HD LYS 68 2HD LYS 68 -2.743 15.809 11.745 492 1HE LYS 68 1HE LYS 68 -1.924 17.467 9.437 493 2HE LYS 68 2HE LYS 68 -2.811 18.284 10.722 494 1HZ LYS 68 1HZ LYS 68 -1.170 17.787 12.273 495 2HZ LYS 68 2HZ LYS 68 -0.286 18.197 10.891 496 3HZ LYS 68 3HZ LYS 68 -0.478 16.573 11.319 497 H SER 69 H SER 69 -0.769 10.895 11.935 498 HA SER 69 HA SER 69 -0.940 9.776 13.901 499 1HB SER 69 1HB SER 69 -0.447 12.398 14.653 500 2HB SER 69 2HB SER 69 -1.876 11.966 15.593 501 HG SER 69 HG SER 69 0.685 10.798 15.608 502 H LYS 70 H LYS 70 -3.382 10.725 12.172 503 HA LYS 70 HA LYS 70 -5.354 9.460 13.910 504 1HB LYS 70 1HB LYS 70 -5.863 12.082 12.493 505 2HB LYS 70 2HB LYS 70 -7.051 11.153 13.395 506 1HG LYS 70 1HG LYS 70 -6.507 12.309 15.199 507 2HG LYS 70 2HG LYS 70 -4.912 11.559 15.154 508 1HD LYS 70 1HD LYS 70 -4.142 13.653 14.939 509 2HD LYS 70 2HD LYS 70 -4.674 13.517 13.261 510 1HE LYS 70 1HE LYS 70 -6.304 15.016 13.553 511 2HE LYS 70 2HE LYS 70 -6.833 14.265 15.057 512 1HZ LYS 70 1HZ LYS 70 -4.688 16.276 14.694 513 2HZ LYS 70 2HZ LYS 70 -4.882 15.394 16.125 514 3HZ LYS 70 3HZ LYS 70 -6.112 16.427 15.595 515 H HIS 71 H HIS 71 -7.400 8.994 12.664 516 HA HIS 71 HA HIS 71 -6.656 7.832 10.105 517 1HB HIS 71 1HB HIS 71 -9.050 6.890 10.284 518 2HB HIS 71 2HB HIS 71 -7.854 6.309 11.436 519 HD1 HIS 71 HD1 HIS 71 -8.091 7.160 13.904 520 HD2 HIS 71 HD2 HIS 71 -11.194 8.261 11.370 521 HE1 HIS 71 HE1 HIS 71 -9.941 7.950 15.413 522 HE2 HIS 71 HE2 HIS 71 -11.837 8.539 13.860 523 H TYR 72 H TYR 72 -6.932 8.937 8.276 524 HA TYR 72 HA TYR 72 -9.008 11.020 8.196 525 1HB TYR 72 1HB TYR 72 -6.295 10.791 7.119 526 2HB TYR 72 2HB TYR 72 -7.464 11.359 5.934 527 HD1 TYR 72 HD1 TYR 72 -8.400 13.547 6.075 528 HD2 TYR 72 HD2 TYR 72 -5.897 12.092 9.191 529 HE1 TYR 72 HE1 TYR 72 -8.240 15.820 6.996 530 HE2 TYR 72 HE2 TYR 72 -5.729 14.360 10.125 531 HH TYR 72 HH TYR 72 -5.989 16.656 9.446 532 HA PRO 73 HA PRO 73 -10.983 8.120 5.340 533 1HB PRO 73 1HB PRO 73 -13.367 9.729 5.574 534 2HB PRO 73 2HB PRO 73 -13.056 8.120 6.230 535 1HG PRO 73 1HG PRO 73 -13.359 10.342 7.786 536 2HG PRO 73 2HG PRO 73 -12.394 8.930 8.260 537 1HD PRO 73 1HD PRO 73 -11.477 11.540 7.089 538 2HD PRO 73 2HD PRO 73 -10.789 10.605 8.438 539 H VAL 74 H VAL 74 -11.217 8.211 3.161 540 HA VAL 74 HA VAL 74 -11.815 10.734 1.851 541 HB VAL 74 HB VAL 74 -9.245 10.423 2.245 542 1HG1 VAL 74 1HG1 VAL 74 -9.154 8.135 1.337 543 2HG1 VAL 74 2HG1 VAL 74 -8.082 9.249 0.489 544 3HG1 VAL 74 3HG1 VAL 74 -9.611 8.767 -0.246 545 1HG2 VAL 74 1HG2 VAL 74 -10.264 11.140 -0.494 546 2HG2 VAL 74 2HG2 VAL 74 -8.775 11.698 0.270 547 3HG2 VAL 74 3HG2 VAL 74 -10.339 12.197 0.916 548 H SER 75 H SER 75 -12.127 10.506 -0.474 549 HA SER 75 HA SER 75 -13.078 7.812 -1.178 550 1HB SER 75 1HB SER 75 -14.718 8.797 -2.556 551 2HB SER 75 2HB SER 75 -14.687 9.845 -1.138 552 HG SER 75 HG SER 75 -14.536 11.253 -2.763 553 H PHE 76 H PHE 76 -12.010 6.745 -2.754 554 HA PHE 76 HA PHE 76 -10.334 8.341 -4.568 555 1HB PHE 76 1HB PHE 76 -9.068 5.835 -4.312 556 2HB PHE 76 2HB PHE 76 -8.477 7.400 -3.786 557 HD1 PHE 76 HD1 PHE 76 -11.087 5.050 -2.491 558 HD2 PHE 76 HD2 PHE 76 -7.546 7.276 -1.727 559 HE1 PHE 76 HE1 PHE 76 -11.109 4.284 -0.152 560 HE2 PHE 76 HE2 PHE 76 -7.564 6.528 0.609 561 HZ PHE 76 HZ PHE 76 -9.346 5.025 1.399 562 H GLU 77 H GLU 77 -9.595 7.140 -6.469 563 HA GLU 77 HA GLU 77 -11.731 5.414 -7.524 564 1HB GLU 77 1HB GLU 77 -10.142 7.633 -8.712 565 2HB GLU 77 2HB GLU 77 -10.518 6.273 -9.761 566 1HG GLU 77 1HG GLU 77 -12.328 7.555 -10.188 567 2HG GLU 77 2HG GLU 77 -12.948 6.676 -8.791 568 H GLY 78 H GLY 78 -10.985 3.748 -9.085 569 1HA GLY 78 1HA GLY 78 -8.334 2.762 -8.258 570 2HA GLY 78 2HA GLY 78 -9.665 1.743 -8.765 571 HA PRO 79 HA PRO 79 -7.997 3.648 -12.879 572 1HB PRO 79 1HB PRO 79 -5.506 5.008 -12.145 573 2HB PRO 79 2HB PRO 79 -6.853 5.594 -13.123 574 1HG PRO 79 1HG PRO 79 -6.322 6.537 -10.645 575 2HG PRO 79 2HG PRO 79 -7.961 6.459 -11.316 576 1HD PRO 79 1HD PRO 79 -6.642 4.671 -9.325 577 2HD PRO 79 2HD PRO 79 -8.318 5.224 -9.422 578 H GLY 80 H GLY 80 -6.893 2.290 -14.152 579 1HA GLY 80 1HA GLY 80 -5.374 0.191 -13.067 580 2HA GLY 80 2HA GLY 80 -5.516 0.570 -14.776 581 H LEU 81 H LEU 81 -3.956 1.878 -15.766 582 HA LEU 81 HA LEU 81 -1.391 1.815 -14.421 583 1HB LEU 81 1HB LEU 81 -2.048 1.278 -16.947 584 2HB LEU 81 2HB LEU 81 -1.631 2.973 -17.123 585 HG LEU 81 HG LEU 81 0.380 1.949 -17.564 586 1HD1 LEU 81 1HD1 LEU 81 0.706 3.591 -15.809 587 2HD1 LEU 81 2HD1 LEU 81 1.856 2.263 -15.655 588 3HD1 LEU 81 3HD1 LEU 81 0.458 2.344 -14.589 589 1HD2 LEU 81 1HD2 LEU 81 0.236 -0.284 -17.286 590 2HD2 LEU 81 2HD2 LEU 81 -0.624 -0.143 -15.753 591 3HD2 LEU 81 3HD2 LEU 81 1.125 0.074 -15.806 592 H VAL 82 H VAL 82 -0.597 3.438 -13.326 593 HA VAL 82 HA VAL 82 -1.285 6.184 -14.129 594 HB VAL 82 HB VAL 82 -0.956 5.157 -11.289 595 1HG1 VAL 82 1HG1 VAL 82 0.066 7.304 -11.365 596 2HG1 VAL 82 2HG1 VAL 82 -1.543 7.528 -10.677 597 3HG1 VAL 82 3HG1 VAL 82 -1.235 7.962 -12.360 598 1HG2 VAL 82 1HG2 VAL 82 -3.311 6.267 -12.815 599 2HG2 VAL 82 2HG2 VAL 82 -3.290 6.042 -11.067 600 3HG2 VAL 82 3HG2 VAL 82 -3.138 4.648 -12.139 601 H GLU 83 H GLU 83 0.449 7.316 -14.717 602 HA GLU 83 HA GLU 83 3.067 6.223 -14.472 603 1HB GLU 83 1HB GLU 83 2.451 7.558 -16.411 604 2HB GLU 83 2HB GLU 83 2.141 8.952 -15.385 605 1HG GLU 83 1HG GLU 83 4.222 9.579 -15.816 606 2HG GLU 83 2HG GLU 83 4.739 8.260 -14.769 607 H VAL 84 H VAL 84 4.048 6.149 -12.565 608 HA VAL 84 HA VAL 84 3.618 8.193 -10.572 609 HB VAL 84 HB VAL 84 3.775 5.956 -9.751 610 1HG1 VAL 84 1HG1 VAL 84 6.355 5.824 -11.280 611 2HG1 VAL 84 2HG1 VAL 84 4.938 4.786 -11.419 612 3HG1 VAL 84 3HG1 VAL 84 5.965 4.690 -9.989 613 1HG2 VAL 84 1HG2 VAL 84 4.937 6.511 -7.929 614 2HG2 VAL 84 2HG2 VAL 84 5.304 8.018 -8.768 615 3HG2 VAL 84 3HG2 VAL 84 6.443 6.673 -8.831 616 H GLN 85 H GLN 85 4.657 10.031 -10.636 617 HA GLN 85 HA GLN 85 7.046 10.456 -12.147 618 1HB GLN 85 1HB GLN 85 5.241 12.162 -11.818 619 2HB GLN 85 2HB GLN 85 5.739 12.299 -10.138 620 1HG GLN 85 1HG GLN 85 6.980 13.993 -10.904 621 2HG GLN 85 2HG GLN 85 8.097 12.713 -11.375 622 1HE2 GLN 85 1HE2 GLN 85 8.635 14.654 -12.822 623 2HE2 GLN 85 2HE2 GLN 85 7.869 14.667 -14.371 624 H GLU 86 H GLU 86 9.123 11.064 -11.324 625 HA GLU 86 HA GLU 86 9.912 9.571 -9.054 626 1HB GLU 86 1HB GLU 86 12.106 10.815 -9.352 627 2HB GLU 86 2HB GLU 86 11.556 9.882 -10.735 628 1HG GLU 86 1HG GLU 86 10.863 11.830 -11.889 629 2HG GLU 86 2HG GLU 86 11.060 12.830 -10.452 630 H SER 87 H SER 87 9.027 10.149 -7.175 631 HA SER 87 HA SER 87 9.777 12.745 -6.076 632 1HB SER 87 1HB SER 87 7.014 11.905 -6.688 633 2HB SER 87 2HB SER 87 7.253 12.557 -5.066 634 HG SER 87 HG SER 87 8.378 14.337 -6.222 635 H GLU 88 H GLU 88 9.088 12.805 -3.669 636 HA GLU 88 HA GLU 88 9.642 11.973 -1.612 637 1HB GLU 88 1HB GLU 88 7.269 11.181 -2.181 638 2HB GLU 88 2HB GLU 88 7.982 9.600 -2.443 639 1HG GLU 88 1HG GLU 88 7.434 9.331 -0.277 640 2HG GLU 88 2HG GLU 88 8.995 10.115 -0.029 641 H TYR 89 H TYR 89 9.335 8.755 -3.038 642 HA TYR 89 HA TYR 89 12.205 8.347 -3.033 643 1HB TYR 89 1HB TYR 89 11.779 6.181 -1.647 644 2HB TYR 89 2HB TYR 89 11.945 7.717 -0.804 645 HD1 TYR 89 HD1 TYR 89 9.073 6.082 -2.563 646 HD2 TYR 89 HD2 TYR 89 10.583 7.732 1.057 647 HE1 TYR 89 HE1 TYR 89 6.885 5.734 -1.499 648 HE2 TYR 89 HE2 TYR 89 8.399 7.386 2.132 649 HH TYR 89 HH TYR 89 5.942 5.484 0.731 650 H TYR 90 H TYR 90 9.833 8.308 -4.886 651 HA TYR 90 HA TYR 90 10.124 5.552 -5.879 652 1HB TYR 90 1HB TYR 90 7.789 7.215 -5.464 653 2HB TYR 90 2HB TYR 90 7.899 6.695 -7.142 654 HD1 TYR 90 HD1 TYR 90 6.173 5.125 -7.298 655 HD2 TYR 90 HD2 TYR 90 8.971 4.827 -4.111 656 HE1 TYR 90 HE1 TYR 90 5.230 2.943 -6.687 657 HE2 TYR 90 HE2 TYR 90 8.039 2.638 -3.489 658 HH TYR 90 HH TYR 90 5.095 1.494 -4.667 659 HA PRO 91 HA PRO 91 11.891 7.385 -9.521 660 1HB PRO 91 1HB PRO 91 12.022 5.226 -11.077 661 2HB PRO 91 2HB PRO 91 12.971 5.332 -9.589 662 1HG PRO 91 1HG PRO 91 10.429 3.854 -10.116 663 2HG PRO 91 2HG PRO 91 11.839 3.355 -9.167 664 1HD PRO 91 1HD PRO 91 9.495 4.419 -8.119 665 2HD PRO 91 2HD PRO 91 11.059 4.369 -7.284 666 H LYS 92 H LYS 92 11.333 8.191 -11.532 667 HA LYS 92 HA LYS 92 8.589 8.479 -12.129 668 1HB LYS 92 1HB LYS 92 10.219 10.187 -12.732 669 2HB LYS 92 2HB LYS 92 11.022 9.066 -13.821 670 1HG LYS 92 1HG LYS 92 9.763 9.933 -15.430 671 2HG LYS 92 2HG LYS 92 8.414 9.051 -14.712 672 1HD LYS 92 1HD LYS 92 7.407 10.974 -14.229 673 2HD LYS 92 2HD LYS 92 8.784 11.455 -13.237 674 1HE LYS 92 1HE LYS 92 8.976 11.738 -16.196 675 2HE LYS 92 2HE LYS 92 8.010 12.904 -15.294 676 1HZ LYS 92 1HZ LYS 92 10.886 12.542 -15.363 677 2HZ LYS 92 2HZ LYS 92 10.236 12.855 -13.833 678 3HZ LYS 92 3HZ LYS 92 9.976 13.944 -15.100 679 H ARG 93 H ARG 93 8.108 6.108 -12.137 680 HA ARG 93 HA ARG 93 8.505 5.006 -14.844 681 1HB ARG 93 1HB ARG 93 9.628 3.897 -12.698 682 2HB ARG 93 2HB ARG 93 8.042 3.151 -12.564 683 1HG ARG 93 1HG ARG 93 8.478 1.720 -14.204 684 2HG ARG 93 2HG ARG 93 9.061 3.003 -15.267 685 1HD ARG 93 1HD ARG 93 11.101 2.810 -13.475 686 2HD ARG 93 2HD ARG 93 10.549 1.137 -13.557 687 HE ARG 93 HE ARG 93 12.052 2.496 -15.511 688 1HH1 ARG 93 1HH1 ARG 93 9.374 0.274 -15.230 689 2HH1 ARG 93 2HH1 ARG 93 9.650 -0.449 -16.779 690 1HH2 ARG 93 1HH2 ARG 93 12.414 1.546 -17.549 691 2HH2 ARG 93 2HH2 ARG 93 11.376 0.272 -18.095 692 H TYR 94 H TYR 94 6.856 3.005 -15.029 693 HA TYR 94 HA TYR 94 4.211 4.203 -14.711 694 1HB TYR 94 1HB TYR 94 5.400 2.130 -16.503 695 2HB TYR 94 2HB TYR 94 3.672 2.051 -16.174 696 HD1 TYR 94 HD1 TYR 94 2.195 3.357 -17.413 697 HD2 TYR 94 HD2 TYR 94 6.321 4.384 -17.355 698 HE1 TYR 94 HE1 TYR 94 1.784 5.068 -19.124 699 HE2 TYR 94 HE2 TYR 94 5.925 6.097 -19.069 700 HH TYR 94 HH TYR 94 4.128 7.427 -19.967 701 H GLN 95 H GLN 95 2.692 3.413 -13.351 702 HA GLN 95 HA GLN 95 3.184 0.796 -12.109 703 1HB GLN 95 1HB GLN 95 3.134 3.394 -10.828 704 2HB GLN 95 2HB GLN 95 1.912 2.331 -10.149 705 1HG GLN 95 1HG GLN 95 3.422 1.044 -9.126 706 2HG GLN 95 2HG GLN 95 4.519 1.064 -10.507 707 1HE2 GLN 95 1HE2 GLN 95 6.399 1.539 -9.532 708 2HE2 GLN 95 2HE2 GLN 95 6.701 2.980 -8.629 709 H SER 96 H SER 96 1.492 -0.543 -12.230 710 HA SER 96 HA SER 96 -1.113 0.602 -12.956 711 1HB SER 96 1HB SER 96 0.152 -1.280 -14.291 712 2HB SER 96 2HB SER 96 -0.554 -2.335 -13.066 713 HG SER 96 HG SER 96 -2.607 -1.500 -13.658 714 H HIS 97 H HIS 97 -3.051 -0.194 -12.012 715 HA HIS 97 HA HIS 97 -4.423 -0.872 -10.333 716 1HB HIS 97 1HB HIS 97 -2.211 -2.716 -10.201 717 2HB HIS 97 2HB HIS 97 -2.812 -2.383 -8.581 718 HD1 HIS 97 HD1 HIS 97 -4.827 -2.735 -11.781 719 HD2 HIS 97 HD2 HIS 97 -4.341 -4.578 -8.088 720 HE1 HIS 97 HE1 HIS 97 -6.599 -4.515 -11.679 721 HE2 HIS 97 HE2 HIS 97 -6.228 -5.676 -9.473 722 H VAL 98 H VAL 98 -3.623 1.613 -10.032 723 HA VAL 98 HA VAL 98 -2.938 1.807 -7.169 724 HB VAL 98 HB VAL 98 -1.137 2.641 -8.767 725 1HG1 VAL 98 1HG1 VAL 98 -1.550 5.086 -9.412 726 2HG1 VAL 98 2HG1 VAL 98 -3.263 4.677 -9.302 727 3HG1 VAL 98 3HG1 VAL 98 -2.224 3.819 -10.441 728 1HG2 VAL 98 1HG2 VAL 98 -0.856 3.296 -6.571 729 2HG2 VAL 98 2HG2 VAL 98 -2.315 4.289 -6.574 730 3HG2 VAL 98 3HG2 VAL 98 -0.879 4.826 -7.451 731 H LEU 99 H LEU 99 -4.119 3.198 -5.915 732 HA LEU 99 HA LEU 99 -6.496 4.362 -7.193 733 1HB LEU 99 1HB LEU 99 -6.021 3.515 -4.335 734 2HB LEU 99 2HB LEU 99 -7.476 4.314 -4.899 735 HG LEU 99 HG LEU 99 -7.769 2.355 -6.495 736 1HD1 LEU 99 1HD1 LEU 99 -5.696 1.300 -6.552 737 2HD1 LEU 99 2HD1 LEU 99 -6.671 0.243 -5.532 738 3HD1 LEU 99 3HD1 LEU 99 -5.513 1.353 -4.799 739 1HD2 LEU 99 1HD2 LEU 99 -9.063 2.712 -4.405 740 2HD2 LEU 99 2HD2 LEU 99 -7.879 1.726 -3.549 741 3HD2 LEU 99 3HD2 LEU 99 -8.860 1.013 -4.829 742 H LEU 100 H LEU 100 -7.110 6.502 -6.706 743 HA LEU 100 HA LEU 100 -5.143 8.045 -5.164 744 1HB LEU 100 1HB LEU 100 -5.797 8.298 -8.001 745 2HB LEU 100 2HB LEU 100 -5.876 9.815 -7.123 746 HG LEU 100 HG LEU 100 -3.476 7.978 -7.215 747 1HD1 LEU 100 1HD1 LEU 100 -4.125 9.263 -9.325 748 2HD1 LEU 100 2HD1 LEU 100 -2.483 9.461 -8.711 749 3HD1 LEU 100 3HD1 LEU 100 -3.691 10.714 -8.420 750 1HD2 LEU 100 1HD2 LEU 100 -3.212 10.762 -6.310 751 2HD2 LEU 100 2HD2 LEU 100 -2.458 9.291 -5.699 752 3HD2 LEU 100 3HD2 LEU 100 -4.105 9.702 -5.221 753 H ALA 101 H ALA 101 -5.921 9.532 -3.823 754 HA ALA 101 HA ALA 101 -8.708 10.423 -4.099 755 1HB ALA 101 1HB ALA 101 -8.973 8.756 -2.474 756 2HB ALA 101 2HB ALA 101 -8.842 10.252 -1.552 757 3HB ALA 101 3HB ALA 101 -7.455 9.170 -1.678 758 H THR 102 H THR 102 -9.144 12.458 -3.164 759 HA THR 102 HA THR 102 -6.724 14.035 -2.614 760 HB THR 102 HB THR 102 -7.746 14.931 -4.526 761 HG1 THR 102 HG1 THR 102 -8.150 16.931 -3.857 762 1HG2 THR 102 1HG2 THR 102 -10.324 15.673 -4.031 763 2HG2 THR 102 2HG2 THR 102 -10.237 14.085 -3.266 764 3HG2 THR 102 3HG2 THR 102 -9.826 14.267 -4.972 765 H GLY 103 H GLY 103 -6.458 14.948 -0.679 766 1HA GLY 103 1HA GLY 103 -8.542 14.561 1.323 767 2HA GLY 103 2HA GLY 103 -6.883 15.051 1.628 768 H PHE 104 H PHE 104 -7.827 16.631 3.072 769 HA PHE 104 HA PHE 104 -9.395 18.773 1.942 770 1HB PHE 104 1HB PHE 104 -9.467 17.841 4.368 771 2HB PHE 104 2HB PHE 104 -8.069 18.876 4.636 772 HD1 PHE 104 HD1 PHE 104 -8.312 21.193 4.954 773 HD2 PHE 104 HD2 PHE 104 -11.626 18.869 3.637 774 HE1 PHE 104 HE1 PHE 104 -9.805 23.111 5.337 775 HE2 PHE 104 HE2 PHE 104 -13.124 20.782 4.018 776 HZ PHE 104 HZ PHE 104 -12.214 22.907 4.870 777 H SER 105 H SER 105 -6.300 18.803 3.718 778 HA SER 105 HA SER 105 -5.503 21.135 2.121 779 1HB SER 105 1HB SER 105 -4.498 20.112 4.785 780 2HB SER 105 2HB SER 105 -3.792 21.478 3.923 781 HG SER 105 HG SER 105 -6.163 21.302 5.332 782 H GLU 106 H GLU 106 -2.933 21.229 2.032 783 HA GLU 106 HA GLU 106 -2.167 19.104 0.300 784 1HB GLU 106 1HB GLU 106 -0.661 21.451 1.447 785 2HB GLU 106 2HB GLU 106 0.079 20.292 0.352 786 1HG GLU 106 1HG GLU 106 -2.062 20.904 -1.101 787 2HG GLU 106 2HG GLU 106 -1.924 22.400 -0.179 788 HA PRO 107 HA PRO 107 -0.465 16.401 3.394 789 1HB PRO 107 1HB PRO 107 0.833 14.677 1.778 790 2HB PRO 107 2HB PRO 107 -0.931 14.712 1.892 791 1HG PRO 107 1HG PRO 107 0.858 15.912 -0.188 792 2HG PRO 107 2HG PRO 107 -0.663 15.024 -0.397 793 1HD PRO 107 1HD PRO 107 -0.498 17.742 -0.478 794 2HD PRO 107 2HD PRO 107 -1.949 16.872 0.060 795 H GLY 108 H GLY 108 1.183 16.964 4.666 796 1HA GLY 108 1HA GLY 108 3.621 18.057 3.494 797 2HA GLY 108 2HA GLY 108 3.188 18.071 5.196 798 H ASP 109 H ASP 109 2.527 15.195 5.171 799 HA ASP 109 HA ASP 109 5.238 14.078 4.892 800 1HB ASP 109 1HB ASP 109 3.490 14.208 7.261 801 2HB ASP 109 2HB ASP 109 4.200 12.625 6.955 802 H ALA 110 H ALA 110 5.388 11.930 4.262 803 HA ALA 110 HA ALA 110 3.408 10.961 2.540 804 1HB ALA 110 1HB ALA 110 4.760 8.763 2.798 805 2HB ALA 110 2HB ALA 110 5.859 9.753 3.757 806 3HB ALA 110 3HB ALA 110 5.533 10.174 2.075 807 H GLY 111 H GLY 111 2.524 8.634 2.774 808 1HA GLY 111 1HA GLY 111 1.295 8.422 5.454 809 2HA GLY 111 2HA GLY 111 0.477 7.992 3.960 810 H GLY 112 H GLY 112 0.221 6.052 5.556 811 1HA GLY 112 1HA GLY 112 2.509 4.223 5.237 812 2HA GLY 112 2HA GLY 112 1.246 4.059 6.448 813 H ILE 113 H ILE 113 -0.656 3.030 5.934 814 HA ILE 113 HA ILE 113 -0.839 1.917 3.211 815 HB ILE 113 HB ILE 113 -1.742 -0.159 4.144 816 1HG1 ILE 113 1HG1 ILE 113 -1.026 1.040 6.831 817 2HG1 ILE 113 2HG1 ILE 113 -2.661 0.773 6.232 818 1HG2 ILE 113 1HG2 ILE 113 0.432 -0.861 5.376 819 2HG2 ILE 113 2HG2 ILE 113 0.985 0.759 4.952 820 3HG2 ILE 113 3HG2 ILE 113 0.513 -0.371 3.683 821 1HD1 ILE 113 1HD1 ILE 113 -1.049 -1.635 6.162 822 2HD1 ILE 113 2HD1 ILE 113 -2.642 -1.354 6.863 823 3HD1 ILE 113 3HD1 ILE 113 -1.191 -0.953 7.781 824 H LEU 114 H LEU 114 -2.893 1.669 2.344 825 HA LEU 114 HA LEU 114 -4.934 3.352 3.545 826 1HB LEU 114 1HB LEU 114 -4.601 3.712 1.225 827 2HB LEU 114 2HB LEU 114 -4.649 1.996 0.873 828 HG LEU 114 HG LEU 114 -7.031 1.925 1.281 829 1HD1 LEU 114 1HD1 LEU 114 -8.296 3.605 2.169 830 2HD1 LEU 114 2HD1 LEU 114 -7.177 4.870 1.658 831 3HD1 LEU 114 3HD1 LEU 114 -6.785 3.850 3.042 832 1HD2 LEU 114 1HD2 LEU 114 -6.026 2.786 -0.923 833 2HD2 LEU 114 2HD2 LEU 114 -6.608 4.367 -0.400 834 3HD2 LEU 114 3HD2 LEU 114 -7.747 3.040 -0.631 835 H ARG 115 H ARG 115 -6.452 2.544 4.842 836 HA ARG 115 HA ARG 115 -7.172 -0.298 4.524 837 1HB ARG 115 1HB ARG 115 -7.655 -0.344 6.928 838 2HB ARG 115 2HB ARG 115 -5.982 0.093 6.613 839 1HG ARG 115 1HG ARG 115 -6.886 2.534 6.788 840 2HG ARG 115 2HG ARG 115 -8.214 1.766 7.661 841 1HD ARG 115 1HD ARG 115 -6.646 2.396 9.305 842 2HD ARG 115 2HD ARG 115 -6.448 0.656 9.095 843 HE ARG 115 HE ARG 115 -4.648 1.935 7.392 844 1HH1 ARG 115 1HH1 ARG 115 -5.205 1.556 10.817 845 2HH1 ARG 115 2HH1 ARG 115 -3.532 1.718 11.233 846 1HH2 ARG 115 1HH2 ARG 115 -2.447 2.149 7.938 847 2HH2 ARG 115 2HH2 ARG 115 -1.966 2.055 9.600 848 H CYS 116 H CYS 116 -9.316 -0.914 4.804 849 HA CYS 116 HA CYS 116 -11.279 1.275 4.598 850 1HB CYS 116 1HB CYS 116 -10.906 -0.286 2.579 851 2HB CYS 116 2HB CYS 116 -11.714 -1.514 3.540 852 H GLU 117 H GLU 117 -13.470 0.694 5.416 853 HA GLU 117 HA GLU 117 -13.393 -0.114 8.077 854 1HB GLU 117 1HB GLU 117 -15.309 0.926 6.340 855 2HB GLU 117 2HB GLU 117 -15.988 -0.609 6.864 856 1HG GLU 117 1HG GLU 117 -16.708 1.227 8.288 857 2HG GLU 117 2HG GLU 117 -15.748 0.051 9.185 858 H HIS 118 H HIS 118 -13.458 -2.005 5.216 859 HA HIS 118 HA HIS 118 -14.449 -4.382 6.558 860 1HB HIS 118 1HB HIS 118 -13.440 -4.056 3.726 861 2HB HIS 118 2HB HIS 118 -14.324 -5.437 4.373 862 HD2 HIS 118 HD2 HIS 118 -17.000 -5.279 3.967 863 HE1 HIS 118 HE1 HIS 118 -17.238 -1.104 3.241 864 HE2 HIS 118 HE2 HIS 118 -18.490 -3.290 3.246 865 H GLY 119 H GLY 119 -11.407 -3.076 5.321 866 1HA GLY 119 1HA GLY 119 -9.818 -4.595 7.057 867 2HA GLY 119 2HA GLY 119 -9.888 -5.448 5.524 868 H VAL 120 H VAL 120 -7.872 -5.198 4.809 869 HA VAL 120 HA VAL 120 -6.681 -2.520 4.727 870 HB VAL 120 HB VAL 120 -5.262 -5.047 3.936 871 1HG1 VAL 120 1HG1 VAL 120 -3.431 -3.497 5.120 872 2HG1 VAL 120 2HG1 VAL 120 -4.534 -2.257 4.524 873 3HG1 VAL 120 3HG1 VAL 120 -3.818 -3.414 3.403 874 1HG2 VAL 120 1HG2 VAL 120 -6.322 -4.571 6.506 875 2HG2 VAL 120 2HG2 VAL 120 -4.585 -4.286 6.605 876 3HG2 VAL 120 3HG2 VAL 120 -5.191 -5.830 6.008 877 H ILE 121 H ILE 121 -6.277 -1.462 2.851 878 HA ILE 121 HA ILE 121 -7.274 -2.693 0.391 879 HB ILE 121 HB ILE 121 -6.441 0.167 0.857 880 1HG1 ILE 121 1HG1 ILE 121 -8.674 -1.135 1.895 881 2HG1 ILE 121 2HG1 ILE 121 -8.458 0.602 1.742 882 1HG2 ILE 121 1HG2 ILE 121 -7.680 -1.270 -1.464 883 2HG2 ILE 121 2HG2 ILE 121 -6.282 -0.195 -1.435 884 3HG2 ILE 121 3HG2 ILE 121 -7.905 0.467 -1.239 885 1HD1 ILE 121 1HD1 ILE 121 -9.863 0.755 -0.044 886 2HD1 ILE 121 2HD1 ILE 121 -10.583 -0.617 0.798 887 3HD1 ILE 121 3HD1 ILE 121 -9.536 -0.890 -0.591 888 H GLY 122 H GLY 122 -4.505 -0.593 1.273 889 1HA GLY 122 1HA GLY 122 -2.578 -2.339 0.155 890 2HA GLY 122 2HA GLY 122 -2.999 -1.098 -1.007 891 H LEU 123 H LEU 123 -0.693 -0.583 -0.819 892 HA LEU 123 HA LEU 123 -0.135 1.092 1.542 893 1HB LEU 123 1HB LEU 123 2.315 0.718 0.764 894 2HB LEU 123 2HB LEU 123 1.493 -0.534 1.674 895 HG LEU 123 HG LEU 123 1.525 -0.601 -1.325 896 1HD1 LEU 123 1HD1 LEU 123 3.865 -0.402 -0.202 897 2HD1 LEU 123 2HD1 LEU 123 3.578 -1.640 -1.426 898 3HD1 LEU 123 3HD1 LEU 123 3.565 -2.070 0.284 899 1HD2 LEU 123 1HD2 LEU 123 1.709 -3.081 0.182 900 2HD2 LEU 123 2HD2 LEU 123 0.578 -2.606 -1.085 901 3HD2 LEU 123 3HD2 LEU 123 0.274 -2.139 0.589 902 H VAL 124 H VAL 124 0.640 3.142 1.246 903 HA VAL 124 HA VAL 124 -0.099 4.548 -1.040 904 HB VAL 124 HB VAL 124 0.202 5.610 1.146 905 1HG1 VAL 124 1HG1 VAL 124 3.161 5.310 0.656 906 2HG1 VAL 124 2HG1 VAL 124 2.223 4.377 1.821 907 3HG1 VAL 124 3HG1 VAL 124 2.398 6.120 2.024 908 1HG2 VAL 124 1HG2 VAL 124 2.088 6.902 -0.809 909 2HG2 VAL 124 2HG2 VAL 124 1.042 7.681 0.377 910 3HG2 VAL 124 3HG2 VAL 124 0.339 6.891 -1.034 911 H THR 125 H THR 125 1.063 5.520 -2.710 912 HA THR 125 HA THR 125 3.783 4.504 -3.165 913 HB THR 125 HB THR 125 2.713 3.172 -4.703 914 HG1 THR 125 HG1 THR 125 3.390 3.937 -6.550 915 1HG2 THR 125 1HG2 THR 125 0.846 4.430 -6.191 916 2HG2 THR 125 2HG2 THR 125 0.591 5.182 -4.617 917 3HG2 THR 125 3HG2 THR 125 0.498 3.429 -4.781 918 H MET 126 H MET 126 1.845 6.549 -5.343 919 HA MET 126 HA MET 126 3.801 8.693 -4.826 920 1HB MET 126 1HB MET 126 3.884 7.988 -7.117 921 2HB MET 126 2HB MET 126 2.136 8.087 -7.270 922 1HG MET 126 1HG MET 126 2.500 10.085 -8.173 923 2HG MET 126 2HG MET 126 2.786 10.634 -6.526 924 1HE MET 126 1HE MET 126 5.680 10.465 -5.525 925 2HE MET 126 2HE MET 126 6.787 9.671 -6.646 926 3HE MET 126 3HE MET 126 5.356 8.818 -6.070 927 H GLY 127 H GLY 127 3.152 10.711 -4.268 928 1HA GLY 127 1HA GLY 127 0.243 11.120 -3.931 929 2HA GLY 127 2HA GLY 127 1.417 11.639 -2.730 930 H GLY 128 H GLY 128 -0.588 12.880 -4.861 931 1HA GLY 128 1HA GLY 128 1.164 14.677 -6.293 932 2HA GLY 128 2HA GLY 128 -0.593 14.705 -6.298 933 H GLU 129 H GLU 129 -0.355 17.037 -6.157 934 HA GLU 129 HA GLU 129 0.819 18.244 -3.855 935 1HB GLU 129 1HB GLU 129 -1.236 19.427 -5.729 936 2HB GLU 129 2HB GLU 129 -0.156 20.310 -4.661 937 1HG GLU 129 1HG GLU 129 1.259 18.545 -6.486 938 2HG GLU 129 2HG GLU 129 0.277 19.753 -7.314 939 H GLY 130 H GLY 130 -2.189 16.727 -4.477 940 1HA GLY 130 1HA GLY 130 -3.037 17.226 -1.756 941 2HA GLY 130 2HA GLY 130 -4.080 17.929 -2.982 942 H VAL 131 H VAL 131 -2.496 15.002 -3.849 943 HA VAL 131 HA VAL 131 -4.943 13.485 -3.243 944 HB VAL 131 HB VAL 131 -3.356 12.698 -5.627 945 1HG1 VAL 131 1HG1 VAL 131 -5.256 11.366 -4.877 946 2HG1 VAL 131 2HG1 VAL 131 -5.553 12.061 -6.470 947 3HG1 VAL 131 3HG1 VAL 131 -6.311 12.770 -5.044 948 1HG2 VAL 131 1HG2 VAL 131 -4.450 14.253 -7.096 949 2HG2 VAL 131 2HG2 VAL 131 -3.594 15.159 -5.846 950 3HG2 VAL 131 3HG2 VAL 131 -5.343 14.959 -5.747 951 H VAL 132 H VAL 132 -4.643 11.163 -3.011 952 HA VAL 132 HA VAL 132 -1.914 10.475 -2.136 953 HB VAL 132 HB VAL 132 -2.824 9.074 -0.413 954 1HG1 VAL 132 1HG1 VAL 132 -4.622 11.294 0.137 955 2HG1 VAL 132 2HG1 VAL 132 -3.032 11.818 -0.421 956 3HG1 VAL 132 3HG1 VAL 132 -3.171 10.772 0.993 957 1HG2 VAL 132 1HG2 VAL 132 -4.751 8.044 -0.971 958 2HG2 VAL 132 2HG2 VAL 132 -5.326 9.408 -1.930 959 3HG2 VAL 132 3HG2 VAL 132 -5.496 9.430 -0.175 960 H GLY 133 H GLY 133 -0.973 8.963 -3.351 961 1HA GLY 133 1HA GLY 133 -2.625 7.218 -5.019 962 2HA GLY 133 2HA GLY 133 -0.884 7.421 -5.137 963 H PHE 134 H PHE 134 -3.121 5.189 -4.434 964 HA PHE 134 HA PHE 134 -1.381 3.867 -2.455 965 1HB PHE 134 1HB PHE 134 -4.355 4.121 -2.563 966 2HB PHE 134 2HB PHE 134 -3.657 2.655 -1.881 967 HD1 PHE 134 HD1 PHE 134 -1.681 3.148 -0.159 968 HD2 PHE 134 HD2 PHE 134 -4.846 5.824 -1.107 969 HE1 PHE 134 HE1 PHE 134 -1.339 4.298 1.987 970 HE2 PHE 134 HE2 PHE 134 -4.512 6.984 1.038 971 HZ PHE 134 HZ PHE 134 -2.755 6.219 2.588 972 H ALA 135 H ALA 135 -0.747 1.830 -2.854 973 HA ALA 135 HA ALA 135 -1.440 0.661 -5.430 974 1HB ALA 135 1HB ALA 135 0.616 -0.086 -3.353 975 2HB ALA 135 2HB ALA 135 0.900 0.695 -4.908 976 3HB ALA 135 3HB ALA 135 0.355 -0.982 -4.849 977 H ASP 136 H ASP 136 -3.203 -0.582 -5.503 978 HA ASP 136 HA ASP 136 -4.439 -1.683 -3.217 979 1HB ASP 136 1HB ASP 136 -5.238 -1.155 -5.766 980 2HB ASP 136 2HB ASP 136 -5.134 -2.912 -5.798 981 H VAL 137 H VAL 137 -4.434 -3.643 -2.309 982 HA VAL 137 HA VAL 137 -2.361 -5.528 -3.114 983 HB VAL 137 HB VAL 137 -4.208 -5.564 -0.713 984 1HG1 VAL 137 1HG1 VAL 137 -3.576 -7.777 -0.925 985 2HG1 VAL 137 2HG1 VAL 137 -2.315 -7.132 0.127 986 3HG1 VAL 137 3HG1 VAL 137 -1.994 -7.369 -1.590 987 1HG2 VAL 137 1HG2 VAL 137 -2.716 -4.352 0.448 988 2HG2 VAL 137 2HG2 VAL 137 -2.199 -3.803 -1.148 989 3HG2 VAL 137 3HG2 VAL 137 -1.331 -5.110 -0.340 990 H ARG 138 H ARG 138 -5.315 -4.998 -4.209 991 HA ARG 138 HA ARG 138 -6.610 -7.513 -3.965 992 1HB ARG 138 1HB ARG 138 -7.047 -5.432 -6.108 993 2HB ARG 138 2HB ARG 138 -8.181 -6.664 -5.572 994 1HG ARG 138 1HG ARG 138 -7.169 -4.617 -3.640 995 2HG ARG 138 2HG ARG 138 -8.469 -4.221 -4.765 996 1HD ARG 138 1HD ARG 138 -8.440 -6.380 -2.667 997 2HD ARG 138 2HD ARG 138 -9.472 -4.952 -2.730 998 HE ARG 138 HE ARG 138 -9.902 -7.440 -4.059 999 1HH1 ARG 138 1HH1 ARG 138 -10.443 -4.001 -4.303 1000 2HH1 ARG 138 2HH1 ARG 138 -11.839 -4.166 -5.315 1001 1HH2 ARG 138 1HH2 ARG 138 -11.737 -7.659 -5.391 1002 2HH2 ARG 138 2HH2 ARG 138 -12.573 -6.242 -5.932 1003 H ASP 139 H ASP 139 -3.862 -6.658 -5.666 1004 HA ASP 139 HA ASP 139 -4.381 -8.509 -7.871 1005 1HB ASP 139 1HB ASP 139 -3.058 -6.094 -7.790 1006 2HB ASP 139 2HB ASP 139 -1.735 -7.255 -7.772 1007 H LEU 140 H LEU 140 -3.613 -9.012 -4.850 1008 HA LEU 140 HA LEU 140 -2.337 -11.471 -5.284 1009 1HB LEU 140 1HB LEU 140 -0.145 -11.055 -4.304 1010 2HB LEU 140 2HB LEU 140 -0.368 -10.142 -5.778 1011 HG LEU 140 HG LEU 140 0.565 -8.479 -4.578 1012 1HD1 LEU 140 1HD1 LEU 140 -1.015 -7.066 -3.350 1013 2HD1 LEU 140 2HD1 LEU 140 -2.193 -8.377 -3.387 1014 3HD1 LEU 140 3HD1 LEU 140 -1.670 -7.621 -4.892 1015 1HD2 LEU 140 1HD2 LEU 140 1.185 -8.673 -2.440 1016 2HD2 LEU 140 2HD2 LEU 140 0.568 -10.319 -2.592 1017 3HD2 LEU 140 3HD2 LEU 140 -0.447 -9.057 -1.895 1018 H LEU 141 H LEU 141 -4.536 -11.016 -3.954 1019 HA LEU 141 HA LEU 141 -4.222 -10.434 -1.194 1020 1HB LEU 141 1HB LEU 141 -6.353 -10.865 -2.962 1021 2HB LEU 141 2HB LEU 141 -6.514 -12.087 -1.715 1022 HG LEU 141 HG LEU 141 -7.771 -10.340 -0.876 1023 1HD1 LEU 141 1HD1 LEU 141 -5.556 -9.172 0.522 1024 2HD1 LEU 141 2HD1 LEU 141 -5.376 -10.921 0.418 1025 3HD1 LEU 141 3HD1 LEU 141 -6.835 -10.228 1.120 1026 1HD2 LEU 141 1HD2 LEU 141 -6.021 -8.717 -2.494 1027 2HD2 LEU 141 2HD2 LEU 141 -6.276 -7.999 -0.904 1028 3HD2 LEU 141 3HD2 LEU 141 -7.658 -8.388 -1.928 1029 H TRP 142 H TRP 142 -3.492 -13.217 -3.013 1030 HA TRP 142 HA TRP 142 -4.110 -15.291 -1.288 1031 1HB TRP 142 1HB TRP 142 -2.181 -16.508 -2.322 1032 2HB TRP 142 2HB TRP 142 -3.299 -15.802 -3.483 1033 HD1 TRP 142 HD1 TRP 142 -2.398 -13.344 -4.563 1034 HE1 TRP 142 HE1 TRP 142 -0.004 -12.731 -5.278 1035 HE3 TRP 142 HE3 TRP 142 0.171 -16.891 -1.930 1036 HZ2 TRP 142 HZ2 TRP 142 2.620 -13.631 -4.790 1037 HZ3 TRP 142 HZ3 TRP 142 2.627 -16.946 -2.111 1038 HH2 TRP 142 HH2 TRP 142 3.826 -15.350 -3.510 1039 H LEU 143 H LEU 143 -3.841 -14.496 0.816 1040 HA LEU 143 HA LEU 143 -1.223 -15.040 1.925 1041 1HB LEU 143 1HB LEU 143 -2.597 -12.398 2.440 1042 2HB LEU 143 2HB LEU 143 -1.145 -12.966 3.238 1043 HG LEU 143 HG LEU 143 -0.245 -13.048 0.725 1044 1HD1 LEU 143 1HD1 LEU 143 -1.796 -12.246 -0.672 1045 2HD1 LEU 143 2HD1 LEU 143 -1.298 -10.669 -0.062 1046 3HD1 LEU 143 3HD1 LEU 143 -2.709 -11.474 0.623 1047 1HD2 LEU 143 1HD2 LEU 143 0.936 -11.112 1.200 1048 2HD2 LEU 143 2HD2 LEU 143 0.474 -11.680 2.804 1049 3HD2 LEU 143 3HD2 LEU 143 -0.423 -10.367 2.042 1050 H GLU 144 H GLU 144 -4.544 -13.967 2.528 1051 HA GLU 144 HA GLU 144 -4.895 -16.043 4.496 1052 1HB GLU 144 1HB GLU 144 -5.371 -14.695 6.375 1053 2HB GLU 144 2HB GLU 144 -3.872 -14.054 5.719 1054 1HG GLU 144 1HG GLU 144 -5.116 -12.250 4.640 1055 2HG GLU 144 2HG GLU 144 -6.619 -12.895 5.294 1056 H ASP 145 H ASP 145 -7.245 -15.041 5.677 1057 HA ASP 145 HA ASP 145 -9.149 -15.674 3.698 1058 1HB ASP 145 1HB ASP 145 -9.262 -14.694 6.514 1059 2HB ASP 145 2HB ASP 145 -10.726 -14.593 5.540 1060 H ASP 146 H ASP 146 -10.644 -14.418 2.601 1061 HA ASP 146 HA ASP 146 -9.921 -11.580 2.349 1062 1HB ASP 146 1HB ASP 146 -11.387 -13.410 0.437 1063 2HB ASP 146 2HB ASP 146 -11.076 -11.701 0.151 1064 H ALA 147 H ALA 147 -11.610 -9.992 2.144 1065 HA ALA 147 HA ALA 147 -13.818 -10.525 3.917 1066 1HB ALA 147 1HB ALA 147 -12.364 -8.309 3.446 1067 2HB ALA 147 2HB ALA 147 -13.978 -8.287 4.155 1068 3HB ALA 147 3HB ALA 147 -13.767 -7.980 2.431 1069 H MET 148 H MET 148 -15.710 -11.312 3.305 1070 HA MET 148 HA MET 148 -16.680 -10.719 0.589 1071 1HB MET 148 1HB MET 148 -17.769 -13.017 0.684 1072 2HB MET 148 2HB MET 148 -16.026 -12.984 0.461 1073 1HG MET 148 1HG MET 148 -15.697 -13.478 2.817 1074 2HG MET 148 2HG MET 148 -17.440 -13.464 3.074 1075 1HE MET 148 1HE MET 148 -15.144 -16.216 3.529 1076 2HE MET 148 2HE MET 148 -14.391 -15.199 2.301 1077 3HE MET 148 3HE MET 148 -14.830 -16.863 1.919 1078 H GLU 149 H GLU 149 -18.777 -10.120 0.409 1079 HA GLU 149 HA GLU 149 -20.480 -10.315 2.795 1080 1HB GLU 149 1HB GLU 149 -19.514 -7.902 1.461 1081 2HB GLU 149 2HB GLU 149 -21.266 -7.944 1.607 1082 1HG GLU 149 1HG GLU 149 -21.162 -7.416 3.751 1083 2HG GLU 149 2HG GLU 149 -20.056 -8.749 4.079 1084 H GLN 150 H GLN 150 -21.466 -12.102 1.714 1085 HA GLN 150 HA GLN 150 -23.402 -11.242 -0.319 1086 1HB GLN 150 1HB GLN 150 -21.497 -13.540 -0.447 1087 2HB GLN 150 2HB GLN 150 -23.085 -13.716 -1.181 1088 1HG GLN 150 1HG GLN 150 -21.454 -11.315 -1.834 1089 2HG GLN 150 2HG GLN 150 -21.040 -12.863 -2.569 1090 1HE2 GLN 150 1HE2 GLN 150 -21.734 -10.913 -4.231 1091 2HE2 GLN 150 2HE2 GLN 150 -23.319 -11.161 -4.872 Start of MODEL 17 1 1H GLY 1 1H GLY 1 17.793 -17.171 17.998 2 2H GLY 1 2H GLY 1 19.406 -17.482 17.597 3 3H GLY 1 3H GLY 1 18.204 -17.594 16.412 4 1HA GLY 1 1HA GLY 1 19.593 -15.273 17.428 5 2HA GLY 1 2HA GLY 1 18.854 -15.538 15.855 6 HA PRO 2 HA PRO 2 16.172 -12.845 18.767 7 1HB PRO 2 1HB PRO 2 16.752 -10.385 17.779 8 2HB PRO 2 2HB PRO 2 17.636 -11.110 19.126 9 1HG PRO 2 1HG PRO 2 18.380 -10.968 16.230 10 2HG PRO 2 2HG PRO 2 19.394 -10.698 17.659 11 1HD PRO 2 1HD PRO 2 19.421 -13.024 16.274 12 2HD PRO 2 2HD PRO 2 19.697 -12.954 18.026 13 H TYR 3 H TYR 3 14.256 -11.739 18.103 14 HA TYR 3 HA TYR 3 13.397 -12.494 15.441 15 1HB TYR 3 1HB TYR 3 11.168 -11.668 16.228 16 2HB TYR 3 2HB TYR 3 11.857 -12.939 17.234 17 HD1 TYR 3 HD1 TYR 3 12.503 -12.507 19.510 18 HD2 TYR 3 HD2 TYR 3 11.065 -9.352 17.043 19 HE1 TYR 3 HE1 TYR 3 12.246 -11.078 21.495 20 HE2 TYR 3 HE2 TYR 3 10.806 -7.915 19.021 21 HH TYR 3 HH TYR 3 12.106 -8.002 21.543 22 H GLY 4 H GLY 4 12.677 -11.098 13.841 23 1HA GLY 4 1HA GLY 4 13.488 -8.280 14.210 24 2HA GLY 4 2HA GLY 4 13.612 -9.145 12.686 25 H HIS 5 H HIS 5 12.253 -6.642 13.219 26 HA HIS 5 HA HIS 5 9.681 -7.351 12.071 27 1HB HIS 5 1HB HIS 5 8.544 -5.718 13.690 28 2HB HIS 5 2HB HIS 5 8.964 -7.309 14.314 29 HD1 HIS 5 HD1 HIS 5 9.331 -6.738 16.731 30 HD2 HIS 5 HD2 HIS 5 11.474 -4.273 14.163 31 HE1 HIS 5 HE1 HIS 5 10.851 -5.387 18.210 32 HE2 HIS 5 HE2 HIS 5 12.072 -3.839 16.642 33 H GLN 6 H GLN 6 8.545 -5.473 11.179 34 HA GLN 6 HA GLN 6 10.075 -3.022 10.902 35 1HB GLN 6 1HB GLN 6 10.594 -4.922 9.061 36 2HB GLN 6 2HB GLN 6 9.201 -4.157 8.310 37 1HG GLN 6 1HG GLN 6 10.455 -2.491 7.585 38 2HG GLN 6 2HG GLN 6 10.990 -2.134 9.227 39 1HE2 GLN 6 1HE2 GLN 6 12.535 -1.888 6.848 40 2HE2 GLN 6 2HE2 GLN 6 13.872 -2.973 6.984 41 H SER 7 H SER 7 8.860 -1.286 9.971 42 HA SER 7 HA SER 7 5.953 -1.777 9.949 43 1HB SER 7 1HB SER 7 5.562 0.264 11.065 44 2HB SER 7 2HB SER 7 6.932 -0.442 11.921 45 HG SER 7 HG SER 7 8.273 0.886 10.514 46 H GLY 8 H GLY 8 4.844 0.296 8.907 47 1HA GLY 8 1HA GLY 8 4.848 1.876 7.137 48 2HA GLY 8 2HA GLY 8 6.359 1.186 6.561 49 H ALA 9 H ALA 9 5.316 -1.566 6.792 50 HA ALA 9 HA ALA 9 3.671 -1.545 4.352 51 1HB ALA 9 1HB ALA 9 6.020 -2.689 4.532 52 2HB ALA 9 2HB ALA 9 4.707 -3.472 3.654 53 3HB ALA 9 3HB ALA 9 5.100 -3.985 5.294 54 H VAL 10 H VAL 10 2.682 -4.079 4.344 55 HA VAL 10 HA VAL 10 1.080 -4.225 6.814 56 HB VAL 10 HB VAL 10 -0.289 -3.308 5.010 57 1HG1 VAL 10 1HG1 VAL 10 1.018 -4.399 3.170 58 2HG1 VAL 10 2HG1 VAL 10 -0.735 -4.464 2.983 59 3HG1 VAL 10 3HG1 VAL 10 0.149 -5.890 3.528 60 1HG2 VAL 10 1HG2 VAL 10 -2.109 -4.469 5.640 61 2HG2 VAL 10 2HG2 VAL 10 -0.979 -5.313 6.698 62 3HG2 VAL 10 3HG2 VAL 10 -1.422 -6.016 5.143 63 H TYR 11 H TYR 11 1.382 -6.082 7.849 64 HA TYR 11 HA TYR 11 2.382 -8.401 6.366 65 1HB TYR 11 1HB TYR 11 3.771 -7.949 8.212 66 2HB TYR 11 2HB TYR 11 2.408 -7.610 9.270 67 HD1 TYR 11 HD1 TYR 11 3.266 -10.532 7.097 68 HD2 TYR 11 HD2 TYR 11 2.392 -9.116 11.010 69 HE1 TYR 11 HE1 TYR 11 3.357 -12.838 7.945 70 HE2 TYR 11 HE2 TYR 11 2.482 -11.418 11.870 71 HH TYR 11 HH TYR 11 3.842 -13.725 10.816 72 H VAL 12 H VAL 12 0.963 -9.876 5.729 73 HA VAL 12 HA VAL 12 -1.436 -10.332 7.380 74 HB VAL 12 HB VAL 12 -1.259 -10.719 4.392 75 1HG1 VAL 12 1HG1 VAL 12 -3.843 -10.562 4.815 76 2HG1 VAL 12 2HG1 VAL 12 -3.390 -11.087 6.438 77 3HG1 VAL 12 3HG1 VAL 12 -2.980 -12.084 5.041 78 1HG2 VAL 12 1HG2 VAL 12 -1.670 -8.319 5.962 79 2HG2 VAL 12 2HG2 VAL 12 -3.033 -8.658 4.897 80 3HG2 VAL 12 3HG2 VAL 12 -1.408 -8.506 4.228 81 H GLY 13 H GLY 13 -1.775 -12.340 8.106 82 1HA GLY 13 1HA GLY 13 -1.301 -14.540 8.607 83 2HA GLY 13 2HA GLY 13 -1.398 -14.743 6.866 84 H ASN 14 H ASN 14 0.270 -15.850 6.114 85 HA ASN 14 HA ASN 14 2.853 -15.659 7.485 86 1HB ASN 14 1HB ASN 14 1.893 -17.645 5.413 87 2HB ASN 14 2HB ASN 14 3.441 -17.705 6.251 88 1HD2 ASN 14 1HD2 ASN 14 0.156 -18.533 6.338 89 2HD2 ASN 14 2HD2 ASN 14 0.121 -19.211 7.926 90 H TYR 15 H TYR 15 1.641 -13.721 5.480 91 HA TYR 15 HA TYR 15 3.978 -13.590 3.689 92 1HB TYR 15 1HB TYR 15 1.065 -13.193 3.020 93 2HB TYR 15 2HB TYR 15 2.338 -12.482 2.040 94 HD1 TYR 15 HD1 TYR 15 0.195 -14.509 1.223 95 HD2 TYR 15 HD2 TYR 15 4.243 -14.962 2.443 96 HE1 TYR 15 HE1 TYR 15 0.335 -16.606 -0.042 97 HE2 TYR 15 HE2 TYR 15 4.391 -17.056 1.176 98 HH TYR 15 HH TYR 15 2.769 -18.838 0.360 99 H LYS 16 H LYS 16 4.626 -11.446 3.130 100 HA LYS 16 HA LYS 16 3.327 -9.266 4.596 101 1HB LYS 16 1HB LYS 16 5.268 -10.169 5.932 102 2HB LYS 16 2HB LYS 16 6.322 -9.671 4.615 103 1HG LYS 16 1HG LYS 16 4.524 -7.585 5.644 104 2HG LYS 16 2HG LYS 16 5.757 -8.154 6.771 105 1HD LYS 16 1HD LYS 16 7.110 -7.850 4.364 106 2HD LYS 16 2HD LYS 16 6.021 -6.463 4.430 107 1HE LYS 16 1HE LYS 16 6.965 -6.465 6.958 108 2HE LYS 16 2HE LYS 16 8.356 -7.130 6.102 109 1HZ LYS 16 1HZ LYS 16 8.475 -5.221 4.733 110 2HZ LYS 16 2HZ LYS 16 8.322 -4.658 6.321 111 3HZ LYS 16 3HZ LYS 16 6.988 -4.631 5.282 112 H VAL 17 H VAL 17 2.792 -7.799 3.090 113 HA VAL 17 HA VAL 17 4.535 -7.562 0.749 114 HB VAL 17 HB VAL 17 2.762 -7.138 -0.564 115 1HG1 VAL 17 1HG1 VAL 17 2.154 -9.112 0.965 116 2HG1 VAL 17 2HG1 VAL 17 0.887 -8.401 -0.035 117 3HG1 VAL 17 3HG1 VAL 17 0.980 -8.006 1.681 118 1HG2 VAL 17 1HG2 VAL 17 2.321 -4.924 0.281 119 2HG2 VAL 17 2HG2 VAL 17 1.479 -5.589 1.681 120 3HG2 VAL 17 3HG2 VAL 17 0.794 -5.782 0.066 121 H VAL 18 H VAL 18 5.843 -5.932 0.551 122 HA VAL 18 HA VAL 18 5.172 -3.344 1.756 123 HB VAL 18 HB VAL 18 6.704 -4.433 3.318 124 1HG1 VAL 18 1HG1 VAL 18 7.750 -5.874 1.497 125 2HG1 VAL 18 2HG1 VAL 18 8.826 -5.250 2.748 126 3HG1 VAL 18 3HG1 VAL 18 8.787 -4.488 1.157 127 1HG2 VAL 18 1HG2 VAL 18 8.304 -2.369 1.838 128 2HG2 VAL 18 2HG2 VAL 18 8.225 -2.667 3.575 129 3HG2 VAL 18 3HG2 VAL 18 6.847 -1.950 2.740 130 H ASN 19 H ASN 19 6.456 -1.547 0.831 131 HA ASN 19 HA ASN 19 6.506 -1.654 -1.986 132 1HB ASN 19 1HB ASN 19 7.271 0.330 0.090 133 2HB ASN 19 2HB ASN 19 7.982 0.543 -1.507 134 1HD2 ASN 19 1HD2 ASN 19 6.252 0.177 -3.308 135 2HD2 ASN 19 2HD2 ASN 19 4.788 1.066 -3.083 136 H ARG 20 H ARG 20 8.169 -1.910 -3.442 137 HA ARG 20 HA ARG 20 10.332 -3.519 -2.745 138 1HB ARG 20 1HB ARG 20 11.246 -2.952 -4.991 139 2HB ARG 20 2HB ARG 20 9.566 -3.467 -5.018 140 1HG ARG 20 1HG ARG 20 9.005 -1.615 -6.082 141 2HG ARG 20 2HG ARG 20 9.615 -0.641 -4.745 142 1HD ARG 20 1HD ARG 20 10.907 0.144 -6.475 143 2HD ARG 20 2HD ARG 20 11.939 -1.143 -5.849 144 HE ARG 20 HE ARG 20 10.146 -1.956 -7.958 145 1HH1 ARG 20 1HH1 ARG 20 13.302 -0.681 -7.183 146 2HH1 ARG 20 2HH1 ARG 20 14.017 -1.213 -8.667 147 1HH2 ARG 20 1HH2 ARG 20 11.086 -2.653 -9.910 148 2HH2 ARG 20 2HH2 ARG 20 12.761 -2.332 -10.216 149 H HIS 21 H HIS 21 10.129 -0.010 -3.054 150 HA HIS 21 HA HIS 21 12.915 0.455 -2.733 151 1HB HIS 21 1HB HIS 21 10.686 2.003 -3.357 152 2HB HIS 21 2HB HIS 21 11.229 2.639 -1.808 153 HD1 HIS 21 HD1 HIS 21 12.559 4.665 -2.294 154 HD2 HIS 21 HD2 HIS 21 13.391 1.595 -4.967 155 HE1 HIS 21 HE1 HIS 21 14.402 5.536 -3.764 156 HE2 HIS 21 HE2 HIS 21 14.947 3.631 -5.319 157 H LEU 22 H LEU 22 10.566 -0.607 -0.570 158 HA LEU 22 HA LEU 22 12.086 0.415 1.732 159 1HB LEU 22 1HB LEU 22 9.467 0.759 1.305 160 2HB LEU 22 2HB LEU 22 9.408 -0.795 2.113 161 HG LEU 22 HG LEU 22 11.069 0.679 3.751 162 1HD1 LEU 22 1HD1 LEU 22 9.190 2.472 2.339 163 2HD1 LEU 22 2HD1 LEU 22 10.758 2.815 3.070 164 3HD1 LEU 22 3HD1 LEU 22 9.324 2.671 4.086 165 1HD2 LEU 22 1HD2 LEU 22 9.214 -0.879 4.348 166 2HD2 LEU 22 2HD2 LEU 22 8.079 0.432 4.027 167 3HD2 LEU 22 3HD2 LEU 22 9.267 0.591 5.321 168 H ALA 23 H ALA 23 11.613 -2.364 -0.098 169 HA ALA 23 HA ALA 23 11.676 -4.251 2.073 170 1HB ALA 23 1HB ALA 23 10.678 -5.321 0.361 171 2HB ALA 23 2HB ALA 23 12.335 -5.725 -0.089 172 3HB ALA 23 3HB ALA 23 11.516 -4.369 -0.864 173 H THR 24 H THR 24 13.406 -5.640 2.584 174 HA THR 24 HA THR 24 16.039 -4.480 1.992 175 HB THR 24 HB THR 24 16.826 -5.570 4.009 176 HG1 THR 24 HG1 THR 24 15.838 -7.349 4.495 177 1HG2 THR 24 1HG2 THR 24 15.653 -4.414 5.686 178 2HG2 THR 24 2HG2 THR 24 14.166 -4.392 4.737 179 3HG2 THR 24 3HG2 THR 24 15.547 -3.413 4.238 180 H HIS 25 H HIS 25 17.858 -6.160 1.982 181 HA HIS 25 HA HIS 25 17.563 -7.855 -0.196 182 1HB HIS 25 1HB HIS 25 19.711 -8.842 0.467 183 2HB HIS 25 2HB HIS 25 19.747 -7.088 0.616 184 HD1 HIS 25 HD1 HIS 25 21.512 -9.294 2.199 185 HD2 HIS 25 HD2 HIS 25 18.339 -7.054 3.677 186 HE1 HIS 25 HE1 HIS 25 21.842 -9.224 4.691 187 HE2 HIS 25 HE2 HIS 25 19.956 -7.793 5.554 188 H VAL 26 H VAL 26 16.914 -8.401 3.173 189 HA VAL 26 HA VAL 26 16.754 -11.249 3.022 190 HB VAL 26 HB VAL 26 15.484 -9.461 5.096 191 1HG1 VAL 26 1HG1 VAL 26 16.584 -12.104 5.791 192 2HG1 VAL 26 2HG1 VAL 26 15.151 -12.115 4.763 193 3HG1 VAL 26 3HG1 VAL 26 15.105 -11.309 6.331 194 1HG2 VAL 26 1HG2 VAL 26 17.603 -8.773 5.447 195 2HG2 VAL 26 2HG2 VAL 26 18.304 -10.148 4.595 196 3HG2 VAL 26 3HG2 VAL 26 17.759 -10.329 6.262 197 H ASP 27 H ASP 27 14.490 -8.607 2.550 198 HA ASP 27 HA ASP 27 12.119 -10.139 2.729 199 1HB ASP 27 1HB ASP 27 12.856 -7.409 2.010 200 2HB ASP 27 2HB ASP 27 11.578 -8.034 0.974 201 H TRP 28 H TRP 28 14.217 -9.150 0.072 202 HA TRP 28 HA TRP 28 12.657 -10.474 -1.894 203 1HB TRP 28 1HB TRP 28 15.411 -9.266 -1.956 204 2HB TRP 28 2HB TRP 28 14.708 -10.074 -3.355 205 HD1 TRP 28 HD1 TRP 28 12.233 -8.974 -4.167 206 HE1 TRP 28 HE1 TRP 28 11.570 -6.488 -4.269 207 HE3 TRP 28 HE3 TRP 28 15.781 -7.062 -1.031 208 HZ2 TRP 28 HZ2 TRP 28 12.432 -4.037 -3.149 209 HZ3 TRP 28 HZ3 TRP 28 15.793 -4.643 -0.603 210 HH2 TRP 28 HH2 TRP 28 14.161 -3.163 -1.643 211 H GLN 29 H GLN 29 15.308 -11.343 0.162 212 HA GLN 29 HA GLN 29 16.284 -13.596 -1.169 213 1HB GLN 29 1HB GLN 29 17.413 -12.609 0.761 214 2HB GLN 29 2HB GLN 29 16.076 -13.072 1.803 215 1HG GLN 29 1HG GLN 29 17.824 -14.626 2.157 216 2HG GLN 29 2HG GLN 29 16.565 -15.454 1.241 217 1HE2 GLN 29 1HE2 GLN 29 19.796 -14.236 1.218 218 2HE2 GLN 29 2HE2 GLN 29 20.275 -14.930 -0.290 219 H ASN 30 H ASN 30 13.630 -13.257 1.150 220 HA ASN 30 HA ASN 30 12.794 -16.008 0.505 221 1HB ASN 30 1HB ASN 30 12.158 -14.336 2.947 222 2HB ASN 30 2HB ASN 30 11.545 -15.958 2.642 223 1HD2 ASN 30 1HD2 ASN 30 12.504 -17.233 4.059 224 2HD2 ASN 30 2HD2 ASN 30 14.204 -17.309 4.361 225 H CYS 31 H CYS 31 12.271 -13.578 -1.055 226 HA CYS 31 HA CYS 31 9.508 -12.895 -0.629 227 1HB CYS 31 1HB CYS 31 10.884 -11.167 -1.512 228 2HB CYS 31 2HB CYS 31 11.507 -12.209 -2.784 229 HG CYS 31 HG CYS 31 8.633 -11.018 -2.791 230 H VAL 32 H VAL 32 7.751 -13.657 -1.647 231 HA VAL 32 HA VAL 32 8.086 -16.016 -3.331 232 HB VAL 32 HB VAL 32 5.602 -16.259 -3.042 233 1HG1 VAL 32 1HG1 VAL 32 7.537 -16.334 -0.780 234 2HG1 VAL 32 2HG1 VAL 32 6.728 -17.658 -1.621 235 3HG1 VAL 32 3HG1 VAL 32 5.834 -16.670 -0.465 236 1HG2 VAL 32 1HG2 VAL 32 5.943 -14.055 -1.021 237 2HG2 VAL 32 2HG2 VAL 32 4.468 -14.958 -1.355 238 3HG2 VAL 32 3HG2 VAL 32 5.135 -13.878 -2.578 239 H TRP 33 H TRP 33 6.549 -12.813 -3.363 240 HA TRP 33 HA TRP 33 6.512 -12.957 -6.291 241 1HB TRP 33 1HB TRP 33 4.290 -13.432 -6.096 242 2HB TRP 33 2HB TRP 33 4.166 -12.702 -4.501 243 HD1 TRP 33 HD1 TRP 33 3.409 -12.040 -8.104 244 HE1 TRP 33 HE1 TRP 33 2.442 -9.667 -8.365 245 HE3 TRP 33 HE3 TRP 33 4.452 -10.229 -3.452 246 HZ2 TRP 33 HZ2 TRP 33 2.161 -7.330 -6.787 247 HZ3 TRP 33 HZ3 TRP 33 3.814 -7.918 -2.905 248 HH2 TRP 33 HH2 TRP 33 2.694 -6.504 -4.547 249 H GLU 34 H GLU 34 6.486 -10.921 -7.368 250 HA GLU 34 HA GLU 34 6.574 -8.459 -5.920 251 1HB GLU 34 1HB GLU 34 8.798 -9.261 -5.338 252 2HB GLU 34 2HB GLU 34 9.162 -9.555 -7.033 253 1HG GLU 34 1HG GLU 34 8.337 -6.814 -6.472 254 2HG GLU 34 2HG GLU 34 9.808 -7.305 -5.632 255 H ASP 35 H ASP 35 5.440 -7.238 -7.289 256 HA ASP 35 HA ASP 35 5.959 -7.499 -10.173 257 1HB ASP 35 1HB ASP 35 3.747 -6.535 -10.527 258 2HB ASP 35 2HB ASP 35 3.640 -7.939 -9.470 259 H TYR 36 H TYR 36 6.918 -5.912 -11.229 260 HA TYR 36 HA TYR 36 7.870 -3.591 -9.917 261 1HB TYR 36 1HB TYR 36 8.522 -2.909 -12.295 262 2HB TYR 36 2HB TYR 36 9.217 -4.402 -11.671 263 HD1 TYR 36 HD1 TYR 36 8.922 -6.426 -12.818 264 HD2 TYR 36 HD2 TYR 36 6.498 -3.081 -13.831 265 HE1 TYR 36 HE1 TYR 36 8.061 -7.649 -14.771 266 HE2 TYR 36 HE2 TYR 36 5.630 -4.293 -15.785 267 HH TYR 36 HH TYR 36 7.024 -7.217 -16.903 268 H ASN 37 H ASN 37 5.110 -4.207 -12.012 269 HA ASN 37 HA ASN 37 4.436 -1.565 -12.626 270 1HB ASN 37 1HB ASN 37 2.131 -2.460 -12.974 271 2HB ASN 37 2HB ASN 37 3.378 -3.397 -13.791 272 1HD2 ASN 37 1HD2 ASN 37 3.543 -5.505 -13.376 273 2HD2 ASN 37 2HD2 ASN 37 2.639 -6.353 -12.171 274 H ARG 38 H ARG 38 4.179 -3.354 -9.689 275 HA ARG 38 HA ARG 38 2.601 -1.164 -8.514 276 1HB ARG 38 1HB ARG 38 1.625 -3.560 -8.572 277 2HB ARG 38 2HB ARG 38 2.792 -3.906 -7.303 278 1HG ARG 38 1HG ARG 38 0.576 -3.360 -6.415 279 2HG ARG 38 2HG ARG 38 1.807 -2.212 -5.888 280 1HD ARG 38 1HD ARG 38 0.253 -1.615 -8.352 281 2HD ARG 38 2HD ARG 38 -0.531 -1.396 -6.789 282 HE ARG 38 HE ARG 38 1.672 -0.029 -6.365 283 1HH1 ARG 38 1HH1 ARG 38 -0.300 -0.091 -9.242 284 2HH1 ARG 38 2HH1 ARG 38 0.106 1.524 -9.706 285 1HH2 ARG 38 1HH2 ARG 38 2.185 2.101 -6.959 286 2HH2 ARG 38 2HH2 ARG 38 1.509 2.775 -8.404 287 H ASP 39 H ASP 39 5.654 -2.433 -8.701 288 HA ASP 39 HA ASP 39 7.533 -2.350 -7.409 289 1HB ASP 39 1HB ASP 39 6.058 0.175 -6.727 290 2HB ASP 39 2HB ASP 39 7.575 -0.203 -5.919 291 H LEU 40 H LEU 40 5.406 -3.959 -6.413 292 HA LEU 40 HA LEU 40 5.930 -3.782 -3.517 293 1HB LEU 40 1HB LEU 40 3.622 -3.170 -4.010 294 2HB LEU 40 2HB LEU 40 3.398 -4.658 -4.909 295 HG LEU 40 HG LEU 40 3.842 -5.902 -2.751 296 1HD1 LEU 40 1HD1 LEU 40 4.732 -3.534 -1.811 297 2HD1 LEU 40 2HD1 LEU 40 4.154 -4.850 -0.787 298 3HD1 LEU 40 3HD1 LEU 40 3.075 -3.520 -1.205 299 1HD2 LEU 40 1HD2 LEU 40 1.564 -5.176 -3.827 300 2HD2 LEU 40 2HD2 LEU 40 1.461 -4.141 -2.401 301 3HD2 LEU 40 3HD2 LEU 40 1.609 -5.889 -2.213 302 H LEU 41 H LEU 41 6.069 -5.776 -2.384 303 HA LEU 41 HA LEU 41 6.189 -8.199 -3.983 304 1HB LEU 41 1HB LEU 41 8.384 -8.849 -3.250 305 2HB LEU 41 2HB LEU 41 8.457 -7.333 -4.107 306 HG LEU 41 HG LEU 41 9.667 -7.951 -1.684 307 1HD1 LEU 41 1HD1 LEU 41 9.832 -6.028 -3.606 308 2HD1 LEU 41 2HD1 LEU 41 10.800 -6.085 -2.131 309 3HD1 LEU 41 3HD1 LEU 41 9.341 -5.095 -2.193 310 1HD2 LEU 41 1HD2 LEU 41 7.260 -6.234 -1.190 311 2HD2 LEU 41 2HD2 LEU 41 8.711 -6.130 -0.202 312 3HD2 LEU 41 3HD2 LEU 41 7.815 -7.643 -0.292 313 H VAL 42 H VAL 42 6.231 -10.167 -2.744 314 HA VAL 42 HA VAL 42 5.270 -9.780 0.007 315 HB VAL 42 HB VAL 42 4.240 -11.682 -2.100 316 1HG1 VAL 42 1HG1 VAL 42 2.960 -12.861 -0.407 317 2HG1 VAL 42 2HG1 VAL 42 3.674 -11.864 0.860 318 3HG1 VAL 42 3HG1 VAL 42 4.679 -12.989 -0.043 319 1HG2 VAL 42 1HG2 VAL 42 2.601 -10.188 -2.207 320 2HG2 VAL 42 2HG2 VAL 42 3.295 -9.266 -0.874 321 3HG2 VAL 42 3HG2 VAL 42 2.175 -10.591 -0.542 322 H SER 43 H SER 43 6.276 -10.853 1.530 323 HA SER 43 HA SER 43 8.089 -13.046 0.777 324 1HB SER 43 1HB SER 43 9.743 -12.272 2.243 325 2HB SER 43 2HB SER 43 9.132 -10.778 1.533 326 HG SER 43 HG SER 43 9.065 -11.622 4.116 327 H THR 44 H THR 44 8.402 -14.661 2.481 328 HA THR 44 HA THR 44 5.928 -14.988 3.999 329 HB THR 44 HB THR 44 6.405 -17.315 4.072 330 HG1 THR 44 HG1 THR 44 8.359 -18.096 3.955 331 1HG2 THR 44 1HG2 THR 44 5.984 -16.078 1.748 332 2HG2 THR 44 2HG2 THR 44 6.143 -17.831 1.907 333 3HG2 THR 44 3HG2 THR 44 7.525 -16.863 1.393 334 H THR 45 H THR 45 5.818 -14.717 6.085 335 HA THR 45 HA THR 45 8.264 -14.260 7.604 336 HB THR 45 HB THR 45 7.021 -12.962 9.027 337 HG1 THR 45 HG1 THR 45 4.682 -14.443 8.429 338 1HG2 THR 45 1HG2 THR 45 6.570 -12.203 6.639 339 2HG2 THR 45 2HG2 THR 45 5.488 -11.613 7.900 340 3HG2 THR 45 3HG2 THR 45 4.973 -12.927 6.839 341 H THR 46 H THR 46 5.585 -16.490 7.389 342 HA THR 46 HA THR 46 5.218 -18.536 8.315 343 HB THR 46 HB THR 46 7.902 -18.649 9.592 344 HG1 THR 46 HG1 THR 46 8.670 -17.782 7.799 345 1HG2 THR 46 1HG2 THR 46 6.005 -20.499 8.378 346 2HG2 THR 46 2HG2 THR 46 7.238 -20.774 9.609 347 3HG2 THR 46 3HG2 THR 46 7.681 -20.772 7.902 348 H ALA 47 H ALA 47 4.497 -16.223 9.765 349 HA ALA 47 HA ALA 47 4.570 -17.315 12.487 350 1HB ALA 47 1HB ALA 47 5.832 -14.896 11.646 351 2HB ALA 47 2HB ALA 47 5.780 -15.619 13.254 352 3HB ALA 47 3HB ALA 47 4.511 -14.505 12.747 353 H HIS 48 H HIS 48 2.996 -15.669 13.839 354 HA HIS 48 HA HIS 48 0.406 -16.202 12.775 355 1HB HIS 48 1HB HIS 48 1.530 -15.424 15.303 356 2HB HIS 48 2HB HIS 48 0.175 -14.367 14.920 357 HD1 HIS 48 HD1 HIS 48 -2.167 -15.383 14.973 358 HD2 HIS 48 HD2 HIS 48 0.854 -18.148 15.671 359 HE1 HIS 48 HE1 HIS 48 -3.331 -17.459 15.788 360 HE2 HIS 48 HE2 HIS 48 -1.489 -19.145 16.122 361 H GLY 49 H GLY 49 -0.819 -14.975 11.500 362 1HA GLY 49 1HA GLY 49 0.102 -12.547 10.405 363 2HA GLY 49 2HA GLY 49 -1.524 -13.193 10.237 364 H CYS 50 H CYS 50 -1.391 -10.558 10.349 365 HA CYS 50 HA CYS 50 -2.537 -9.958 12.968 366 1HB CYS 50 1HB CYS 50 -0.066 -8.782 11.861 367 2HB CYS 50 2HB CYS 50 -1.223 -7.622 12.504 368 HG CYS 50 HG CYS 50 -0.658 -9.832 14.489 369 H ASP 51 H ASP 51 -1.614 -8.019 10.126 370 HA ASP 51 HA ASP 51 -4.058 -6.588 10.104 371 1HB ASP 51 1HB ASP 51 -1.960 -6.885 7.944 372 2HB ASP 51 2HB ASP 51 -3.266 -5.704 7.928 373 H THR 52 H THR 52 -5.810 -6.705 8.703 374 HA THR 52 HA THR 52 -6.062 -9.227 7.199 375 HB THR 52 HB THR 52 -8.245 -7.740 8.675 376 HG1 THR 52 HG1 THR 52 -6.783 -10.079 9.279 377 1HG2 THR 52 1HG2 THR 52 -9.132 -10.290 8.220 378 2HG2 THR 52 2HG2 THR 52 -8.340 -9.867 6.702 379 3HG2 THR 52 3HG2 THR 52 -9.629 -8.845 7.339 380 H ILE 53 H ILE 53 -6.228 -8.908 5.086 381 HA ILE 53 HA ILE 53 -6.739 -6.297 4.004 382 HB ILE 53 HB ILE 53 -6.781 -8.744 2.297 383 1HG1 ILE 53 1HG1 ILE 53 -4.788 -8.701 4.033 384 2HG1 ILE 53 2HG1 ILE 53 -4.517 -9.136 2.352 385 1HG2 ILE 53 1HG2 ILE 53 -7.221 -6.653 1.223 386 2HG2 ILE 53 2HG2 ILE 53 -5.622 -7.209 0.728 387 3HG2 ILE 53 3HG2 ILE 53 -5.777 -5.934 1.936 388 1HD1 ILE 53 1HD1 ILE 53 -2.777 -7.670 3.042 389 2HD1 ILE 53 2HD1 ILE 53 -3.936 -6.496 3.668 390 3HD1 ILE 53 3HD1 ILE 53 -3.821 -6.785 1.932 391 H ALA 54 H ALA 54 -8.530 -5.546 2.972 392 HA ALA 54 HA ALA 54 -10.958 -7.162 3.275 393 1HB ALA 54 1HB ALA 54 -10.364 -4.406 3.704 394 2HB ALA 54 2HB ALA 54 -11.855 -5.284 4.038 395 3HB ALA 54 3HB ALA 54 -11.609 -4.536 2.461 396 H ARG 55 H ARG 55 -11.706 -8.172 1.537 397 HA ARG 55 HA ARG 55 -10.844 -7.329 -1.113 398 1HB ARG 55 1HB ARG 55 -11.719 -9.820 0.111 399 2HB ARG 55 2HB ARG 55 -12.524 -9.526 -1.423 400 1HG ARG 55 1HG ARG 55 -9.864 -8.924 -1.922 401 2HG ARG 55 2HG ARG 55 -9.807 -10.351 -0.887 402 1HD ARG 55 1HD ARG 55 -11.176 -11.592 -2.390 403 2HD ARG 55 2HD ARG 55 -11.549 -10.150 -3.334 404 HE ARG 55 HE ARG 55 -8.745 -10.796 -3.229 405 1HH1 ARG 55 1HH1 ARG 55 -11.755 -11.333 -4.913 406 2HH1 ARG 55 2HH1 ARG 55 -10.986 -11.797 -6.394 407 1HH2 ARG 55 1HH2 ARG 55 -7.734 -11.405 -5.175 408 2HH2 ARG 55 2HH2 ARG 55 -8.704 -11.840 -6.543 409 H CYS 56 H CYS 56 -12.519 -5.508 0.089 410 HA CYS 56 HA CYS 56 -15.153 -5.918 -1.119 411 1HB CYS 56 1HB CYS 56 -15.777 -3.869 0.181 412 2HB CYS 56 2HB CYS 56 -15.251 -5.222 1.176 413 H GLN 57 H GLN 57 -16.146 -3.928 -2.139 414 HA GLN 57 HA GLN 57 -14.121 -2.570 -3.793 415 1HB GLN 57 1HB GLN 57 -15.980 -4.283 -4.721 416 2HB GLN 57 2HB GLN 57 -16.897 -2.785 -4.801 417 1HG GLN 57 1HG GLN 57 -14.456 -2.115 -5.900 418 2HG GLN 57 2HG GLN 57 -14.753 -3.749 -6.493 419 1HE2 GLN 57 1HE2 GLN 57 -16.233 -0.559 -6.184 420 2HE2 GLN 57 2HE2 GLN 57 -17.198 -0.671 -7.613 421 H CYS 58 H CYS 58 -14.938 -1.505 -1.307 422 HA CYS 58 HA CYS 58 -16.991 0.450 -1.680 423 1HB CYS 58 1HB CYS 58 -14.795 0.497 0.395 424 2HB CYS 58 2HB CYS 58 -16.356 1.305 0.476 425 H THR 59 H THR 59 -16.856 2.409 -2.580 426 HA THR 59 HA THR 59 -14.467 3.251 -3.873 427 HB THR 59 HB THR 59 -16.665 5.197 -3.395 428 HG1 THR 59 HG1 THR 59 -18.023 4.133 -4.810 429 1HG2 THR 59 1HG2 THR 59 -16.376 5.758 -5.678 430 2HG2 THR 59 2HG2 THR 59 -15.392 4.324 -5.971 431 3HG2 THR 59 3HG2 THR 59 -14.770 5.630 -4.962 432 H THR 60 H THR 60 -15.556 3.564 -0.687 433 HA THR 60 HA THR 60 -13.865 5.923 -0.227 434 HB THR 60 HB THR 60 -15.136 6.414 1.688 435 HG1 THR 60 HG1 THR 60 -16.626 4.898 2.559 436 1HG2 THR 60 1HG2 THR 60 -16.977 5.316 -0.411 437 2HG2 THR 60 2HG2 THR 60 -16.508 6.994 -0.133 438 3HG2 THR 60 3HG2 THR 60 -17.552 6.166 1.023 439 H GLY 61 H GLY 61 -12.560 5.944 1.726 440 1HA GLY 61 1HA GLY 61 -12.013 3.639 3.260 441 2HA GLY 61 2HA GLY 61 -10.858 3.736 1.936 442 H VAL 62 H VAL 62 -10.443 4.008 4.861 443 HA VAL 62 HA VAL 62 -9.552 6.807 4.988 444 HB VAL 62 HB VAL 62 -10.980 6.156 6.837 445 1HG1 VAL 62 1HG1 VAL 62 -8.980 3.940 7.203 446 2HG1 VAL 62 2HG1 VAL 62 -10.722 3.814 6.959 447 3HG1 VAL 62 3HG1 VAL 62 -10.088 4.444 8.479 448 1HG2 VAL 62 1HG2 VAL 62 -9.779 7.535 8.086 449 2HG2 VAL 62 2HG2 VAL 62 -8.357 7.206 7.096 450 3HG2 VAL 62 3HG2 VAL 62 -8.692 6.213 8.513 451 H TYR 63 H TYR 63 -7.462 7.351 5.189 452 HA TYR 63 HA TYR 63 -5.495 5.174 5.433 453 1HB TYR 63 1HB TYR 63 -4.094 6.186 3.783 454 2HB TYR 63 2HB TYR 63 -5.708 6.088 3.091 455 HD1 TYR 63 HD1 TYR 63 -3.464 8.458 4.899 456 HD2 TYR 63 HD2 TYR 63 -6.646 7.985 2.110 457 HE1 TYR 63 HE1 TYR 63 -3.378 10.863 4.401 458 HE2 TYR 63 HE2 TYR 63 -6.564 10.389 1.606 459 HH TYR 63 HH TYR 63 -5.056 12.254 1.753 460 H PHE 64 H PHE 64 -3.702 5.570 6.689 461 HA PHE 64 HA PHE 64 -3.923 7.358 8.808 462 1HB PHE 64 1HB PHE 64 -2.432 5.270 8.573 463 2HB PHE 64 2HB PHE 64 -1.266 6.348 7.812 464 HD1 PHE 64 HD1 PHE 64 -3.503 6.604 10.793 465 HD2 PHE 64 HD2 PHE 64 0.446 6.878 9.232 466 HE1 PHE 64 HE1 PHE 64 -2.675 7.265 13.014 467 HE2 PHE 64 HE2 PHE 64 1.282 7.539 11.449 468 HZ PHE 64 HZ PHE 64 -0.280 7.733 13.344 469 H CYS 65 H CYS 65 -3.732 9.494 8.885 470 HA CYS 65 HA CYS 65 -2.780 11.013 6.680 471 1HB CYS 65 1HB CYS 65 -4.468 11.576 8.679 472 2HB CYS 65 2HB CYS 65 -3.009 12.294 9.353 473 HG CYS 65 HG CYS 65 -3.089 13.507 6.768 474 H ALA 66 H ALA 66 -0.890 12.106 6.371 475 HA ALA 66 HA ALA 66 1.382 11.207 7.930 476 1HB ALA 66 1HB ALA 66 0.944 12.204 5.262 477 2HB ALA 66 2HB ALA 66 2.314 11.304 5.914 478 3HB ALA 66 3HB ALA 66 2.273 13.063 6.042 479 H SER 67 H SER 67 -0.195 14.283 7.129 480 HA SER 67 HA SER 67 1.576 15.847 8.742 481 1HB SER 67 1HB SER 67 -0.553 17.474 8.438 482 2HB SER 67 2HB SER 67 0.659 17.237 7.179 483 HG SER 67 HG SER 67 -1.855 15.949 7.422 484 H LYS 68 H LYS 68 -1.447 14.191 9.230 485 HA LYS 68 HA LYS 68 -1.523 15.175 12.005 486 1HB LYS 68 1HB LYS 68 -3.493 15.655 10.402 487 2HB LYS 68 2HB LYS 68 -3.872 13.948 10.586 488 1HG LYS 68 1HG LYS 68 -4.732 14.239 12.626 489 2HG LYS 68 2HG LYS 68 -3.434 15.328 13.121 490 1HD LYS 68 1HD LYS 68 -4.518 17.145 11.849 491 2HD LYS 68 2HD LYS 68 -5.837 16.047 11.441 492 1HE LYS 68 1HE LYS 68 -6.562 17.356 13.287 493 2HE LYS 68 2HE LYS 68 -6.214 15.741 13.902 494 1HZ LYS 68 1HZ LYS 68 -5.327 17.907 15.086 495 2HZ LYS 68 2HZ LYS 68 -4.055 17.708 13.989 496 3HZ LYS 68 3HZ LYS 68 -4.435 16.469 15.078 497 H SER 69 H SER 69 -2.057 13.660 13.659 498 HA SER 69 HA SER 69 -1.161 10.949 13.018 499 1HB SER 69 1HB SER 69 -1.712 11.911 15.807 500 2HB SER 69 2HB SER 69 -0.539 10.717 15.253 501 HG SER 69 HG SER 69 0.525 12.624 15.790 502 H LYS 70 H LYS 70 -3.760 11.747 12.187 503 HA LYS 70 HA LYS 70 -5.396 9.942 13.829 504 1HB LYS 70 1HB LYS 70 -6.848 11.585 14.246 505 2HB LYS 70 2HB LYS 70 -5.789 12.711 13.417 506 1HG LYS 70 1HG LYS 70 -7.160 11.511 11.346 507 2HG LYS 70 2HG LYS 70 -8.371 11.641 12.622 508 1HD LYS 70 1HD LYS 70 -6.614 13.969 11.966 509 2HD LYS 70 2HD LYS 70 -8.022 13.611 10.962 510 1HE LYS 70 1HE LYS 70 -8.125 13.966 13.952 511 2HE LYS 70 2HE LYS 70 -8.433 15.261 12.795 512 1HZ LYS 70 1HZ LYS 70 -9.952 12.829 12.369 513 2HZ LYS 70 2HZ LYS 70 -10.448 14.444 12.290 514 3HZ LYS 70 3HZ LYS 70 -10.328 13.670 13.789 515 H HIS 71 H HIS 71 -7.385 9.200 12.568 516 HA HIS 71 HA HIS 71 -6.457 8.105 10.052 517 1HB HIS 71 1HB HIS 71 -8.760 7.597 11.892 518 2HB HIS 71 2HB HIS 71 -8.896 7.081 10.215 519 HD1 HIS 71 HD1 HIS 71 -8.653 4.602 10.438 520 HD2 HIS 71 HD2 HIS 71 -5.674 6.674 12.462 521 HE1 HIS 71 HE1 HIS 71 -7.028 2.850 11.220 522 HE2 HIS 71 HE2 HIS 71 -5.285 4.119 12.524 523 H TYR 72 H TYR 72 -6.959 8.896 8.100 524 HA TYR 72 HA TYR 72 -9.011 11.000 7.965 525 1HB TYR 72 1HB TYR 72 -6.357 10.647 6.731 526 2HB TYR 72 2HB TYR 72 -7.600 11.270 5.653 527 HD1 TYR 72 HD1 TYR 72 -7.687 13.553 5.464 528 HD2 TYR 72 HD2 TYR 72 -6.456 11.867 9.173 529 HE1 TYR 72 HE1 TYR 72 -7.337 15.812 6.365 530 HE2 TYR 72 HE2 TYR 72 -6.103 14.122 10.091 531 HH TYR 72 HH TYR 72 -5.885 16.844 8.237 532 HA PRO 73 HA PRO 73 -11.094 7.969 5.341 533 1HB PRO 73 1HB PRO 73 -13.445 9.623 5.471 534 2HB PRO 73 2HB PRO 73 -13.150 8.081 6.276 535 1HG PRO 73 1HG PRO 73 -13.398 10.487 7.584 536 2HG PRO 73 2HG PRO 73 -12.537 9.078 8.229 537 1HD PRO 73 1HD PRO 73 -11.442 11.523 6.892 538 2HD PRO 73 2HD PRO 73 -10.811 10.617 8.285 539 H VAL 74 H VAL 74 -10.709 8.055 3.215 540 HA VAL 74 HA VAL 74 -11.448 10.494 1.750 541 HB VAL 74 HB VAL 74 -8.850 8.975 1.523 542 1HG1 VAL 74 1HG1 VAL 74 -9.493 9.385 -0.712 543 2HG1 VAL 74 2HG1 VAL 74 -8.304 10.616 -0.280 544 3HG1 VAL 74 3HG1 VAL 74 -10.021 11.027 -0.330 545 1HG2 VAL 74 1HG2 VAL 74 -9.678 11.589 2.612 546 2HG2 VAL 74 2HG2 VAL 74 -8.175 11.564 1.688 547 3HG2 VAL 74 3HG2 VAL 74 -8.361 10.519 3.098 548 H SER 75 H SER 75 -12.270 10.223 -0.267 549 HA SER 75 HA SER 75 -12.940 7.484 -1.055 550 1HB SER 75 1HB SER 75 -14.400 8.776 -2.767 551 2HB SER 75 2HB SER 75 -14.889 8.810 -1.073 552 HG SER 75 HG SER 75 -14.346 10.872 -0.937 553 H PHE 76 H PHE 76 -11.886 6.516 -2.698 554 HA PHE 76 HA PHE 76 -10.407 8.242 -4.569 555 1HB PHE 76 1HB PHE 76 -8.984 5.794 -4.282 556 2HB PHE 76 2HB PHE 76 -8.452 7.420 -3.878 557 HD1 PHE 76 HD1 PHE 76 -10.591 4.707 -2.471 558 HD2 PHE 76 HD2 PHE 76 -7.794 7.824 -1.722 559 HE1 PHE 76 HE1 PHE 76 -10.558 4.100 -0.087 560 HE2 PHE 76 HE2 PHE 76 -7.756 7.222 0.662 561 HZ PHE 76 HZ PHE 76 -9.138 5.359 1.480 562 H GLU 77 H GLU 77 -9.632 7.062 -6.492 563 HA GLU 77 HA GLU 77 -11.678 5.182 -7.463 564 1HB GLU 77 1HB GLU 77 -11.199 7.597 -8.520 565 2HB GLU 77 2HB GLU 77 -9.950 6.693 -9.364 566 1HG GLU 77 1HG GLU 77 -11.420 5.740 -10.731 567 2HG GLU 77 2HG GLU 77 -12.516 5.340 -9.410 568 H GLY 78 H GLY 78 -10.862 3.534 -9.012 569 1HA GLY 78 1HA GLY 78 -8.113 2.771 -8.263 570 2HA GLY 78 2HA GLY 78 -9.387 1.636 -8.659 571 HA PRO 79 HA PRO 79 -8.038 3.477 -12.922 572 1HB PRO 79 1HB PRO 79 -5.583 4.979 -12.342 573 2HB PRO 79 2HB PRO 79 -6.991 5.462 -13.290 574 1HG PRO 79 1HG PRO 79 -6.434 6.540 -10.881 575 2HG PRO 79 2HG PRO 79 -8.092 6.318 -11.467 576 1HD PRO 79 1HD PRO 79 -6.548 4.694 -9.492 577 2HD PRO 79 2HD PRO 79 -8.255 5.154 -9.491 578 H GLY 80 H GLY 80 -6.861 2.204 -14.247 579 1HA GLY 80 1HA GLY 80 -5.281 0.144 -13.191 580 2HA GLY 80 2HA GLY 80 -5.419 0.549 -14.894 581 H LEU 81 H LEU 81 -3.842 1.788 -15.877 582 HA LEU 81 HA LEU 81 -1.305 1.818 -14.487 583 1HB LEU 81 1HB LEU 81 -1.842 1.171 -16.972 584 2HB LEU 81 2HB LEU 81 -1.611 2.891 -17.233 585 HG LEU 81 HG LEU 81 0.499 2.066 -17.629 586 1HD1 LEU 81 1HD1 LEU 81 0.612 2.555 -14.675 587 2HD1 LEU 81 2HD1 LEU 81 0.561 3.819 -15.901 588 3HD1 LEU 81 3HD1 LEU 81 1.933 2.716 -15.827 589 1HD2 LEU 81 1HD2 LEU 81 0.686 -0.129 -17.238 590 2HD2 LEU 81 2HD2 LEU 81 -0.313 -0.051 -15.787 591 3HD2 LEU 81 3HD2 LEU 81 1.394 0.382 -15.706 592 H VAL 82 H VAL 82 -0.556 3.464 -13.407 593 HA VAL 82 HA VAL 82 -1.258 6.187 -14.272 594 HB VAL 82 HB VAL 82 -0.892 5.278 -11.396 595 1HG1 VAL 82 1HG1 VAL 82 -1.308 7.984 -12.643 596 2HG1 VAL 82 2HG1 VAL 82 -0.048 7.470 -11.520 597 3HG1 VAL 82 3HG1 VAL 82 -1.709 7.652 -10.958 598 1HG2 VAL 82 1HG2 VAL 82 -3.293 6.037 -11.220 599 2HG2 VAL 82 2HG2 VAL 82 -3.034 4.562 -12.150 600 3HG2 VAL 82 3HG2 VAL 82 -3.326 6.087 -12.983 601 H GLU 83 H GLU 83 0.480 7.315 -14.862 602 HA GLU 83 HA GLU 83 3.091 6.218 -14.570 603 1HB GLU 83 1HB GLU 83 3.779 8.499 -15.540 604 2HB GLU 83 2HB GLU 83 2.790 7.445 -16.540 605 1HG GLU 83 1HG GLU 83 1.054 8.858 -16.542 606 2HG GLU 83 2HG GLU 83 1.285 9.314 -14.855 607 H VAL 84 H VAL 84 4.049 6.164 -12.665 608 HA VAL 84 HA VAL 84 3.573 8.107 -10.622 609 HB VAL 84 HB VAL 84 5.457 5.768 -10.856 610 1HG1 VAL 84 1HG1 VAL 84 5.548 8.007 -8.931 611 2HG1 VAL 84 2HG1 VAL 84 6.824 6.916 -9.466 612 3HG1 VAL 84 3HG1 VAL 84 5.664 6.385 -8.249 613 1HG2 VAL 84 1HG2 VAL 84 4.095 4.896 -9.002 614 2HG2 VAL 84 2HG2 VAL 84 3.129 5.242 -10.437 615 3HG2 VAL 84 3HG2 VAL 84 3.101 6.352 -9.066 616 H GLN 85 H GLN 85 4.402 10.063 -10.648 617 HA GLN 85 HA GLN 85 6.725 10.750 -12.190 618 1HB GLN 85 1HB GLN 85 6.346 13.019 -11.383 619 2HB GLN 85 2HB GLN 85 4.833 12.315 -11.940 620 1HG GLN 85 1HG GLN 85 4.137 11.903 -9.673 621 2HG GLN 85 2HG GLN 85 5.693 12.462 -9.061 622 1HE2 GLN 85 1HE2 GLN 85 6.183 14.724 -10.349 623 2HE2 GLN 85 2HE2 GLN 85 4.951 15.901 -10.059 624 H GLU 86 H GLU 86 8.737 11.540 -11.327 625 HA GLU 86 HA GLU 86 9.614 10.078 -9.070 626 1HB GLU 86 1HB GLU 86 11.003 10.936 -11.058 627 2HB GLU 86 2HB GLU 86 11.053 12.469 -10.199 628 1HG GLU 86 1HG GLU 86 12.052 11.282 -8.260 629 2HG GLU 86 2HG GLU 86 12.122 9.823 -9.248 630 H SER 87 H SER 87 8.634 10.526 -7.209 631 HA SER 87 HA SER 87 9.137 13.137 -6.013 632 1HB SER 87 1HB SER 87 6.889 13.378 -6.927 633 2HB SER 87 2HB SER 87 6.386 11.877 -6.147 634 HG SER 87 HG SER 87 5.943 13.043 -4.471 635 H GLU 88 H GLU 88 8.843 13.120 -3.663 636 HA GLU 88 HA GLU 88 9.386 12.236 -1.635 637 1HB GLU 88 1HB GLU 88 6.978 11.331 -2.319 638 2HB GLU 88 2HB GLU 88 7.801 9.783 -2.237 639 1HG GLU 88 1HG GLU 88 8.524 10.349 0.068 640 2HG GLU 88 2HG GLU 88 7.543 11.810 -0.032 641 H TYR 89 H TYR 89 9.023 9.082 -3.211 642 HA TYR 89 HA TYR 89 11.871 8.654 -3.345 643 1HB TYR 89 1HB TYR 89 11.655 6.552 -1.894 644 2HB TYR 89 2HB TYR 89 11.696 8.101 -1.058 645 HD1 TYR 89 HD1 TYR 89 9.143 5.821 -2.575 646 HD2 TYR 89 HD2 TYR 89 10.193 8.370 0.666 647 HE1 TYR 89 HE1 TYR 89 7.023 5.266 -1.458 648 HE2 TYR 89 HE2 TYR 89 8.077 7.822 1.791 649 HH TYR 89 HH TYR 89 6.388 6.108 1.804 650 H TYR 90 H TYR 90 9.441 8.613 -5.063 651 HA TYR 90 HA TYR 90 9.619 5.832 -6.014 652 1HB TYR 90 1HB TYR 90 7.339 7.476 -5.452 653 2HB TYR 90 2HB TYR 90 7.366 7.105 -7.172 654 HD1 TYR 90 HD1 TYR 90 7.354 4.727 -7.916 655 HD2 TYR 90 HD2 TYR 90 6.786 5.815 -3.843 656 HE1 TYR 90 HE1 TYR 90 6.411 2.503 -7.461 657 HE2 TYR 90 HE2 TYR 90 5.842 3.593 -3.376 658 HH TYR 90 HH TYR 90 4.584 1.707 -5.199 659 HA PRO 91 HA PRO 91 11.803 7.789 -9.435 660 1HB PRO 91 1HB PRO 91 11.475 5.099 -10.629 661 2HB PRO 91 2HB PRO 91 12.945 6.041 -10.361 662 1HG PRO 91 1HG PRO 91 12.379 3.914 -8.851 663 2HG PRO 91 2HG PRO 91 13.141 5.359 -8.158 664 1HD PRO 91 1HD PRO 91 10.290 4.458 -8.005 665 2HD PRO 91 2HD PRO 91 11.308 5.198 -6.753 666 H LYS 92 H LYS 92 11.276 8.541 -11.464 667 HA LYS 92 HA LYS 92 8.560 8.776 -12.146 668 1HB LYS 92 1HB LYS 92 10.791 10.116 -12.836 669 2HB LYS 92 2HB LYS 92 10.583 9.145 -14.285 670 1HG LYS 92 1HG LYS 92 8.366 10.811 -13.143 671 2HG LYS 92 2HG LYS 92 9.546 11.454 -14.283 672 1HD LYS 92 1HD LYS 92 8.233 8.905 -15.019 673 2HD LYS 92 2HD LYS 92 7.225 10.355 -15.044 674 1HE LYS 92 1HE LYS 92 9.911 10.349 -16.365 675 2HE LYS 92 2HE LYS 92 8.513 9.654 -17.186 676 1HZ LYS 92 1HZ LYS 92 7.445 11.928 -16.527 677 2HZ LYS 92 2HZ LYS 92 8.417 11.804 -17.905 678 3HZ LYS 92 3HZ LYS 92 9.054 12.448 -16.477 679 H ARG 93 H ARG 93 8.061 6.399 -12.054 680 HA ARG 93 HA ARG 93 8.520 5.172 -14.696 681 1HB ARG 93 1HB ARG 93 8.950 4.098 -12.005 682 2HB ARG 93 2HB ARG 93 8.014 3.035 -13.045 683 1HG ARG 93 1HG ARG 93 10.727 4.177 -13.680 684 2HG ARG 93 2HG ARG 93 10.391 2.527 -13.151 685 1HD ARG 93 1HD ARG 93 9.751 1.885 -15.198 686 2HD ARG 93 2HD ARG 93 8.806 3.350 -15.459 687 HE ARG 93 HE ARG 93 11.648 3.752 -15.634 688 1HH1 ARG 93 1HH1 ARG 93 8.771 2.840 -17.386 689 2HH1 ARG 93 2HH1 ARG 93 9.424 3.275 -18.930 690 1HH2 ARG 93 1HH2 ARG 93 12.507 4.325 -17.666 691 2HH2 ARG 93 2HH2 ARG 93 11.543 4.117 -19.090 692 H TYR 94 H TYR 94 6.904 3.192 -14.886 693 HA TYR 94 HA TYR 94 4.222 4.333 -14.588 694 1HB TYR 94 1HB TYR 94 5.482 2.382 -16.468 695 2HB TYR 94 2HB TYR 94 3.750 2.270 -16.179 696 HD1 TYR 94 HD1 TYR 94 2.358 3.454 -17.590 697 HD2 TYR 94 HD2 TYR 94 6.324 4.858 -16.969 698 HE1 TYR 94 HE1 TYR 94 1.972 5.245 -19.225 699 HE2 TYR 94 HE2 TYR 94 5.952 6.653 -18.603 700 HH TYR 94 HH TYR 94 3.416 7.851 -19.478 701 H GLN 95 H GLN 95 2.709 3.425 -13.300 702 HA GLN 95 HA GLN 95 3.250 0.750 -12.206 703 1HB GLN 95 1HB GLN 95 2.518 3.245 -10.689 704 2HB GLN 95 2HB GLN 95 2.257 1.638 -10.023 705 1HG GLN 95 1HG GLN 95 4.938 1.900 -11.037 706 2HG GLN 95 2HG GLN 95 4.573 3.180 -9.880 707 1HE2 GLN 95 1HE2 GLN 95 3.968 2.604 -7.760 708 2HE2 GLN 95 2HE2 GLN 95 4.386 1.065 -7.096 709 H SER 96 H SER 96 1.561 -0.616 -12.256 710 HA SER 96 HA SER 96 -1.032 0.497 -13.082 711 1HB SER 96 1HB SER 96 -1.503 -1.532 -14.137 712 2HB SER 96 2HB SER 96 0.233 -1.355 -14.394 713 HG SER 96 HG SER 96 -1.119 -3.016 -12.550 714 H HIS 97 H HIS 97 -2.961 -0.090 -12.092 715 HA HIS 97 HA HIS 97 -4.388 -0.763 -10.456 716 1HB HIS 97 1HB HIS 97 -2.307 -2.720 -10.345 717 2HB HIS 97 2HB HIS 97 -2.799 -2.336 -8.700 718 HD1 HIS 97 HD1 HIS 97 -5.834 -1.903 -9.252 719 HD2 HIS 97 HD2 HIS 97 -3.594 -5.111 -10.648 720 HE1 HIS 97 HE1 HIS 97 -7.493 -3.743 -9.686 721 HE2 HIS 97 HE2 HIS 97 -6.107 -5.694 -10.473 722 H VAL 98 H VAL 98 -3.566 1.684 -10.106 723 HA VAL 98 HA VAL 98 -2.891 1.843 -7.238 724 HB VAL 98 HB VAL 98 -1.032 2.677 -8.674 725 1HG1 VAL 98 1HG1 VAL 98 -1.768 3.722 -10.534 726 2HG1 VAL 98 2HG1 VAL 98 -1.620 5.139 -9.489 727 3HG1 VAL 98 3HG1 VAL 98 -3.195 4.383 -9.738 728 1HG2 VAL 98 1HG2 VAL 98 -2.436 4.393 -6.700 729 2HG2 VAL 98 2HG2 VAL 98 -1.049 5.051 -7.574 730 3HG2 VAL 98 3HG2 VAL 98 -0.868 3.592 -6.595 731 H LEU 99 H LEU 99 -4.050 3.278 -5.986 732 HA LEU 99 HA LEU 99 -6.451 4.387 -7.256 733 1HB LEU 99 1HB LEU 99 -5.842 3.442 -4.476 734 2HB LEU 99 2HB LEU 99 -7.165 4.558 -4.758 735 HG LEU 99 HG LEU 99 -8.193 2.922 -6.300 736 1HD1 LEU 99 1HD1 LEU 99 -6.621 1.541 -7.188 737 2HD1 LEU 99 2HD1 LEU 99 -7.169 0.515 -5.862 738 3HD1 LEU 99 3HD1 LEU 99 -5.688 1.457 -5.693 739 1HD2 LEU 99 1HD2 LEU 99 -7.582 1.801 -3.567 740 2HD2 LEU 99 2HD2 LEU 99 -8.956 1.382 -4.589 741 3HD2 LEU 99 3HD2 LEU 99 -8.817 3.008 -3.921 742 H LEU 100 H LEU 100 -7.030 6.546 -6.961 743 HA LEU 100 HA LEU 100 -5.099 8.205 -5.498 744 1HB LEU 100 1HB LEU 100 -5.720 8.261 -8.357 745 2HB LEU 100 2HB LEU 100 -5.794 9.832 -7.582 746 HG LEU 100 HG LEU 100 -3.408 7.975 -7.530 747 1HD1 LEU 100 1HD1 LEU 100 -4.025 9.113 -9.730 748 2HD1 LEU 100 2HD1 LEU 100 -2.389 9.351 -9.112 749 3HD1 LEU 100 3HD1 LEU 100 -3.597 10.623 -8.923 750 1HD2 LEU 100 1HD2 LEU 100 -2.389 9.385 -6.103 751 2HD2 LEU 100 2HD2 LEU 100 -4.035 9.839 -5.668 752 3HD2 LEU 100 3HD2 LEU 100 -3.127 10.814 -6.820 753 H ALA 101 H ALA 101 -5.873 9.978 -4.458 754 HA ALA 101 HA ALA 101 -8.613 10.860 -4.858 755 1HB ALA 101 1HB ALA 101 -7.693 9.740 -2.209 756 2HB ALA 101 2HB ALA 101 -8.939 9.069 -3.264 757 3HB ALA 101 3HB ALA 101 -9.196 10.623 -2.480 758 H THR 102 H THR 102 -8.980 12.957 -4.139 759 HA THR 102 HA THR 102 -6.561 14.395 -3.326 760 HB THR 102 HB THR 102 -7.432 15.370 -5.274 761 HG1 THR 102 HG1 THR 102 -7.020 17.014 -3.872 762 1HG2 THR 102 1HG2 THR 102 -9.783 16.115 -5.494 763 2HG2 THR 102 2HG2 THR 102 -10.158 15.239 -4.010 764 3HG2 THR 102 3HG2 THR 102 -9.593 14.363 -5.433 765 H GLY 103 H GLY 103 -6.334 15.151 -1.335 766 1HA GLY 103 1HA GLY 103 -8.391 14.745 0.624 767 2HA GLY 103 2HA GLY 103 -6.817 15.476 0.901 768 H PHE 104 H PHE 104 -6.889 17.631 -0.806 769 HA PHE 104 HA PHE 104 -7.577 19.794 -0.933 770 1HB PHE 104 1HB PHE 104 -9.770 18.360 -1.568 771 2HB PHE 104 2HB PHE 104 -10.369 19.192 -0.137 772 HD1 PHE 104 HD1 PHE 104 -10.423 21.668 -0.085 773 HD2 PHE 104 HD2 PHE 104 -9.450 19.500 -3.615 774 HE1 PHE 104 HE1 PHE 104 -10.863 23.677 -1.436 775 HE2 PHE 104 HE2 PHE 104 -9.887 21.505 -4.973 776 HZ PHE 104 HZ PHE 104 -10.594 23.598 -3.883 777 H SER 105 H SER 105 -6.694 18.651 1.611 778 HA SER 105 HA SER 105 -7.786 20.730 3.361 779 1HB SER 105 1HB SER 105 -7.399 17.848 4.205 780 2HB SER 105 2HB SER 105 -7.898 19.173 5.256 781 HG SER 105 HG SER 105 -9.317 18.180 3.005 782 H GLU 106 H GLU 106 -5.390 18.082 3.385 783 HA GLU 106 HA GLU 106 -3.267 20.019 3.832 784 1HB GLU 106 1HB GLU 106 -4.301 18.192 5.897 785 2HB GLU 106 2HB GLU 106 -2.554 18.155 5.697 786 1HG GLU 106 1HG GLU 106 -2.353 20.456 6.200 787 2HG GLU 106 2HG GLU 106 -4.094 20.703 6.081 788 HA PRO 107 HA PRO 107 -1.206 17.067 1.237 789 1HB PRO 107 1HB PRO 107 1.288 18.060 1.327 790 2HB PRO 107 2HB PRO 107 -0.021 18.910 0.497 791 1HG PRO 107 1HG PRO 107 1.130 19.400 3.217 792 2HG PRO 107 2HG PRO 107 0.674 20.573 1.969 793 1HD PRO 107 1HD PRO 107 -0.901 19.958 4.120 794 2HD PRO 107 2HD PRO 107 -1.538 20.530 2.565 795 H GLY 108 H GLY 108 1.094 15.891 1.332 796 1HA GLY 108 1HA GLY 108 2.688 14.758 2.699 797 2HA GLY 108 2HA GLY 108 1.619 14.978 4.074 798 H ASP 109 H ASP 109 2.860 12.534 3.265 799 HA ASP 109 HA ASP 109 0.467 10.895 3.058 800 1HB ASP 109 1HB ASP 109 1.763 11.385 0.740 801 2HB ASP 109 2HB ASP 109 2.678 9.990 1.305 802 H ALA 110 H ALA 110 4.023 10.846 3.197 803 HA ALA 110 HA ALA 110 5.488 9.609 4.423 804 1HB ALA 110 1HB ALA 110 3.231 9.296 6.393 805 2HB ALA 110 2HB ALA 110 4.205 10.758 6.242 806 3HB ALA 110 3HB ALA 110 4.964 9.240 6.718 807 H GLY 111 H GLY 111 5.280 7.400 6.027 808 1HA GLY 111 1HA GLY 111 4.573 5.371 4.059 809 2HA GLY 111 2HA GLY 111 5.513 5.119 5.522 810 H GLY 112 H GLY 112 2.458 4.862 4.060 811 1HA GLY 112 1HA GLY 112 1.392 3.649 6.482 812 2HA GLY 112 2HA GLY 112 0.509 5.037 5.864 813 H ILE 113 H ILE 113 -0.943 2.858 6.022 814 HA ILE 113 HA ILE 113 -1.082 1.869 3.251 815 HB ILE 113 HB ILE 113 -1.956 -0.264 4.069 816 1HG1 ILE 113 1HG1 ILE 113 -1.309 -0.516 6.694 817 2HG1 ILE 113 2HG1 ILE 113 -1.843 1.161 6.657 818 1HG2 ILE 113 1HG2 ILE 113 0.729 0.607 5.096 819 2HG2 ILE 113 2HG2 ILE 113 0.351 -0.293 3.627 820 3HG2 ILE 113 3HG2 ILE 113 0.174 -1.065 5.205 821 1HD1 ILE 113 1HD1 ILE 113 -3.947 0.362 5.560 822 2HD1 ILE 113 2HD1 ILE 113 -3.713 -0.169 7.226 823 3HD1 ILE 113 3HD1 ILE 113 -3.408 -1.284 5.893 824 H LEU 114 H LEU 114 -3.125 1.627 2.351 825 HA LEU 114 HA LEU 114 -5.200 3.233 3.602 826 1HB LEU 114 1HB LEU 114 -4.907 3.719 1.316 827 2HB LEU 114 2HB LEU 114 -4.825 2.025 0.877 828 HG LEU 114 HG LEU 114 -7.188 1.754 1.162 829 1HD1 LEU 114 1HD1 LEU 114 -8.658 3.396 2.004 830 2HD1 LEU 114 2HD1 LEU 114 -7.391 4.624 2.020 831 3HD1 LEU 114 3HD1 LEU 114 -7.327 3.276 3.155 832 1HD2 LEU 114 1HD2 LEU 114 -6.133 3.074 -0.859 833 2HD2 LEU 114 2HD2 LEU 114 -7.110 4.389 -0.207 834 3HD2 LEU 114 3HD2 LEU 114 -7.879 2.881 -0.700 835 H ARG 115 H ARG 115 -6.610 2.312 4.939 836 HA ARG 115 HA ARG 115 -7.375 -0.487 4.433 837 1HB ARG 115 1HB ARG 115 -7.678 -0.786 6.809 838 2HB ARG 115 2HB ARG 115 -6.061 -0.167 6.502 839 1HG ARG 115 1HG ARG 115 -7.366 2.145 6.908 840 2HG ARG 115 2HG ARG 115 -8.326 1.067 7.923 841 1HD ARG 115 1HD ARG 115 -5.380 0.849 8.136 842 2HD ARG 115 2HD ARG 115 -6.121 2.308 8.788 843 HE ARG 115 HE ARG 115 -7.159 1.037 10.427 844 1HH1 ARG 115 1HH1 ARG 115 -5.483 -1.036 8.167 845 2HH1 ARG 115 2HH1 ARG 115 -5.587 -2.432 9.185 846 1HH2 ARG 115 1HH2 ARG 115 -7.292 -0.799 11.760 847 2HH2 ARG 115 2HH2 ARG 115 -6.613 -2.299 11.220 848 H CYS 116 H CYS 116 -9.499 -1.103 4.725 849 HA CYS 116 HA CYS 116 -11.457 1.095 4.679 850 1HB CYS 116 1HB CYS 116 -11.195 -0.491 2.668 851 2HB CYS 116 2HB CYS 116 -11.939 -1.713 3.689 852 H GLU 117 H GLU 117 -13.628 0.494 5.602 853 HA GLU 117 HA GLU 117 -13.414 -0.249 8.276 854 1HB GLU 117 1HB GLU 117 -15.955 -0.602 8.082 855 2HB GLU 117 2HB GLU 117 -15.318 0.998 7.730 856 1HG GLU 117 1HG GLU 117 -16.012 0.936 5.614 857 2HG GLU 117 2HG GLU 117 -15.464 -0.724 5.385 858 H HIS 118 H HIS 118 -13.578 -2.200 5.457 859 HA HIS 118 HA HIS 118 -14.460 -4.572 6.876 860 1HB HIS 118 1HB HIS 118 -13.526 -4.273 4.014 861 2HB HIS 118 2HB HIS 118 -14.344 -5.672 4.705 862 HD2 HIS 118 HD2 HIS 118 -17.028 -5.623 4.350 863 HE1 HIS 118 HE1 HIS 118 -17.447 -1.474 3.561 864 HE2 HIS 118 HE2 HIS 118 -18.638 -3.685 3.765 865 H GLY 119 H GLY 119 -11.487 -3.236 5.498 866 1HA GLY 119 1HA GLY 119 -9.805 -4.654 7.238 867 2HA GLY 119 2HA GLY 119 -9.893 -5.552 5.730 868 H VAL 120 H VAL 120 -7.979 -5.254 4.830 869 HA VAL 120 HA VAL 120 -6.850 -2.546 4.678 870 HB VAL 120 HB VAL 120 -5.395 -5.060 3.903 871 1HG1 VAL 120 1HG1 VAL 120 -3.600 -3.328 4.992 872 2HG1 VAL 120 2HG1 VAL 120 -4.746 -2.234 4.219 873 3HG1 VAL 120 3HG1 VAL 120 -3.951 -3.490 3.271 874 1HG2 VAL 120 1HG2 VAL 120 -6.335 -4.483 6.503 875 2HG2 VAL 120 2HG2 VAL 120 -4.599 -4.178 6.494 876 3HG2 VAL 120 3HG2 VAL 120 -5.219 -5.752 5.998 877 H ILE 121 H ILE 121 -6.544 -1.527 2.767 878 HA ILE 121 HA ILE 121 -7.585 -2.853 0.367 879 HB ILE 121 HB ILE 121 -6.897 0.053 0.776 880 1HG1 ILE 121 1HG1 ILE 121 -9.045 -1.373 1.853 881 2HG1 ILE 121 2HG1 ILE 121 -8.903 0.375 1.722 882 1HG2 ILE 121 1HG2 ILE 121 -8.379 0.289 -1.286 883 2HG2 ILE 121 2HG2 ILE 121 -8.155 -1.448 -1.499 884 3HG2 ILE 121 3HG2 ILE 121 -6.760 -0.368 -1.521 885 1HD1 ILE 121 1HD1 ILE 121 -9.999 -1.220 -0.554 886 2HD1 ILE 121 2HD1 ILE 121 -10.266 0.473 -0.137 887 3HD1 ILE 121 3HD1 ILE 121 -11.013 -0.802 0.825 888 H GLY 122 H GLY 122 -4.990 -0.477 0.990 889 1HA GLY 122 1HA GLY 122 -3.050 -2.181 -0.327 890 2HA GLY 122 2HA GLY 122 -3.478 -0.729 -1.214 891 H LEU 123 H LEU 123 -1.097 -0.433 -0.937 892 HA LEU 123 HA LEU 123 -0.504 0.875 1.637 893 1HB LEU 123 1HB LEU 123 1.918 0.462 0.988 894 2HB LEU 123 2HB LEU 123 0.981 -0.936 1.479 895 HG LEU 123 HG LEU 123 1.177 -0.300 -1.431 896 1HD1 LEU 123 1HD1 LEU 123 3.298 -1.879 -0.005 897 2HD1 LEU 123 2HD1 LEU 123 3.485 -0.169 -0.390 898 3HD1 LEU 123 3HD1 LEU 123 3.270 -1.345 -1.686 899 1HD2 LEU 123 1HD2 LEU 123 0.595 -2.483 -1.726 900 2HD2 LEU 123 2HD2 LEU 123 -0.161 -2.197 -0.158 901 3HD2 LEU 123 3HD2 LEU 123 1.398 -3.014 -0.249 902 H VAL 124 H VAL 124 1.105 2.686 1.444 903 HA VAL 124 HA VAL 124 0.183 4.543 -0.508 904 HB VAL 124 HB VAL 124 1.834 6.095 0.452 905 1HG1 VAL 124 1HG1 VAL 124 -0.027 6.343 1.706 906 2HG1 VAL 124 2HG1 VAL 124 0.981 5.618 2.960 907 3HG1 VAL 124 3HG1 VAL 124 -0.153 4.618 2.052 908 1HG2 VAL 124 1HG2 VAL 124 3.267 5.429 2.280 909 2HG2 VAL 124 2HG2 VAL 124 3.601 4.417 0.875 910 3HG2 VAL 124 3HG2 VAL 124 2.642 3.782 2.212 911 H THR 125 H THR 125 1.104 5.290 -2.343 912 HA THR 125 HA THR 125 3.747 4.255 -3.089 913 HB THR 125 HB THR 125 2.515 2.865 -4.452 914 HG1 THR 125 HG1 THR 125 2.354 3.979 -6.563 915 1HG2 THR 125 1HG2 THR 125 0.533 4.691 -5.563 916 2HG2 THR 125 2HG2 THR 125 0.327 4.370 -3.843 917 3HG2 THR 125 3HG2 THR 125 0.362 3.034 -4.989 918 H MET 126 H MET 126 1.640 6.182 -5.188 919 HA MET 126 HA MET 126 3.673 8.252 -5.203 920 1HB MET 126 1HB MET 126 1.718 7.303 -7.045 921 2HB MET 126 2HB MET 126 1.383 9.001 -6.737 922 1HG MET 126 1HG MET 126 3.928 7.790 -7.772 923 2HG MET 126 2HG MET 126 2.822 8.867 -8.619 924 1HE MET 126 1HE MET 126 5.867 9.708 -5.409 925 2HE MET 126 2HE MET 126 6.474 9.322 -7.023 926 3HE MET 126 3HE MET 126 5.398 8.195 -6.192 927 H GLY 127 H GLY 127 3.353 10.398 -4.579 928 1HA GLY 127 1HA GLY 127 0.817 11.066 -3.275 929 2HA GLY 127 2HA GLY 127 2.275 11.113 -2.294 930 H GLY 128 H GLY 128 0.266 12.836 -4.398 931 1HA GLY 128 1HA GLY 128 2.321 14.779 -5.127 932 2HA GLY 128 2HA GLY 128 0.645 14.787 -5.657 933 H GLU 129 H GLU 129 0.946 17.124 -5.126 934 HA GLU 129 HA GLU 129 0.869 17.732 -2.275 935 1HB GLU 129 1HB GLU 129 0.750 19.661 -4.596 936 2HB GLU 129 2HB GLU 129 1.098 20.040 -2.914 937 1HG GLU 129 1HG GLU 129 3.225 19.118 -3.012 938 2HG GLU 129 2HG GLU 129 2.853 18.172 -4.452 939 H GLY 130 H GLY 130 -1.359 16.448 -3.986 940 1HA GLY 130 1HA GLY 130 -3.505 17.899 -2.701 941 2HA GLY 130 2HA GLY 130 -3.529 17.981 -4.454 942 H VAL 131 H VAL 131 -2.458 15.247 -4.755 943 HA VAL 131 HA VAL 131 -4.889 13.771 -3.987 944 HB VAL 131 HB VAL 131 -3.193 12.851 -6.261 945 1HG1 VAL 131 1HG1 VAL 131 -6.164 12.810 -5.772 946 2HG1 VAL 131 2HG1 VAL 131 -5.049 11.484 -5.446 947 3HG1 VAL 131 3HG1 VAL 131 -5.315 12.024 -7.102 948 1HG2 VAL 131 1HG2 VAL 131 -5.286 14.998 -6.559 949 2HG2 VAL 131 2HG2 VAL 131 -4.347 14.246 -7.850 950 3HG2 VAL 131 3HG2 VAL 131 -3.546 15.269 -6.656 951 H VAL 132 H VAL 132 -4.647 11.482 -3.573 952 HA VAL 132 HA VAL 132 -1.984 10.816 -2.498 953 HB VAL 132 HB VAL 132 -3.056 9.480 -0.802 954 1HG1 VAL 132 1HG1 VAL 132 -3.121 12.199 -0.880 955 2HG1 VAL 132 2HG1 VAL 132 -3.527 11.218 0.529 956 3HG1 VAL 132 3HG1 VAL 132 -4.807 11.809 -0.532 957 1HG2 VAL 132 1HG2 VAL 132 -4.932 8.512 -1.782 958 2HG2 VAL 132 2HG2 VAL 132 -5.553 10.060 -2.353 959 3HG2 VAL 132 3HG2 VAL 132 -5.628 9.659 -0.637 960 H GLY 133 H GLY 133 -0.968 9.260 -3.590 961 1HA GLY 133 1HA GLY 133 -2.534 7.412 -5.241 962 2HA GLY 133 2HA GLY 133 -0.803 7.688 -5.360 963 H PHE 134 H PHE 134 -2.998 5.431 -4.537 964 HA PHE 134 HA PHE 134 -1.174 4.185 -2.587 965 1HB PHE 134 1HB PHE 134 -4.182 3.883 -2.660 966 2HB PHE 134 2HB PHE 134 -3.087 3.160 -1.487 967 HD1 PHE 134 HD1 PHE 134 -5.538 5.109 -1.171 968 HD2 PHE 134 HD2 PHE 134 -1.315 5.615 -1.105 969 HE1 PHE 134 HE1 PHE 134 -5.801 7.072 0.285 970 HE2 PHE 134 HE2 PHE 134 -1.570 7.580 0.352 971 HZ PHE 134 HZ PHE 134 -3.815 8.311 1.049 972 H ALA 135 H ALA 135 -0.643 2.074 -2.886 973 HA ALA 135 HA ALA 135 -1.338 0.885 -5.447 974 1HB ALA 135 1HB ALA 135 0.605 -0.021 -3.322 975 2HB ALA 135 2HB ALA 135 1.006 0.914 -4.763 976 3HB ALA 135 3HB ALA 135 0.417 -0.742 -4.919 977 H ASP 136 H ASP 136 -3.087 -0.379 -5.576 978 HA ASP 136 HA ASP 136 -4.415 -1.416 -3.295 979 1HB ASP 136 1HB ASP 136 -5.833 -2.614 -4.984 980 2HB ASP 136 2HB ASP 136 -5.715 -0.874 -5.228 981 H VAL 137 H VAL 137 -4.517 -3.427 -2.426 982 HA VAL 137 HA VAL 137 -2.365 -5.270 -3.118 983 HB VAL 137 HB VAL 137 -4.319 -5.264 -0.805 984 1HG1 VAL 137 1HG1 VAL 137 -2.569 -6.963 0.101 985 2HG1 VAL 137 2HG1 VAL 137 -2.219 -7.233 -1.604 986 3HG1 VAL 137 3HG1 VAL 137 -3.845 -7.516 -0.982 987 1HG2 VAL 137 1HG2 VAL 137 -2.824 -4.088 0.365 988 2HG2 VAL 137 2HG2 VAL 137 -2.096 -3.703 -1.196 989 3HG2 VAL 137 3HG2 VAL 137 -1.468 -5.044 -0.237 990 H ARG 138 H ARG 138 -5.220 -4.784 -4.428 991 HA ARG 138 HA ARG 138 -6.524 -7.298 -4.275 992 1HB ARG 138 1HB ARG 138 -6.776 -5.323 -6.533 993 2HB ARG 138 2HB ARG 138 -7.972 -6.479 -5.968 994 1HG ARG 138 1HG ARG 138 -7.284 -4.773 -3.797 995 2HG ARG 138 2HG ARG 138 -7.636 -3.775 -5.208 996 1HD ARG 138 1HD ARG 138 -9.530 -5.963 -4.853 997 2HD ARG 138 2HD ARG 138 -9.488 -4.859 -3.482 998 HE ARG 138 HE ARG 138 -10.304 -3.158 -4.836 999 1HH1 ARG 138 1HH1 ARG 138 -9.719 -6.047 -6.717 1000 2HH1 ARG 138 2HH1 ARG 138 -10.618 -5.484 -8.083 1001 1HH2 ARG 138 1HH2 ARG 138 -11.483 -2.425 -6.637 1002 2HH2 ARG 138 2HH2 ARG 138 -11.618 -3.432 -8.040 1003 H ASP 139 H ASP 139 -3.629 -6.468 -5.730 1004 HA ASP 139 HA ASP 139 -3.947 -8.339 -7.951 1005 1HB ASP 139 1HB ASP 139 -1.740 -7.506 -8.687 1006 2HB ASP 139 2HB ASP 139 -2.910 -6.204 -8.485 1007 H LEU 140 H LEU 140 -3.455 -8.847 -4.862 1008 HA LEU 140 HA LEU 140 -2.159 -11.309 -5.193 1009 1HB LEU 140 1HB LEU 140 -0.043 -10.916 -4.056 1010 2HB LEU 140 2HB LEU 140 -0.149 -9.989 -5.536 1011 HG LEU 140 HG LEU 140 0.739 -8.377 -4.222 1012 1HD1 LEU 140 1HD1 LEU 140 -1.402 -7.442 -4.818 1013 2HD1 LEU 140 2HD1 LEU 140 -0.937 -6.900 -3.203 1014 3HD1 LEU 140 3HD1 LEU 140 -2.144 -8.172 -3.394 1015 1HD2 LEU 140 1HD2 LEU 140 -0.620 -8.901 -1.680 1016 2HD2 LEU 140 2HD2 LEU 140 1.077 -8.556 -2.018 1017 3HD2 LEU 140 3HD2 LEU 140 0.447 -10.190 -2.240 1018 H LEU 141 H LEU 141 -4.462 -10.691 -4.029 1019 HA LEU 141 HA LEU 141 -4.348 -10.169 -1.256 1020 1HB LEU 141 1HB LEU 141 -6.337 -10.548 -3.198 1021 2HB LEU 141 2HB LEU 141 -6.635 -11.753 -1.958 1022 HG LEU 141 HG LEU 141 -7.899 -9.887 -1.312 1023 1HD1 LEU 141 1HD1 LEU 141 -7.238 -9.793 0.806 1024 2HD1 LEU 141 2HD1 LEU 141 -5.669 -9.105 0.382 1025 3HD1 LEU 141 3HD1 LEU 141 -5.920 -10.845 0.295 1026 1HD2 LEU 141 1HD2 LEU 141 -7.451 -7.783 -1.889 1027 2HD2 LEU 141 2HD2 LEU 141 -6.074 -8.421 -2.788 1028 3HD2 LEU 141 3HD2 LEU 141 -5.857 -7.844 -1.136 1029 H TRP 142 H TRP 142 -3.553 -12.962 -3.024 1030 HA TRP 142 HA TRP 142 -4.344 -15.009 -1.315 1031 1HB TRP 142 1HB TRP 142 -2.423 -16.300 -2.295 1032 2HB TRP 142 2HB TRP 142 -3.508 -15.580 -3.478 1033 HD1 TRP 142 HD1 TRP 142 -2.540 -13.182 -4.603 1034 HE1 TRP 142 HE1 TRP 142 -0.124 -12.618 -5.281 1035 HE3 TRP 142 HE3 TRP 142 -0.073 -16.702 -1.837 1036 HZ2 TRP 142 HZ2 TRP 142 2.476 -13.543 -4.724 1037 HZ3 TRP 142 HZ3 TRP 142 2.385 -16.795 -1.968 1038 HH2 TRP 142 HH2 TRP 142 3.632 -15.248 -3.380 1039 H LEU 143 H LEU 143 -4.077 -14.109 0.794 1040 HA LEU 143 HA LEU 143 -1.448 -14.701 1.918 1041 1HB LEU 143 1HB LEU 143 -2.961 -12.134 2.409 1042 2HB LEU 143 2HB LEU 143 -1.616 -12.679 3.389 1043 HG LEU 143 HG LEU 143 -0.453 -12.708 0.939 1044 1HD1 LEU 143 1HD1 LEU 143 -2.124 -11.843 -0.388 1045 2HD1 LEU 143 2HD1 LEU 143 -1.189 -10.404 0.018 1046 3HD1 LEU 143 3HD1 LEU 143 -2.698 -10.744 0.865 1047 1HD2 LEU 143 1HD2 LEU 143 -0.608 -10.100 2.373 1048 2HD2 LEU 143 2HD2 LEU 143 0.790 -10.932 1.694 1049 3HD2 LEU 143 3HD2 LEU 143 0.074 -11.498 3.203 1050 H GLU 144 H GLU 144 -4.805 -13.771 2.591 1051 HA GLU 144 HA GLU 144 -5.073 -15.976 4.438 1052 1HB GLU 144 1HB GLU 144 -5.628 -14.723 6.378 1053 2HB GLU 144 2HB GLU 144 -4.116 -14.055 5.779 1054 1HG GLU 144 1HG GLU 144 -5.248 -12.160 4.854 1055 2HG GLU 144 2HG GLU 144 -6.821 -12.860 5.227 1056 H ASP 145 H ASP 145 -7.451 -15.119 5.678 1057 HA ASP 145 HA ASP 145 -9.340 -15.715 3.670 1058 1HB ASP 145 1HB ASP 145 -9.315 -15.504 6.494 1059 2HB ASP 145 2HB ASP 145 -10.599 -14.444 5.920 1060 H ASP 146 H ASP 146 -10.223 -14.443 2.192 1061 HA ASP 146 HA ASP 146 -9.845 -11.573 2.320 1062 1HB ASP 146 1HB ASP 146 -10.984 -13.416 0.218 1063 2HB ASP 146 2HB ASP 146 -10.979 -11.663 0.045 1064 H ALA 147 H ALA 147 -11.571 -10.037 2.086 1065 HA ALA 147 HA ALA 147 -13.881 -10.751 3.657 1066 1HB ALA 147 1HB ALA 147 -12.499 -8.506 3.582 1067 2HB ALA 147 2HB ALA 147 -14.225 -8.511 3.943 1068 3HB ALA 147 3HB ALA 147 -13.665 -8.104 2.321 1069 H MET 148 H MET 148 -15.701 -11.540 2.851 1070 HA MET 148 HA MET 148 -16.295 -11.105 0.006 1071 1HB MET 148 1HB MET 148 -17.001 -13.286 1.942 1072 2HB MET 148 2HB MET 148 -17.973 -13.035 0.500 1073 1HG MET 148 1HG MET 148 -16.542 -14.266 -0.640 1074 2HG MET 148 2HG MET 148 -15.302 -13.045 -0.355 1075 1HE MET 148 1HE MET 148 -16.901 -15.478 2.532 1076 2HE MET 148 2HE MET 148 -15.980 -16.898 2.039 1077 3HE MET 148 3HE MET 148 -17.095 -16.133 0.906 1078 H GLU 149 H GLU 149 -18.715 -11.104 -0.485 1079 HA GLU 149 HA GLU 149 -19.885 -8.843 0.677 1080 1HB GLU 149 1HB GLU 149 -20.343 -10.184 -1.585 1081 2HB GLU 149 2HB GLU 149 -21.645 -10.864 -0.618 1082 1HG GLU 149 1HG GLU 149 -21.997 -8.254 -0.092 1083 2HG GLU 149 2HG GLU 149 -21.311 -8.152 -1.714 1084 H GLN 150 H GLN 150 -20.996 -8.557 2.494 1085 HA GLN 150 HA GLN 150 -21.630 -10.837 4.157 1086 1HB GLN 150 1HB GLN 150 -20.693 -8.469 4.844 1087 2HB GLN 150 2HB GLN 150 -22.398 -8.041 4.881 1088 1HG GLN 150 1HG GLN 150 -21.738 -8.651 7.081 1089 2HG GLN 150 2HG GLN 150 -22.775 -9.929 6.450 1090 1HE2 GLN 150 1HE2 GLN 150 -19.321 -9.144 6.189 1091 2HE2 GLN 150 2HE2 GLN 150 -18.756 -10.705 6.668
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