NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | in_recoord | stage | position | program | type |
8460 | 1m94 | 5481 | cing | recoord | 1-original | 41 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H MET 1 1H MET 1 10.709 6.852 7.683 2 HA MET 1 HA MET 1 9.943 4.864 5.618 3 1HB MET 1 2HB MET 1 11.363 4.256 7.870 4 2HB MET 1 1HB MET 1 9.712 4.176 8.488 5 1HG MET 1 2HG MET 1 9.408 2.189 7.483 6 2HG MET 1 1HG MET 1 9.791 2.902 5.917 7 1HE MET 1 1HE MET 1 11.246 1.671 4.574 8 2HE MET 1 2HE MET 1 10.611 0.303 5.486 9 3HE MET 1 3HE MET 1 12.336 0.395 5.137 10 H ILE 2 H ILE 2 7.733 4.656 5.430 11 HA ILE 2 HA ILE 2 6.034 6.196 7.355 12 HB ILE 2 HB ILE 2 4.537 6.732 5.431 13 1HG1 ILE 2 2HG1 ILE 2 6.783 5.963 3.582 14 2HG1 ILE 2 1HG1 ILE 2 5.606 4.744 4.070 15 1HG2 ILE 2 1HG2 ILE 2 6.162 8.394 6.164 16 2HG2 ILE 2 2HG2 ILE 2 6.059 8.428 4.404 17 3HG2 ILE 2 3HG2 ILE 2 7.422 7.634 5.193 18 1HD1 ILE 2 1HD1 ILE 2 4.900 5.827 1.978 19 2HD1 ILE 2 2HD1 ILE 2 4.961 7.405 2.764 20 3HD1 ILE 2 3HD1 ILE 2 3.773 6.208 3.280 21 H GLU 3 H GLU 3 3.774 5.403 7.452 22 HA GLU 3 HA GLU 3 3.597 2.474 6.841 23 1HB GLU 3 2HB GLU 3 3.575 3.605 9.345 24 2HB GLU 3 1HB GLU 3 1.852 3.534 8.977 25 1HG GLU 3 2HG GLU 3 3.700 1.164 8.611 26 2HG GLU 3 1HG GLU 3 2.819 1.464 10.108 27 H VAL 4 H VAL 4 2.180 2.190 5.187 28 HA VAL 4 HA VAL 4 -0.194 4.010 5.051 29 HB VAL 4 HB VAL 4 -0.195 3.795 2.677 30 1HG1 VAL 4 1HG1 VAL 4 2.307 4.461 4.036 31 2HG1 VAL 4 2HG1 VAL 4 1.493 5.295 2.717 32 3HG1 VAL 4 3HG1 VAL 4 2.567 3.944 2.371 33 1HG2 VAL 4 1HG2 VAL 4 1.804 2.213 1.782 34 2HG2 VAL 4 2HG2 VAL 4 0.159 1.630 2.024 35 3HG2 VAL 4 3HG2 VAL 4 1.387 1.348 3.257 36 H VAL 5 H VAL 5 -2.236 3.050 4.530 37 HA VAL 5 HA VAL 5 -2.366 0.132 5.167 38 HB VAL 5 HB VAL 5 -4.758 0.603 5.779 39 1HG1 VAL 5 1HG1 VAL 5 -2.972 2.466 7.330 40 2HG1 VAL 5 2HG1 VAL 5 -2.681 0.727 7.355 41 3HG1 VAL 5 3HG1 VAL 5 -4.219 1.373 7.929 42 1HG2 VAL 5 1HG2 VAL 5 -4.185 3.515 5.955 43 2HG2 VAL 5 2HG2 VAL 5 -5.699 2.687 5.599 44 3HG2 VAL 5 3HG2 VAL 5 -4.487 2.887 4.336 45 H VAL 6 H VAL 6 -3.433 -1.252 3.759 46 HA VAL 6 HA VAL 6 -4.482 -0.024 1.237 47 HB VAL 6 HB VAL 6 -3.293 -2.793 1.318 48 1HG1 VAL 6 1HG1 VAL 6 -3.246 -2.582 -0.993 49 2HG1 VAL 6 2HG1 VAL 6 -3.092 -0.826 -0.934 50 3HG1 VAL 6 3HG1 VAL 6 -4.652 -1.586 -0.617 51 1HG2 VAL 6 1HG2 VAL 6 -1.124 -1.797 0.617 52 2HG2 VAL 6 2HG2 VAL 6 -1.560 -1.311 2.255 53 3HG2 VAL 6 3HG2 VAL 6 -1.780 -0.187 0.914 54 H ASN 7 H ASN 7 -6.583 -0.495 0.851 55 HA ASN 7 HA ASN 7 -7.770 -2.877 2.225 56 1HB ASN 7 2HB ASN 7 -9.942 -1.301 1.773 57 2HB ASN 7 1HB ASN 7 -9.026 -1.289 3.277 58 1HD2 ASN 7 1HD2 ASN 7 -7.498 0.510 3.621 59 2HD2 ASN 7 2HD2 ASN 7 -7.608 1.930 2.698 60 H ASP 8 H ASP 8 -8.319 -4.411 0.793 61 HA ASP 8 HA ASP 8 -8.583 -3.817 -2.059 62 1HB ASP 8 2HB ASP 8 -7.621 -5.970 -0.891 63 2HB ASP 8 1HB ASP 8 -9.311 -6.465 -0.827 64 H ARG 9 H ARG 9 -10.483 -3.811 -3.256 65 HA ARG 9 HA ARG 9 -12.937 -3.150 -1.923 66 1HB ARG 9 2HB ARG 9 -12.030 -2.841 -4.469 67 2HB ARG 9 1HB ARG 9 -13.133 -4.199 -4.689 68 1HG ARG 9 2HG ARG 9 -14.597 -2.411 -4.949 69 2HG ARG 9 1HG ARG 9 -14.756 -2.712 -3.219 70 1HD ARG 9 2HD ARG 9 -12.561 -0.885 -4.037 71 2HD ARG 9 1HD ARG 9 -14.201 -0.269 -4.233 72 HE ARG 9 HE ARG 9 -14.426 -1.046 -1.723 73 1HH1 ARG 9 1HH2 ARG 9 -13.290 1.725 -2.380 74 2HH1 ARG 9 2HH2 ARG 9 -11.902 1.765 -1.345 75 1HH2 ARG 9 2HH1 ARG 9 -11.913 -1.665 -0.763 76 2HH2 ARG 9 1HH1 ARG 9 -11.119 -0.164 -0.426 77 H LEU 10 H LEU 10 -11.651 -6.193 -3.204 78 HA LEU 10 HA LEU 10 -14.079 -7.716 -3.056 79 1HB LEU 10 2HB LEU 10 -11.150 -8.393 -3.070 80 2HB LEU 10 1HB LEU 10 -12.325 -9.654 -2.698 81 HG LEU 10 HG LEU 10 -13.039 -8.004 -5.032 82 1HD1 LEU 10 1HD1 LEU 10 -11.284 -8.485 -6.425 83 2HD1 LEU 10 2HD1 LEU 10 -10.930 -10.015 -5.621 84 3HD1 LEU 10 3HD1 LEU 10 -10.381 -8.497 -4.910 85 1HD2 LEU 10 1HD2 LEU 10 -13.564 -10.225 -5.947 86 2HD2 LEU 10 2HD2 LEU 10 -14.222 -10.071 -4.319 87 3HD2 LEU 10 3HD2 LEU 10 -12.744 -10.994 -4.589 88 H GLY 11 H GLY 11 -11.418 -7.240 -0.703 89 1HA GLY 11 2HA GLY 11 -12.637 -6.932 1.655 90 2HA GLY 11 1HA GLY 11 -13.000 -8.636 1.382 91 H LYS 12 H LYS 12 -10.152 -6.448 1.239 92 HA LYS 12 HA LYS 12 -8.664 -8.354 2.947 93 1HB LYS 12 2HB LYS 12 -8.379 -8.619 0.250 94 2HB LYS 12 1HB LYS 12 -7.120 -7.433 0.590 95 1HG LYS 12 2HG LYS 12 -6.096 -9.593 0.826 96 2HG LYS 12 1HG LYS 12 -6.333 -8.966 2.457 97 1HD LYS 12 2HD LYS 12 -7.681 -10.687 2.993 98 2HD LYS 12 1HD LYS 12 -8.694 -10.393 1.586 99 1HE LYS 12 2HE LYS 12 -6.421 -11.500 0.466 100 2HE LYS 12 1HE LYS 12 -6.580 -12.391 1.978 101 1HZ LYS 12 1HZ LYS 12 -8.053 -13.613 0.858 102 2HZ LYS 12 2HZ LYS 12 -8.230 -12.466 -0.384 103 3HZ LYS 12 3HZ LYS 12 -9.122 -12.311 1.056 104 H LYS 13 H LYS 13 -8.344 -6.859 4.560 105 HA LYS 13 HA LYS 13 -7.228 -4.195 3.831 106 1HB LYS 13 2HB LYS 13 -8.835 -5.261 6.093 107 2HB LYS 13 1HB LYS 13 -7.627 -4.045 6.513 108 1HG LYS 13 2HG LYS 13 -9.266 -2.574 5.921 109 2HG LYS 13 1HG LYS 13 -8.712 -2.918 4.283 110 1HD LYS 13 2HD LYS 13 -10.691 -4.821 5.423 111 2HD LYS 13 1HD LYS 13 -11.290 -3.205 5.046 112 1HE LYS 13 2HE LYS 13 -9.866 -3.680 2.800 113 2HE LYS 13 1HE LYS 13 -10.307 -5.334 3.217 114 1HZ LYS 13 1HZ LYS 13 -12.011 -4.464 1.848 115 2HZ LYS 13 2HZ LYS 13 -12.133 -3.041 2.769 116 3HZ LYS 13 3HZ LYS 13 -12.639 -4.527 3.423 117 H VAL 14 H VAL 14 -5.037 -4.529 3.544 118 HA VAL 14 HA VAL 14 -3.555 -5.763 5.837 119 HB VAL 14 HB VAL 14 -2.697 -5.751 2.923 120 1HG1 VAL 14 1HG1 VAL 14 -1.392 -7.780 4.301 121 2HG1 VAL 14 2HG1 VAL 14 -1.422 -6.458 5.467 122 3HG1 VAL 14 3HG1 VAL 14 -0.696 -6.216 3.880 123 1HG2 VAL 14 1HG2 VAL 14 -3.323 -8.106 2.886 124 2HG2 VAL 14 2HG2 VAL 14 -4.729 -7.163 3.373 125 3HG2 VAL 14 3HG2 VAL 14 -3.798 -8.046 4.582 126 H ARG 15 H ARG 15 -1.809 -4.603 6.638 127 HA ARG 15 HA ARG 15 -1.450 -1.855 5.544 128 1HB ARG 15 2HB ARG 15 -0.488 -1.303 7.741 129 2HB ARG 15 1HB ARG 15 -2.089 -2.014 7.927 130 1HG ARG 15 2HG ARG 15 -1.254 -3.681 9.185 131 2HG ARG 15 1HG ARG 15 -0.103 -4.111 7.920 132 1HD ARG 15 2HD ARG 15 0.906 -1.734 9.010 133 2HD ARG 15 1HD ARG 15 0.347 -2.662 10.402 134 HE ARG 15 HE ARG 15 1.786 -4.556 9.486 135 1HH1 ARG 15 1HH2 ARG 15 3.394 -2.260 10.664 136 2HH1 ARG 15 2HH2 ARG 15 4.603 -2.034 9.445 137 1HH2 ARG 15 2HH1 ARG 15 2.883 -3.855 7.035 138 2HH2 ARG 15 1HH1 ARG 15 4.312 -2.939 7.381 139 H VAL 16 H VAL 16 0.663 -1.064 5.100 140 HA VAL 16 HA VAL 16 2.955 -2.900 5.356 141 HB VAL 16 HB VAL 16 1.786 -3.527 3.223 142 1HG1 VAL 16 1HG1 VAL 16 2.714 -0.835 2.197 143 2HG1 VAL 16 2HG1 VAL 16 1.066 -1.113 2.760 144 3HG1 VAL 16 3HG1 VAL 16 1.690 -2.015 1.380 145 1HG2 VAL 16 1HG2 VAL 16 3.792 -3.782 2.017 146 2HG2 VAL 16 2HG2 VAL 16 4.355 -3.588 3.677 147 3HG2 VAL 16 3HG2 VAL 16 4.425 -2.227 2.557 148 H LYS 17 H LYS 17 4.911 -1.779 5.433 149 HA LYS 17 HA LYS 17 4.676 1.188 5.387 150 1HB LYS 17 2HB LYS 17 6.663 1.232 6.769 151 2HB LYS 17 1HB LYS 17 5.536 0.067 7.456 152 1HG LYS 17 2HG LYS 17 6.771 -1.788 6.538 153 2HG LYS 17 1HG LYS 17 7.793 -0.709 5.587 154 1HD LYS 17 2HD LYS 17 8.907 0.117 7.511 155 2HD LYS 17 1HD LYS 17 7.668 -0.509 8.598 156 1HE LYS 17 2HE LYS 17 8.762 -2.670 7.031 157 2HE LYS 17 1HE LYS 17 10.066 -1.789 7.822 158 1HZ LYS 17 1HZ LYS 17 9.372 -3.375 9.366 159 2HZ LYS 17 2HZ LYS 17 7.724 -3.101 9.063 160 3HZ LYS 17 3HZ LYS 17 8.642 -1.935 9.892 161 H CYS 18 H CYS 18 6.273 2.469 4.314 162 HA CYS 18 HA CYS 18 8.294 1.265 2.588 163 1HB CYS 18 2HB CYS 18 7.288 2.065 0.455 164 2HB CYS 18 1HB CYS 18 6.293 0.830 1.223 165 HG CYS 18 HG CYS 18 5.502 3.767 0.831 166 H LEU 19 H LEU 19 8.286 3.577 0.733 167 HA LEU 19 HA LEU 19 8.762 5.853 2.601 168 1HB LEU 19 2HB LEU 19 10.690 4.610 0.648 169 2HB LEU 19 1HB LEU 19 10.808 6.324 1.040 170 HG LEU 19 HG LEU 19 10.469 4.816 3.471 171 1HD1 LEU 19 1HD1 LEU 19 12.946 3.840 3.107 172 2HD1 LEU 19 2HD1 LEU 19 12.362 3.717 1.446 173 3HD1 LEU 19 3HD1 LEU 19 11.507 2.891 2.752 174 1HD2 LEU 19 1HD2 LEU 19 12.849 6.348 2.372 175 2HD2 LEU 19 2HD2 LEU 19 12.541 5.975 4.068 176 3HD2 LEU 19 3HD2 LEU 19 11.476 7.084 3.202 177 H ALA 20 H ALA 20 8.512 7.932 1.598 178 HA ALA 20 HA ALA 20 6.548 8.104 -0.468 179 1HB ALA 20 1HB ALA 20 6.566 10.323 0.019 180 2HB ALA 20 2HB ALA 20 8.306 10.451 -0.242 181 3HB ALA 20 3HB ALA 20 7.686 9.888 1.309 182 H GLU 21 H GLU 21 10.071 8.101 -0.565 183 HA GLU 21 HA GLU 21 10.207 8.799 -3.408 184 1HB GLU 21 2HB GLU 21 12.628 8.295 -3.154 185 2HB GLU 21 1HB GLU 21 12.059 9.425 -1.929 186 1HG GLU 21 2HG GLU 21 11.719 6.701 -1.002 187 2HG GLU 21 1HG GLU 21 13.390 6.972 -1.494 188 H ASP 22 H ASP 22 9.744 5.916 -1.553 189 HA ASP 22 HA ASP 22 10.883 3.952 -3.270 190 1HB ASP 22 2HB ASP 22 9.972 3.541 -0.958 191 2HB ASP 22 1HB ASP 22 8.347 3.687 -1.623 192 H SER 23 H SER 23 9.988 2.798 -5.042 193 HA SER 23 HA SER 23 7.917 4.279 -6.524 194 1HB SER 23 2HB SER 23 10.166 3.196 -7.430 195 2HB SER 23 1HB SER 23 9.149 1.767 -7.578 196 HG SER 23 HG SER 23 8.740 2.765 -9.431 197 H VAL 24 H VAL 24 6.109 3.111 -7.561 198 HA VAL 24 HA VAL 24 4.574 1.580 -5.696 199 HB VAL 24 HB VAL 24 4.254 1.848 -8.702 200 1HG1 VAL 24 1HG1 VAL 24 2.842 0.239 -6.764 201 2HG1 VAL 24 2HG1 VAL 24 2.581 0.356 -8.504 202 3HG1 VAL 24 3HG1 VAL 24 1.765 1.475 -7.413 203 1HG2 VAL 24 1HG2 VAL 24 3.181 3.413 -6.342 204 2HG2 VAL 24 2HG2 VAL 24 2.462 3.506 -7.950 205 3HG2 VAL 24 3HG2 VAL 24 4.129 4.021 -7.699 206 H GLY 25 H GLY 25 6.756 0.626 -8.319 207 1HA GLY 25 2HA GLY 25 6.034 -2.128 -8.511 208 2HA GLY 25 1HA GLY 25 7.630 -1.476 -8.895 209 H ASP 26 H ASP 26 8.559 -0.540 -6.528 210 HA ASP 26 HA ASP 26 9.314 -2.920 -5.094 211 1HB ASP 26 2HB ASP 26 10.244 -0.304 -5.234 212 2HB ASP 26 1HB ASP 26 9.608 -0.416 -3.594 213 H PHE 27 H PHE 27 6.863 -0.428 -4.579 214 HA PHE 27 HA PHE 27 6.107 -1.108 -1.907 215 1HB PHE 27 2HB PHE 27 5.399 0.967 -3.103 216 2HB PHE 27 1HB PHE 27 4.365 -0.013 -4.141 217 HD1 PHE 27 HD1 PHE 27 4.863 1.292 -0.730 218 HD2 PHE 27 HD2 PHE 27 2.330 -1.050 -3.286 219 HE1 PHE 27 HE1 PHE 27 3.068 1.372 0.971 220 HE2 PHE 27 HE2 PHE 27 0.533 -0.967 -1.584 221 HZ PHE 27 HZ PHE 27 0.901 0.244 0.546 222 H LYS 28 H LYS 28 4.902 -2.250 -5.073 223 HA LYS 28 HA LYS 28 2.907 -4.026 -4.003 224 1HB LYS 28 2HB LYS 28 4.342 -3.875 -6.660 225 2HB LYS 28 1HB LYS 28 3.147 -5.127 -6.316 226 1HG LYS 28 2HG LYS 28 1.657 -3.102 -5.548 227 2HG LYS 28 1HG LYS 28 2.760 -2.156 -6.548 228 1HD LYS 28 2HD LYS 28 1.909 -4.586 -7.909 229 2HD LYS 28 1HD LYS 28 0.532 -3.588 -7.443 230 1HE LYS 28 2HE LYS 28 2.731 -1.998 -8.531 231 2HE LYS 28 1HE LYS 28 2.136 -3.195 -9.680 232 1HZ LYS 28 1HZ LYS 28 -0.103 -2.380 -9.335 233 2HZ LYS 28 2HZ LYS 28 0.912 -1.114 -9.836 234 3HZ LYS 28 3HZ LYS 28 0.453 -1.241 -8.206 235 H LYS 29 H LYS 29 6.369 -4.372 -4.593 236 HA LYS 29 HA LYS 29 6.461 -7.252 -4.399 237 1HB LYS 29 2HB LYS 29 8.526 -5.072 -4.048 238 2HB LYS 29 1HB LYS 29 8.921 -6.773 -3.798 239 1HG LYS 29 2HG LYS 29 8.093 -7.276 -6.091 240 2HG LYS 29 1HG LYS 29 7.800 -5.554 -6.339 241 1HD LYS 29 2HD LYS 29 10.403 -5.577 -5.425 242 2HD LYS 29 1HD LYS 29 10.333 -7.047 -6.399 243 1HE LYS 29 2HE LYS 29 10.100 -5.895 -8.350 244 2HE LYS 29 1HE LYS 29 9.030 -4.696 -7.625 245 1HZ LYS 29 1HZ LYS 29 10.845 -3.406 -7.903 246 2HZ LYS 29 2HZ LYS 29 11.935 -4.708 -7.849 247 3HZ LYS 29 3HZ LYS 29 11.292 -4.074 -6.410 248 H VAL 30 H VAL 30 6.880 -4.623 -2.020 249 HA VAL 30 HA VAL 30 7.451 -6.382 0.207 250 HB VAL 30 HB VAL 30 6.345 -3.551 0.228 251 1HG1 VAL 30 1HG1 VAL 30 6.065 -4.742 2.373 252 2HG1 VAL 30 2HG1 VAL 30 7.288 -3.481 2.511 253 3HG1 VAL 30 3HG1 VAL 30 7.776 -5.169 2.361 254 1HG2 VAL 30 1HG2 VAL 30 9.190 -4.610 0.327 255 2HG2 VAL 30 2HG2 VAL 30 8.738 -2.930 0.616 256 3HG2 VAL 30 3HG2 VAL 30 8.476 -3.654 -0.969 257 H LEU 31 H LEU 31 4.482 -4.824 -1.012 258 HA LEU 31 HA LEU 31 2.756 -5.791 1.083 259 1HB LEU 31 2HB LEU 31 2.203 -3.896 -0.466 260 2HB LEU 31 1HB LEU 31 2.020 -5.066 -1.772 261 HG LEU 31 HG LEU 31 0.294 -6.248 -0.344 262 1HD1 LEU 31 1HD1 LEU 31 0.886 -5.387 1.843 263 2HD1 LEU 31 2HD1 LEU 31 -0.734 -4.808 1.455 264 3HD1 LEU 31 3HD1 LEU 31 0.648 -3.726 1.303 265 1HD2 LEU 31 1HD2 LEU 31 -0.477 -4.855 -2.144 266 2HD2 LEU 31 2HD2 LEU 31 -0.138 -3.384 -1.234 267 3HD2 LEU 31 3HD2 LEU 31 -1.458 -4.444 -0.738 268 H SER 32 H SER 32 3.659 -7.068 -2.111 269 HA SER 32 HA SER 32 1.876 -9.238 -2.332 270 1HB SER 32 2HB SER 32 3.383 -8.614 -4.146 271 2HB SER 32 1HB SER 32 4.785 -9.052 -3.176 272 HG SER 32 HG SER 32 4.505 -10.950 -4.031 273 H LEU 33 H LEU 33 4.738 -8.922 -0.281 274 HA LEU 33 HA LEU 33 5.061 -11.715 0.320 275 1HB LEU 33 2HB LEU 33 5.896 -9.162 1.688 276 2HB LEU 33 1HB LEU 33 6.168 -10.723 2.461 277 HG LEU 33 HG LEU 33 6.989 -10.429 -0.398 278 1HD1 LEU 33 1HD1 LEU 33 9.122 -9.424 0.228 279 2HD1 LEU 33 2HD1 LEU 33 8.636 -9.379 1.923 280 3HD1 LEU 33 3HD1 LEU 33 7.811 -8.361 0.743 281 1HD2 LEU 33 1HD2 LEU 33 7.506 -12.151 1.923 282 2HD2 LEU 33 2HD2 LEU 33 8.981 -11.670 1.086 283 3HD2 LEU 33 3HD2 LEU 33 7.699 -12.498 0.205 284 H GLN 34 H GLN 34 3.062 -9.157 1.766 285 HA GLN 34 HA GLN 34 2.164 -10.886 3.956 286 1HB GLN 34 2HB GLN 34 1.368 -8.122 3.024 287 2HB GLN 34 1HB GLN 34 0.564 -8.940 4.364 288 1HG GLN 34 2HG GLN 34 2.629 -9.087 5.609 289 2HG GLN 34 1HG GLN 34 3.559 -8.504 4.228 290 1HE2 GLN 34 1HE2 GLN 34 3.055 -6.198 3.505 291 2HE2 GLN 34 2HE2 GLN 34 2.554 -5.081 4.682 292 H ILE 35 H ILE 35 0.578 -9.442 1.067 293 HA ILE 35 HA ILE 35 -1.860 -10.982 1.507 294 HB ILE 35 HB ILE 35 -2.502 -10.130 -0.777 295 1HG1 ILE 35 2HG1 ILE 35 0.144 -8.661 -0.574 296 2HG1 ILE 35 1HG1 ILE 35 -0.178 -9.993 -1.680 297 1HG2 ILE 35 1HG2 ILE 35 -1.496 -7.788 0.778 298 2HG2 ILE 35 2HG2 ILE 35 -2.627 -8.889 1.564 299 3HG2 ILE 35 3HG2 ILE 35 -3.088 -8.070 0.072 300 1HD1 ILE 35 1HD1 ILE 35 -0.983 -7.173 -1.859 301 2HD1 ILE 35 2HD1 ILE 35 -2.305 -8.302 -2.158 302 3HD1 ILE 35 3HD1 ILE 35 -0.838 -8.384 -3.132 303 H GLY 36 H GLY 36 1.093 -11.505 -0.326 304 1HA GLY 36 2HA GLY 36 1.821 -13.415 -1.498 305 2HA GLY 36 1HA GLY 36 0.453 -14.285 -0.791 306 H THR 37 H THR 37 0.624 -11.435 -2.920 307 HA THR 37 HA THR 37 -1.223 -12.834 -4.815 308 HB THR 37 HB THR 37 -0.966 -9.838 -4.499 309 HG1 THR 37 HG1 THR 37 -2.805 -10.044 -3.121 310 1HG2 THR 37 1HG2 THR 37 -2.811 -9.709 -5.829 311 2HG2 THR 37 2HG2 THR 37 -3.511 -11.193 -5.182 312 3HG2 THR 37 3HG2 THR 37 -2.238 -11.276 -6.399 313 H GLN 38 H GLN 38 1.957 -11.973 -4.546 314 HA GLN 38 HA GLN 38 3.680 -11.733 -6.103 315 1HB GLN 38 2HB GLN 38 1.435 -12.792 -7.724 316 2HB GLN 38 1HB GLN 38 2.686 -11.945 -8.633 317 1HG GLN 38 2HG GLN 38 4.316 -13.489 -8.099 318 2HG GLN 38 1HG GLN 38 3.563 -13.907 -6.558 319 1HE2 GLN 38 1HE2 GLN 38 1.435 -15.181 -6.746 320 2HE2 GLN 38 2HE2 GLN 38 1.281 -16.274 -8.036 321 HA PRO 39 HA PRO 39 3.431 -7.493 -7.222 322 1HB PRO 39 2HB PRO 39 5.608 -7.346 -8.901 323 2HB PRO 39 1HB PRO 39 5.724 -7.429 -7.135 324 1HG PRO 39 2HG PRO 39 6.240 -9.569 -9.157 325 2HG PRO 39 1HG PRO 39 6.950 -9.350 -7.549 326 1HD PRO 39 2HD PRO 39 4.916 -11.184 -8.186 327 2HD PRO 39 1HD PRO 39 5.340 -10.646 -6.547 328 H ASN 40 H ASN 40 2.967 -9.983 -9.535 329 HA ASN 40 HA ASN 40 2.400 -8.080 -11.743 330 1HB ASN 40 2HB ASN 40 2.874 -11.027 -11.539 331 2HB ASN 40 1HB ASN 40 1.881 -10.436 -12.873 332 1HD2 ASN 40 1HD2 ASN 40 5.135 -10.253 -11.431 333 2HD2 ASN 40 2HD2 ASN 40 5.885 -9.591 -12.804 334 H LYS 41 H LYS 41 0.729 -9.703 -9.214 335 HA LYS 41 HA LYS 41 -1.849 -9.406 -10.703 336 1HB LYS 41 2HB LYS 41 -0.822 -11.648 -9.388 337 2HB LYS 41 1HB LYS 41 -2.020 -10.997 -8.271 338 1HG LYS 41 2HG LYS 41 -2.987 -10.933 -11.017 339 2HG LYS 41 1HG LYS 41 -2.542 -12.567 -10.525 340 1HD LYS 41 2HD LYS 41 -3.976 -12.435 -8.571 341 2HD LYS 41 1HD LYS 41 -4.322 -10.735 -8.894 342 1HE LYS 41 2HE LYS 41 -5.799 -11.214 -10.576 343 2HE LYS 41 1HE LYS 41 -4.883 -12.618 -11.122 344 1HZ LYS 41 1HZ LYS 41 -6.589 -13.707 -10.169 345 2HZ LYS 41 2HZ LYS 41 -6.982 -12.432 -9.116 346 3HZ LYS 41 3HZ LYS 41 -5.695 -13.476 -8.747 347 H ILE 42 H ILE 42 -0.181 -7.482 -8.844 348 HA ILE 42 HA ILE 42 -2.398 -6.887 -6.923 349 HB ILE 42 HB ILE 42 0.537 -6.114 -6.842 350 1HG1 ILE 42 2HG1 ILE 42 -1.096 -7.705 -4.848 351 2HG1 ILE 42 1HG1 ILE 42 -0.206 -8.471 -6.164 352 1HG2 ILE 42 1HG2 ILE 42 -1.861 -5.061 -5.431 353 2HG2 ILE 42 2HG2 ILE 42 -0.326 -4.268 -5.782 354 3HG2 ILE 42 3HG2 ILE 42 -0.449 -5.386 -4.425 355 1HD1 ILE 42 1HD1 ILE 42 0.835 -7.826 -3.671 356 2HD1 ILE 42 2HD1 ILE 42 1.416 -6.521 -4.703 357 3HD1 ILE 42 3HD1 ILE 42 1.779 -8.196 -5.112 358 H VAL 43 H VAL 43 -3.489 -4.992 -7.139 359 HA VAL 43 HA VAL 43 -2.406 -2.922 -9.011 360 HB VAL 43 HB VAL 43 -5.306 -3.792 -8.746 361 1HG1 VAL 43 1HG1 VAL 43 -4.934 -1.363 -9.247 362 2HG1 VAL 43 2HG1 VAL 43 -5.730 -2.227 -10.562 363 3HG1 VAL 43 3HG1 VAL 43 -4.014 -1.838 -10.674 364 1HG2 VAL 43 1HG2 VAL 43 -4.145 -5.484 -9.979 365 2HG2 VAL 43 2HG2 VAL 43 -3.195 -4.287 -10.859 366 3HG2 VAL 43 3HG2 VAL 43 -4.919 -4.458 -11.185 367 H LEU 44 H LEU 44 -2.052 -1.097 -7.839 368 HA LEU 44 HA LEU 44 -3.601 -0.672 -5.334 369 1HB LEU 44 2HB LEU 44 -1.031 0.500 -6.408 370 2HB LEU 44 1HB LEU 44 -1.852 1.168 -4.998 371 HG LEU 44 HG LEU 44 -1.443 -1.776 -5.008 372 1HD1 LEU 44 1HD1 LEU 44 0.706 -0.805 -5.906 373 2HD1 LEU 44 2HD1 LEU 44 0.879 -1.631 -4.357 374 3HD1 LEU 44 3HD1 LEU 44 0.836 0.131 -4.417 375 1HD2 LEU 44 1HD2 LEU 44 -2.443 -0.145 -3.188 376 2HD2 LEU 44 2HD2 LEU 44 -0.747 0.150 -2.807 377 3HD2 LEU 44 3HD2 LEU 44 -1.407 -1.481 -2.692 378 H GLN 45 H GLN 45 -4.765 1.250 -4.960 379 HA GLN 45 HA GLN 45 -5.141 3.025 -7.336 380 1HB GLN 45 2HB GLN 45 -7.360 2.300 -5.415 381 2HB GLN 45 1HB GLN 45 -7.500 3.108 -6.973 382 1HG GLN 45 2HG GLN 45 -6.222 0.425 -7.007 383 2HG GLN 45 1HG GLN 45 -7.947 0.460 -6.651 384 1HE2 GLN 45 1HE2 GLN 45 -9.342 1.682 -8.282 385 2HE2 GLN 45 2HE2 GLN 45 -8.845 1.700 -9.905 386 H LYS 46 H LYS 46 -5.255 5.220 -6.892 387 HA LYS 46 HA LYS 46 -5.156 6.028 -4.014 388 1HB LYS 46 2HB LYS 46 -2.891 6.103 -5.091 389 2HB LYS 46 1HB LYS 46 -3.527 7.267 -6.254 390 1HG LYS 46 2HG LYS 46 -3.157 8.931 -4.788 391 2HG LYS 46 1HG LYS 46 -4.262 8.166 -3.646 392 1HD LYS 46 2HD LYS 46 -2.161 6.589 -3.216 393 2HD LYS 46 1HD LYS 46 -1.280 8.001 -3.799 394 1HE LYS 46 2HE LYS 46 -1.663 9.142 -1.887 395 2HE LYS 46 1HE LYS 46 -3.376 8.725 -1.899 396 1HZ LYS 46 1HZ LYS 46 -2.967 6.716 -0.812 397 2HZ LYS 46 2HZ LYS 46 -1.977 7.833 -0.001 398 3HZ LYS 46 3HZ LYS 46 -1.301 6.762 -1.133 399 H GLY 47 H GLY 47 -7.337 6.698 -4.032 400 1HA GLY 47 2HA GLY 47 -9.079 8.244 -4.314 401 2HA GLY 47 1HA GLY 47 -7.870 9.361 -4.945 402 H GLY 48 H GLY 48 -9.122 6.215 -6.120 403 1HA GLY 48 2HA GLY 48 -10.103 5.639 -8.172 404 2HA GLY 48 1HA GLY 48 -10.532 7.339 -8.364 405 H SER 49 H SER 49 -7.343 5.743 -8.098 406 HA SER 49 HA SER 49 -6.711 6.445 -10.901 407 1HB SER 49 2HB SER 49 -6.070 8.282 -8.989 408 2HB SER 49 1HB SER 49 -4.621 7.281 -8.972 409 HG SER 49 HG SER 49 -5.260 9.139 -10.703 410 H VAL 50 H VAL 50 -5.435 4.849 -11.772 411 HA VAL 50 HA VAL 50 -4.630 2.623 -10.055 412 HB VAL 50 HB VAL 50 -5.549 2.278 -12.348 413 1HG1 VAL 50 1HG1 VAL 50 -3.787 4.287 -13.078 414 2HG1 VAL 50 2HG1 VAL 50 -4.645 3.227 -14.195 415 3HG1 VAL 50 3HG1 VAL 50 -3.000 2.834 -13.694 416 1HG2 VAL 50 1HG2 VAL 50 -4.479 0.319 -11.971 417 2HG2 VAL 50 2HG2 VAL 50 -3.084 1.128 -11.259 418 3HG2 VAL 50 3HG2 VAL 50 -3.198 0.947 -13.008 419 H LEU 51 H LEU 51 -2.658 2.286 -9.187 420 HA LEU 51 HA LEU 51 -0.489 4.208 -9.819 421 1HB LEU 51 2HB LEU 51 -0.390 2.039 -7.712 422 2HB LEU 51 1HB LEU 51 0.537 3.536 -7.780 423 HG LEU 51 HG LEU 51 -2.446 3.283 -7.282 424 1HD1 LEU 51 1HD1 LEU 51 -0.059 3.987 -5.579 425 2HD1 LEU 51 2HD1 LEU 51 -1.328 2.806 -5.259 426 3HD1 LEU 51 3HD1 LEU 51 -1.679 4.529 -5.147 427 1HD2 LEU 51 1HD2 LEU 51 -2.665 5.574 -7.476 428 2HD2 LEU 51 2HD2 LEU 51 -1.386 5.325 -8.663 429 3HD2 LEU 51 3HD2 LEU 51 -0.985 5.877 -7.038 430 H LYS 52 H LYS 52 1.419 3.574 -10.816 431 HA LYS 52 HA LYS 52 1.585 0.707 -11.665 432 1HB LYS 52 2HB LYS 52 1.574 3.174 -13.208 433 2HB LYS 52 1HB LYS 52 3.022 2.217 -13.527 434 1HG LYS 52 2HG LYS 52 1.673 0.262 -14.049 435 2HG LYS 52 1HG LYS 52 0.197 1.116 -13.598 436 1HD LYS 52 2HD LYS 52 1.358 2.827 -15.440 437 2HD LYS 52 1HD LYS 52 1.723 1.232 -16.096 438 1HE LYS 52 2HE LYS 52 -0.724 0.648 -15.744 439 2HE LYS 52 1HE LYS 52 -0.998 2.351 -15.387 440 1HZ LYS 52 1HZ LYS 52 -0.484 2.977 -17.528 441 2HZ LYS 52 2HZ LYS 52 -1.282 1.499 -17.790 442 3HZ LYS 52 3HZ LYS 52 0.415 1.577 -17.852 443 H ASP 53 H ASP 53 3.674 -0.215 -11.781 444 HA ASP 53 HA ASP 53 5.539 0.599 -9.796 445 1HB ASP 53 2HB ASP 53 7.048 -1.095 -10.774 446 2HB ASP 53 1HB ASP 53 5.410 -1.722 -10.607 447 H HIS 54 H HIS 54 5.324 1.392 -13.223 448 HA HIS 54 HA HIS 54 7.973 2.426 -13.566 449 1HB HIS 54 2HB HIS 54 5.382 3.151 -14.963 450 2HB HIS 54 1HB HIS 54 6.985 3.644 -15.510 451 HD1 HIS 54 HD1 HIS 54 8.700 1.540 -15.936 452 HD2 HIS 54 HD2 HIS 54 4.627 0.652 -15.894 453 HE1 HIS 54 HE1 HIS 54 8.452 -0.732 -17.026 454 H ILE 55 H ILE 55 5.188 3.751 -11.932 455 HA ILE 55 HA ILE 55 6.475 6.443 -11.860 456 HB ILE 55 HB ILE 55 3.653 5.570 -11.161 457 1HG1 ILE 55 2HG1 ILE 55 3.425 7.424 -13.122 458 2HG1 ILE 55 1HG1 ILE 55 4.993 6.741 -13.551 459 1HG2 ILE 55 1HG2 ILE 55 4.143 7.392 -9.713 460 2HG2 ILE 55 2HG2 ILE 55 3.328 8.126 -11.094 461 3HG2 ILE 55 3HG2 ILE 55 5.084 8.225 -10.950 462 1HD1 ILE 55 1HD1 ILE 55 2.317 5.552 -13.767 463 2HD1 ILE 55 2HD1 ILE 55 3.494 4.486 -13.003 464 3HD1 ILE 55 3HD1 ILE 55 3.805 5.131 -14.614 465 H SER 56 H SER 56 7.071 7.358 -9.892 466 HA SER 56 HA SER 56 7.508 5.495 -7.688 467 1HB SER 56 2HB SER 56 8.926 7.617 -8.583 468 2HB SER 56 1HB SER 56 8.020 8.391 -7.285 469 HG SER 56 HG SER 56 9.590 7.546 -6.134 470 H LEU 57 H LEU 57 6.791 5.903 -5.479 471 HA LEU 57 HA LEU 57 4.000 6.442 -5.234 472 1HB LEU 57 2HB LEU 57 6.229 6.304 -3.191 473 2HB LEU 57 1HB LEU 57 4.545 6.559 -2.735 474 HG LEU 57 HG LEU 57 5.336 4.259 -4.521 475 1HD1 LEU 57 1HD1 LEU 57 6.686 3.812 -2.637 476 2HD1 LEU 57 2HD1 LEU 57 5.197 2.926 -2.300 477 3HD1 LEU 57 3HD1 LEU 57 5.499 4.479 -1.517 478 1HD2 LEU 57 1HD2 LEU 57 2.908 5.138 -4.057 479 2HD2 LEU 57 2HD2 LEU 57 3.112 4.351 -2.492 480 3HD2 LEU 57 3HD2 LEU 57 3.219 3.405 -3.977 481 H GLU 58 H GLU 58 6.838 8.527 -4.785 482 HA GLU 58 HA GLU 58 5.592 10.734 -3.517 483 1HB GLU 58 2HB GLU 58 8.092 10.360 -4.041 484 2HB GLU 58 1HB GLU 58 7.732 11.039 -5.628 485 1HG GLU 58 2HG GLU 58 8.444 12.885 -4.293 486 2HG GLU 58 1HG GLU 58 6.688 13.021 -4.388 487 H ASP 59 H ASP 59 5.673 9.805 -6.945 488 HA ASP 59 HA ASP 59 4.567 12.227 -8.013 489 1HB ASP 59 2HB ASP 59 4.361 9.369 -9.015 490 2HB ASP 59 1HB ASP 59 3.897 10.791 -9.949 491 H TYR 60 H TYR 60 3.039 9.195 -6.911 492 HA TYR 60 HA TYR 60 0.330 10.145 -7.375 493 1HB TYR 60 2HB TYR 60 1.426 7.820 -5.766 494 2HB TYR 60 1HB TYR 60 -0.295 8.120 -6.010 495 HD1 TYR 60 HD1 TYR 60 2.422 6.303 -7.223 496 HD2 TYR 60 HD2 TYR 60 -0.889 8.665 -8.611 497 HE1 TYR 60 HE1 TYR 60 2.530 5.166 -9.424 498 HE2 TYR 60 HE2 TYR 60 -0.778 7.529 -10.811 499 HH TYR 60 HH TYR 60 1.157 6.298 -12.149 500 H GLU 61 H GLU 61 2.655 10.643 -4.888 501 HA GLU 61 HA GLU 61 2.552 12.024 -3.007 502 1HB GLU 61 2HB GLU 61 0.353 12.882 -4.420 503 2HB GLU 61 1HB GLU 61 -0.377 12.343 -2.909 504 1HG GLU 61 2HG GLU 61 0.225 14.656 -2.615 505 2HG GLU 61 1HG GLU 61 1.381 13.699 -1.689 506 H VAL 62 H VAL 62 3.017 9.695 -2.281 507 HA VAL 62 HA VAL 62 0.847 8.702 -0.476 508 HB VAL 62 HB VAL 62 3.313 7.259 -1.513 509 1HG1 VAL 62 1HG1 VAL 62 0.922 6.043 -0.125 510 2HG1 VAL 62 2HG1 VAL 62 2.317 6.619 0.785 511 3HG1 VAL 62 3HG1 VAL 62 2.511 5.328 -0.400 512 1HG2 VAL 62 1HG2 VAL 62 1.969 7.249 -3.387 513 2HG2 VAL 62 2HG2 VAL 62 0.490 7.482 -2.456 514 3HG2 VAL 62 3HG2 VAL 62 1.238 5.888 -2.536 515 H HIS 63 H HIS 63 1.135 9.394 1.587 516 HA HIS 63 HA HIS 63 3.940 9.664 2.604 517 1HB HIS 63 2HB HIS 63 1.486 11.352 3.138 518 2HB HIS 63 1HB HIS 63 2.915 11.410 4.171 519 HD1 HIS 63 HD1 HIS 63 1.701 12.309 0.737 520 HD2 HIS 63 HD2 HIS 63 5.214 12.595 2.964 521 HE1 HIS 63 HE1 HIS 63 3.251 13.835 -0.562 522 H ASP 64 H ASP 64 3.590 9.881 5.253 523 HA ASP 64 HA ASP 64 2.931 7.207 6.086 524 1HB ASP 64 2HB ASP 64 3.402 8.002 8.354 525 2HB ASP 64 1HB ASP 64 4.620 8.617 7.239 526 H GLN 65 H GLN 65 1.184 6.445 7.292 527 HA GLN 65 HA GLN 65 -1.048 6.263 7.942 528 1HB GLN 65 2HB GLN 65 -0.768 9.245 8.435 529 2HB GLN 65 1HB GLN 65 -2.022 8.198 9.098 530 1HG GLN 65 2HG GLN 65 0.946 7.805 9.583 531 2HG GLN 65 1HG GLN 65 -0.136 8.637 10.700 532 1HE2 GLN 65 1HE2 GLN 65 0.954 5.508 9.636 533 2HE2 GLN 65 2HE2 GLN 65 -0.085 4.586 10.611 534 H THR 66 H THR 66 -0.570 6.609 5.136 535 HA THR 66 HA THR 66 -2.828 8.351 4.264 536 HB THR 66 HB THR 66 -0.516 8.497 3.164 537 HG1 THR 66 HG1 THR 66 -1.785 9.372 1.764 538 1HG2 THR 66 1HG2 THR 66 -1.451 5.866 1.985 539 2HG2 THR 66 2HG2 THR 66 -0.057 6.090 3.040 540 3HG2 THR 66 3HG2 THR 66 -0.063 6.797 1.424 541 H ASN 67 H ASN 67 -4.394 7.432 2.709 542 HA ASN 67 HA ASN 67 -4.925 4.564 3.317 543 1HB ASN 67 2HB ASN 67 -6.629 6.538 3.661 544 2HB ASN 67 1HB ASN 67 -6.889 6.360 1.925 545 1HD2 ASN 67 1HD2 ASN 67 -7.150 4.648 5.045 546 2HD2 ASN 67 2HD2 ASN 67 -8.179 3.425 4.475 547 H LEU 68 H LEU 68 -4.788 3.042 1.750 548 HA LEU 68 HA LEU 68 -4.638 3.932 -1.105 549 1HB LEU 68 2HB LEU 68 -2.745 2.288 0.495 550 2HB LEU 68 1HB LEU 68 -3.092 1.707 -1.133 551 HG LEU 68 HG LEU 68 -2.572 4.618 -0.892 552 1HD1 LEU 68 1HD1 LEU 68 -0.014 3.790 -1.110 553 2HD1 LEU 68 2HD1 LEU 68 -0.630 2.530 -0.041 554 3HD1 LEU 68 3HD1 LEU 68 -0.743 4.224 0.436 555 1HD2 LEU 68 1HD2 LEU 68 -2.521 4.192 -3.113 556 2HD2 LEU 68 2HD2 LEU 68 -2.415 2.451 -2.845 557 3HD2 LEU 68 3HD2 LEU 68 -0.952 3.436 -2.838 558 H GLU 69 H GLU 69 -5.516 2.421 -2.627 559 HA GLU 69 HA GLU 69 -7.385 0.447 -1.396 560 1HB GLU 69 2HB GLU 69 -7.752 2.390 -3.388 561 2HB GLU 69 1HB GLU 69 -7.722 0.854 -4.254 562 1HG GLU 69 2HG GLU 69 -9.270 0.654 -1.795 563 2HG GLU 69 1HG GLU 69 -9.895 1.922 -2.850 564 H LEU 70 H LEU 70 -7.529 -1.693 -2.320 565 HA LEU 70 HA LEU 70 -5.101 -2.507 -3.866 566 1HB LEU 70 2HB LEU 70 -5.142 -3.237 -1.434 567 2HB LEU 70 1HB LEU 70 -6.546 -4.223 -1.833 568 HG LEU 70 HG LEU 70 -5.224 -5.430 -3.532 569 1HD1 LEU 70 1HD1 LEU 70 -3.413 -4.392 -4.383 570 2HD1 LEU 70 2HD1 LEU 70 -2.576 -4.766 -2.876 571 3HD1 LEU 70 3HD1 LEU 70 -3.398 -3.218 -3.067 572 1HD2 LEU 70 1HD2 LEU 70 -3.831 -5.302 -0.838 573 2HD2 LEU 70 2HD2 LEU 70 -3.753 -6.643 -1.982 574 3HD2 LEU 70 3HD2 LEU 70 -5.277 -6.249 -1.187 575 H TYR 71 H TYR 71 -5.390 -4.126 -5.425 576 HA TYR 71 HA TYR 71 -8.107 -5.179 -5.936 577 1HB TYR 71 2HB TYR 71 -6.842 -3.025 -7.478 578 2HB TYR 71 1HB TYR 71 -7.308 -4.398 -8.478 579 HD1 TYR 71 HD1 TYR 71 -8.446 -1.380 -7.116 580 HD2 TYR 71 HD2 TYR 71 -9.722 -5.419 -7.831 581 HE1 TYR 71 HE1 TYR 71 -10.812 -0.649 -7.023 582 HE2 TYR 71 HE2 TYR 71 -12.089 -4.687 -7.735 583 HH TYR 71 HH TYR 71 -13.095 -1.888 -6.434 584 H TYR 72 H TYR 72 -8.045 -7.106 -7.209 585 HA TYR 72 HA TYR 72 -5.293 -8.220 -7.540 586 1HB TYR 72 2HB TYR 72 -7.952 -9.651 -7.255 587 2HB TYR 72 1HB TYR 72 -6.383 -10.438 -7.428 588 HD1 TYR 72 HD1 TYR 72 -4.625 -8.769 -5.771 589 HD2 TYR 72 HD2 TYR 72 -8.652 -10.079 -5.044 590 HE1 TYR 72 HE1 TYR 72 -4.253 -8.556 -3.331 591 HE2 TYR 72 HE2 TYR 72 -8.278 -9.867 -2.602 592 HH TYR 72 HH TYR 72 -5.685 -9.914 -1.129 593 H LEU 73 HN LEU 73 -4.622 -7.967 -9.596 594 HA LEU 73 HA LEU 73 -6.171 -9.161 -11.774 595 1HB LEU 73 2HB LEU 73 -6.767 -6.553 -11.315 596 2HB LEU 73 1HB LEU 73 -5.387 -6.365 -12.398 597 HG LEU 73 HG LEU 73 -6.993 -8.443 -13.477 598 1HD1 LEU 73 1HD1 LEU 73 -9.139 -7.280 -13.803 599 2HD1 LEU 73 2HD1 LEU 73 -8.586 -5.958 -12.775 600 3HD1 LEU 73 3HD1 LEU 73 -8.840 -7.563 -12.089 601 1HD2 LEU 73 1HD2 LEU 73 -7.450 -6.253 -15.063 602 2HD2 LEU 73 2HD2 LEU 73 -5.994 -7.243 -15.136 603 3HD2 LEU 73 3HD2 LEU 73 -5.999 -5.753 -14.194 Start of MODEL 2 1 H MET 1 1H MET 1 10.665 6.567 6.887 2 HA MET 1 HA MET 1 9.475 4.960 4.690 3 1HB MET 1 2HB MET 1 11.196 4.106 6.705 4 2HB MET 1 1HB MET 1 9.593 3.776 7.365 5 1HG MET 1 2HG MET 1 9.175 2.135 5.850 6 2HG MET 1 1HG MET 1 9.895 3.049 4.524 7 1HE MET 1 1HE MET 1 11.312 -0.620 5.178 8 2HE MET 1 2HE MET 1 11.229 0.356 3.716 9 3HE MET 1 3HE MET 1 9.833 0.269 4.787 10 H ILE 2 H ILE 2 7.266 4.837 4.789 11 HA ILE 2 HA ILE 2 5.916 6.096 7.149 12 HB ILE 2 HB ILE 2 4.132 6.825 5.581 13 1HG1 ILE 2 2HG1 ILE 2 6.018 6.091 3.335 14 2HG1 ILE 2 1HG1 ILE 2 4.754 4.985 3.874 15 1HG2 ILE 2 1HG2 ILE 2 6.647 7.879 4.365 16 2HG2 ILE 2 2HG2 ILE 2 6.439 8.078 6.105 17 3HG2 ILE 2 3HG2 ILE 2 5.250 8.753 4.992 18 1HD1 ILE 2 1HD1 ILE 2 4.231 7.850 3.039 19 2HD1 ILE 2 2HD1 ILE 2 3.031 6.601 3.368 20 3HD1 ILE 2 3HD1 ILE 2 4.073 6.470 1.951 21 H GLU 3 H GLU 3 3.691 5.270 7.531 22 HA GLU 3 HA GLU 3 3.485 2.378 6.791 23 1HB GLU 3 2HB GLU 3 3.779 2.715 9.193 24 2HB GLU 3 1HB GLU 3 2.448 3.869 9.223 25 1HG GLU 3 2HG GLU 3 1.714 1.651 10.023 26 2HG GLU 3 1HG GLU 3 0.879 2.095 8.536 27 H VAL 4 H VAL 4 2.068 2.236 5.104 28 HA VAL 4 HA VAL 4 -0.428 3.884 5.237 29 HB VAL 4 HB VAL 4 -0.563 3.650 2.793 30 1HG1 VAL 4 1HG1 VAL 4 0.959 5.312 2.377 31 2HG1 VAL 4 2HG1 VAL 4 2.286 4.431 3.132 32 3HG1 VAL 4 3HG1 VAL 4 1.115 5.291 4.133 33 1HG2 VAL 4 1HG2 VAL 4 0.502 1.412 2.641 34 2HG2 VAL 4 2HG2 VAL 4 2.056 2.138 3.048 35 3HG2 VAL 4 3HG2 VAL 4 1.249 2.567 1.540 36 H VAL 5 H VAL 5 -2.410 2.813 4.471 37 HA VAL 5 HA VAL 5 -2.318 -0.160 4.830 38 HB VAL 5 HB VAL 5 -4.636 0.052 5.789 39 1HG1 VAL 5 1HG1 VAL 5 -2.559 1.650 7.311 40 2HG1 VAL 5 2HG1 VAL 5 -2.532 -0.108 7.176 41 3HG1 VAL 5 3HG1 VAL 5 -3.876 0.693 7.988 42 1HG2 VAL 5 1HG2 VAL 5 -4.318 2.843 6.571 43 2HG2 VAL 5 2HG2 VAL 5 -5.713 2.039 5.850 44 3HG2 VAL 5 3HG2 VAL 5 -4.434 2.676 4.819 45 H VAL 6 H VAL 6 -3.569 -1.385 3.400 46 HA VAL 6 HA VAL 6 -4.900 0.152 1.203 47 HB VAL 6 HB VAL 6 -4.347 -1.781 -0.281 48 1HG1 VAL 6 1HG1 VAL 6 -2.895 0.181 -0.268 49 2HG1 VAL 6 2HG1 VAL 6 -1.915 -1.275 -0.437 50 3HG1 VAL 6 3HG1 VAL 6 -2.009 -0.452 1.120 51 1HG2 VAL 6 1HG2 VAL 6 -2.763 -2.697 2.145 52 2HG2 VAL 6 2HG2 VAL 6 -2.599 -3.379 0.528 53 3HG2 VAL 6 3HG2 VAL 6 -4.121 -3.543 1.402 54 H ASN 7 H ASN 7 -7.027 -0.282 0.881 55 HA ASN 7 HA ASN 7 -8.203 -2.622 2.328 56 1HB ASN 7 2HB ASN 7 -9.220 0.144 1.725 57 2HB ASN 7 1HB ASN 7 -10.368 -1.174 1.957 58 1HD2 ASN 7 1HD2 ASN 7 -7.597 0.459 3.581 59 2HD2 ASN 7 2HD2 ASN 7 -8.107 0.082 5.155 60 H ASP 8 H ASP 8 -8.702 -4.257 0.963 61 HA ASP 8 HA ASP 8 -8.957 -3.841 -1.910 62 1HB ASP 8 2HB ASP 8 -8.105 -5.946 -0.544 63 2HB ASP 8 1HB ASP 8 -9.812 -6.385 -0.569 64 H ARG 9 H ARG 9 -10.842 -3.892 -3.143 65 HA ARG 9 HA ARG 9 -13.284 -3.014 -1.932 66 1HB ARG 9 2HB ARG 9 -12.565 -2.651 -4.343 67 2HB ARG 9 1HB ARG 9 -13.031 -4.322 -4.654 68 1HG ARG 9 2HG ARG 9 -14.942 -3.009 -5.230 69 2HG ARG 9 1HG ARG 9 -15.316 -3.718 -3.660 70 1HD ARG 9 2HD ARG 9 -15.899 -1.326 -3.686 71 2HD ARG 9 1HD ARG 9 -14.589 -1.633 -2.547 72 HE ARG 9 HE ARG 9 -13.820 -0.773 -5.275 73 1HH1 ARG 9 1HH2 ARG 9 -12.591 -0.742 -2.288 74 2HH1 ARG 9 2HH2 ARG 9 -12.363 0.968 -2.140 75 1HH2 ARG 9 2HH1 ARG 9 -14.264 1.734 -4.951 76 2HH2 ARG 9 1HH1 ARG 9 -13.315 2.376 -3.653 77 H LEU 10 H LEU 10 -12.139 -6.235 -2.910 78 HA LEU 10 HA LEU 10 -14.635 -7.618 -2.573 79 1HB LEU 10 2HB LEU 10 -11.756 -8.387 -2.721 80 2HB LEU 10 1HB LEU 10 -12.859 -9.556 -1.998 81 HG LEU 10 HG LEU 10 -14.101 -8.492 -4.351 82 1HD1 LEU 10 1HD1 LEU 10 -12.358 -8.137 -5.734 83 2HD1 LEU 10 2HD1 LEU 10 -12.027 -9.867 -5.647 84 3HD1 LEU 10 3HD1 LEU 10 -11.210 -8.755 -4.544 85 1HD2 LEU 10 1HD2 LEU 10 -14.795 -10.627 -3.873 86 2HD2 LEU 10 2HD2 LEU 10 -13.224 -11.104 -3.227 87 3HD2 LEU 10 3HD2 LEU 10 -13.483 -11.057 -4.972 88 H GLY 11 H GLY 11 -11.873 -7.133 -0.343 89 1HA GLY 11 2HA GLY 11 -12.960 -6.513 2.011 90 2HA GLY 11 1HA GLY 11 -13.495 -8.190 1.905 91 H LYS 12 H LYS 12 -10.483 -6.279 1.524 92 HA LYS 12 HA LYS 12 -9.090 -8.222 3.274 93 1HB LYS 12 2HB LYS 12 -8.826 -8.212 0.415 94 2HB LYS 12 1HB LYS 12 -7.304 -7.664 1.119 95 1HG LYS 12 2HG LYS 12 -6.891 -9.676 2.143 96 2HG LYS 12 1HG LYS 12 -8.601 -10.008 2.416 97 1HD LYS 12 2HD LYS 12 -7.765 -9.931 -0.424 98 2HD LYS 12 1HD LYS 12 -7.109 -11.269 0.519 99 1HE LYS 12 2HE LYS 12 -9.080 -12.313 0.162 100 2HE LYS 12 1HE LYS 12 -9.776 -11.168 1.309 101 1HZ LYS 12 1HZ LYS 12 -10.192 -9.652 -0.555 102 2HZ LYS 12 2HZ LYS 12 -11.003 -11.133 -0.748 103 3HZ LYS 12 3HZ LYS 12 -9.589 -10.813 -1.634 104 H LYS 13 H LYS 13 -8.508 -6.750 4.830 105 HA LYS 13 HA LYS 13 -7.341 -4.144 3.985 106 1HB LYS 13 2HB LYS 13 -9.211 -4.417 5.785 107 2HB LYS 13 1HB LYS 13 -7.897 -4.943 6.838 108 1HG LYS 13 2HG LYS 13 -7.155 -2.549 5.369 109 2HG LYS 13 1HG LYS 13 -8.639 -2.292 6.286 110 1HD LYS 13 2HD LYS 13 -7.549 -2.347 8.269 111 2HD LYS 13 1HD LYS 13 -6.615 -3.769 7.805 112 1HE LYS 13 2HE LYS 13 -5.653 -1.633 6.213 113 2HE LYS 13 1HE LYS 13 -5.784 -1.009 7.856 114 1HZ LYS 13 1HZ LYS 13 -3.643 -2.186 7.209 115 2HZ LYS 13 2HZ LYS 13 -4.535 -3.630 7.294 116 3HZ LYS 13 3HZ LYS 13 -4.368 -2.648 8.671 117 H VAL 14 H VAL 14 -5.163 -4.164 3.747 118 HA VAL 14 HA VAL 14 -3.536 -5.746 5.704 119 HB VAL 14 HB VAL 14 -2.820 -5.280 2.792 120 1HG1 VAL 14 1HG1 VAL 14 -1.705 -7.321 4.725 121 2HG1 VAL 14 2HG1 VAL 14 -1.010 -5.708 4.566 122 3HG1 VAL 14 3HG1 VAL 14 -1.029 -6.800 3.182 123 1HG2 VAL 14 1HG2 VAL 14 -4.059 -7.697 4.148 124 2HG2 VAL 14 2HG2 VAL 14 -3.371 -7.715 2.524 125 3HG2 VAL 14 3HG2 VAL 14 -4.785 -6.720 2.871 126 H ARG 15 H ARG 15 -1.666 -4.726 6.469 127 HA ARG 15 HA ARG 15 -1.395 -1.836 5.753 128 1HB ARG 15 2HB ARG 15 -0.373 -1.530 7.961 129 2HB ARG 15 1HB ARG 15 -1.947 -2.303 8.132 130 1HG ARG 15 2HG ARG 15 -0.285 -4.478 7.855 131 2HG ARG 15 1HG ARG 15 0.736 -3.352 8.749 132 1HD ARG 15 2HD ARG 15 -0.438 -3.692 10.633 133 2HD ARG 15 1HD ARG 15 -1.952 -3.312 9.814 134 HE ARG 15 HE ARG 15 -0.788 -6.025 10.130 135 1HH1 ARG 15 1HH2 ARG 15 -3.558 -5.119 11.048 136 2HH1 ARG 15 2HH2 ARG 15 -4.561 -5.852 9.842 137 1HH2 ARG 15 2HH1 ARG 15 -1.942 -6.476 7.654 138 2HH2 ARG 15 1HH1 ARG 15 -3.647 -6.618 7.919 139 H VAL 16 H VAL 16 0.555 -1.104 4.973 140 HA VAL 16 HA VAL 16 2.943 -2.852 5.147 141 HB VAL 16 HB VAL 16 1.827 -3.537 3.066 142 1HG1 VAL 16 1HG1 VAL 16 0.567 -1.941 2.072 143 2HG1 VAL 16 2HG1 VAL 16 2.072 -1.454 1.292 144 3HG1 VAL 16 3HG1 VAL 16 1.527 -0.627 2.750 145 1HG2 VAL 16 1HG2 VAL 16 4.299 -3.469 3.138 146 2HG2 VAL 16 2HG2 VAL 16 4.266 -1.810 2.539 147 3HG2 VAL 16 3HG2 VAL 16 3.693 -3.128 1.517 148 H LYS 17 H LYS 17 4.850 -1.674 5.244 149 HA LYS 17 HA LYS 17 4.559 1.297 5.065 150 1HB LYS 17 2HB LYS 17 6.453 1.437 6.635 151 2HB LYS 17 1HB LYS 17 5.144 0.480 7.319 152 1HG LYS 17 2HG LYS 17 6.628 -1.446 6.023 153 2HG LYS 17 1HG LYS 17 7.878 -0.333 6.573 154 1HD LYS 17 2HD LYS 17 6.835 -0.409 8.867 155 2HD LYS 17 1HD LYS 17 5.767 -1.681 8.277 156 1HE LYS 17 2HE LYS 17 7.871 -2.952 7.586 157 2HE LYS 17 1HE LYS 17 8.783 -1.763 8.513 158 1HZ LYS 17 1HZ LYS 17 6.500 -3.079 9.800 159 2HZ LYS 17 2HZ LYS 17 7.948 -2.508 10.482 160 3HZ LYS 17 3HZ LYS 17 7.933 -3.967 9.611 161 H CYS 18 H CYS 18 5.935 2.464 3.770 162 HA CYS 18 HA CYS 18 8.355 1.242 2.624 163 1HB CYS 18 2HB CYS 18 5.876 1.157 1.198 164 2HB CYS 18 1HB CYS 18 6.930 2.315 0.387 165 HG CYS 18 HG CYS 18 7.250 -0.614 0.162 166 H LEU 19 H LEU 19 9.576 2.891 1.294 167 HA LEU 19 HA LEU 19 9.382 5.533 2.553 168 1HB LEU 19 2HB LEU 19 11.363 4.031 0.995 169 2HB LEU 19 1HB LEU 19 11.270 5.725 0.521 170 HG LEU 19 HG LEU 19 11.237 5.287 3.438 171 1HD1 LEU 19 1HD1 LEU 19 13.363 4.139 1.710 172 2HD1 LEU 19 2HD1 LEU 19 12.882 3.695 3.346 173 3HD1 LEU 19 3HD1 LEU 19 13.920 5.096 3.082 174 1HD2 LEU 19 1HD2 LEU 19 12.052 7.258 1.472 175 2HD2 LEU 19 2HD2 LEU 19 13.366 6.946 2.606 176 3HD2 LEU 19 3HD2 LEU 19 11.791 7.465 3.204 177 H ALA 20 H ALA 20 8.844 7.469 1.475 178 HA ALA 20 HA ALA 20 6.889 7.310 -0.617 179 1HB ALA 20 1HB ALA 20 8.520 9.733 0.205 180 2HB ALA 20 2HB ALA 20 7.065 9.185 1.038 181 3HB ALA 20 3HB ALA 20 6.968 9.744 -0.632 182 H GLU 21 H GLU 21 10.367 7.485 -0.693 183 HA GLU 21 HA GLU 21 10.513 8.434 -3.463 184 1HB GLU 21 2HB GLU 21 12.938 7.971 -3.239 185 2HB GLU 21 1HB GLU 21 12.342 8.951 -1.901 186 1HG GLU 21 2HG GLU 21 13.291 7.414 -0.538 187 2HG GLU 21 1HG GLU 21 11.965 6.349 -0.998 188 H ASP 22 H ASP 22 10.194 5.370 -1.838 189 HA ASP 22 HA ASP 22 11.340 3.663 -3.820 190 1HB ASP 22 2HB ASP 22 9.498 3.345 -1.525 191 2HB ASP 22 1HB ASP 22 9.333 2.127 -2.789 192 H SER 23 H SER 23 10.316 2.478 -5.519 193 HA SER 23 HA SER 23 8.227 3.991 -6.901 194 1HB SER 23 2HB SER 23 8.576 2.359 -8.720 195 2HB SER 23 1HB SER 23 10.107 3.027 -8.165 196 HG SER 23 HG SER 23 10.031 0.685 -8.411 197 H VAL 24 H VAL 24 6.296 2.849 -7.823 198 HA VAL 24 HA VAL 24 4.721 1.610 -5.781 199 HB VAL 24 HB VAL 24 4.340 1.591 -8.794 200 1HG1 VAL 24 1HG1 VAL 24 1.932 1.486 -7.167 201 2HG1 VAL 24 2HG1 VAL 24 2.977 0.105 -6.841 202 3HG1 VAL 24 3HG1 VAL 24 2.432 0.427 -8.487 203 1HG2 VAL 24 1HG2 VAL 24 2.528 3.305 -7.412 204 2HG2 VAL 24 2HG2 VAL 24 3.796 3.763 -8.547 205 3HG2 VAL 24 3HG2 VAL 24 4.151 3.668 -6.822 206 H GLY 25 H GLY 25 6.746 0.286 -8.372 207 1HA GLY 25 2HA GLY 25 5.922 -2.438 -8.250 208 2HA GLY 25 1HA GLY 25 7.532 -1.896 -8.735 209 H ASP 26 H ASP 26 8.390 -0.652 -6.384 210 HA ASP 26 HA ASP 26 9.220 -2.904 -4.778 211 1HB ASP 26 2HB ASP 26 10.293 -0.488 -5.151 212 2HB ASP 26 1HB ASP 26 9.356 -0.108 -3.706 213 H PHE 27 H PHE 27 6.746 -0.392 -4.427 214 HA PHE 27 HA PHE 27 5.955 -0.952 -1.736 215 1HB PHE 27 2HB PHE 27 5.272 1.059 -3.084 216 2HB PHE 27 1HB PHE 27 4.212 0.014 -4.027 217 HD1 PHE 27 HD1 PHE 27 4.903 1.214 -0.560 218 HD2 PHE 27 HD2 PHE 27 2.071 -0.590 -3.235 219 HE1 PHE 27 HE1 PHE 27 3.134 1.441 1.159 220 HE2 PHE 27 HE2 PHE 27 0.300 -0.362 -1.516 221 HZ PHE 27 HZ PHE 27 0.831 0.654 0.680 222 H LYS 28 H LYS 28 4.806 -2.220 -4.867 223 HA LYS 28 HA LYS 28 2.824 -3.998 -3.756 224 1HB LYS 28 2HB LYS 28 4.266 -3.890 -6.414 225 2HB LYS 28 1HB LYS 28 3.077 -5.141 -6.044 226 1HG LYS 28 2HG LYS 28 1.497 -3.211 -5.409 227 2HG LYS 28 1HG LYS 28 2.653 -2.156 -6.221 228 1HD LYS 28 2HD LYS 28 2.248 -4.321 -7.979 229 2HD LYS 28 1HD LYS 28 0.646 -3.891 -7.385 230 1HE LYS 28 2HE LYS 28 0.634 -1.920 -8.504 231 2HE LYS 28 1HE LYS 28 2.299 -1.559 -8.057 232 1HZ LYS 28 1HZ LYS 28 3.117 -2.574 -9.896 233 2HZ LYS 28 2HZ LYS 28 1.605 -2.121 -10.526 234 3HZ LYS 28 3HZ LYS 28 1.862 -3.711 -9.985 235 H LYS 29 H LYS 29 6.273 -4.302 -4.484 236 HA LYS 29 HA LYS 29 6.524 -7.133 -4.232 237 1HB LYS 29 2HB LYS 29 8.401 -4.810 -3.877 238 2HB LYS 29 1HB LYS 29 8.926 -6.432 -3.427 239 1HG LYS 29 2HG LYS 29 7.628 -6.610 -5.967 240 2HG LYS 29 1HG LYS 29 8.790 -5.285 -6.045 241 1HD LYS 29 2HD LYS 29 10.335 -6.905 -6.418 242 2HD LYS 29 1HD LYS 29 10.212 -7.213 -4.687 243 1HE LYS 29 2HE LYS 29 8.107 -8.511 -6.293 244 2HE LYS 29 1HE LYS 29 9.735 -9.094 -6.630 245 1HZ LYS 29 1HZ LYS 29 9.942 -9.210 -4.091 246 2HZ LYS 29 2HZ LYS 29 9.036 -10.412 -4.878 247 3HZ LYS 29 3HZ LYS 29 8.248 -9.134 -4.082 248 H VAL 30 H VAL 30 6.753 -4.531 -1.787 249 HA VAL 30 HA VAL 30 7.356 -6.252 0.433 250 HB VAL 30 HB VAL 30 5.849 -3.616 0.535 251 1HG1 VAL 30 1HG1 VAL 30 6.090 -3.748 2.780 252 2HG1 VAL 30 2HG1 VAL 30 7.780 -4.226 2.640 253 3HG1 VAL 30 3HG1 VAL 30 6.509 -5.444 2.540 254 1HG2 VAL 30 1HG2 VAL 30 7.733 -2.763 -0.415 255 2HG2 VAL 30 2HG2 VAL 30 8.646 -4.250 -0.152 256 3HG2 VAL 30 3HG2 VAL 30 8.482 -3.073 1.152 257 H LEU 31 H LEU 31 4.282 -5.096 -0.958 258 HA LEU 31 HA LEU 31 2.569 -6.264 1.043 259 1HB LEU 31 2HB LEU 31 2.203 -5.252 -1.757 260 2HB LEU 31 1HB LEU 31 0.918 -6.221 -1.036 261 HG LEU 31 HG LEU 31 2.096 -3.971 0.560 262 1HD1 LEU 31 1HD1 LEU 31 0.577 -3.721 -1.962 263 2HD1 LEU 31 2HD1 LEU 31 1.583 -2.536 -1.130 264 3HD1 LEU 31 3HD1 LEU 31 -0.082 -2.798 -0.611 265 1HD2 LEU 31 1HD2 LEU 31 0.115 -4.131 1.756 266 2HD2 LEU 31 2HD2 LEU 31 0.249 -5.794 1.187 267 3HD2 LEU 31 3HD2 LEU 31 -0.812 -4.659 0.352 268 H SER 32 H SER 32 3.969 -7.489 -1.977 269 HA SER 32 HA SER 32 2.482 -9.920 -2.161 270 1HB SER 32 2HB SER 32 5.329 -9.356 -3.052 271 2HB SER 32 1HB SER 32 4.343 -10.714 -3.584 272 HG SER 32 HG SER 32 4.432 -8.286 -4.593 273 H LEU 33 H LEU 33 5.383 -9.079 -0.300 274 HA LEU 33 HA LEU 33 6.035 -11.779 0.486 275 1HB LEU 33 2HB LEU 33 6.699 -9.071 1.663 276 2HB LEU 33 1HB LEU 33 7.288 -10.578 2.365 277 HG LEU 33 HG LEU 33 7.666 -10.224 -0.570 278 1HD1 LEU 33 1HD1 LEU 33 8.355 -8.036 0.104 279 2HD1 LEU 33 2HD1 LEU 33 9.836 -8.983 -0.040 280 3HD1 LEU 33 3HD1 LEU 33 9.148 -8.656 1.552 281 1HD2 LEU 33 1HD2 LEU 33 8.406 -12.260 0.603 282 2HD2 LEU 33 2HD2 LEU 33 9.387 -11.283 1.697 283 3HD2 LEU 33 3HD2 LEU 33 9.797 -11.369 -0.017 284 H GLN 34 H GLN 34 3.747 -9.394 1.676 285 HA GLN 34 HA GLN 34 3.290 -10.781 4.214 286 1HB GLN 34 2HB GLN 34 1.894 -8.473 2.841 287 2HB GLN 34 1HB GLN 34 1.390 -9.116 4.404 288 1HG GLN 34 2HG GLN 34 3.679 -8.693 5.287 289 2HG GLN 34 1HG GLN 34 4.119 -7.970 3.738 290 1HE2 GLN 34 1HE2 GLN 34 2.622 -6.066 3.041 291 2HE2 GLN 34 2HE2 GLN 34 2.067 -5.040 4.273 292 H ILE 35 H ILE 35 1.435 -10.376 1.154 293 HA ILE 35 HA ILE 35 -0.396 -12.523 2.132 294 HB ILE 35 HB ILE 35 -2.010 -11.704 0.458 295 1HG1 ILE 35 2HG1 ILE 35 0.103 -9.595 -0.123 296 2HG1 ILE 35 1HG1 ILE 35 -0.390 -10.878 -1.226 297 1HG2 ILE 35 1HG2 ILE 35 -0.865 -9.444 2.124 298 2HG2 ILE 35 2HG2 ILE 35 -1.889 -10.729 2.763 299 3HG2 ILE 35 3HG2 ILE 35 -2.531 -9.604 1.567 300 1HD1 ILE 35 1HD1 ILE 35 -2.692 -9.400 -0.234 301 2HD1 ILE 35 2HD1 ILE 35 -2.200 -9.714 -1.897 302 3HD1 ILE 35 3HD1 ILE 35 -1.534 -8.332 -1.028 303 H GLY 36 H GLY 36 1.435 -11.555 -0.801 304 1HA GLY 36 2HA GLY 36 2.695 -13.272 -2.032 305 2HA GLY 36 1HA GLY 36 1.463 -14.443 -1.568 306 H THR 37 H THR 37 1.368 -11.212 -3.121 307 HA THR 37 HA THR 37 -0.457 -12.376 -5.185 308 HB THR 37 HB THR 37 -0.623 -9.640 -5.498 309 HG1 THR 37 HG1 THR 37 0.567 -9.342 -3.566 310 1HG2 THR 37 1HG2 THR 37 -2.313 -11.385 -3.690 311 2HG2 THR 37 2HG2 THR 37 -2.472 -11.279 -5.444 312 3HG2 THR 37 3HG2 THR 37 -2.815 -9.871 -4.442 313 H GLN 38 H GLN 38 2.688 -11.072 -4.719 314 HA GLN 38 HA GLN 38 4.451 -10.713 -6.208 315 1HB GLN 38 2HB GLN 38 2.465 -12.076 -8.014 316 2HB GLN 38 1HB GLN 38 3.933 -11.375 -8.687 317 1HG GLN 38 2HG GLN 38 4.835 -13.404 -8.177 318 2HG GLN 38 1HG GLN 38 4.958 -12.721 -6.553 319 1HE2 GLN 38 1HE2 GLN 38 3.046 -14.919 -8.597 320 2HE2 GLN 38 2HE2 GLN 38 2.197 -15.644 -7.318 321 HA PRO 39 HA PRO 39 3.647 -6.727 -7.896 322 1HB PRO 39 2HB PRO 39 5.883 -6.464 -9.484 323 2HB PRO 39 1HB PRO 39 5.917 -6.332 -7.717 324 1HG PRO 39 2HG PRO 39 6.837 -8.580 -9.451 325 2HG PRO 39 1HG PRO 39 7.406 -8.093 -7.846 326 1HD PRO 39 2HD PRO 39 5.668 -10.250 -8.387 327 2HD PRO 39 1HD PRO 39 5.950 -9.520 -6.793 328 H ASN 40 H ASN 40 1.878 -8.161 -9.126 329 HA ASN 40 HA ASN 40 1.864 -7.305 -11.901 330 1HB ASN 40 2HB ASN 40 3.200 -9.652 -11.576 331 2HB ASN 40 1HB ASN 40 1.552 -10.257 -11.742 332 1HD2 ASN 40 1HD2 ASN 40 4.137 -8.492 -13.428 333 2HD2 ASN 40 2HD2 ASN 40 3.424 -8.576 -14.967 334 H LYS 41 H LYS 41 0.451 -9.538 -9.491 335 HA LYS 41 HA LYS 41 -2.239 -9.133 -10.667 336 1HB LYS 41 2HB LYS 41 -0.958 -11.220 -9.197 337 2HB LYS 41 1HB LYS 41 -2.327 -10.649 -8.242 338 1HG LYS 41 2HG LYS 41 -3.864 -11.044 -10.024 339 2HG LYS 41 1HG LYS 41 -2.562 -11.275 -11.190 340 1HD LYS 41 2HD LYS 41 -3.214 -13.480 -10.699 341 2HD LYS 41 1HD LYS 41 -1.830 -13.235 -9.634 342 1HE LYS 41 2HE LYS 41 -4.331 -12.342 -8.413 343 2HE LYS 41 1HE LYS 41 -4.371 -14.052 -8.834 344 1HZ LYS 41 1HZ LYS 41 -2.036 -14.060 -7.747 345 2HZ LYS 41 2HZ LYS 41 -3.418 -14.088 -6.759 346 3HZ LYS 41 3HZ LYS 41 -2.567 -12.636 -6.994 347 H ILE 42 H ILE 42 -0.389 -7.291 -8.699 348 HA ILE 42 HA ILE 42 -2.540 -6.667 -6.742 349 HB ILE 42 HB ILE 42 0.285 -5.568 -6.905 350 1HG1 ILE 42 2HG1 ILE 42 -0.795 -7.588 -4.929 351 2HG1 ILE 42 1HG1 ILE 42 0.021 -8.075 -6.416 352 1HG2 ILE 42 1HG2 ILE 42 -0.940 -4.008 -5.659 353 2HG2 ILE 42 2HG2 ILE 42 -0.374 -5.110 -4.403 354 3HG2 ILE 42 3HG2 ILE 42 -2.025 -5.236 -5.009 355 1HD1 ILE 42 1HD1 ILE 42 1.305 -6.080 -4.560 356 2HD1 ILE 42 2HD1 ILE 42 2.068 -7.132 -5.752 357 3HD1 ILE 42 3HD1 ILE 42 1.448 -7.810 -4.249 358 H VAL 43 H VAL 43 -3.828 -4.922 -7.040 359 HA VAL 43 HA VAL 43 -2.968 -2.831 -9.007 360 HB VAL 43 HB VAL 43 -5.789 -3.803 -8.431 361 1HG1 VAL 43 1HG1 VAL 43 -6.512 -1.938 -9.463 362 2HG1 VAL 43 2HG1 VAL 43 -5.449 -2.240 -10.837 363 3HG1 VAL 43 3HG1 VAL 43 -4.856 -1.335 -9.445 364 1HG2 VAL 43 1HG2 VAL 43 -4.588 -4.011 -11.140 365 2HG2 VAL 43 2HG2 VAL 43 -5.671 -5.121 -10.300 366 3HG2 VAL 43 3HG2 VAL 43 -3.948 -5.121 -9.929 367 H LEU 44 H LEU 44 -2.381 -1.110 -7.746 368 HA LEU 44 HA LEU 44 -3.923 -0.554 -5.263 369 1HB LEU 44 2HB LEU 44 -1.192 0.136 -6.258 370 2HB LEU 44 1HB LEU 44 -1.971 1.267 -5.152 371 HG LEU 44 HG LEU 44 -2.302 -1.493 -4.273 372 1HD1 LEU 44 1HD1 LEU 44 0.522 -0.542 -4.021 373 2HD1 LEU 44 2HD1 LEU 44 0.040 -1.314 -5.531 374 3HD1 LEU 44 3HD1 LEU 44 -0.112 -2.187 -4.007 375 1HD2 LEU 44 1HD2 LEU 44 -0.939 0.909 -3.011 376 2HD2 LEU 44 2HD2 LEU 44 -1.519 -0.526 -2.166 377 3HD2 LEU 44 3HD2 LEU 44 -2.669 0.577 -2.921 378 H GLN 45 H GLN 45 -5.077 1.355 -4.978 379 HA GLN 45 HA GLN 45 -5.200 3.208 -7.325 380 1HB GLN 45 2HB GLN 45 -7.564 2.676 -5.526 381 2HB GLN 45 1HB GLN 45 -7.551 3.405 -7.127 382 1HG GLN 45 2HG GLN 45 -6.432 0.689 -7.096 383 2HG GLN 45 1HG GLN 45 -8.118 0.750 -6.586 384 1HE2 GLN 45 1HE2 GLN 45 -9.722 1.255 -8.186 385 2HE2 GLN 45 2HE2 GLN 45 -9.343 1.505 -9.822 386 H LYS 46 H LYS 46 -4.793 5.311 -6.804 387 HA LYS 46 HA LYS 46 -5.006 6.098 -3.925 388 1HB LYS 46 2HB LYS 46 -2.682 5.976 -5.396 389 2HB LYS 46 1HB LYS 46 -3.146 7.666 -5.587 390 1HG LYS 46 2HG LYS 46 -3.504 6.735 -2.841 391 2HG LYS 46 1HG LYS 46 -1.835 6.567 -3.385 392 1HD LYS 46 2HD LYS 46 -1.553 8.843 -3.682 393 2HD LYS 46 1HD LYS 46 -3.266 9.120 -4.001 394 1HE LYS 46 2HE LYS 46 -2.523 8.128 -1.285 395 2HE LYS 46 1HE LYS 46 -2.140 9.806 -1.666 396 1HZ LYS 46 1HZ LYS 46 -4.778 8.483 -1.601 397 2HZ LYS 46 2HZ LYS 46 -4.545 9.904 -2.502 398 3HZ LYS 46 3HZ LYS 46 -4.282 9.908 -0.824 399 H GLY 47 H GLY 47 -7.034 7.057 -4.061 400 1HA GLY 47 2HA GLY 47 -8.534 8.821 -4.422 401 2HA GLY 47 1HA GLY 47 -7.184 9.744 -5.079 402 H GLY 48 H GLY 48 -8.776 6.712 -6.163 403 1HA GLY 48 2HA GLY 48 -9.780 6.174 -8.217 404 2HA GLY 48 1HA GLY 48 -10.058 7.900 -8.448 405 H SER 49 H SER 49 -7.037 6.009 -8.142 406 HA SER 49 HA SER 49 -6.330 6.570 -10.950 407 1HB SER 49 2HB SER 49 -5.251 8.096 -8.677 408 2HB SER 49 1HB SER 49 -4.002 7.367 -9.683 409 HG SER 49 HG SER 49 -4.523 9.334 -10.574 410 H VAL 50 H VAL 50 -5.133 4.869 -11.733 411 HA VAL 50 HA VAL 50 -4.474 2.683 -9.906 412 HB VAL 50 HB VAL 50 -5.358 2.286 -12.210 413 1HG1 VAL 50 1HG1 VAL 50 -2.646 3.374 -13.025 414 2HG1 VAL 50 2HG1 VAL 50 -4.222 4.051 -13.432 415 3HG1 VAL 50 3HG1 VAL 50 -3.730 2.498 -14.106 416 1HG2 VAL 50 1HG2 VAL 50 -4.400 0.296 -11.711 417 2HG2 VAL 50 2HG2 VAL 50 -2.973 1.064 -11.018 418 3HG2 VAL 50 3HG2 VAL 50 -3.077 0.804 -12.759 419 H LEU 51 H LEU 51 -2.460 2.095 -9.182 420 HA LEU 51 HA LEU 51 -0.254 4.024 -9.687 421 1HB LEU 51 2HB LEU 51 -0.313 1.823 -7.608 422 2HB LEU 51 1HB LEU 51 0.726 3.245 -7.644 423 HG LEU 51 HG LEU 51 -2.280 3.216 -7.221 424 1HD1 LEU 51 1HD1 LEU 51 -1.751 3.092 -5.040 425 2HD1 LEU 51 2HD1 LEU 51 -0.831 4.589 -5.189 426 3HD1 LEU 51 3HD1 LEU 51 -0.035 3.036 -5.442 427 1HD2 LEU 51 1HD2 LEU 51 -2.230 5.588 -7.177 428 2HD2 LEU 51 2HD2 LEU 51 -1.271 5.164 -8.593 429 3HD2 LEU 51 3HD2 LEU 51 -0.469 5.632 -7.094 430 H LYS 52 H LYS 52 1.256 3.452 -11.149 431 HA LYS 52 HA LYS 52 1.593 0.561 -11.806 432 1HB LYS 52 2HB LYS 52 1.914 3.109 -13.329 433 2HB LYS 52 1HB LYS 52 2.968 1.762 -13.760 434 1HG LYS 52 2HG LYS 52 0.026 1.271 -13.419 435 2HG LYS 52 1HG LYS 52 0.609 2.001 -14.915 436 1HD LYS 52 2HD LYS 52 1.130 -0.069 -15.639 437 2HD LYS 52 1HD LYS 52 2.373 -0.137 -14.390 438 1HE LYS 52 2HE LYS 52 0.595 -0.926 -12.778 439 2HE LYS 52 1HE LYS 52 -0.503 -1.052 -14.152 440 1HZ LYS 52 1HZ LYS 52 0.481 -3.170 -13.794 441 2HZ LYS 52 2HZ LYS 52 2.048 -2.513 -13.760 442 3HZ LYS 52 3HZ LYS 52 1.159 -2.534 -15.210 443 H ASP 53 H ASP 53 3.663 -0.368 -11.830 444 HA ASP 53 HA ASP 53 5.515 0.479 -9.847 445 1HB ASP 53 2HB ASP 53 7.024 -1.235 -10.794 446 2HB ASP 53 1HB ASP 53 5.379 -1.850 -10.636 447 H HIS 54 H HIS 54 5.279 1.305 -13.253 448 HA HIS 54 HA HIS 54 7.958 2.281 -13.616 449 1HB HIS 54 2HB HIS 54 5.357 2.962 -15.013 450 2HB HIS 54 1HB HIS 54 6.932 3.555 -15.539 451 HD1 HIS 54 HD1 HIS 54 4.759 0.550 -15.563 452 HD2 HIS 54 HD2 HIS 54 8.726 1.459 -16.462 453 HE1 HIS 54 HE1 HIS 54 5.671 -1.425 -16.861 454 H ILE 55 H ILE 55 5.259 3.596 -11.883 455 HA ILE 55 HA ILE 55 6.523 6.302 -11.884 456 HB ILE 55 HB ILE 55 3.735 5.442 -11.038 457 1HG1 ILE 55 2HG1 ILE 55 3.395 7.211 -13.058 458 2HG1 ILE 55 1HG1 ILE 55 4.935 6.509 -13.547 459 1HG2 ILE 55 1HG2 ILE 55 5.150 8.117 -11.052 460 2HG2 ILE 55 2HG2 ILE 55 4.345 7.326 -9.697 461 3HG2 ILE 55 3HG2 ILE 55 3.392 7.978 -11.028 462 1HD1 ILE 55 1HD1 ILE 55 2.466 4.892 -12.856 463 2HD1 ILE 55 2HD1 ILE 55 3.988 4.267 -13.492 464 3HD1 ILE 55 3HD1 ILE 55 2.966 5.293 -14.499 465 H SER 56 H SER 56 7.003 7.302 -9.874 466 HA SER 56 HA SER 56 7.595 5.403 -7.710 467 1HB SER 56 2HB SER 56 8.816 7.285 -6.696 468 2HB SER 56 1HB SER 56 9.286 7.068 -8.378 469 HG SER 56 HG SER 56 8.855 9.258 -7.890 470 H LEU 57 H LEU 57 6.944 5.771 -5.490 471 HA LEU 57 HA LEU 57 4.169 6.346 -5.136 472 1HB LEU 57 2HB LEU 57 6.445 6.229 -3.133 473 2HB LEU 57 1HB LEU 57 4.747 6.368 -2.676 474 HG LEU 57 HG LEU 57 5.693 4.164 -4.509 475 1HD1 LEU 57 1HD1 LEU 57 7.013 4.142 -2.365 476 2HD1 LEU 57 2HD1 LEU 57 5.996 2.720 -2.587 477 3HD1 LEU 57 3HD1 LEU 57 5.490 4.002 -1.488 478 1HD2 LEU 57 1HD2 LEU 57 3.457 3.812 -4.510 479 2HD2 LEU 57 2HD2 LEU 57 3.206 4.979 -3.213 480 3HD2 LEU 57 3HD2 LEU 57 3.626 3.311 -2.827 481 H GLU 58 H GLU 58 7.064 8.356 -4.807 482 HA GLU 58 HA GLU 58 5.873 10.613 -3.517 483 1HB GLU 58 2HB GLU 58 8.387 9.960 -4.781 484 2HB GLU 58 1HB GLU 58 7.858 11.557 -5.308 485 1HG GLU 58 2HG GLU 58 7.544 10.980 -2.414 486 2HG GLU 58 1HG GLU 58 9.201 11.136 -2.993 487 H ASP 59 H ASP 59 6.060 9.649 -6.931 488 HA ASP 59 HA ASP 59 5.060 12.087 -8.065 489 1HB ASP 59 2HB ASP 59 5.475 9.304 -8.957 490 2HB ASP 59 1HB ASP 59 4.149 10.132 -9.773 491 H TYR 60 H TYR 60 3.407 9.112 -6.978 492 HA TYR 60 HA TYR 60 0.750 10.091 -7.623 493 1HB TYR 60 2HB TYR 60 1.800 7.794 -5.966 494 2HB TYR 60 1HB TYR 60 0.077 8.157 -6.049 495 HD1 TYR 60 HD1 TYR 60 2.580 6.196 -7.468 496 HD2 TYR 60 HD2 TYR 60 -0.735 8.686 -8.600 497 HE1 TYR 60 HE1 TYR 60 2.426 5.007 -9.639 498 HE2 TYR 60 HE2 TYR 60 -0.887 7.498 -10.770 499 HH TYR 60 HH TYR 60 0.703 6.168 -12.254 500 H GLU 61 H GLU 61 2.940 10.656 -5.019 501 HA GLU 61 HA GLU 61 2.759 12.045 -3.153 502 1HB GLU 61 2HB GLU 61 0.976 13.182 -4.800 503 2HB GLU 61 1HB GLU 61 -0.150 12.576 -3.586 504 1HG GLU 61 2HG GLU 61 2.318 14.145 -2.821 505 2HG GLU 61 1HG GLU 61 0.797 14.944 -3.217 506 H VAL 62 H VAL 62 2.973 9.894 -2.112 507 HA VAL 62 HA VAL 62 0.461 8.938 -0.812 508 HB VAL 62 HB VAL 62 3.191 7.636 -1.098 509 1HG1 VAL 62 1HG1 VAL 62 1.890 5.621 -0.171 510 2HG1 VAL 62 2HG1 VAL 62 0.683 6.789 0.365 511 3HG1 VAL 62 3HG1 VAL 62 2.331 6.875 0.989 512 1HG2 VAL 62 1HG2 VAL 62 1.914 7.607 -3.170 513 2HG2 VAL 62 2HG2 VAL 62 0.470 7.061 -2.313 514 3HG2 VAL 62 3HG2 VAL 62 1.866 5.992 -2.459 515 H HIS 63 H HIS 63 0.121 9.679 1.215 516 HA HIS 63 HA HIS 63 2.398 10.803 2.755 517 1HB HIS 63 2HB HIS 63 -0.366 11.480 2.458 518 2HB HIS 63 1HB HIS 63 -0.087 11.068 4.149 519 HD1 HIS 63 HD1 HIS 63 1.318 13.330 1.436 520 HD2 HIS 63 HD2 HIS 63 1.277 13.019 5.591 521 HE1 HIS 63 HE1 HIS 63 2.412 15.435 2.324 522 H ASP 64 H ASP 64 2.369 10.367 5.171 523 HA ASP 64 HA ASP 64 2.435 7.504 5.636 524 1HB ASP 64 2HB ASP 64 3.113 8.095 7.923 525 2HB ASP 64 1HB ASP 64 4.016 9.056 6.755 526 H GLN 65 H GLN 65 0.994 6.244 6.822 527 HA GLN 65 HA GLN 65 -1.052 5.586 7.742 528 1HB GLN 65 2HB GLN 65 -0.341 8.043 9.032 529 2HB GLN 65 1HB GLN 65 -2.082 8.054 8.755 530 1HG GLN 65 2HG GLN 65 -1.583 7.001 10.913 531 2HG GLN 65 1HG GLN 65 -2.245 5.806 9.798 532 1HE2 GLN 65 1HE2 GLN 65 1.028 7.129 10.634 533 2HE2 GLN 65 2HE2 GLN 65 1.797 5.616 10.609 534 H THR 66 H THR 66 -0.912 6.612 4.970 535 HA THR 66 HA THR 66 -3.498 7.991 4.584 536 HB THR 66 HB THR 66 -1.394 8.533 3.241 537 HG1 THR 66 HG1 THR 66 -2.816 9.300 1.936 538 1HG2 THR 66 1HG2 THR 66 -0.741 6.144 2.880 539 2HG2 THR 66 2HG2 THR 66 -0.830 7.074 1.384 540 3HG2 THR 66 3HG2 THR 66 -2.132 5.965 1.812 541 H ASN 67 H ASN 67 -5.186 7.054 3.225 542 HA ASN 67 HA ASN 67 -5.314 4.094 3.511 543 1HB ASN 67 2HB ASN 67 -7.160 5.857 4.254 544 2HB ASN 67 1HB ASN 67 -7.640 5.725 2.562 545 1HD2 ASN 67 1HD2 ASN 67 -7.324 3.900 5.598 546 2HD2 ASN 67 2HD2 ASN 67 -8.236 2.563 5.088 547 H LEU 68 H LEU 68 -4.940 2.856 1.760 548 HA LEU 68 HA LEU 68 -5.238 4.084 -0.954 549 1HB LEU 68 2HB LEU 68 -3.277 2.129 0.202 550 2HB LEU 68 1HB LEU 68 -3.663 2.031 -1.515 551 HG LEU 68 HG LEU 68 -3.175 4.779 -0.619 552 1HD1 LEU 68 1HD1 LEU 68 -0.855 4.606 -0.130 553 2HD1 LEU 68 2HD1 LEU 68 -0.790 2.922 -0.651 554 3HD1 LEU 68 3HD1 LEU 68 -1.615 3.350 0.847 555 1HD2 LEU 68 1HD2 LEU 68 -2.016 2.972 -2.767 556 2HD2 LEU 68 2HD2 LEU 68 -1.664 4.694 -2.620 557 3HD2 LEU 68 3HD2 LEU 68 -3.305 4.157 -2.974 558 H GLU 69 H GLU 69 -5.930 2.542 -2.671 559 HA GLU 69 HA GLU 69 -7.935 0.609 -1.599 560 1HB GLU 69 2HB GLU 69 -8.201 2.601 -3.490 561 2HB GLU 69 1HB GLU 69 -7.965 1.167 -4.488 562 1HG GLU 69 2HG GLU 69 -9.836 0.865 -2.198 563 2HG GLU 69 1HG GLU 69 -10.382 1.903 -3.515 564 H LEU 70 H LEU 70 -7.794 -1.563 -2.113 565 HA LEU 70 HA LEU 70 -5.439 -2.392 -3.762 566 1HB LEU 70 2HB LEU 70 -5.412 -3.009 -1.309 567 2HB LEU 70 1HB LEU 70 -6.827 -4.016 -1.610 568 HG LEU 70 HG LEU 70 -5.543 -5.294 -3.305 569 1HD1 LEU 70 1HD1 LEU 70 -3.010 -4.926 -3.254 570 2HD1 LEU 70 2HD1 LEU 70 -3.349 -3.384 -2.468 571 3HD1 LEU 70 3HD1 LEU 70 -3.954 -3.697 -4.096 572 1HD2 LEU 70 1HD2 LEU 70 -4.236 -6.555 -1.743 573 2HD2 LEU 70 2HD2 LEU 70 -5.576 -5.880 -0.817 574 3HD2 LEU 70 3HD2 LEU 70 -3.976 -5.143 -0.717 575 H TYR 71 H TYR 71 -5.741 -3.964 -5.342 576 HA TYR 71 HA TYR 71 -8.422 -5.171 -5.701 577 1HB TYR 71 2HB TYR 71 -7.451 -2.921 -7.239 578 2HB TYR 71 1HB TYR 71 -7.629 -4.327 -8.287 579 HD1 TYR 71 HD1 TYR 71 -9.316 -1.544 -7.154 580 HD2 TYR 71 HD2 TYR 71 -9.872 -5.784 -7.576 581 HE1 TYR 71 HE1 TYR 71 -11.773 -1.219 -7.177 582 HE2 TYR 71 HE2 TYR 71 -12.330 -5.459 -7.597 583 HH TYR 71 HH TYR 71 -13.794 -2.422 -6.798 584 H TYR 72 H TYR 72 -8.337 -7.093 -6.986 585 HA TYR 72 HA TYR 72 -5.558 -8.103 -7.422 586 1HB TYR 72 2HB TYR 72 -8.165 -9.599 -7.001 587 2HB TYR 72 1HB TYR 72 -6.612 -10.369 -7.331 588 HD1 TYR 72 HD1 TYR 72 -4.635 -9.115 -5.787 589 HD2 TYR 72 HD2 TYR 72 -8.762 -9.716 -4.747 590 HE1 TYR 72 HE1 TYR 72 -4.051 -8.964 -3.382 591 HE2 TYR 72 HE2 TYR 72 -8.176 -9.567 -2.342 592 HH TYR 72 HH TYR 72 -5.851 -8.257 -1.092 593 H LEU 73 HN LEU 73 -4.907 -8.528 -9.472 594 HA LEU 73 HA LEU 73 -6.648 -7.892 -11.712 595 1HB LEU 73 2HB LEU 73 -3.894 -7.996 -11.307 596 2HB LEU 73 1HB LEU 73 -4.202 -9.342 -12.403 597 HG LEU 73 HG LEU 73 -5.763 -7.062 -13.228 598 1HD1 LEU 73 1HD1 LEU 73 -3.988 -5.775 -12.043 599 2HD1 LEU 73 2HD1 LEU 73 -3.958 -5.510 -13.785 600 3HD1 LEU 73 3HD1 LEU 73 -2.772 -6.580 -13.034 601 1HD2 LEU 73 1HD2 LEU 73 -5.207 -8.811 -14.767 602 2HD2 LEU 73 2HD2 LEU 73 -3.486 -8.681 -14.401 603 3HD2 LEU 73 3HD2 LEU 73 -4.296 -7.397 -15.298 Start of MODEL 3 1 H MET 1 1H MET 1 10.207 7.101 5.671 2 HA MET 1 HA MET 1 9.476 5.022 4.731 3 1HB MET 1 2HB MET 1 11.086 3.845 6.546 4 2HB MET 1 1HB MET 1 9.546 3.684 7.391 5 1HG MET 1 2HG MET 1 8.597 2.387 5.681 6 2HG MET 1 1HG MET 1 9.761 2.946 4.481 7 1HE MET 1 1HE MET 1 9.755 0.452 3.807 8 2HE MET 1 2HE MET 1 11.261 -0.378 4.191 9 3HE MET 1 3HE MET 1 11.305 1.266 3.560 10 H ILE 2 H ILE 2 7.257 4.912 4.666 11 HA ILE 2 HA ILE 2 5.772 6.007 7.025 12 HB ILE 2 HB ILE 2 4.077 6.829 5.417 13 1HG1 ILE 2 2HG1 ILE 2 5.998 6.315 3.164 14 2HG1 ILE 2 1HG1 ILE 2 4.910 5.022 3.669 15 1HG2 ILE 2 1HG2 ILE 2 6.809 7.801 4.562 16 2HG2 ILE 2 2HG2 ILE 2 6.134 8.179 6.146 17 3HG2 ILE 2 3HG2 ILE 2 5.314 8.728 4.685 18 1HD1 ILE 2 1HD1 ILE 2 4.163 6.779 1.825 19 2HD1 ILE 2 2HD1 ILE 2 3.764 7.754 3.239 20 3HD1 ILE 2 3HD1 ILE 2 3.010 6.175 3.015 21 H GLU 3 H GLU 3 3.538 5.167 7.251 22 HA GLU 3 HA GLU 3 3.349 2.326 6.322 23 1HB GLU 3 2HB GLU 3 1.826 2.038 8.339 24 2HB GLU 3 1HB GLU 3 3.520 2.344 8.717 25 1HG GLU 3 2HG GLU 3 2.051 4.841 8.447 26 2HG GLU 3 1HG GLU 3 1.304 3.796 9.653 27 H VAL 4 H VAL 4 1.601 1.791 5.082 28 HA VAL 4 HA VAL 4 -0.684 3.720 4.983 29 HB VAL 4 HB VAL 4 -0.816 3.355 2.536 30 1HG1 VAL 4 1HG1 VAL 4 1.997 4.187 3.274 31 2HG1 VAL 4 2HG1 VAL 4 0.594 5.197 3.618 32 3HG1 VAL 4 3HG1 VAL 4 0.998 4.789 1.951 33 1HG2 VAL 4 1HG2 VAL 4 1.006 2.203 1.373 34 2HG2 VAL 4 2HG2 VAL 4 0.254 1.104 2.528 35 3HG2 VAL 4 3HG2 VAL 4 1.801 1.861 2.908 36 H VAL 5 H VAL 5 -2.721 2.757 4.258 37 HA VAL 5 HA VAL 5 -2.836 -0.187 4.808 38 HB VAL 5 HB VAL 5 -5.217 0.250 5.507 39 1HG1 VAL 5 1HG1 VAL 5 -2.929 0.430 6.956 40 2HG1 VAL 5 2HG1 VAL 5 -4.538 0.581 7.663 41 3HG1 VAL 5 3HG1 VAL 5 -3.612 2.027 7.259 42 1HG2 VAL 5 1HG2 VAL 5 -4.723 2.765 4.339 43 2HG2 VAL 5 2HG2 VAL 5 -4.815 3.072 6.072 44 3HG2 VAL 5 3HG2 VAL 5 -6.158 2.286 5.242 45 H VAL 6 H VAL 6 -3.843 -1.480 3.290 46 HA VAL 6 HA VAL 6 -5.072 -0.087 0.941 47 HB VAL 6 HB VAL 6 -4.229 -1.978 -0.459 48 1HG1 VAL 6 1HG1 VAL 6 -1.653 -1.209 0.444 49 2HG1 VAL 6 2HG1 VAL 6 -2.723 0.163 0.737 50 3HG1 VAL 6 3HG1 VAL 6 -2.581 -0.514 -0.885 51 1HG2 VAL 6 1HG2 VAL 6 -3.604 -3.846 0.658 52 2HG2 VAL 6 2HG2 VAL 6 -3.459 -2.977 2.185 53 3HG2 VAL 6 3HG2 VAL 6 -2.114 -2.988 1.047 54 H ASN 7 H ASN 7 -7.179 -0.571 0.704 55 HA ASN 7 HA ASN 7 -8.206 -3.111 1.907 56 1HB ASN 7 2HB ASN 7 -10.452 -1.937 1.806 57 2HB ASN 7 1HB ASN 7 -9.287 -1.214 2.913 58 1HD2 ASN 7 1HD2 ASN 7 -8.457 0.908 2.397 59 2HD2 ASN 7 2HD2 ASN 7 -9.070 1.835 1.114 60 H ASP 8 H ASP 8 -9.436 -4.518 0.643 61 HA ASP 8 HA ASP 8 -9.066 -4.297 -2.241 62 1HB ASP 8 2HB ASP 8 -10.074 -6.359 -0.347 63 2HB ASP 8 1HB ASP 8 -10.679 -6.445 -2.002 64 H ARG 9 H ARG 9 -12.131 -5.151 -0.594 65 HA ARG 9 HA ARG 9 -13.590 -2.839 -1.478 66 1HB ARG 9 2HB ARG 9 -13.086 -4.069 -3.683 67 2HB ARG 9 1HB ARG 9 -14.213 -5.302 -3.117 68 1HG ARG 9 2HG ARG 9 -15.742 -3.969 -4.185 69 2HG ARG 9 1HG ARG 9 -15.703 -3.096 -2.654 70 1HD ARG 9 2HD ARG 9 -13.530 -2.079 -4.093 71 2HD ARG 9 1HD ARG 9 -14.821 -2.225 -5.285 72 HE ARG 9 HE ARG 9 -16.232 -0.849 -3.704 73 1HH1 ARG 9 1HH2 ARG 9 -14.346 -0.965 -1.356 74 2HH1 ARG 9 2HH2 ARG 9 -13.558 0.574 -1.450 75 1HH2 ARG 9 2HH1 ARG 9 -14.545 1.180 -4.730 76 2HH2 ARG 9 1HH1 ARG 9 -13.670 1.791 -3.367 77 H LEU 10 H LEU 10 -14.091 -6.389 -1.118 78 HA LEU 10 HA LEU 10 -16.686 -6.097 0.109 79 1HB LEU 10 2HB LEU 10 -14.996 -8.249 -0.721 80 2HB LEU 10 1HB LEU 10 -15.435 -8.534 0.963 81 HG LEU 10 HG LEU 10 -17.749 -7.595 -0.475 82 1HD1 LEU 10 1HD1 LEU 10 -16.756 -10.214 -1.567 83 2HD1 LEU 10 2HD1 LEU 10 -16.271 -8.706 -2.342 84 3HD1 LEU 10 3HD1 LEU 10 -17.980 -9.126 -2.224 85 1HD2 LEU 10 1HD2 LEU 10 -17.037 -10.268 0.774 86 2HD2 LEU 10 2HD2 LEU 10 -18.666 -9.742 0.349 87 3HD2 LEU 10 3HD2 LEU 10 -17.770 -8.902 1.614 88 H GLY 11 H GLY 11 -13.712 -7.363 1.667 89 1HA GLY 11 2HA GLY 11 -13.778 -5.489 3.853 90 2HA GLY 11 1HA GLY 11 -14.541 -7.008 4.333 91 H LYS 12 H LYS 12 -11.651 -6.104 2.413 92 HA LYS 12 HA LYS 12 -10.000 -7.801 4.222 93 1HB LYS 12 2HB LYS 12 -10.816 -8.947 2.004 94 2HB LYS 12 1HB LYS 12 -9.591 -7.933 1.245 95 1HG LYS 12 2HG LYS 12 -8.341 -9.037 3.514 96 2HG LYS 12 1HG LYS 12 -9.244 -10.364 2.785 97 1HD LYS 12 2HD LYS 12 -7.789 -10.504 1.069 98 2HD LYS 12 1HD LYS 12 -7.929 -8.776 0.741 99 1HE LYS 12 2HE LYS 12 -6.445 -8.685 3.000 100 2HE LYS 12 1HE LYS 12 -5.912 -10.240 2.361 101 1HZ LYS 12 1HZ LYS 12 -5.486 -7.566 1.328 102 2HZ LYS 12 2HZ LYS 12 -5.860 -8.740 0.160 103 3HZ LYS 12 3HZ LYS 12 -4.523 -8.953 1.185 104 H LYS 13 H LYS 13 -8.633 -6.269 5.037 105 HA LYS 13 HA LYS 13 -7.222 -4.504 3.080 106 1HB LYS 13 2HB LYS 13 -7.172 -2.724 4.760 107 2HB LYS 13 1HB LYS 13 -8.835 -3.199 4.425 108 1HG LYS 13 2HG LYS 13 -8.676 -4.745 6.437 109 2HG LYS 13 1HG LYS 13 -7.153 -3.943 6.826 110 1HD LYS 13 2HD LYS 13 -9.446 -2.148 6.249 111 2HD LYS 13 1HD LYS 13 -9.557 -3.089 7.737 112 1HE LYS 13 2HE LYS 13 -7.657 -2.103 8.666 113 2HE LYS 13 1HE LYS 13 -6.996 -1.664 7.093 114 1HZ LYS 13 1HZ LYS 13 -8.946 -0.104 6.904 115 2HZ LYS 13 2HZ LYS 13 -7.766 0.312 8.051 116 3HZ LYS 13 3HZ LYS 13 -9.231 -0.388 8.554 117 H VAL 14 H VAL 14 -5.022 -3.928 3.678 118 HA VAL 14 HA VAL 14 -3.785 -5.595 5.819 119 HB VAL 14 HB VAL 14 -1.911 -5.544 3.699 120 1HG1 VAL 14 1HG1 VAL 14 -1.993 -7.915 3.918 121 2HG1 VAL 14 2HG1 VAL 14 -3.665 -7.880 4.478 122 3HG1 VAL 14 3HG1 VAL 14 -2.374 -7.276 5.517 123 1HG2 VAL 14 1HG2 VAL 14 -4.086 -5.114 2.323 124 2HG2 VAL 14 2HG2 VAL 14 -4.462 -6.797 2.690 125 3HG2 VAL 14 3HG2 VAL 14 -2.999 -6.396 1.791 126 H ARG 15 H ARG 15 -1.633 -4.804 6.454 127 HA ARG 15 HA ARG 15 -1.345 -1.868 5.947 128 1HB ARG 15 2HB ARG 15 -0.922 -3.614 8.322 129 2HB ARG 15 1HB ARG 15 0.221 -2.292 8.106 130 1HG ARG 15 2HG ARG 15 -1.497 -1.307 9.379 131 2HG ARG 15 1HG ARG 15 -1.890 -0.818 7.732 132 1HD ARG 15 2HD ARG 15 -3.921 -1.616 8.789 133 2HD ARG 15 1HD ARG 15 -3.425 -2.806 7.584 134 HE ARG 15 HE ARG 15 -2.241 -3.812 9.814 135 1HH1 ARG 15 1HH2 ARG 15 -5.238 -4.129 8.561 136 2HH1 ARG 15 2HH2 ARG 15 -6.074 -4.413 10.052 137 1HH2 ARG 15 2HH1 ARG 15 -3.384 -3.488 12.051 138 2HH2 ARG 15 1HH1 ARG 15 -5.035 -4.031 12.027 139 H VAL 16 H VAL 16 0.530 -1.138 5.012 140 HA VAL 16 HA VAL 16 2.920 -2.892 4.954 141 HB VAL 16 HB VAL 16 1.611 -3.430 2.903 142 1HG1 VAL 16 1HG1 VAL 16 1.432 -1.684 1.136 143 2HG1 VAL 16 2HG1 VAL 16 2.006 -0.488 2.297 144 3HG1 VAL 16 3HG1 VAL 16 0.468 -1.308 2.564 145 1HG2 VAL 16 1HG2 VAL 16 3.544 -2.494 1.284 146 2HG2 VAL 16 2HG2 VAL 16 3.821 -3.818 2.414 147 3HG2 VAL 16 3HG2 VAL 16 4.316 -2.181 2.839 148 H LYS 17 H LYS 17 4.828 -1.712 4.988 149 HA LYS 17 HA LYS 17 4.523 1.262 4.919 150 1HB LYS 17 2HB LYS 17 6.496 1.332 6.451 151 2HB LYS 17 1HB LYS 17 5.104 0.515 7.153 152 1HG LYS 17 2HG LYS 17 6.368 -1.594 5.971 153 2HG LYS 17 1HG LYS 17 7.749 -0.582 6.389 154 1HD LYS 17 2HD LYS 17 7.385 -0.771 8.656 155 2HD LYS 17 1HD LYS 17 5.637 -0.931 8.467 156 1HE LYS 17 2HE LYS 17 6.614 -3.193 7.190 157 2HE LYS 17 1HE LYS 17 7.692 -3.015 8.578 158 1HZ LYS 17 1HZ LYS 17 5.936 -4.231 9.422 159 2HZ LYS 17 2HZ LYS 17 4.766 -3.372 8.539 160 3HZ LYS 17 3HZ LYS 17 5.524 -2.649 9.877 161 H CYS 18 H CYS 18 5.843 2.435 3.610 162 HA CYS 18 HA CYS 18 8.272 1.245 2.428 163 1HB CYS 18 2HB CYS 18 5.745 1.364 1.015 164 2HB CYS 18 1HB CYS 18 6.942 2.383 0.214 165 HG CYS 18 HG CYS 18 7.001 -0.661 0.325 166 H LEU 19 H LEU 19 9.602 2.900 1.350 167 HA LEU 19 HA LEU 19 9.347 5.517 2.624 168 1HB LEU 19 2HB LEU 19 11.385 4.041 1.115 169 2HB LEU 19 1HB LEU 19 11.328 5.749 0.692 170 HG LEU 19 HG LEU 19 11.188 5.125 3.593 171 1HD1 LEU 19 1HD1 LEU 19 12.940 3.655 3.369 172 2HD1 LEU 19 2HD1 LEU 19 13.870 5.154 3.329 173 3HD1 LEU 19 3HD1 LEU 19 13.455 4.335 1.824 174 1HD2 LEU 19 1HD2 LEU 19 12.717 7.119 1.884 175 2HD2 LEU 19 2HD2 LEU 19 12.713 7.101 3.647 176 3HD2 LEU 19 3HD2 LEU 19 11.223 7.437 2.765 177 H ALA 20 H ALA 20 8.814 7.470 1.604 178 HA ALA 20 HA ALA 20 6.981 7.397 -0.589 179 1HB ALA 20 1HB ALA 20 7.024 9.217 1.089 180 2HB ALA 20 2HB ALA 20 7.140 9.854 -0.551 181 3HB ALA 20 3HB ALA 20 8.582 9.753 0.459 182 H GLU 21 H GLU 21 10.459 7.525 -0.515 183 HA GLU 21 HA GLU 21 10.741 8.597 -3.225 184 1HB GLU 21 2HB GLU 21 13.141 8.052 -2.932 185 2HB GLU 21 1HB GLU 21 12.518 8.982 -1.571 186 1HG GLU 21 2HG GLU 21 13.367 7.354 -0.249 187 2HG GLU 21 1HG GLU 21 12.035 6.350 -0.815 188 H ASP 22 H ASP 22 10.299 5.463 -1.765 189 HA ASP 22 HA ASP 22 11.447 3.843 -3.825 190 1HB ASP 22 2HB ASP 22 9.517 3.425 -1.599 191 2HB ASP 22 1HB ASP 22 9.476 2.244 -2.907 192 H SER 23 H SER 23 10.355 2.699 -5.548 193 HA SER 23 HA SER 23 8.272 4.339 -6.826 194 1HB SER 23 2HB SER 23 8.641 2.852 -8.775 195 2HB SER 23 1HB SER 23 10.149 3.546 -8.189 196 HG SER 23 HG SER 23 9.846 1.099 -8.607 197 H VAL 24 H VAL 24 6.402 3.166 -7.908 198 HA VAL 24 HA VAL 24 4.804 1.801 -5.972 199 HB VAL 24 HB VAL 24 4.534 1.897 -8.995 200 1HG1 VAL 24 1HG1 VAL 24 2.500 0.851 -8.833 201 2HG1 VAL 24 2HG1 VAL 24 2.171 1.514 -7.233 202 3HG1 VAL 24 3HG1 VAL 24 3.240 0.124 -7.408 203 1HG2 VAL 24 1HG2 VAL 24 4.498 4.104 -7.862 204 2HG2 VAL 24 2HG2 VAL 24 3.212 3.527 -6.802 205 3HG2 VAL 24 3HG2 VAL 24 2.920 3.695 -8.532 206 H GLY 25 H GLY 25 6.955 0.626 -8.536 207 1HA GLY 25 2HA GLY 25 6.218 -2.119 -8.552 208 2HA GLY 25 1HA GLY 25 7.836 -1.518 -8.920 209 H ASP 26 H ASP 26 8.566 -0.370 -6.497 210 HA ASP 26 HA ASP 26 9.330 -2.664 -4.921 211 1HB ASP 26 2HB ASP 26 10.617 -0.489 -5.080 212 2HB ASP 26 1HB ASP 26 9.374 0.249 -4.070 213 H PHE 27 H PHE 27 6.812 -0.183 -4.612 214 HA PHE 27 HA PHE 27 5.879 -0.836 -1.994 215 1HB PHE 27 2HB PHE 27 5.227 1.195 -3.330 216 2HB PHE 27 1HB PHE 27 4.237 0.154 -4.350 217 HD1 PHE 27 HD1 PHE 27 4.811 0.483 -0.643 218 HD2 PHE 27 HD2 PHE 27 1.975 0.309 -3.864 219 HE1 PHE 27 HE1 PHE 27 2.951 0.654 0.984 220 HE2 PHE 27 HE2 PHE 27 0.115 0.478 -2.236 221 HZ PHE 27 HZ PHE 27 0.602 0.650 0.188 222 H LYS 28 H LYS 28 5.043 -2.134 -5.203 223 HA LYS 28 HA LYS 28 2.994 -3.946 -4.240 224 1HB LYS 28 2HB LYS 28 4.596 -3.780 -6.802 225 2HB LYS 28 1HB LYS 28 3.420 -5.063 -6.513 226 1HG LYS 28 2HG LYS 28 1.623 -3.484 -6.305 227 2HG LYS 28 1HG LYS 28 2.743 -2.122 -6.269 228 1HD LYS 28 2HD LYS 28 3.444 -2.637 -8.583 229 2HD LYS 28 1HD LYS 28 2.314 -3.991 -8.621 230 1HE LYS 28 2HE LYS 28 0.425 -2.568 -8.530 231 2HE LYS 28 1HE LYS 28 1.380 -1.194 -7.978 232 1HZ LYS 28 1HZ LYS 28 1.534 -2.464 -10.659 233 2HZ LYS 28 2HZ LYS 28 2.505 -1.175 -10.129 234 3HZ LYS 28 3HZ LYS 28 0.829 -0.963 -10.304 235 H LYS 29 H LYS 29 6.493 -4.161 -4.726 236 HA LYS 29 HA LYS 29 6.743 -7.010 -4.472 237 1HB LYS 29 2HB LYS 29 8.621 -4.689 -4.080 238 2HB LYS 29 1HB LYS 29 9.128 -6.325 -3.657 239 1HG LYS 29 2HG LYS 29 8.550 -7.078 -5.951 240 2HG LYS 29 1HG LYS 29 8.114 -5.420 -6.367 241 1HD LYS 29 2HD LYS 29 10.636 -5.143 -5.243 242 2HD LYS 29 1HD LYS 29 10.766 -6.644 -6.157 243 1HE LYS 29 2HE LYS 29 10.802 -5.524 -8.110 244 2HE LYS 29 1HE LYS 29 9.317 -4.668 -7.695 245 1HZ LYS 29 1HZ LYS 29 11.000 -3.380 -6.136 246 2HZ LYS 29 2HZ LYS 29 10.733 -2.923 -7.750 247 3HZ LYS 29 3HZ LYS 29 12.096 -3.852 -7.342 248 H VAL 30 H VAL 30 6.833 -4.373 -2.064 249 HA VAL 30 HA VAL 30 7.410 -6.101 0.180 250 HB VAL 30 HB VAL 30 6.053 -3.381 0.159 251 1HG1 VAL 30 1HG1 VAL 30 7.263 -3.424 2.506 252 2HG1 VAL 30 2HG1 VAL 30 7.154 -5.172 2.304 253 3HG1 VAL 30 3HG1 VAL 30 5.687 -4.193 2.313 254 1HG2 VAL 30 1HG2 VAL 30 8.141 -2.396 0.121 255 2HG2 VAL 30 2HG2 VAL 30 8.515 -3.841 -0.817 256 3HG2 VAL 30 3HG2 VAL 30 8.922 -3.774 0.897 257 H LEU 31 H LEU 31 4.418 -4.960 -1.351 258 HA LEU 31 HA LEU 31 2.641 -6.021 0.674 259 1HB LEU 31 2HB LEU 31 2.369 -4.891 -2.068 260 2HB LEU 31 1HB LEU 31 1.066 -5.944 -1.517 261 HG LEU 31 HG LEU 31 2.023 -3.905 0.425 262 1HD1 LEU 31 1HD1 LEU 31 1.534 -3.078 -2.185 263 2HD1 LEU 31 2HD1 LEU 31 1.456 -2.061 -0.747 264 3HD1 LEU 31 3HD1 LEU 31 -0.009 -2.817 -1.373 265 1HD2 LEU 31 1HD2 LEU 31 -0.424 -5.431 -0.264 266 2HD2 LEU 31 2HD2 LEU 31 -0.700 -3.787 0.310 267 3HD2 LEU 31 3HD2 LEU 31 0.185 -4.934 1.314 268 H SER 32 H SER 32 3.652 -7.215 -2.552 269 HA SER 32 HA SER 32 2.204 -9.627 -2.601 270 1HB SER 32 2HB SER 32 3.977 -10.462 -4.131 271 2HB SER 32 1HB SER 32 3.456 -8.832 -4.539 272 HG SER 32 HG SER 32 5.792 -9.221 -4.449 273 H LEU 33 H LEU 33 4.925 -8.818 -0.574 274 HA LEU 33 HA LEU 33 5.747 -11.555 -0.051 275 1HB LEU 33 2HB LEU 33 6.556 -8.883 0.766 276 2HB LEU 33 1HB LEU 33 6.510 -9.978 2.146 277 HG LEU 33 HG LEU 33 8.726 -9.994 1.033 278 1HD1 LEU 33 1HD1 LEU 33 8.083 -12.017 2.176 279 2HD1 LEU 33 2HD1 LEU 33 8.833 -12.490 0.651 280 3HD1 LEU 33 3HD1 LEU 33 7.077 -12.528 0.820 281 1HD2 LEU 33 1HD2 LEU 33 8.964 -10.151 -1.211 282 2HD2 LEU 33 2HD2 LEU 33 7.226 -9.870 -1.311 283 3HD2 LEU 33 3HD2 LEU 33 7.854 -11.519 -1.308 284 H GLN 34 H GLN 34 3.612 -9.217 1.620 285 HA GLN 34 HA GLN 34 3.043 -11.128 3.768 286 1HB GLN 34 2HB GLN 34 1.558 -9.410 4.660 287 2HB GLN 34 1HB GLN 34 3.102 -8.691 4.210 288 1HG GLN 34 2HG GLN 34 2.073 -8.008 2.021 289 2HG GLN 34 1HG GLN 34 0.520 -8.587 2.623 290 1HE2 GLN 34 1HE2 GLN 34 2.952 -6.043 2.960 291 2HE2 GLN 34 2HE2 GLN 34 2.029 -5.049 3.980 292 H ILE 35 H ILE 35 1.365 -10.021 0.822 293 HA ILE 35 HA ILE 35 -0.983 -11.693 1.527 294 HB ILE 35 HB ILE 35 -1.761 -10.859 -0.834 295 1HG1 ILE 35 2HG1 ILE 35 0.304 -8.746 -0.167 296 2HG1 ILE 35 1HG1 ILE 35 0.525 -9.963 -1.422 297 1HG2 ILE 35 1HG2 ILE 35 -2.722 -8.901 0.186 298 2HG2 ILE 35 2HG2 ILE 35 -1.452 -8.854 1.410 299 3HG2 ILE 35 3HG2 ILE 35 -2.635 -10.163 1.415 300 1HD1 ILE 35 1HD1 ILE 35 -0.331 -7.833 -2.355 301 2HD1 ILE 35 2HD1 ILE 35 -1.745 -7.952 -1.310 302 3HD1 ILE 35 3HD1 ILE 35 -1.486 -9.144 -2.581 303 H GLY 36 H GLY 36 1.851 -11.827 -0.518 304 1HA GLY 36 2HA GLY 36 2.701 -13.626 -1.777 305 2HA GLY 36 1HA GLY 36 1.419 -14.632 -1.094 306 H THR 37 H THR 37 1.209 -11.647 -3.022 307 HA THR 37 HA THR 37 -0.429 -13.154 -5.023 308 HB THR 37 HB THR 37 -0.644 -10.177 -4.685 309 HG1 THR 37 HG1 THR 37 -1.944 -12.116 -3.068 310 1HG2 THR 37 1HG2 THR 37 -3.136 -11.486 -4.968 311 2HG2 THR 37 2HG2 THR 37 -2.021 -12.282 -6.079 312 3HG2 THR 37 3HG2 THR 37 -2.274 -10.539 -6.181 313 H GLN 38 H GLN 38 2.588 -11.870 -4.642 314 HA GLN 38 HA GLN 38 4.275 -11.285 -6.146 315 1HB GLN 38 2HB GLN 38 2.161 -12.277 -8.060 316 2HB GLN 38 1HB GLN 38 3.676 -11.596 -8.649 317 1HG GLN 38 2HG GLN 38 4.835 -13.454 -8.097 318 2HG GLN 38 1HG GLN 38 4.098 -13.526 -6.496 319 1HE2 GLN 38 1HE2 GLN 38 2.037 -14.703 -6.282 320 2HE2 GLN 38 2HE2 GLN 38 1.539 -15.804 -7.474 321 HA PRO 39 HA PRO 39 3.429 -7.066 -7.046 322 1HB PRO 39 2HB PRO 39 5.599 -6.516 -8.652 323 2HB PRO 39 1HB PRO 39 5.688 -6.670 -6.889 324 1HG PRO 39 2HG PRO 39 6.563 -8.602 -8.992 325 2HG PRO 39 1HG PRO 39 7.189 -8.369 -7.352 326 1HD PRO 39 2HD PRO 39 5.462 -10.441 -8.153 327 2HD PRO 39 1HD PRO 39 5.767 -9.944 -6.475 328 H ASN 40 H ASN 40 3.619 -9.448 -9.563 329 HA ASN 40 HA ASN 40 2.797 -7.607 -11.706 330 1HB ASN 40 2HB ASN 40 3.646 -10.441 -11.492 331 2HB ASN 40 1HB ASN 40 2.480 -10.089 -12.768 332 1HD2 ASN 40 1HD2 ASN 40 5.785 -9.496 -11.670 333 2HD2 ASN 40 2HD2 ASN 40 6.303 -8.706 -13.080 334 H LYS 41 H LYS 41 1.248 -9.561 -9.292 335 HA LYS 41 HA LYS 41 -1.332 -9.456 -10.799 336 1HB LYS 41 2HB LYS 41 -0.095 -11.464 -9.153 337 2HB LYS 41 1HB LYS 41 -1.613 -10.965 -8.408 338 1HG LYS 41 2HG LYS 41 -2.568 -11.179 -10.840 339 2HG LYS 41 1HG LYS 41 -1.148 -12.194 -11.108 340 1HD LYS 41 2HD LYS 41 -2.097 -13.111 -8.676 341 2HD LYS 41 1HD LYS 41 -3.581 -12.763 -9.564 342 1HE LYS 41 2HE LYS 41 -3.285 -14.529 -10.936 343 2HE LYS 41 1HE LYS 41 -1.604 -14.096 -11.244 344 1HZ LYS 41 1HZ LYS 41 -2.312 -16.260 -9.898 345 2HZ LYS 41 2HZ LYS 41 -2.201 -15.167 -8.603 346 3HZ LYS 41 3HZ LYS 41 -0.860 -15.435 -9.610 347 H ILE 42 H ILE 42 0.281 -7.592 -8.586 348 HA ILE 42 HA ILE 42 -2.140 -7.042 -6.940 349 HB ILE 42 HB ILE 42 0.766 -6.244 -6.613 350 1HG1 ILE 42 2HG1 ILE 42 -1.045 -7.699 -4.677 351 2HG1 ILE 42 1HG1 ILE 42 -0.150 -8.564 -5.927 352 1HG2 ILE 42 1HG2 ILE 42 -1.584 -5.463 -4.862 353 2HG2 ILE 42 2HG2 ILE 42 -0.790 -4.372 -5.995 354 3HG2 ILE 42 3HG2 ILE 42 0.104 -5.016 -4.619 355 1HD1 ILE 42 1HD1 ILE 42 1.054 -8.442 -3.721 356 2HD1 ILE 42 2HD1 ILE 42 1.136 -6.692 -3.921 357 3HD1 ILE 42 3HD1 ILE 42 1.962 -7.751 -5.065 358 H VAL 43 H VAL 43 -3.415 -5.392 -7.518 359 HA VAL 43 HA VAL 43 -2.280 -3.190 -9.205 360 HB VAL 43 HB VAL 43 -5.165 -4.130 -8.967 361 1HG1 VAL 43 1HG1 VAL 43 -4.183 -1.645 -9.738 362 2HG1 VAL 43 2HG1 VAL 43 -5.765 -2.303 -10.156 363 3HG1 VAL 43 3HG1 VAL 43 -4.410 -2.488 -11.270 364 1HG2 VAL 43 1HG2 VAL 43 -4.171 -5.813 -10.242 365 2HG2 VAL 43 2HG2 VAL 43 -2.956 -4.726 -10.917 366 3HG2 VAL 43 3HG2 VAL 43 -4.620 -4.657 -11.496 367 H LEU 44 H LEU 44 -1.753 -1.599 -7.710 368 HA LEU 44 HA LEU 44 -3.641 -1.079 -5.469 369 1HB LEU 44 2HB LEU 44 -0.805 -0.160 -5.996 370 2HB LEU 44 1HB LEU 44 -1.776 0.418 -4.642 371 HG LEU 44 HG LEU 44 -1.662 -2.531 -5.006 372 1HD1 LEU 44 1HD1 LEU 44 0.576 -2.717 -4.927 373 2HD1 LEU 44 2HD1 LEU 44 0.588 -1.813 -3.413 374 3HD1 LEU 44 3HD1 LEU 44 0.739 -0.962 -4.950 375 1HD2 LEU 44 1HD2 LEU 44 -2.873 -1.332 -3.154 376 2HD2 LEU 44 2HD2 LEU 44 -1.313 -0.749 -2.574 377 3HD2 LEU 44 3HD2 LEU 44 -1.663 -2.477 -2.577 378 H GLN 45 H GLN 45 -4.564 0.975 -5.124 379 HA GLN 45 HA GLN 45 -4.250 2.978 -7.320 380 1HB GLN 45 2HB GLN 45 -6.957 2.662 -6.114 381 2HB GLN 45 1HB GLN 45 -6.508 3.108 -7.756 382 1HG GLN 45 2HG GLN 45 -5.730 0.677 -8.039 383 2HG GLN 45 1HG GLN 45 -6.585 0.343 -6.532 384 1HE2 GLN 45 1HE2 GLN 45 -6.994 0.573 -9.916 385 2HE2 GLN 45 2HE2 GLN 45 -8.691 0.634 -9.944 386 H LYS 46 H LYS 46 -4.015 5.053 -6.556 387 HA LYS 46 HA LYS 46 -4.333 5.463 -3.620 388 1HB LYS 46 2HB LYS 46 -2.194 6.038 -5.179 389 2HB LYS 46 1HB LYS 46 -3.063 7.567 -5.297 390 1HG LYS 46 2HG LYS 46 -3.165 6.756 -2.570 391 2HG LYS 46 1HG LYS 46 -1.496 6.569 -3.106 392 1HD LYS 46 2HD LYS 46 -1.188 8.813 -3.348 393 2HD LYS 46 1HD LYS 46 -2.803 9.057 -4.015 394 1HE LYS 46 2HE LYS 46 -3.267 8.310 -1.364 395 2HE LYS 46 1HE LYS 46 -1.876 9.388 -1.271 396 1HZ LYS 46 1HZ LYS 46 -3.832 10.702 -1.151 397 2HZ LYS 46 2HZ LYS 46 -4.506 9.953 -2.518 398 3HZ LYS 46 3HZ LYS 46 -3.150 10.964 -2.680 399 H GLY 47 H GLY 47 -6.523 5.956 -3.410 400 1HA GLY 47 2HA GLY 47 -8.337 7.457 -3.308 401 2HA GLY 47 1HA GLY 47 -7.354 8.636 -4.177 402 H GLY 48 H GLY 48 -7.332 8.567 -6.498 403 1HA GLY 48 2HA GLY 48 -9.323 6.757 -7.785 404 2HA GLY 48 1HA GLY 48 -9.458 8.498 -8.040 405 H SER 49 H SER 49 -6.620 6.317 -7.934 406 HA SER 49 HA SER 49 -6.092 6.774 -10.798 407 1HB SER 49 2HB SER 49 -3.810 7.682 -10.358 408 2HB SER 49 1HB SER 49 -5.082 8.768 -9.806 409 HG SER 49 HG SER 49 -3.328 8.372 -8.283 410 H VAL 50 H VAL 50 -4.903 5.087 -11.668 411 HA VAL 50 HA VAL 50 -4.380 2.781 -9.935 412 HB VAL 50 HB VAL 50 -3.785 3.156 -12.891 413 1HG1 VAL 50 1HG1 VAL 50 -4.109 0.541 -12.661 414 2HG1 VAL 50 2HG1 VAL 50 -3.660 0.844 -10.982 415 3HG1 VAL 50 3HG1 VAL 50 -2.551 1.278 -12.283 416 1HG2 VAL 50 1HG2 VAL 50 -5.903 1.800 -13.153 417 2HG2 VAL 50 2HG2 VAL 50 -6.163 3.425 -12.521 418 3HG2 VAL 50 3HG2 VAL 50 -6.198 2.039 -11.431 419 H LEU 51 H LEU 51 -2.428 2.264 -9.061 420 HA LEU 51 HA LEU 51 -0.150 4.072 -9.528 421 1HB LEU 51 2HB LEU 51 -0.297 1.648 -7.711 422 2HB LEU 51 1HB LEU 51 0.890 2.951 -7.648 423 HG LEU 51 HG LEU 51 -2.086 3.207 -7.113 424 1HD1 LEU 51 1HD1 LEU 51 -0.097 4.032 -5.097 425 2HD1 LEU 51 2HD1 LEU 51 -0.120 2.301 -5.432 426 3HD1 LEU 51 3HD1 LEU 51 -1.590 3.115 -4.899 427 1HD2 LEU 51 1HD2 LEU 51 -0.927 5.178 -8.283 428 2HD2 LEU 51 2HD2 LEU 51 0.032 5.349 -6.813 429 3HD2 LEU 51 3HD2 LEU 51 -1.720 5.539 -6.751 430 H LYS 52 H LYS 52 1.486 3.626 -10.900 431 HA LYS 52 HA LYS 52 1.775 0.816 -11.889 432 1HB LYS 52 2HB LYS 52 1.098 2.867 -13.455 433 2HB LYS 52 1HB LYS 52 2.840 3.131 -13.454 434 1HG LYS 52 2HG LYS 52 2.471 1.689 -15.295 435 2HG LYS 52 1HG LYS 52 3.052 0.627 -14.013 436 1HD LYS 52 2HD LYS 52 0.186 0.924 -13.829 437 2HD LYS 52 1HD LYS 52 0.637 0.391 -15.449 438 1HE LYS 52 2HE LYS 52 1.745 -1.540 -14.631 439 2HE LYS 52 1HE LYS 52 1.813 -0.908 -12.986 440 1HZ LYS 52 1HZ LYS 52 -0.716 -1.570 -14.393 441 2HZ LYS 52 2HZ LYS 52 -0.534 -1.151 -12.758 442 3HZ LYS 52 3HZ LYS 52 0.082 -2.628 -13.336 443 H ASP 53 H ASP 53 3.854 -0.054 -11.973 444 HA ASP 53 HA ASP 53 5.785 0.800 -10.083 445 1HB ASP 53 2HB ASP 53 7.296 -0.824 -11.160 446 2HB ASP 53 1HB ASP 53 5.679 -1.502 -10.975 447 H HIS 54 H HIS 54 5.315 1.770 -13.421 448 HA HIS 54 HA HIS 54 7.937 2.849 -13.899 449 1HB HIS 54 2HB HIS 54 5.238 3.506 -15.112 450 2HB HIS 54 1HB HIS 54 6.767 4.147 -15.713 451 HD1 HIS 54 HD1 HIS 54 4.669 1.078 -15.666 452 HD2 HIS 54 HD2 HIS 54 8.519 2.142 -16.857 453 HE1 HIS 54 HE1 HIS 54 5.532 -0.832 -17.086 454 H ILE 55 H ILE 55 5.321 3.990 -11.938 455 HA ILE 55 HA ILE 55 6.516 6.732 -11.886 456 HB ILE 55 HB ILE 55 3.772 5.791 -10.986 457 1HG1 ILE 55 2HG1 ILE 55 3.357 7.642 -12.933 458 2HG1 ILE 55 1HG1 ILE 55 4.866 6.928 -13.502 459 1HG2 ILE 55 1HG2 ILE 55 3.381 8.315 -10.871 460 2HG2 ILE 55 2HG2 ILE 55 5.134 8.493 -10.954 461 3HG2 ILE 55 3HG2 ILE 55 4.397 7.636 -9.600 462 1HD1 ILE 55 1HD1 ILE 55 3.648 5.234 -14.350 463 2HD1 ILE 55 2HD1 ILE 55 2.186 5.821 -13.557 464 3HD1 ILE 55 3HD1 ILE 55 3.289 4.749 -12.694 465 H SER 56 H SER 56 6.989 7.668 -9.819 466 HA SER 56 HA SER 56 7.685 5.674 -7.767 467 1HB SER 56 2HB SER 56 9.002 7.870 -8.642 468 2HB SER 56 1HB SER 56 8.165 8.554 -7.252 469 HG SER 56 HG SER 56 10.289 7.535 -6.876 470 H LEU 57 H LEU 57 7.105 5.993 -5.488 471 HA LEU 57 HA LEU 57 4.313 6.455 -5.071 472 1HB LEU 57 2HB LEU 57 6.646 6.301 -3.142 473 2HB LEU 57 1HB LEU 57 4.975 6.474 -2.606 474 HG LEU 57 HG LEU 57 5.763 4.276 -4.515 475 1HD1 LEU 57 1HD1 LEU 57 5.527 3.166 -1.943 476 2HD1 LEU 57 2HD1 LEU 57 6.569 4.573 -1.741 477 3HD1 LEU 57 3HD1 LEU 57 7.004 3.314 -2.896 478 1HD2 LEU 57 1HD2 LEU 57 3.342 4.930 -4.049 479 2HD2 LEU 57 2HD2 LEU 57 3.604 4.393 -2.390 480 3HD2 LEU 57 3HD2 LEU 57 3.741 3.244 -3.721 481 H GLU 58 H GLU 58 7.150 8.543 -4.621 482 HA GLU 58 HA GLU 58 5.855 10.695 -3.266 483 1HB GLU 58 2HB GLU 58 7.738 12.083 -4.084 484 2HB GLU 58 1HB GLU 58 8.302 10.545 -3.437 485 1HG GLU 58 2HG GLU 58 8.254 9.654 -5.822 486 2HG GLU 58 1HG GLU 58 7.993 11.315 -6.350 487 H ASP 59 H ASP 59 5.970 9.824 -6.689 488 HA ASP 59 HA ASP 59 4.971 12.324 -7.722 489 1HB ASP 59 2HB ASP 59 4.896 9.494 -8.807 490 2HB ASP 59 1HB ASP 59 4.298 10.885 -9.709 491 H TYR 60 H TYR 60 3.373 9.280 -6.752 492 HA TYR 60 HA TYR 60 0.697 10.219 -7.350 493 1HB TYR 60 2HB TYR 60 1.788 7.913 -5.729 494 2HB TYR 60 1HB TYR 60 0.058 8.240 -5.831 495 HD1 TYR 60 HD1 TYR 60 -0.825 8.688 -8.318 496 HD2 TYR 60 HD2 TYR 60 2.724 6.483 -7.314 497 HE1 TYR 60 HE1 TYR 60 -0.910 7.548 -10.518 498 HE2 TYR 60 HE2 TYR 60 2.637 5.345 -9.514 499 HH TYR 60 HH TYR 60 0.002 5.225 -11.423 500 H GLU 61 H GLU 61 2.878 10.790 -4.742 501 HA GLU 61 HA GLU 61 2.664 12.199 -2.892 502 1HB GLU 61 2HB GLU 61 0.622 13.072 -4.528 503 2HB GLU 61 1HB GLU 61 -0.244 12.631 -3.056 504 1HG GLU 61 2HG GLU 61 0.393 14.890 -2.714 505 2HG GLU 61 1HG GLU 61 1.577 13.956 -1.800 506 H VAL 62 H VAL 62 2.797 9.636 -2.317 507 HA VAL 62 HA VAL 62 0.470 8.729 -0.752 508 HB VAL 62 HB VAL 62 3.256 7.543 -1.015 509 1HG1 VAL 62 1HG1 VAL 62 0.709 6.189 -0.097 510 2HG1 VAL 62 2HG1 VAL 62 1.860 6.908 1.028 511 3HG1 VAL 62 3HG1 VAL 62 2.357 5.569 -0.005 512 1HG2 VAL 62 1HG2 VAL 62 0.863 7.495 -2.726 513 2HG2 VAL 62 2HG2 VAL 62 1.470 5.889 -2.325 514 3HG2 VAL 62 3HG2 VAL 62 2.527 7.060 -3.112 515 H HIS 63 H HIS 63 0.156 9.594 1.245 516 HA HIS 63 HA HIS 63 2.503 10.637 2.750 517 1HB HIS 63 2HB HIS 63 -0.476 11.100 2.984 518 2HB HIS 63 1HB HIS 63 0.663 11.651 4.214 519 HD1 HIS 63 HD1 HIS 63 -0.636 12.457 0.848 520 HD2 HIS 63 HD2 HIS 63 2.594 13.606 3.219 521 HE1 HIS 63 HE1 HIS 63 0.313 14.557 -0.202 522 H ASP 64 H ASP 64 2.205 10.393 5.244 523 HA ASP 64 HA ASP 64 2.289 7.580 5.875 524 1HB ASP 64 2HB ASP 64 3.436 9.635 7.056 525 2HB ASP 64 1HB ASP 64 1.935 9.699 7.980 526 H GLN 65 H GLN 65 0.747 6.275 6.789 527 HA GLN 65 HA GLN 65 -1.372 5.507 7.387 528 1HB GLN 65 2HB GLN 65 -1.458 8.308 8.534 529 2HB GLN 65 1HB GLN 65 -2.757 7.140 8.771 530 1HG GLN 65 2HG GLN 65 0.116 6.469 9.423 531 2HG GLN 65 1HG GLN 65 -0.943 7.248 10.598 532 1HE2 GLN 65 1HE2 GLN 65 -0.482 4.259 8.706 533 2HE2 GLN 65 2HE2 GLN 65 -1.541 3.312 9.633 534 H THR 66 H THR 66 -1.073 6.418 4.721 535 HA THR 66 HA THR 66 -3.521 7.961 4.098 536 HB THR 66 HB THR 66 -1.314 8.340 2.892 537 HG1 THR 66 HG1 THR 66 -2.700 9.137 1.560 538 1HG2 THR 66 1HG2 THR 66 -1.248 5.616 2.663 539 2HG2 THR 66 2HG2 THR 66 -0.322 6.720 1.647 540 3HG2 THR 66 3HG2 THR 66 -1.862 6.080 1.076 541 H ASN 67 H ASN 67 -5.129 7.067 2.581 542 HA ASN 67 HA ASN 67 -5.509 4.152 3.034 543 1HB ASN 67 2HB ASN 67 -7.291 6.474 2.653 544 2HB ASN 67 1HB ASN 67 -7.800 5.016 1.802 545 1HD2 ASN 67 1HD2 ASN 67 -8.293 3.091 3.106 546 2HD2 ASN 67 2HD2 ASN 67 -8.561 3.215 4.777 547 H LEU 68 H LEU 68 -5.248 2.725 1.407 548 HA LEU 68 HA LEU 68 -5.157 3.756 -1.404 549 1HB LEU 68 2HB LEU 68 -3.274 1.990 0.111 550 2HB LEU 68 1HB LEU 68 -3.517 1.664 -1.604 551 HG LEU 68 HG LEU 68 -3.112 4.514 -0.932 552 1HD1 LEU 68 1HD1 LEU 68 -0.891 2.469 -0.625 553 2HD1 LEU 68 2HD1 LEU 68 -1.532 3.508 0.647 554 3HD1 LEU 68 3HD1 LEU 68 -0.649 4.214 -0.707 555 1HD2 LEU 68 1HD2 LEU 68 -1.274 3.549 -2.846 556 2HD2 LEU 68 2HD2 LEU 68 -2.776 4.415 -3.160 557 3HD2 LEU 68 3HD2 LEU 68 -2.769 2.653 -3.125 558 H GLU 69 H GLU 69 -5.637 2.048 -3.035 559 HA GLU 69 HA GLU 69 -7.681 0.135 -1.992 560 1HB GLU 69 2HB GLU 69 -7.281 1.369 -4.732 561 2HB GLU 69 1HB GLU 69 -8.452 0.093 -4.403 562 1HG GLU 69 2HG GLU 69 -9.881 1.787 -3.914 563 2HG GLU 69 1HG GLU 69 -8.993 1.901 -2.394 564 H LEU 70 H LEU 70 -7.567 -2.063 -2.627 565 HA LEU 70 HA LEU 70 -5.045 -2.876 -4.015 566 1HB LEU 70 2HB LEU 70 -4.869 -3.342 -1.606 567 2HB LEU 70 1HB LEU 70 -6.390 -4.233 -1.655 568 HG LEU 70 HG LEU 70 -5.411 -5.880 -3.183 569 1HD1 LEU 70 1HD1 LEU 70 -2.947 -4.123 -2.973 570 2HD1 LEU 70 2HD1 LEU 70 -3.877 -4.476 -4.430 571 3HD1 LEU 70 3HD1 LEU 70 -2.942 -5.750 -3.651 572 1HD2 LEU 70 1HD2 LEU 70 -3.230 -6.206 -1.457 573 2HD2 LEU 70 2HD2 LEU 70 -4.847 -6.869 -1.231 574 3HD2 LEU 70 3HD2 LEU 70 -4.418 -5.324 -0.499 575 H TYR 71 H TYR 71 -5.383 -4.160 -5.754 576 HA TYR 71 HA TYR 71 -7.918 -5.725 -5.931 577 1HB TYR 71 2HB TYR 71 -6.815 -3.726 -7.896 578 2HB TYR 71 1HB TYR 71 -7.796 -5.077 -8.464 579 HD1 TYR 71 HD1 TYR 71 -7.788 -1.881 -6.729 580 HD2 TYR 71 HD2 TYR 71 -10.132 -5.372 -7.605 581 HE1 TYR 71 HE1 TYR 71 -9.842 -0.668 -6.061 582 HE2 TYR 71 HE2 TYR 71 -12.188 -4.159 -6.935 583 HH TYR 71 HH TYR 71 -12.120 -1.218 -5.248 584 H TYR 72 H TYR 72 -7.728 -7.649 -7.214 585 HA TYR 72 HA TYR 72 -4.895 -8.461 -7.720 586 1HB TYR 72 2HB TYR 72 -7.330 -10.203 -7.220 587 2HB TYR 72 1HB TYR 72 -5.679 -10.780 -7.450 588 HD1 TYR 72 HD1 TYR 72 -3.990 -9.073 -5.905 589 HD2 TYR 72 HD2 TYR 72 -7.966 -10.421 -4.987 590 HE1 TYR 72 HE1 TYR 72 -3.543 -8.748 -3.488 591 HE2 TYR 72 HE2 TYR 72 -7.516 -10.096 -2.570 592 HH TYR 72 HH TYR 72 -4.687 -9.942 -1.233 593 H LEU 73 HN LEU 73 -4.322 -8.617 -9.802 594 HA LEU 73 HA LEU 73 -4.405 -9.087 -12.092 595 1HB LEU 73 2HB LEU 73 -6.395 -10.761 -11.051 596 2HB LEU 73 1HB LEU 73 -7.195 -9.882 -12.354 597 HG LEU 73 HG LEU 73 -4.785 -10.471 -13.513 598 1HD1 LEU 73 1HD1 LEU 73 -4.494 -12.949 -13.019 599 2HD1 LEU 73 2HD1 LEU 73 -5.518 -12.705 -11.603 600 3HD1 LEU 73 3HD1 LEU 73 -3.976 -11.859 -11.733 601 1HD2 LEU 73 1HD2 LEU 73 -7.325 -12.132 -13.459 602 2HD2 LEU 73 2HD2 LEU 73 -6.046 -12.308 -14.659 603 3HD2 LEU 73 3HD2 LEU 73 -6.960 -10.805 -14.561 Start of MODEL 4 1 H MET 1 1H MET 1 10.083 7.342 4.964 2 HA MET 1 HA MET 1 9.483 5.033 4.676 3 1HB MET 1 2HB MET 1 11.136 4.745 6.982 4 2HB MET 1 1HB MET 1 9.516 4.203 7.422 5 1HG MET 1 2HG MET 1 9.463 2.600 5.659 6 2HG MET 1 1HG MET 1 10.872 3.309 4.872 7 1HE MET 1 1HE MET 1 11.858 0.515 4.921 8 2HE MET 1 2HE MET 1 13.371 0.935 5.723 9 3HE MET 1 3HE MET 1 12.597 2.099 4.650 10 H ILE 2 H ILE 2 7.288 5.001 4.644 11 HA ILE 2 HA ILE 2 5.828 6.334 6.890 12 HB ILE 2 HB ILE 2 4.110 7.019 5.224 13 1HG1 ILE 2 2HG1 ILE 2 6.055 6.448 3.013 14 2HG1 ILE 2 1HG1 ILE 2 5.040 5.129 3.595 15 1HG2 ILE 2 1HG2 ILE 2 6.054 8.452 3.867 16 2HG2 ILE 2 2HG2 ILE 2 6.870 8.003 5.364 17 3HG2 ILE 2 3HG2 ILE 2 5.353 8.900 5.422 18 1HD1 ILE 2 1HD1 ILE 2 4.310 7.152 1.773 19 2HD1 ILE 2 2HD1 ILE 2 3.460 7.530 3.271 20 3HD1 ILE 2 3HD1 ILE 2 3.249 5.952 2.511 21 H GLU 3 H GLU 3 3.590 5.509 7.180 22 HA GLU 3 HA GLU 3 3.407 2.607 6.458 23 1HB GLU 3 2HB GLU 3 3.496 3.697 8.974 24 2HB GLU 3 1HB GLU 3 1.757 3.606 8.698 25 1HG GLU 3 2HG GLU 3 3.481 1.238 8.028 26 2HG GLU 3 1HG GLU 3 3.027 1.532 9.706 27 H VAL 4 H VAL 4 1.622 1.993 5.279 28 HA VAL 4 HA VAL 4 -0.663 3.920 5.123 29 HB VAL 4 HB VAL 4 -0.859 3.419 2.705 30 1HG1 VAL 4 1HG1 VAL 4 0.440 5.380 3.425 31 2HG1 VAL 4 2HG1 VAL 4 1.156 4.663 1.981 32 3HG1 VAL 4 3HG1 VAL 4 1.888 4.383 3.561 33 1HG2 VAL 4 1HG2 VAL 4 0.555 1.977 1.572 34 2HG2 VAL 4 2HG2 VAL 4 0.488 1.163 3.134 35 3HG2 VAL 4 3HG2 VAL 4 1.869 2.183 2.730 36 H VAL 5 H VAL 5 -2.721 2.949 4.593 37 HA VAL 5 HA VAL 5 -2.867 0.067 5.370 38 HB VAL 5 HB VAL 5 -5.272 0.569 5.895 39 1HG1 VAL 5 1HG1 VAL 5 -2.903 1.606 7.266 40 2HG1 VAL 5 2HG1 VAL 5 -4.287 0.731 7.920 41 3HG1 VAL 5 3HG1 VAL 5 -4.373 2.479 7.699 42 1HG2 VAL 5 1HG2 VAL 5 -4.722 2.929 4.428 43 2HG2 VAL 5 2HG2 VAL 5 -4.973 3.442 6.096 44 3HG2 VAL 5 3HG2 VAL 5 -6.221 2.517 5.260 45 H VAL 6 H VAL 6 -3.328 -1.342 3.758 46 HA VAL 6 HA VAL 6 -4.458 -0.263 1.217 47 HB VAL 6 HB VAL 6 -3.300 -3.029 1.583 48 1HG1 VAL 6 1HG1 VAL 6 -3.064 -1.305 -0.857 49 2HG1 VAL 6 2HG1 VAL 6 -4.623 -2.045 -0.496 50 3HG1 VAL 6 3HG1 VAL 6 -3.199 -3.060 -0.735 51 1HG2 VAL 6 1HG2 VAL 6 -1.855 -0.720 2.130 52 2HG2 VAL 6 2HG2 VAL 6 -1.506 -1.008 0.426 53 3HG2 VAL 6 3HG2 VAL 6 -1.163 -2.259 1.621 54 H ASN 7 H ASN 7 -6.591 -0.580 0.891 55 HA ASN 7 HA ASN 7 -7.914 -2.870 2.286 56 1HB ASN 7 2HB ASN 7 -8.977 -0.193 1.355 57 2HB ASN 7 1HB ASN 7 -10.027 -1.513 1.875 58 1HD2 ASN 7 1HD2 ASN 7 -7.440 0.684 3.009 59 2HD2 ASN 7 2HD2 ASN 7 -7.777 0.485 4.661 60 H ASP 8 H ASP 8 -8.273 -4.546 0.930 61 HA ASP 8 HA ASP 8 -8.340 -4.208 -1.965 62 1HB ASP 8 2HB ASP 8 -7.480 -6.256 -0.652 63 2HB ASP 8 1HB ASP 8 -9.178 -6.693 -0.464 64 H ARG 9 H ARG 9 -10.150 -4.344 -3.315 65 HA ARG 9 HA ARG 9 -12.643 -3.385 -2.312 66 1HB ARG 9 2HB ARG 9 -11.566 -3.614 -4.802 67 2HB ARG 9 1HB ARG 9 -12.739 -4.929 -4.838 68 1HG ARG 9 2HG ARG 9 -14.360 -3.131 -3.804 69 2HG ARG 9 1HG ARG 9 -13.213 -1.983 -4.492 70 1HD ARG 9 2HD ARG 9 -14.256 -2.244 -6.471 71 2HD ARG 9 1HD ARG 9 -13.645 -3.895 -6.506 72 HE ARG 9 HE ARG 9 -16.353 -3.079 -5.603 73 1HH1 ARG 9 1HH2 ARG 9 -16.148 -4.923 -7.863 74 2HH1 ARG 9 2HH2 ARG 9 -16.313 -6.481 -7.126 75 1HH2 ARG 9 2HH1 ARG 9 -15.612 -5.321 -3.917 76 2HH2 ARG 9 1HH1 ARG 9 -16.004 -6.714 -4.868 77 H LEU 10 H LEU 10 -11.545 -6.702 -3.032 78 HA LEU 10 HA LEU 10 -14.093 -7.975 -2.712 79 1HB LEU 10 2HB LEU 10 -11.338 -8.796 -3.032 80 2HB LEU 10 1HB LEU 10 -12.108 -9.763 -1.775 81 HG LEU 10 HG LEU 10 -14.031 -9.562 -3.815 82 1HD1 LEU 10 1HD1 LEU 10 -11.255 -10.081 -4.920 83 2HD1 LEU 10 2HD1 LEU 10 -12.364 -8.794 -5.397 84 3HD1 LEU 10 3HD1 LEU 10 -12.747 -10.474 -5.773 85 1HD2 LEU 10 1HD2 LEU 10 -13.773 -11.948 -3.932 86 2HD2 LEU 10 2HD2 LEU 10 -13.409 -11.491 -2.268 87 3HD2 LEU 10 3HD2 LEU 10 -12.097 -11.858 -3.390 88 H GLY 11 H GLY 11 -11.436 -7.442 -0.365 89 1HA GLY 11 2HA GLY 11 -12.674 -6.640 1.872 90 2HA GLY 11 1HA GLY 11 -13.195 -8.325 1.849 91 H LYS 12 H LYS 12 -10.164 -6.459 1.436 92 HA LYS 12 HA LYS 12 -8.846 -8.326 3.347 93 1HB LYS 12 2HB LYS 12 -8.498 -8.761 0.730 94 2HB LYS 12 1HB LYS 12 -7.306 -7.478 0.932 95 1HG LYS 12 2HG LYS 12 -5.880 -9.006 1.751 96 2HG LYS 12 1HG LYS 12 -6.951 -9.195 3.140 97 1HD LYS 12 2HD LYS 12 -7.920 -11.114 2.310 98 2HD LYS 12 1HD LYS 12 -7.706 -10.618 0.631 99 1HE LYS 12 2HE LYS 12 -5.115 -10.862 1.350 100 2HE LYS 12 1HE LYS 12 -5.829 -12.054 2.434 101 1HZ LYS 12 1HZ LYS 12 -5.513 -12.128 -0.423 102 2HZ LYS 12 2HZ LYS 12 -7.075 -12.555 0.089 103 3HZ LYS 12 3HZ LYS 12 -5.722 -13.400 0.677 104 H LYS 13 H LYS 13 -8.151 -6.982 4.945 105 HA LYS 13 HA LYS 13 -7.128 -4.281 4.185 106 1HB LYS 13 2HB LYS 13 -9.033 -4.824 6.007 107 2HB LYS 13 1HB LYS 13 -7.613 -4.982 7.042 108 1HG LYS 13 2HG LYS 13 -7.248 -2.667 5.409 109 2HG LYS 13 1HG LYS 13 -8.864 -2.583 6.111 110 1HD LYS 13 2HD LYS 13 -7.729 -1.692 7.891 111 2HD LYS 13 1HD LYS 13 -7.469 -3.393 8.284 112 1HE LYS 13 2HE LYS 13 -5.447 -2.786 6.442 113 2HE LYS 13 1HE LYS 13 -5.530 -1.370 7.488 114 1HZ LYS 13 1HZ LYS 13 -4.550 -3.981 8.060 115 2HZ LYS 13 2HZ LYS 13 -5.731 -3.514 9.185 116 3HZ LYS 13 3HZ LYS 13 -4.361 -2.544 8.937 117 H VAL 14 H VAL 14 -4.945 -4.282 3.981 118 HA VAL 14 HA VAL 14 -3.343 -5.811 5.997 119 HB VAL 14 HB VAL 14 -2.592 -5.380 3.089 120 1HG1 VAL 14 1HG1 VAL 14 -0.630 -5.663 4.427 121 2HG1 VAL 14 2HG1 VAL 14 -0.949 -7.239 3.703 122 3HG1 VAL 14 3HG1 VAL 14 -1.382 -6.938 5.386 123 1HG2 VAL 14 1HG2 VAL 14 -4.365 -6.913 2.945 124 2HG2 VAL 14 2HG2 VAL 14 -3.997 -7.634 4.513 125 3HG2 VAL 14 3HG2 VAL 14 -2.968 -7.975 3.121 126 H ARG 15 H ARG 15 -1.459 -4.793 6.743 127 HA ARG 15 HA ARG 15 -1.248 -1.876 6.124 128 1HB ARG 15 2HB ARG 15 -0.536 -3.553 8.530 129 2HB ARG 15 1HB ARG 15 0.176 -1.957 8.296 130 1HG ARG 15 2HG ARG 15 -2.558 -1.597 7.796 131 2HG ARG 15 1HG ARG 15 -2.491 -2.659 9.202 132 1HD ARG 15 2HD ARG 15 -0.616 -0.952 9.979 133 2HD ARG 15 1HD ARG 15 -1.474 0.132 8.886 134 HE ARG 15 HE ARG 15 -3.079 -1.304 10.926 135 1HH1 ARG 15 2HH1 ARG 15 -1.227 0.901 11.998 136 2HH1 ARG 15 1HH1 ARG 15 -2.295 2.263 11.988 137 1HH2 ARG 15 1HH2 ARG 15 -4.639 0.740 9.910 138 2HH2 ARG 15 2HH2 ARG 15 -4.240 2.174 10.797 139 H VAL 16 H VAL 16 0.563 -1.172 5.058 140 HA VAL 16 HA VAL 16 3.027 -2.833 5.185 141 HB VAL 16 HB VAL 16 1.742 -3.469 3.134 142 1HG1 VAL 16 1HG1 VAL 16 2.412 -0.949 1.754 143 2HG1 VAL 16 2HG1 VAL 16 1.130 -0.802 2.956 144 3HG1 VAL 16 3HG1 VAL 16 0.968 -1.953 1.631 145 1HG2 VAL 16 1HG2 VAL 16 3.640 -3.500 1.730 146 2HG2 VAL 16 2HG2 VAL 16 4.324 -3.373 3.351 147 3HG2 VAL 16 3HG2 VAL 16 4.217 -1.943 2.324 148 H LYS 17 H LYS 17 4.913 -1.624 5.185 149 HA LYS 17 HA LYS 17 4.563 1.343 5.019 150 1HB LYS 17 2HB LYS 17 6.481 1.530 6.538 151 2HB LYS 17 1HB LYS 17 5.225 0.524 7.256 152 1HG LYS 17 2HG LYS 17 6.811 -1.051 7.567 153 2HG LYS 17 1HG LYS 17 6.819 -1.279 5.819 154 1HD LYS 17 2HD LYS 17 8.428 0.812 5.852 155 2HD LYS 17 1HD LYS 17 8.692 0.330 7.528 156 1HE LYS 17 2HE LYS 17 10.288 -1.025 6.613 157 2HE LYS 17 1HE LYS 17 8.914 -2.082 6.296 158 1HZ LYS 17 1HZ LYS 17 10.542 -1.350 4.392 159 2HZ LYS 17 2HZ LYS 17 9.522 0.008 4.336 160 3HZ LYS 17 3HZ LYS 17 8.883 -1.549 4.101 161 H CYS 18 H CYS 18 5.986 2.548 3.766 162 HA CYS 18 HA CYS 18 8.316 1.288 2.486 163 1HB CYS 18 2HB CYS 18 5.737 1.574 1.114 164 2HB CYS 18 1HB CYS 18 7.060 2.362 0.255 165 HG CYS 18 HG CYS 18 7.107 -0.117 -0.503 166 H LEU 19 H LEU 19 9.508 2.940 1.126 167 HA LEU 19 HA LEU 19 9.396 5.566 2.460 168 1HB LEU 19 2HB LEU 19 11.332 4.106 0.727 169 2HB LEU 19 1HB LEU 19 11.368 5.866 0.652 170 HG LEU 19 HG LEU 19 11.159 5.014 3.402 171 1HD1 LEU 19 1HD1 LEU 19 13.396 3.925 3.558 172 2HD1 LEU 19 2HD1 LEU 19 13.465 3.871 1.795 173 3HD1 LEU 19 3HD1 LEU 19 12.236 2.947 2.658 174 1HD2 LEU 19 1HD2 LEU 19 12.495 6.828 3.616 175 2HD2 LEU 19 2HD2 LEU 19 12.347 7.028 1.871 176 3HD2 LEU 19 3HD2 LEU 19 13.715 6.139 2.544 177 H ALA 20 H ALA 20 9.124 7.558 1.317 178 HA ALA 20 HA ALA 20 7.160 7.511 -0.795 179 1HB ALA 20 1HB ALA 20 7.070 9.450 0.524 180 2HB ALA 20 2HB ALA 20 7.869 10.028 -0.939 181 3HB ALA 20 3HB ALA 20 8.821 9.664 0.500 182 H GLU 21 H GLU 21 10.644 7.459 -0.768 183 HA GLU 21 HA GLU 21 10.960 8.378 -3.526 184 1HB GLU 21 2HB GLU 21 13.325 7.697 -3.223 185 2HB GLU 21 1HB GLU 21 12.773 8.728 -1.905 186 1HG GLU 21 2HG GLU 21 13.513 7.117 -0.502 187 2HG GLU 21 1HG GLU 21 12.138 6.154 -1.037 188 H ASP 22 H ASP 22 10.298 5.354 -1.934 189 HA ASP 22 HA ASP 22 11.331 3.589 -3.950 190 1HB ASP 22 2HB ASP 22 9.473 3.354 -1.638 191 2HB ASP 22 1HB ASP 22 9.308 2.134 -2.900 192 H SER 23 H SER 23 10.160 2.482 -5.622 193 HA SER 23 HA SER 23 8.090 4.161 -6.865 194 1HB SER 23 2HB SER 23 8.365 2.656 -8.803 195 2HB SER 23 1HB SER 23 9.917 3.277 -8.253 196 HG SER 23 HG SER 23 9.830 0.962 -8.653 197 H VAL 24 H VAL 24 6.144 3.064 -7.849 198 HA VAL 24 HA VAL 24 4.562 1.767 -5.858 199 HB VAL 24 HB VAL 24 4.211 1.843 -8.872 200 1HG1 VAL 24 1HG1 VAL 24 2.124 1.290 -6.744 201 2HG1 VAL 24 2HG1 VAL 24 2.912 0.028 -7.692 202 3HG1 VAL 24 3HG1 VAL 24 1.905 1.233 -8.494 203 1HG2 VAL 24 1HG2 VAL 24 2.344 3.490 -7.565 204 2HG2 VAL 24 2HG2 VAL 24 3.745 4.019 -8.495 205 3HG2 VAL 24 3HG2 VAL 24 3.877 3.798 -6.750 206 H GLY 25 H GLY 25 6.647 0.500 -8.418 207 1HA GLY 25 2HA GLY 25 5.788 -2.220 -8.397 208 2HA GLY 25 1HA GLY 25 7.412 -1.679 -8.832 209 H ASP 26 H ASP 26 8.342 -0.557 -6.515 210 HA ASP 26 HA ASP 26 9.095 -2.807 -4.912 211 1HB ASP 26 2HB ASP 26 10.301 -0.544 -5.148 212 2HB ASP 26 1HB ASP 26 9.143 0.069 -3.967 213 H PHE 27 H PHE 27 6.592 -0.316 -4.523 214 HA PHE 27 HA PHE 27 5.743 -0.986 -1.883 215 1HB PHE 27 2HB PHE 27 5.038 1.050 -3.204 216 2HB PHE 27 1HB PHE 27 3.993 0.000 -4.159 217 HD1 PHE 27 HD1 PHE 27 4.424 1.741 -0.992 218 HD2 PHE 27 HD2 PHE 27 2.131 -1.255 -3.045 219 HE1 PHE 27 HE1 PHE 27 2.666 1.889 0.748 220 HE2 PHE 27 HE2 PHE 27 0.375 -1.105 -1.305 221 HZ PHE 27 HZ PHE 27 0.643 0.465 0.591 222 H LYS 28 H LYS 28 4.680 -2.187 -5.072 223 HA LYS 28 HA LYS 28 2.713 -4.032 -4.052 224 1HB LYS 28 2HB LYS 28 4.225 -3.866 -6.671 225 2HB LYS 28 1HB LYS 28 3.015 -5.110 -6.352 226 1HG LYS 28 2HG LYS 28 1.292 -3.456 -6.037 227 2HG LYS 28 1HG LYS 28 2.469 -2.144 -6.080 228 1HD LYS 28 2HD LYS 28 2.958 -2.569 -8.409 229 2HD LYS 28 1HD LYS 28 1.977 -4.034 -8.395 230 1HE LYS 28 2HE LYS 28 -0.042 -2.829 -8.235 231 2HE LYS 28 1HE LYS 28 0.770 -1.366 -7.680 232 1HZ LYS 28 1HZ LYS 28 -0.016 -1.608 -10.144 233 2HZ LYS 28 2HZ LYS 28 1.455 -2.439 -10.323 234 3HZ LYS 28 3HZ LYS 28 1.447 -0.830 -9.777 235 H LYS 29 H LYS 29 6.193 -4.206 -4.531 236 HA LYS 29 HA LYS 29 6.439 -7.078 -4.378 237 1HB LYS 29 2HB LYS 29 8.406 -4.846 -3.786 238 2HB LYS 29 1HB LYS 29 8.835 -6.557 -3.808 239 1HG LYS 29 2HG LYS 29 7.488 -6.268 -6.198 240 2HG LYS 29 1HG LYS 29 8.335 -4.728 -6.055 241 1HD LYS 29 2HD LYS 29 10.161 -5.802 -6.827 242 2HD LYS 29 1HD LYS 29 10.236 -6.588 -5.254 243 1HE LYS 29 2HE LYS 29 8.348 -7.753 -7.232 244 2HE LYS 29 1HE LYS 29 10.066 -7.986 -7.546 245 1HZ LYS 29 1HZ LYS 29 10.357 -9.043 -5.485 246 2HZ LYS 29 2HZ LYS 29 8.946 -9.725 -6.141 247 3HZ LYS 29 3HZ LYS 29 8.835 -8.557 -4.913 248 H VAL 30 H VAL 30 6.750 -4.473 -1.940 249 HA VAL 30 HA VAL 30 7.294 -6.254 0.269 250 HB VAL 30 HB VAL 30 6.112 -3.455 0.328 251 1HG1 VAL 30 1HG1 VAL 30 7.851 -4.561 2.489 252 2HG1 VAL 30 2HG1 VAL 30 6.188 -5.143 2.411 253 3HG1 VAL 30 3HG1 VAL 30 6.511 -3.419 2.598 254 1HG2 VAL 30 1HG2 VAL 30 8.531 -2.824 0.796 255 2HG2 VAL 30 2HG2 VAL 30 8.208 -3.358 -0.853 256 3HG2 VAL 30 3HG2 VAL 30 8.973 -4.456 0.295 257 H LEU 31 H LEU 31 4.323 -4.789 -1.030 258 HA LEU 31 HA LEU 31 2.577 -5.791 1.037 259 1HB LEU 31 2HB LEU 31 1.997 -3.904 -0.496 260 2HB LEU 31 1HB LEU 31 1.893 -5.055 -1.828 261 HG LEU 31 HG LEU 31 0.159 -6.316 -0.488 262 1HD1 LEU 31 1HD1 LEU 31 0.947 -5.154 1.689 263 2HD1 LEU 31 2HD1 LEU 31 -0.787 -5.370 1.462 264 3HD1 LEU 31 3HD1 LEU 31 -0.048 -3.797 1.163 265 1HD2 LEU 31 1HD2 LEU 31 -0.750 -5.000 -2.205 266 2HD2 LEU 31 2HD2 LEU 31 -0.226 -3.491 -1.457 267 3HD2 LEU 31 3HD2 LEU 31 -1.587 -4.385 -0.779 268 H SER 32 H SER 32 3.504 -7.013 -2.179 269 HA SER 32 HA SER 32 1.788 -9.229 -2.411 270 1HB SER 32 2HB SER 32 3.336 -8.500 -4.190 271 2HB SER 32 1HB SER 32 4.704 -9.051 -3.231 272 HG SER 32 HG SER 32 4.350 -10.917 -4.113 273 H LEU 33 H LEU 33 4.673 -8.881 -0.387 274 HA LEU 33 HA LEU 33 5.024 -11.675 0.203 275 1HB LEU 33 2HB LEU 33 5.831 -9.143 1.644 276 2HB LEU 33 1HB LEU 33 6.218 -10.743 2.276 277 HG LEU 33 HG LEU 33 6.868 -10.168 -0.587 278 1HD1 LEU 33 1HD1 LEU 33 8.826 -9.424 1.573 279 2HD1 LEU 33 2HD1 LEU 33 7.642 -8.241 1.013 280 3HD1 LEU 33 3HD1 LEU 33 8.801 -8.933 -0.122 281 1HD2 LEU 33 1HD2 LEU 33 8.931 -11.539 0.277 282 2HD2 LEU 33 2HD2 LEU 33 7.392 -12.368 0.042 283 3HD2 LEU 33 3HD2 LEU 33 7.896 -11.886 1.663 284 H GLN 34 H GLN 34 3.020 -9.137 1.668 285 HA GLN 34 HA GLN 34 2.187 -10.858 3.891 286 1HB GLN 34 2HB GLN 34 1.272 -8.133 2.938 287 2HB GLN 34 1HB GLN 34 0.585 -8.950 4.344 288 1HG GLN 34 2HG GLN 34 2.755 -9.009 5.437 289 2HG GLN 34 1HG GLN 34 3.537 -8.346 4.002 290 1HE2 GLN 34 1HE2 GLN 34 2.868 -6.072 3.367 291 2HE2 GLN 34 2HE2 GLN 34 2.351 -5.009 4.585 292 H ILE 35 H ILE 35 0.506 -9.435 1.045 293 HA ILE 35 HA ILE 35 -1.891 -11.013 1.508 294 HB ILE 35 HB ILE 35 -2.533 -10.236 -0.811 295 1HG1 ILE 35 2HG1 ILE 35 0.068 -8.686 -0.610 296 2HG1 ILE 35 1HG1 ILE 35 -0.193 -10.060 -1.681 297 1HG2 ILE 35 1HG2 ILE 35 -3.251 -8.251 0.046 298 2HG2 ILE 35 2HG2 ILE 35 -1.643 -7.787 0.604 299 3HG2 ILE 35 3HG2 ILE 35 -2.611 -8.921 1.546 300 1HD1 ILE 35 1HD1 ILE 35 -2.345 -8.540 -2.330 301 2HD1 ILE 35 2HD1 ILE 35 -0.794 -8.427 -3.163 302 3HD1 ILE 35 3HD1 ILE 35 -1.196 -7.276 -1.889 303 H GLY 36 H GLY 36 1.082 -11.571 -0.270 304 1HA GLY 36 2HA GLY 36 1.829 -13.492 -1.406 305 2HA GLY 36 1HA GLY 36 0.479 -14.360 -0.667 306 H THR 37 H THR 37 0.572 -11.571 -2.883 307 HA THR 37 HA THR 37 -1.252 -13.075 -4.717 308 HB THR 37 HB THR 37 -1.046 -10.066 -4.495 309 HG1 THR 37 HG1 THR 37 -3.029 -10.405 -3.198 310 1HG2 THR 37 1HG2 THR 37 -3.633 -11.184 -5.119 311 2HG2 THR 37 2HG2 THR 37 -2.412 -11.813 -6.225 312 3HG2 THR 37 3HG2 THR 37 -2.643 -10.072 -6.065 313 H GLN 38 H GLN 38 1.910 -12.244 -4.526 314 HA GLN 38 HA GLN 38 3.603 -12.080 -6.130 315 1HB GLN 38 2HB GLN 38 1.387 -13.275 -7.531 316 2HB GLN 38 1HB GLN 38 2.210 -12.146 -8.606 317 1HG GLN 38 2HG GLN 38 4.313 -13.435 -7.349 318 2HG GLN 38 1HG GLN 38 3.127 -14.725 -7.551 319 1HE2 GLN 38 1HE2 GLN 38 2.212 -14.961 -9.851 320 2HE2 GLN 38 2HE2 GLN 38 3.237 -14.589 -11.150 321 HA PRO 39 HA PRO 39 3.480 -7.808 -7.171 322 1HB PRO 39 2HB PRO 39 5.718 -7.709 -8.772 323 2HB PRO 39 1HB PRO 39 5.771 -7.813 -7.004 324 1HG PRO 39 2HG PRO 39 6.303 -9.943 -9.029 325 2HG PRO 39 1HG PRO 39 6.950 -9.766 -7.390 326 1HD PRO 39 2HD PRO 39 4.882 -11.523 -8.151 327 2HD PRO 39 1HD PRO 39 5.271 -11.044 -6.484 328 H ASN 40 H ASN 40 2.966 -10.263 -9.496 329 HA ASN 40 HA ASN 40 2.513 -8.310 -11.697 330 1HB ASN 40 2HB ASN 40 2.725 -11.329 -11.633 331 2HB ASN 40 1HB ASN 40 2.205 -10.439 -13.064 332 1HD2 ASN 40 1HD2 ASN 40 3.811 -9.075 -14.160 333 2HD2 ASN 40 2HD2 ASN 40 5.468 -9.228 -13.824 334 H LYS 41 H LYS 41 0.753 -9.714 -9.191 335 HA LYS 41 HA LYS 41 -1.776 -9.550 -10.788 336 1HB LYS 41 2HB LYS 41 -0.733 -11.682 -9.119 337 2HB LYS 41 1HB LYS 41 -2.287 -11.117 -8.509 338 1HG LYS 41 2HG LYS 41 -3.283 -12.329 -10.121 339 2HG LYS 41 1HG LYS 41 -2.586 -11.220 -11.303 340 1HD LYS 41 2HD LYS 41 -0.478 -12.936 -10.600 341 2HD LYS 41 1HD LYS 41 -1.883 -13.988 -10.756 342 1HE LYS 41 2HE LYS 41 -2.196 -13.469 -13.002 343 2HE LYS 41 1HE LYS 41 -1.398 -11.904 -12.857 344 1HZ LYS 41 1HZ LYS 41 0.464 -13.880 -12.200 345 2HZ LYS 41 2HZ LYS 41 0.466 -12.845 -13.547 346 3HZ LYS 41 3HZ LYS 41 -0.292 -14.364 -13.637 347 H ILE 42 H ILE 42 -0.203 -7.580 -8.950 348 HA ILE 42 HA ILE 42 -2.458 -7.007 -7.068 349 HB ILE 42 HB ILE 42 0.479 -6.263 -6.876 350 1HG1 ILE 42 2HG1 ILE 42 -1.187 -7.901 -4.956 351 2HG1 ILE 42 1HG1 ILE 42 -0.324 -8.644 -6.301 352 1HG2 ILE 42 1HG2 ILE 42 -0.089 -4.640 -5.421 353 2HG2 ILE 42 2HG2 ILE 42 -1.059 -5.776 -4.485 354 3HG2 ILE 42 3HG2 ILE 42 -1.782 -4.901 -5.834 355 1HD1 ILE 42 1HD1 ILE 42 0.980 -8.634 -4.150 356 2HD1 ILE 42 2HD1 ILE 42 0.991 -6.872 -4.224 357 3HD1 ILE 42 3HD1 ILE 42 1.800 -7.811 -5.478 358 H VAL 43 H VAL 43 -3.546 -5.130 -7.350 359 HA VAL 43 HA VAL 43 -2.366 -3.048 -9.149 360 HB VAL 43 HB VAL 43 -5.284 -3.875 -8.926 361 1HG1 VAL 43 1HG1 VAL 43 -3.852 -1.629 -10.321 362 2HG1 VAL 43 2HG1 VAL 43 -5.372 -1.594 -9.427 363 3HG1 VAL 43 3HG1 VAL 43 -5.315 -2.308 -11.039 364 1HG2 VAL 43 1HG2 VAL 43 -3.113 -4.882 -10.519 365 2HG2 VAL 43 2HG2 VAL 43 -4.251 -4.050 -11.579 366 3HG2 VAL 43 3HG2 VAL 43 -4.809 -5.367 -10.547 367 H LEU 44 H LEU 44 -1.852 -1.367 -7.818 368 HA LEU 44 HA LEU 44 -3.532 -0.867 -5.416 369 1HB LEU 44 2HB LEU 44 -0.724 -0.279 -6.198 370 2HB LEU 44 1HB LEU 44 -1.518 0.901 -5.155 371 HG LEU 44 HG LEU 44 -2.060 -1.834 -4.301 372 1HD1 LEU 44 1HD1 LEU 44 0.347 -2.055 -3.373 373 2HD1 LEU 44 2HD1 LEU 44 0.793 -0.916 -4.644 374 3HD1 LEU 44 3HD1 LEU 44 0.081 -2.473 -5.065 375 1HD2 LEU 44 1HD2 LEU 44 -1.479 -0.912 -2.144 376 2HD2 LEU 44 2HD2 LEU 44 -2.383 0.324 -3.021 377 3HD2 LEU 44 3HD2 LEU 44 -0.628 0.439 -2.894 378 H GLN 45 H GLN 45 -4.648 1.053 -5.107 379 HA GLN 45 HA GLN 45 -4.535 3.061 -7.321 380 1HB GLN 45 2HB GLN 45 -7.113 2.542 -5.875 381 2HB GLN 45 1HB GLN 45 -6.856 3.179 -7.495 382 1HG GLN 45 2HG GLN 45 -5.755 0.534 -7.391 383 2HG GLN 45 1HG GLN 45 -7.390 0.481 -6.736 384 1HE2 GLN 45 1HE2 GLN 45 -9.082 1.712 -8.169 385 2HE2 GLN 45 2HE2 GLN 45 -8.891 1.568 -9.849 386 H LYS 46 H LYS 46 -4.940 5.248 -6.664 387 HA LYS 46 HA LYS 46 -5.032 5.702 -3.714 388 1HB LYS 46 2HB LYS 46 -2.800 6.153 -5.417 389 2HB LYS 46 1HB LYS 46 -3.446 7.735 -4.984 390 1HG LYS 46 2HG LYS 46 -3.566 6.401 -2.581 391 2HG LYS 46 1HG LYS 46 -2.096 5.736 -3.294 392 1HD LYS 46 2HD LYS 46 -0.973 7.649 -2.897 393 2HD LYS 46 1HD LYS 46 -2.205 8.591 -3.736 394 1HE LYS 46 2HE LYS 46 -3.610 8.309 -1.576 395 2HE LYS 46 1HE LYS 46 -2.091 7.838 -0.816 396 1HZ LYS 46 1HZ LYS 46 -2.194 10.118 -0.495 397 2HZ LYS 46 2HZ LYS 46 -2.816 10.421 -2.051 398 3HZ LYS 46 3HZ LYS 46 -1.191 9.975 -1.855 399 H GLY 47 H GLY 47 -7.047 6.602 -3.546 400 1HA GLY 47 2HA GLY 47 -8.757 8.187 -3.768 401 2HA GLY 47 1HA GLY 47 -7.530 9.277 -4.415 402 H GLY 48 H GLY 48 -8.839 6.178 -5.650 403 1HA GLY 48 2HA GLY 48 -9.882 5.668 -7.689 404 2HA GLY 48 1HA GLY 48 -10.361 7.363 -7.783 405 H SER 49 H SER 49 -7.103 5.897 -7.706 406 HA SER 49 HA SER 49 -6.634 6.797 -10.499 407 1HB SER 49 2HB SER 49 -5.783 8.329 -8.320 408 2HB SER 49 1HB SER 49 -4.351 7.413 -8.782 409 HG SER 49 HG SER 49 -4.351 9.184 -10.073 410 H VAL 50 H VAL 50 -5.301 5.371 -11.590 411 HA VAL 50 HA VAL 50 -4.552 2.906 -10.207 412 HB VAL 50 HB VAL 50 -3.721 2.181 -12.447 413 1HG1 VAL 50 1HG1 VAL 50 -6.118 1.946 -11.759 414 2HG1 VAL 50 2HG1 VAL 50 -5.902 2.089 -13.503 415 3HG1 VAL 50 3HG1 VAL 50 -6.459 3.477 -12.567 416 1HG2 VAL 50 1HG2 VAL 50 -4.594 4.972 -13.271 417 2HG2 VAL 50 2HG2 VAL 50 -4.170 3.678 -14.390 418 3HG2 VAL 50 3HG2 VAL 50 -2.948 4.342 -13.307 419 H LEU 51 H LEU 51 -2.631 2.502 -9.263 420 HA LEU 51 HA LEU 51 -0.392 4.410 -9.680 421 1HB LEU 51 2HB LEU 51 -0.500 2.112 -7.704 422 2HB LEU 51 1HB LEU 51 0.567 3.514 -7.668 423 HG LEU 51 HG LEU 51 -2.451 3.617 -7.367 424 1HD1 LEU 51 1HD1 LEU 51 -1.041 2.612 -5.456 425 2HD1 LEU 51 2HD1 LEU 51 -2.111 3.953 -5.048 426 3HD1 LEU 51 3HD1 LEU 51 -0.383 4.235 -5.256 427 1HD2 LEU 51 1HD2 LEU 51 -2.268 5.847 -7.656 428 2HD2 LEU 51 2HD2 LEU 51 -0.592 5.602 -8.143 429 3HD2 LEU 51 3HD2 LEU 51 -0.979 5.937 -6.456 430 H LYS 52 H LYS 52 1.353 3.857 -10.905 431 HA LYS 52 HA LYS 52 1.584 1.002 -11.766 432 1HB LYS 52 2HB LYS 52 1.809 3.587 -13.200 433 2HB LYS 52 1HB LYS 52 2.975 2.343 -13.662 434 1HG LYS 52 2HG LYS 52 0.676 0.877 -13.516 435 2HG LYS 52 1HG LYS 52 0.050 2.431 -14.070 436 1HD LYS 52 2HD LYS 52 1.510 2.435 -15.974 437 2HD LYS 52 1HD LYS 52 2.414 1.050 -15.357 438 1HE LYS 52 2HE LYS 52 -0.506 0.649 -15.667 439 2HE LYS 52 1HE LYS 52 0.406 0.819 -17.164 440 1HZ LYS 52 1HZ LYS 52 0.173 -1.492 -16.156 441 2HZ LYS 52 2HZ LYS 52 1.326 -0.986 -15.015 442 3HZ LYS 52 3HZ LYS 52 1.715 -1.012 -16.671 443 H ASP 53 H ASP 53 3.654 0.064 -11.862 444 HA ASP 53 HA ASP 53 5.521 0.845 -9.861 445 1HB ASP 53 2HB ASP 53 7.004 -0.872 -10.823 446 2HB ASP 53 1HB ASP 53 5.352 -1.471 -10.698 447 H HIS 54 H HIS 54 5.307 1.698 -13.268 448 HA HIS 54 HA HIS 54 7.975 2.687 -13.610 449 1HB HIS 54 2HB HIS 54 5.352 3.282 -14.978 450 2HB HIS 54 1HB HIS 54 6.849 4.084 -15.453 451 HD1 HIS 54 HD1 HIS 54 5.133 0.752 -15.482 452 HD2 HIS 54 HD2 HIS 54 8.779 2.372 -16.685 453 HE1 HIS 54 HE1 HIS 54 6.255 -1.003 -16.922 454 H ILE 55 H ILE 55 5.312 3.986 -11.806 455 HA ILE 55 HA ILE 55 6.618 6.675 -11.769 456 HB ILE 55 HB ILE 55 3.808 5.855 -10.961 457 1HG1 ILE 55 2HG1 ILE 55 3.493 7.659 -12.933 458 2HG1 ILE 55 1HG1 ILE 55 5.053 7.000 -13.420 459 1HG2 ILE 55 1HG2 ILE 55 3.506 8.389 -10.875 460 2HG2 ILE 55 2HG2 ILE 55 5.265 8.509 -10.901 461 3HG2 ILE 55 3HG2 ILE 55 4.455 7.691 -9.564 462 1HD1 ILE 55 1HD1 ILE 55 2.598 5.884 -14.023 463 2HD1 ILE 55 2HD1 ILE 55 3.125 4.931 -12.635 464 3HD1 ILE 55 3HD1 ILE 55 4.142 5.033 -14.073 465 H SER 56 H SER 56 7.192 7.596 -9.763 466 HA SER 56 HA SER 56 7.697 5.656 -7.625 467 1HB SER 56 2HB SER 56 9.169 7.715 -8.491 468 2HB SER 56 1HB SER 56 8.263 8.556 -7.238 469 HG SER 56 HG SER 56 10.066 7.681 -6.286 470 H LEU 57 H LEU 57 7.052 6.029 -5.387 471 HA LEU 57 HA LEU 57 4.272 6.634 -5.073 472 1HB LEU 57 2HB LEU 57 6.521 6.366 -3.057 473 2HB LEU 57 1HB LEU 57 4.834 6.592 -2.593 474 HG LEU 57 HG LEU 57 5.604 4.394 -4.504 475 1HD1 LEU 57 1HD1 LEU 57 5.478 2.992 -2.264 476 2HD1 LEU 57 2HD1 LEU 57 5.990 4.513 -1.533 477 3HD1 LEU 57 3HD1 LEU 57 6.996 3.742 -2.760 478 1HD2 LEU 57 1HD2 LEU 57 3.295 5.090 -2.709 479 2HD2 LEU 57 2HD2 LEU 57 3.585 3.401 -3.125 480 3HD2 LEU 57 3HD2 LEU 57 3.277 4.582 -4.397 481 H GLU 58 H GLU 58 7.196 8.576 -4.630 482 HA GLU 58 HA GLU 58 6.024 10.793 -3.265 483 1HB GLU 58 2HB GLU 58 7.962 12.092 -4.243 484 2HB GLU 58 1HB GLU 58 8.426 10.629 -3.378 485 1HG GLU 58 2HG GLU 58 9.234 9.637 -5.256 486 2HG GLU 58 1HG GLU 58 7.876 10.183 -6.237 487 H ASP 59 H ASP 59 6.045 9.889 -6.678 488 HA ASP 59 HA ASP 59 5.139 12.444 -7.694 489 1HB ASP 59 2HB ASP 59 4.954 9.639 -8.840 490 2HB ASP 59 1HB ASP 59 4.505 11.097 -9.724 491 H TYR 60 H TYR 60 3.496 9.439 -6.700 492 HA TYR 60 HA TYR 60 0.833 10.408 -7.328 493 1HB TYR 60 2HB TYR 60 1.875 8.106 -5.666 494 2HB TYR 60 1HB TYR 60 0.151 8.452 -5.813 495 HD1 TYR 60 HD1 TYR 60 -0.590 8.969 -8.375 496 HD2 TYR 60 HD2 TYR 60 2.750 6.554 -7.165 497 HE1 TYR 60 HE1 TYR 60 -0.640 7.804 -10.563 498 HE2 TYR 60 HE2 TYR 60 2.701 5.390 -9.354 499 HH TYR 60 HH TYR 60 1.234 6.507 -12.000 500 H GLU 61 H GLU 61 3.023 10.979 -4.729 501 HA GLU 61 HA GLU 61 2.835 12.408 -2.895 502 1HB GLU 61 2HB GLU 61 0.634 13.158 -4.523 503 2HB GLU 61 1HB GLU 61 0.022 13.019 -2.875 504 1HG GLU 61 2HG GLU 61 1.161 14.849 -2.187 505 2HG GLU 61 1HG GLU 61 2.637 14.336 -3.003 506 H VAL 62 H VAL 62 2.907 9.850 -2.282 507 HA VAL 62 HA VAL 62 0.553 9.025 -0.716 508 HB VAL 62 HB VAL 62 3.312 7.769 -0.922 509 1HG1 VAL 62 1HG1 VAL 62 0.855 6.226 -0.227 510 2HG1 VAL 62 2HG1 VAL 62 1.528 7.271 1.023 511 3HG1 VAL 62 3HG1 VAL 62 2.518 5.996 0.314 512 1HG2 VAL 62 1HG2 VAL 62 2.677 7.006 -2.945 513 2HG2 VAL 62 2HG2 VAL 62 1.188 7.943 -2.824 514 3HG2 VAL 62 3HG2 VAL 62 1.235 6.283 -2.230 515 H HIS 63 H HIS 63 0.241 9.817 1.301 516 HA HIS 63 HA HIS 63 2.574 10.923 2.786 517 1HB HIS 63 2HB HIS 63 -0.414 11.294 3.082 518 2HB HIS 63 1HB HIS 63 0.744 11.901 4.265 519 HD1 HIS 63 HD1 HIS 63 -0.831 12.750 1.086 520 HD2 HIS 63 HD2 HIS 63 2.709 13.770 3.025 521 HE1 HIS 63 HE1 HIS 63 0.041 14.830 -0.065 522 H ASP 64 H ASP 64 2.362 10.646 5.263 523 HA ASP 64 HA ASP 64 2.441 7.819 5.864 524 1HB ASP 64 2HB ASP 64 3.773 9.708 6.997 525 2HB ASP 64 1HB ASP 64 2.301 10.042 7.910 526 H GLN 65 H GLN 65 0.913 6.546 6.854 527 HA GLN 65 HA GLN 65 -1.178 5.840 7.613 528 1HB GLN 65 2HB GLN 65 -0.596 8.285 8.995 529 2HB GLN 65 1HB GLN 65 -2.318 8.258 8.613 530 1HG GLN 65 2HG GLN 65 -2.307 7.081 10.616 531 2HG GLN 65 1HG GLN 65 -2.145 5.758 9.462 532 1HE2 GLN 65 1HE2 GLN 65 0.001 4.756 9.223 533 2HE2 GLN 65 2HE2 GLN 65 1.209 4.996 10.391 534 H THR 66 H THR 66 -0.917 6.803 4.875 535 HA THR 66 HA THR 66 -3.444 8.237 4.333 536 HB THR 66 HB THR 66 -1.297 8.710 3.064 537 HG1 THR 66 HG1 THR 66 -2.695 9.442 1.715 538 1HG2 THR 66 1HG2 THR 66 -0.230 6.777 2.468 539 2HG2 THR 66 2HG2 THR 66 -1.235 6.938 1.029 540 3HG2 THR 66 3HG2 THR 66 -1.730 5.862 2.334 541 H ASN 67 H ASN 67 -4.884 7.260 2.551 542 HA ASN 67 HA ASN 67 -5.354 4.403 3.232 543 1HB ASN 67 2HB ASN 67 -7.184 6.190 3.415 544 2HB ASN 67 1HB ASN 67 -7.195 6.206 1.651 545 1HD2 ASN 67 1HD2 ASN 67 -7.966 4.238 4.499 546 2HD2 ASN 67 2HD2 ASN 67 -8.812 3.033 3.653 547 H LEU 68 H LEU 68 -4.752 2.870 1.826 548 HA LEU 68 HA LEU 68 -4.336 3.617 -1.042 549 1HB LEU 68 2HB LEU 68 -2.747 2.071 0.872 550 2HB LEU 68 1HB LEU 68 -3.056 1.175 -0.613 551 HG LEU 68 HG LEU 68 -0.985 2.498 -0.804 552 1HD1 LEU 68 1HD1 LEU 68 -2.931 3.978 -2.531 553 2HD1 LEU 68 2HD1 LEU 68 -2.825 2.227 -2.703 554 3HD1 LEU 68 3HD1 LEU 68 -1.396 3.226 -2.963 555 1HD2 LEU 68 1HD2 LEU 68 -2.048 4.320 0.789 556 2HD2 LEU 68 2HD2 LEU 68 -2.600 5.031 -0.728 557 3HD2 LEU 68 3HD2 LEU 68 -0.875 4.800 -0.438 558 H GLU 69 H GLU 69 -5.193 2.220 -2.635 559 HA GLU 69 HA GLU 69 -7.322 0.377 -1.647 560 1HB GLU 69 2HB GLU 69 -6.898 1.777 -4.299 561 2HB GLU 69 1HB GLU 69 -8.135 0.545 -4.051 562 1HG GLU 69 2HG GLU 69 -9.433 2.323 -3.453 563 2HG GLU 69 1HG GLU 69 -8.605 2.159 -1.905 564 H LEU 70 H LEU 70 -7.471 -1.760 -2.517 565 HA LEU 70 HA LEU 70 -5.034 -2.709 -3.966 566 1HB LEU 70 2HB LEU 70 -5.121 -3.375 -1.516 567 2HB LEU 70 1HB LEU 70 -6.555 -4.318 -1.902 568 HG LEU 70 HG LEU 70 -5.280 -5.630 -3.543 569 1HD1 LEU 70 1HD1 LEU 70 -3.164 -3.617 -2.860 570 2HD1 LEU 70 2HD1 LEU 70 -3.610 -4.281 -4.432 571 3HD1 LEU 70 3HD1 LEU 70 -2.671 -5.252 -3.299 572 1HD2 LEU 70 1HD2 LEU 70 -3.709 -6.739 -1.933 573 2HD2 LEU 70 2HD2 LEU 70 -5.314 -6.460 -1.256 574 3HD2 LEU 70 3HD2 LEU 70 -3.975 -5.401 -0.815 575 H TYR 71 H TYR 71 -5.399 -4.076 -5.662 576 HA TYR 71 HA TYR 71 -8.141 -5.150 -6.102 577 1HB TYR 71 2HB TYR 71 -6.646 -3.187 -7.785 578 2HB TYR 71 1HB TYR 71 -7.555 -4.446 -8.621 579 HD1 TYR 71 HD1 TYR 71 -10.000 -4.598 -8.403 580 HD2 TYR 71 HD2 TYR 71 -7.769 -1.478 -6.467 581 HE1 TYR 71 HE1 TYR 71 -12.100 -3.336 -8.015 582 HE2 TYR 71 HE2 TYR 71 -9.869 -0.217 -6.079 583 HH TYR 71 HH TYR 71 -12.344 -0.779 -5.873 584 H TYR 72 H TYR 72 -8.138 -7.114 -7.272 585 HA TYR 72 HA TYR 72 -5.433 -8.312 -7.669 586 1HB TYR 72 2HB TYR 72 -8.152 -9.610 -7.332 587 2HB TYR 72 1HB TYR 72 -6.654 -10.492 -7.625 588 HD1 TYR 72 HD1 TYR 72 -4.731 -8.905 -5.986 589 HD2 TYR 72 HD2 TYR 72 -8.732 -10.209 -5.115 590 HE1 TYR 72 HE1 TYR 72 -4.224 -8.841 -3.561 591 HE2 TYR 72 HE2 TYR 72 -8.223 -10.145 -2.688 592 HH TYR 72 HH TYR 72 -5.930 -8.536 -1.331 593 H LEU 73 HN LEU 73 -4.743 -8.718 -9.699 594 HA LEU 73 HA LEU 73 -6.558 -8.173 -11.958 595 1HB LEU 73 2HB LEU 73 -3.956 -7.574 -11.612 596 2HB LEU 73 1HB LEU 73 -3.772 -9.131 -12.422 597 HG LEU 73 HG LEU 73 -5.796 -7.775 -13.842 598 1HD1 LEU 73 1HD1 LEU 73 -4.489 -5.704 -14.519 599 2HD1 LEU 73 2HD1 LEU 73 -3.467 -5.983 -13.107 600 3HD1 LEU 73 3HD1 LEU 73 -5.188 -5.654 -12.900 601 1HD2 LEU 73 1HD2 LEU 73 -3.794 -9.327 -14.516 602 2HD2 LEU 73 2HD2 LEU 73 -2.910 -7.812 -14.706 603 3HD2 LEU 73 3HD2 LEU 73 -4.360 -8.115 -15.665 Start of MODEL 5 1 H MET 1 1H MET 1 10.536 6.613 7.117 2 HA MET 1 HA MET 1 9.412 5.329 4.691 3 1HB MET 1 2HB MET 1 10.917 4.325 6.832 4 2HB MET 1 1HB MET 1 9.250 3.889 7.213 5 1HG MET 1 2HG MET 1 8.976 2.857 5.024 6 2HG MET 1 1HG MET 1 10.588 3.383 4.543 7 1HE MET 1 1HE MET 1 10.097 0.432 4.072 8 2HE MET 1 2HE MET 1 11.635 -0.141 4.714 9 3HE MET 1 3HE MET 1 11.561 1.408 3.878 10 H ILE 2 H ILE 2 7.190 5.054 4.634 11 HA ILE 2 HA ILE 2 5.631 6.217 6.910 12 HB ILE 2 HB ILE 2 3.950 6.960 5.257 13 1HG1 ILE 2 2HG1 ILE 2 5.914 6.374 3.053 14 2HG1 ILE 2 1HG1 ILE 2 4.786 5.121 3.573 15 1HG2 ILE 2 1HG2 ILE 2 6.636 7.980 4.339 16 2HG2 ILE 2 2HG2 ILE 2 6.023 8.344 5.953 17 3HG2 ILE 2 3HG2 ILE 2 5.127 8.871 4.529 18 1HD1 ILE 2 1HD1 ILE 2 3.131 7.303 3.370 19 2HD1 ILE 2 2HD1 ILE 2 3.352 6.096 2.103 20 3HD1 ILE 2 3HD1 ILE 2 4.274 7.599 2.059 21 H GLU 3 H GLU 3 3.397 5.321 7.081 22 HA GLU 3 HA GLU 3 3.320 2.453 6.218 23 1HB GLU 3 2HB GLU 3 3.389 3.316 8.782 24 2HB GLU 3 1HB GLU 3 1.648 3.362 8.508 25 1HG GLU 3 2HG GLU 3 3.197 0.935 7.657 26 2HG GLU 3 1HG GLU 3 2.786 1.140 9.359 27 H VAL 4 H VAL 4 1.723 2.011 4.782 28 HA VAL 4 HA VAL 4 -0.657 3.832 4.719 29 HB VAL 4 HB VAL 4 -0.793 3.341 2.280 30 1HG1 VAL 4 1HG1 VAL 4 0.479 5.167 1.917 31 2HG1 VAL 4 2HG1 VAL 4 1.955 4.307 2.356 32 3HG1 VAL 4 3HG1 VAL 4 0.968 5.064 3.608 33 1HG2 VAL 4 1HG2 VAL 4 1.930 2.060 2.669 34 2HG2 VAL 4 2HG2 VAL 4 1.042 2.220 1.155 35 3HG2 VAL 4 3HG2 VAL 4 0.438 1.153 2.421 36 H VAL 5 H VAL 5 -2.694 2.851 4.379 37 HA VAL 5 HA VAL 5 -2.733 -0.092 4.895 38 HB VAL 5 HB VAL 5 -5.077 0.290 5.651 39 1HG1 VAL 5 1HG1 VAL 5 -2.991 2.067 6.955 40 2HG1 VAL 5 2HG1 VAL 5 -3.248 0.356 7.289 41 3HG1 VAL 5 3HG1 VAL 5 -4.489 1.534 7.718 42 1HG2 VAL 5 1HG2 VAL 5 -5.364 2.371 4.188 43 2HG2 VAL 5 2HG2 VAL 5 -4.455 3.244 5.421 44 3HG2 VAL 5 3HG2 VAL 5 -5.997 2.492 5.829 45 H VAL 6 H VAL 6 -3.767 -1.465 3.446 46 HA VAL 6 HA VAL 6 -4.920 -0.161 1.011 47 HB VAL 6 HB VAL 6 -4.245 -2.220 -0.229 48 1HG1 VAL 6 1HG1 VAL 6 -1.955 -1.589 -0.462 49 2HG1 VAL 6 2HG1 VAL 6 -1.874 -1.003 1.201 50 3HG1 VAL 6 3HG1 VAL 6 -2.812 -0.118 -0.002 51 1HG2 VAL 6 1HG2 VAL 6 -2.236 -3.274 1.422 52 2HG2 VAL 6 2HG2 VAL 6 -3.760 -4.055 1.000 53 3HG2 VAL 6 3HG2 VAL 6 -3.635 -3.106 2.480 54 H ASN 7 H ASN 7 -7.037 -0.523 0.691 55 HA ASN 7 HA ASN 7 -8.360 -2.712 2.231 56 1HB ASN 7 2HB ASN 7 -9.868 -0.550 0.782 57 2HB ASN 7 1HB ASN 7 -10.317 -1.438 2.238 58 1HD2 ASN 7 1HD2 ASN 7 -8.367 -1.042 4.058 59 2HD2 ASN 7 2HD2 ASN 7 -8.030 0.601 4.299 60 H ASP 8 H ASP 8 -8.764 -4.520 1.061 61 HA ASP 8 HA ASP 8 -8.720 -4.459 -1.861 62 1HB ASP 8 2HB ASP 8 -7.826 -6.339 -0.353 63 2HB ASP 8 1HB ASP 8 -9.511 -6.824 -0.162 64 H ARG 9 H ARG 9 -10.451 -4.981 -3.241 65 HA ARG 9 HA ARG 9 -13.020 -3.945 -2.544 66 1HB ARG 9 2HB ARG 9 -11.929 -4.311 -4.883 67 2HB ARG 9 1HB ARG 9 -12.621 -5.929 -4.772 68 1HG ARG 9 2HG ARG 9 -14.719 -4.287 -3.984 69 2HG ARG 9 1HG ARG 9 -13.953 -3.372 -5.282 70 1HD ARG 9 2HD ARG 9 -14.697 -6.299 -5.517 71 2HD ARG 9 1HD ARG 9 -15.736 -4.982 -6.061 72 HE ARG 9 HE ARG 9 -13.778 -4.336 -7.582 73 1HH1 ARG 9 1HH2 ARG 9 -15.177 -6.606 -8.787 74 2HH1 ARG 9 2HH2 ARG 9 -13.928 -7.786 -9.003 75 1HH2 ARG 9 2HH1 ARG 9 -11.733 -6.248 -6.783 76 2HH2 ARG 9 1HH1 ARG 9 -11.966 -7.582 -7.863 77 H LEU 10 H LEU 10 -11.839 -7.314 -2.780 78 HA LEU 10 HA LEU 10 -14.346 -8.582 -2.237 79 1HB LEU 10 2HB LEU 10 -11.517 -9.361 -2.341 80 2HB LEU 10 1HB LEU 10 -12.439 -10.274 -1.148 81 HG LEU 10 HG LEU 10 -14.077 -10.075 -3.456 82 1HD1 LEU 10 1HD1 LEU 10 -11.777 -9.562 -4.528 83 2HD1 LEU 10 2HD1 LEU 10 -12.742 -10.849 -5.248 84 3HD1 LEU 10 3HD1 LEU 10 -11.393 -11.248 -4.184 85 1HD2 LEU 10 1HD2 LEU 10 -14.126 -11.940 -1.901 86 2HD2 LEU 10 2HD2 LEU 10 -12.445 -12.333 -2.256 87 3HD2 LEU 10 3HD2 LEU 10 -13.683 -12.565 -3.489 88 H GLY 11 H GLY 11 -11.709 -7.533 -0.069 89 1HA GLY 11 2HA GLY 11 -12.816 -6.499 2.077 90 2HA GLY 11 1HA GLY 11 -13.433 -8.139 2.286 91 H LYS 12 H LYS 12 -10.349 -6.417 1.730 92 HA LYS 12 HA LYS 12 -9.089 -8.148 3.783 93 1HB LYS 12 2HB LYS 12 -8.818 -8.820 1.163 94 2HB LYS 12 1HB LYS 12 -7.460 -7.712 1.350 95 1HG LYS 12 2HG LYS 12 -6.647 -9.000 3.276 96 2HG LYS 12 1HG LYS 12 -8.027 -10.097 3.130 97 1HD LYS 12 2HD LYS 12 -7.266 -10.547 0.748 98 2HD LYS 12 1HD LYS 12 -5.781 -9.682 1.146 99 1HE LYS 12 2HE LYS 12 -5.520 -11.281 3.108 100 2HE LYS 12 1HE LYS 12 -6.838 -12.224 2.407 101 1HZ LYS 12 1HZ LYS 12 -4.983 -11.610 0.389 102 2HZ LYS 12 2HZ LYS 12 -5.412 -13.134 1.001 103 3HZ LYS 12 3HZ LYS 12 -4.135 -12.262 1.704 104 H LYS 13 H LYS 13 -8.197 -6.741 5.179 105 HA LYS 13 HA LYS 13 -7.119 -4.158 4.136 106 1HB LYS 13 2HB LYS 13 -8.359 -5.013 6.721 107 2HB LYS 13 1HB LYS 13 -7.143 -3.735 6.771 108 1HG LYS 13 2HG LYS 13 -8.928 -2.382 6.321 109 2HG LYS 13 1HG LYS 13 -8.638 -2.902 4.661 110 1HD LYS 13 2HD LYS 13 -10.165 -4.962 5.511 111 2HD LYS 13 1HD LYS 13 -10.815 -3.674 6.527 112 1HE LYS 13 2HE LYS 13 -11.669 -2.505 4.741 113 2HE LYS 13 1HE LYS 13 -10.379 -3.020 3.657 114 1HZ LYS 13 1HZ LYS 13 -12.536 -4.811 4.632 115 2HZ LYS 13 2HZ LYS 13 -11.372 -5.158 3.444 116 3HZ LYS 13 3HZ LYS 13 -12.578 -4.001 3.142 117 H VAL 14 H VAL 14 -4.951 -4.252 3.821 118 HA VAL 14 HA VAL 14 -3.311 -5.851 5.753 119 HB VAL 14 HB VAL 14 -2.634 -5.209 2.865 120 1HG1 VAL 14 1HG1 VAL 14 -1.102 -7.294 3.425 121 2HG1 VAL 14 2HG1 VAL 14 -1.317 -6.737 5.085 122 3HG1 VAL 14 3HG1 VAL 14 -0.593 -5.669 3.882 123 1HG2 VAL 14 1HG2 VAL 14 -4.114 -7.475 4.149 124 2HG2 VAL 14 2HG2 VAL 14 -3.020 -7.848 2.816 125 3HG2 VAL 14 3HG2 VAL 14 -4.361 -6.730 2.569 126 H ARG 15 H ARG 15 -1.339 -4.925 6.465 127 HA ARG 15 HA ARG 15 -1.156 -1.963 6.079 128 1HB ARG 15 2HB ARG 15 0.257 -3.467 8.275 129 2HB ARG 15 1HB ARG 15 -0.247 -1.779 8.238 130 1HG ARG 15 2HG ARG 15 -2.403 -3.819 8.023 131 2HG ARG 15 1HG ARG 15 -1.619 -3.655 9.592 132 1HD ARG 15 2HD ARG 15 -2.310 -1.449 9.854 133 2HD ARG 15 1HD ARG 15 -2.494 -1.198 8.117 134 HE ARG 15 HE ARG 15 -4.339 -3.148 9.322 135 1HH1 ARG 15 2HH1 ARG 15 -4.978 -1.876 6.760 136 2HH1 ARG 15 1HH1 ARG 15 -6.061 -0.600 7.207 137 1HH2 ARG 15 1HH2 ARG 15 -5.136 -0.668 10.569 138 2HH2 ARG 15 2HH2 ARG 15 -6.154 0.089 9.391 139 H VAL 16 H VAL 16 0.590 -1.209 4.980 140 HA VAL 16 HA VAL 16 3.067 -2.859 4.899 141 HB VAL 16 HB VAL 16 1.761 -3.399 2.868 142 1HG1 VAL 16 1HG1 VAL 16 1.236 -1.697 1.218 143 2HG1 VAL 16 2HG1 VAL 16 2.017 -0.455 2.196 144 3HG1 VAL 16 3HG1 VAL 16 0.533 -1.219 2.763 145 1HG2 VAL 16 1HG2 VAL 16 3.562 -3.253 1.404 146 2HG2 VAL 16 2HG2 VAL 16 4.369 -2.973 2.948 147 3HG2 VAL 16 3HG2 VAL 16 3.967 -1.610 1.903 148 H LYS 17 H LYS 17 4.918 -1.622 5.029 149 HA LYS 17 HA LYS 17 4.549 1.346 4.928 150 1HB LYS 17 2HB LYS 17 6.460 1.486 6.516 151 2HB LYS 17 1HB LYS 17 5.097 0.596 7.186 152 1HG LYS 17 2HG LYS 17 6.718 -1.302 5.828 153 2HG LYS 17 1HG LYS 17 7.804 -0.298 6.786 154 1HD LYS 17 2HD LYS 17 7.205 -1.536 8.575 155 2HD LYS 17 1HD LYS 17 5.627 -0.755 8.478 156 1HE LYS 17 2HE LYS 17 5.965 -2.955 6.557 157 2HE LYS 17 1HE LYS 17 6.060 -3.469 8.240 158 1HZ LYS 17 1HZ LYS 17 3.769 -3.298 7.071 159 2HZ LYS 17 2HZ LYS 17 3.914 -1.639 7.402 160 3HZ LYS 17 3HZ LYS 17 3.932 -2.766 8.673 161 H CYS 18 H CYS 18 5.879 2.530 3.624 162 HA CYS 18 HA CYS 18 8.353 1.361 2.516 163 1HB CYS 18 2HB CYS 18 5.881 1.306 1.059 164 2HB CYS 18 1HB CYS 18 6.967 2.452 0.274 165 HG CYS 18 HG CYS 18 7.374 -0.583 0.411 166 H LEU 19 H LEU 19 9.600 3.027 1.291 167 HA LEU 19 HA LEU 19 9.318 5.657 2.558 168 1HB LEU 19 2HB LEU 19 11.400 4.159 1.175 169 2HB LEU 19 1HB LEU 19 11.316 5.827 0.608 170 HG LEU 19 HG LEU 19 11.125 5.450 3.545 171 1HD1 LEU 19 1HD1 LEU 19 13.361 4.405 1.934 172 2HD1 LEU 19 2HD1 LEU 19 12.941 4.082 3.615 173 3HD1 LEU 19 3HD1 LEU 19 13.855 5.530 3.197 174 1HD2 LEU 19 1HD2 LEU 19 11.147 7.680 2.546 175 2HD2 LEU 19 2HD2 LEU 19 12.644 7.311 1.688 176 3HD2 LEU 19 3HD2 LEU 19 12.644 7.439 3.448 177 H ALA 20 H ALA 20 8.932 7.622 1.435 178 HA ALA 20 HA ALA 20 7.062 7.503 -0.742 179 1HB ALA 20 1HB ALA 20 8.711 9.861 0.223 180 2HB ALA 20 2HB ALA 20 7.145 9.379 0.876 181 3HB ALA 20 3HB ALA 20 7.267 9.954 -0.786 182 H GLU 21 H GLU 21 10.544 7.582 -0.649 183 HA GLU 21 HA GLU 21 10.874 8.543 -3.391 184 1HB GLU 21 2HB GLU 21 13.255 7.948 -3.060 185 2HB GLU 21 1HB GLU 21 12.647 8.929 -1.727 186 1HG GLU 21 2HG GLU 21 13.423 7.315 -0.347 187 2HG GLU 21 1HG GLU 21 12.095 6.313 -0.928 188 H ASP 22 H ASP 22 10.332 5.475 -1.828 189 HA ASP 22 HA ASP 22 11.430 3.768 -3.852 190 1HB ASP 22 2HB ASP 22 9.499 3.444 -1.597 191 2HB ASP 22 1HB ASP 22 9.498 2.205 -2.852 192 H SER 23 H SER 23 10.339 2.690 -5.583 193 HA SER 23 HA SER 23 8.170 4.296 -6.760 194 1HB SER 23 2HB SER 23 10.310 2.694 -7.772 195 2HB SER 23 1HB SER 23 8.796 2.029 -8.376 196 HG SER 23 HG SER 23 9.141 3.615 -9.776 197 H VAL 24 H VAL 24 6.340 3.069 -7.862 198 HA VAL 24 HA VAL 24 4.830 1.603 -5.937 199 HB VAL 24 HB VAL 24 4.508 1.735 -8.951 200 1HG1 VAL 24 1HG1 VAL 24 2.770 0.620 -6.753 201 2HG1 VAL 24 2HG1 VAL 24 3.219 -0.129 -8.285 202 3HG1 VAL 24 3HG1 VAL 24 2.066 1.204 -8.261 203 1HG2 VAL 24 1HG2 VAL 24 4.328 3.787 -7.166 204 2HG2 VAL 24 2HG2 VAL 24 2.678 3.168 -7.115 205 3HG2 VAL 24 3HG2 VAL 24 3.375 3.696 -8.646 206 H GLY 25 H GLY 25 7.088 0.564 -8.445 207 1HA GLY 25 2HA GLY 25 6.445 -2.211 -8.544 208 2HA GLY 25 1HA GLY 25 8.048 -1.540 -8.856 209 H ASP 26 H ASP 26 8.657 -0.401 -6.393 210 HA ASP 26 HA ASP 26 9.415 -2.715 -4.823 211 1HB ASP 26 2HB ASP 26 10.644 -0.449 -5.014 212 2HB ASP 26 1HB ASP 26 9.468 0.143 -3.842 213 H PHE 27 H PHE 27 6.911 -0.228 -4.574 214 HA PHE 27 HA PHE 27 5.950 -0.862 -1.955 215 1HB PHE 27 2HB PHE 27 5.371 1.201 -3.233 216 2HB PHE 27 1HB PHE 27 4.409 0.222 -4.336 217 HD1 PHE 27 HD1 PHE 27 4.818 0.515 -0.606 218 HD2 PHE 27 HD2 PHE 27 2.129 0.304 -3.949 219 HE1 PHE 27 HE1 PHE 27 2.885 0.673 0.938 220 HE2 PHE 27 HE2 PHE 27 0.197 0.460 -2.405 221 HZ PHE 27 HZ PHE 27 0.573 0.644 0.038 222 H LYS 28 H LYS 28 5.286 -2.253 -5.142 223 HA LYS 28 HA LYS 28 3.079 -3.917 -4.207 224 1HB LYS 28 2HB LYS 28 4.656 -3.709 -6.763 225 2HB LYS 28 1HB LYS 28 3.546 -5.057 -6.500 226 1HG LYS 28 2HG LYS 28 1.960 -3.011 -5.732 227 2HG LYS 28 1HG LYS 28 2.961 -2.176 -6.919 228 1HD LYS 28 2HD LYS 28 2.475 -4.217 -8.446 229 2HD LYS 28 1HD LYS 28 1.159 -4.555 -7.324 230 1HE LYS 28 2HE LYS 28 -0.111 -2.984 -8.312 231 2HE LYS 28 1HE LYS 28 1.107 -1.762 -7.954 232 1HZ LYS 28 1HZ LYS 28 1.486 -3.609 -10.219 233 2HZ LYS 28 2HZ LYS 28 2.135 -2.058 -9.980 234 3HZ LYS 28 3HZ LYS 28 0.498 -2.242 -10.396 235 H LYS 29 H LYS 29 6.556 -4.417 -4.865 236 HA LYS 29 HA LYS 29 6.512 -7.261 -4.458 237 1HB LYS 29 2HB LYS 29 8.896 -7.154 -4.387 238 2HB LYS 29 1HB LYS 29 8.388 -5.910 -5.526 239 1HG LYS 29 2HG LYS 29 8.984 -4.183 -4.118 240 2HG LYS 29 1HG LYS 29 8.701 -5.126 -2.659 241 1HD LYS 29 2HD LYS 29 10.737 -6.546 -3.758 242 2HD LYS 29 1HD LYS 29 11.136 -4.927 -4.330 243 1HE LYS 29 2HE LYS 29 11.065 -4.061 -2.052 244 2HE LYS 29 1HE LYS 29 10.549 -5.634 -1.442 245 1HZ LYS 29 1HZ LYS 29 12.608 -6.593 -2.045 246 2HZ LYS 29 2HZ LYS 29 12.978 -5.150 -1.226 247 3HZ LYS 29 3HZ LYS 29 13.086 -5.220 -2.920 248 H VAL 30 H VAL 30 6.588 -4.543 -2.235 249 HA VAL 30 HA VAL 30 7.331 -6.171 0.087 250 HB VAL 30 HB VAL 30 6.137 -3.380 -0.081 251 1HG1 VAL 30 1HG1 VAL 30 5.878 -4.721 2.109 252 2HG1 VAL 30 2HG1 VAL 30 6.645 -3.138 2.227 253 3HG1 VAL 30 3HG1 VAL 30 7.632 -4.599 2.246 254 1HG2 VAL 30 1HG2 VAL 30 8.894 -3.587 0.811 255 2HG2 VAL 30 2HG2 VAL 30 8.223 -2.632 -0.511 256 3HG2 VAL 30 3HG2 VAL 30 8.699 -4.307 -0.788 257 H LEU 31 H LEU 31 4.346 -4.843 -1.332 258 HA LEU 31 HA LEU 31 2.577 -5.740 0.763 259 1HB LEU 31 2HB LEU 31 2.329 -4.570 -1.928 260 2HB LEU 31 1HB LEU 31 1.023 -5.681 -1.517 261 HG LEU 31 HG LEU 31 1.882 -3.636 0.503 262 1HD1 LEU 31 1HD1 LEU 31 0.321 -2.010 -0.459 263 2HD1 LEU 31 2HD1 LEU 31 -0.039 -3.113 -1.787 264 3HD1 LEU 31 3HD1 LEU 31 1.570 -2.406 -1.639 265 1HD2 LEU 31 1HD2 LEU 31 -0.402 -3.866 1.243 266 2HD2 LEU 31 2HD2 LEU 31 0.210 -5.495 0.954 267 3HD2 LEU 31 3HD2 LEU 31 -0.850 -4.728 -0.229 268 H SER 32 H SER 32 3.595 -7.164 -2.341 269 HA SER 32 HA SER 32 1.931 -9.422 -2.432 270 1HB SER 32 2HB SER 32 3.766 -10.494 -3.743 271 2HB SER 32 1HB SER 32 3.401 -8.859 -4.280 272 HG SER 32 HG SER 32 5.719 -9.650 -3.761 273 H LEU 33 H LEU 33 4.663 -8.838 -0.294 274 HA LEU 33 HA LEU 33 5.079 -11.609 0.443 275 1HB LEU 33 2HB LEU 33 6.091 -8.982 1.270 276 2HB LEU 33 1HB LEU 33 5.913 -10.101 2.620 277 HG LEU 33 HG LEU 33 8.157 -10.267 1.574 278 1HD1 LEU 33 1HD1 LEU 33 8.102 -12.744 1.168 279 2HD1 LEU 33 2HD1 LEU 33 6.341 -12.669 1.211 280 3HD1 LEU 33 3HD1 LEU 33 7.276 -12.256 2.648 281 1HD2 LEU 33 1HD2 LEU 33 8.445 -10.980 -0.690 282 2HD2 LEU 33 2HD2 LEU 33 7.252 -9.683 -0.747 283 3HD2 LEU 33 3HD2 LEU 33 6.732 -11.364 -0.861 284 H GLN 34 H GLN 34 3.023 -8.994 1.683 285 HA GLN 34 HA GLN 34 2.123 -10.574 3.984 286 1HB GLN 34 2HB GLN 34 1.335 -7.893 2.837 287 2HB GLN 34 1HB GLN 34 0.443 -8.632 4.166 288 1HG GLN 34 2HG GLN 34 1.969 -7.636 5.514 289 2HG GLN 34 1HG GLN 34 3.063 -8.916 4.988 290 1HE2 GLN 34 1HE2 GLN 34 1.932 -5.651 3.913 291 2HE2 GLN 34 2HE2 GLN 34 3.431 -5.193 3.259 292 H ILE 35 H ILE 35 0.539 -9.336 1.001 293 HA ILE 35 HA ILE 35 -1.856 -10.931 1.476 294 HB ILE 35 HB ILE 35 -2.429 -10.235 -0.911 295 1HG1 ILE 35 2HG1 ILE 35 0.037 -8.502 -0.575 296 2HG1 ILE 35 1HG1 ILE 35 -0.029 -9.923 -1.614 297 1HG2 ILE 35 1HG2 ILE 35 -2.624 -7.775 -0.230 298 2HG2 ILE 35 2HG2 ILE 35 -1.794 -8.232 1.257 299 3HG2 ILE 35 3HG2 ILE 35 -3.353 -8.953 0.860 300 1HD1 ILE 35 1HD1 ILE 35 -2.142 -8.747 -2.627 301 2HD1 ILE 35 2HD1 ILE 35 -0.538 -8.201 -3.111 302 3HD1 ILE 35 3HD1 ILE 35 -1.453 -7.293 -1.908 303 H GLY 36 H GLY 36 1.194 -11.558 -0.080 304 1HA GLY 36 2HA GLY 36 1.990 -13.491 -1.158 305 2HA GLY 36 1HA GLY 36 0.572 -14.331 -0.518 306 H THR 37 H THR 37 0.841 -11.549 -2.721 307 HA THR 37 HA THR 37 -0.836 -13.046 -4.697 308 HB THR 37 HB THR 37 -0.615 -10.041 -4.435 309 HG1 THR 37 HG1 THR 37 -2.446 -11.837 -3.221 310 1HG2 THR 37 1HG2 THR 37 -2.759 -10.084 -5.627 311 2HG2 THR 37 2HG2 THR 37 -2.729 -11.847 -5.640 312 3HG2 THR 37 3HG2 THR 37 -1.523 -10.936 -6.552 313 H GLN 38 H GLN 38 2.230 -11.562 -4.202 314 HA GLN 38 HA GLN 38 4.079 -11.353 -5.623 315 1HB GLN 38 2HB GLN 38 2.323 -12.532 -7.800 316 2HB GLN 38 1HB GLN 38 4.082 -12.444 -7.786 317 1HG GLN 38 2HG GLN 38 2.514 -13.935 -5.671 318 2HG GLN 38 1HG GLN 38 3.084 -14.705 -7.151 319 1HE2 GLN 38 1HE2 GLN 38 4.100 -13.382 -4.048 320 2HE2 GLN 38 2HE2 GLN 38 5.725 -13.861 -4.166 321 HA PRO 39 HA PRO 39 3.234 -7.488 -7.557 322 1HB PRO 39 2HB PRO 39 5.619 -7.167 -8.901 323 2HB PRO 39 1HB PRO 39 5.437 -6.941 -7.153 324 1HG PRO 39 2HG PRO 39 6.682 -9.212 -8.636 325 2HG PRO 39 1HG PRO 39 7.027 -8.613 -7.004 326 1HD PRO 39 2HD PRO 39 5.488 -10.899 -7.625 327 2HD PRO 39 1HD PRO 39 5.541 -10.077 -6.050 328 H ASN 40 H ASN 40 1.703 -9.104 -8.894 329 HA ASN 40 HA ASN 40 2.137 -8.484 -11.748 330 1HB ASN 40 2HB ASN 40 2.343 -11.205 -10.585 331 2HB ASN 40 1HB ASN 40 1.321 -11.071 -12.015 332 1HD2 ASN 40 1HD2 ASN 40 4.627 -10.948 -10.858 333 2HD2 ASN 40 2HD2 ASN 40 5.355 -10.727 -12.375 334 H LYS 41 H LYS 41 0.063 -10.154 -9.354 335 HA LYS 41 HA LYS 41 -2.332 -9.329 -10.921 336 1HB LYS 41 2HB LYS 41 -1.763 -11.495 -8.937 337 2HB LYS 41 1HB LYS 41 -3.411 -10.875 -9.047 338 1HG LYS 41 2HG LYS 41 -3.762 -11.833 -11.074 339 2HG LYS 41 1HG LYS 41 -2.164 -11.376 -11.661 340 1HD LYS 41 2HD LYS 41 -1.916 -13.371 -9.583 341 2HD LYS 41 1HD LYS 41 -3.001 -13.947 -10.851 342 1HE LYS 41 2HE LYS 41 -1.165 -14.434 -12.072 343 2HE LYS 41 1HE LYS 41 -0.900 -12.697 -12.225 344 1HZ LYS 41 1HZ LYS 41 0.159 -12.995 -9.876 345 2HZ LYS 41 2HZ LYS 41 1.055 -13.356 -11.269 346 3HZ LYS 41 3HZ LYS 41 0.339 -14.607 -10.370 347 H ILE 42 H ILE 42 -0.544 -7.741 -8.853 348 HA ILE 42 HA ILE 42 -2.687 -6.997 -6.928 349 HB ILE 42 HB ILE 42 0.230 -6.160 -7.030 350 1HG1 ILE 42 2HG1 ILE 42 -1.137 -8.026 -5.075 351 2HG1 ILE 42 1HG1 ILE 42 -0.290 -8.606 -6.510 352 1HG2 ILE 42 1HG2 ILE 42 -0.959 -4.449 -5.889 353 2HG2 ILE 42 2HG2 ILE 42 -0.353 -5.496 -4.606 354 3HG2 ILE 42 3HG2 ILE 42 -2.039 -5.607 -5.112 355 1HD1 ILE 42 1HD1 ILE 42 1.672 -7.100 -5.612 356 2HD1 ILE 42 2HD1 ILE 42 1.405 -8.694 -4.906 357 3HD1 ILE 42 3HD1 ILE 42 0.827 -7.251 -4.071 358 H VAL 43 H VAL 43 -3.814 -5.133 -7.172 359 HA VAL 43 HA VAL 43 -2.768 -3.072 -9.074 360 HB VAL 43 HB VAL 43 -5.660 -3.929 -8.691 361 1HG1 VAL 43 1HG1 VAL 43 -4.710 -2.146 -10.902 362 2HG1 VAL 43 2HG1 VAL 43 -4.935 -1.440 -9.303 363 3HG1 VAL 43 3HG1 VAL 43 -6.289 -2.216 -10.122 364 1HG2 VAL 43 1HG2 VAL 43 -5.310 -4.507 -11.201 365 2HG2 VAL 43 2HG2 VAL 43 -4.646 -5.615 -10.000 366 3HG2 VAL 43 3HG2 VAL 43 -3.588 -4.467 -10.819 367 H LEU 44 H LEU 44 -2.085 -1.512 -7.647 368 HA LEU 44 HA LEU 44 -3.796 -0.863 -5.301 369 1HB LEU 44 2HB LEU 44 -0.949 -0.136 -6.031 370 2HB LEU 44 1HB LEU 44 -1.791 0.557 -4.644 371 HG LEU 44 HG LEU 44 -1.900 -2.402 -4.898 372 1HD1 LEU 44 1HD1 LEU 44 0.390 -2.260 -5.419 373 2HD1 LEU 44 2HD1 LEU 44 0.385 -2.430 -3.664 374 3HD1 LEU 44 3HD1 LEU 44 0.630 -0.845 -4.395 375 1HD2 LEU 44 1HD2 LEU 44 -1.046 -0.977 -2.429 376 2HD2 LEU 44 2HD2 LEU 44 -2.208 -2.288 -2.625 377 3HD2 LEU 44 3HD2 LEU 44 -2.676 -0.631 -3.007 378 H GLN 45 H GLN 45 -4.810 1.109 -5.080 379 HA GLN 45 HA GLN 45 -4.395 3.136 -7.241 380 1HB GLN 45 2HB GLN 45 -7.117 2.677 -6.044 381 2HB GLN 45 1HB GLN 45 -6.696 3.407 -7.591 382 1HG GLN 45 2HG GLN 45 -5.692 0.956 -8.022 383 2HG GLN 45 1HG GLN 45 -6.942 0.527 -6.855 384 1HE2 GLN 45 1HE2 GLN 45 -9.151 1.866 -7.415 385 2HE2 GLN 45 2HE2 GLN 45 -9.605 1.774 -9.047 386 H LYS 46 H LYS 46 -4.019 5.150 -6.431 387 HA LYS 46 HA LYS 46 -4.404 5.575 -3.518 388 1HB LYS 46 2HB LYS 46 -2.325 6.214 -5.242 389 2HB LYS 46 1HB LYS 46 -3.151 7.756 -5.021 390 1HG LYS 46 2HG LYS 46 -3.037 6.489 -2.476 391 2HG LYS 46 1HG LYS 46 -1.426 6.384 -3.185 392 1HD LYS 46 2HD LYS 46 -1.104 8.642 -3.107 393 2HD LYS 46 1HD LYS 46 -2.785 8.994 -3.509 394 1HE LYS 46 2HE LYS 46 -3.326 8.103 -1.141 395 2HE LYS 46 1HE LYS 46 -1.606 8.313 -0.820 396 1HZ LYS 46 1HZ LYS 46 -2.714 10.300 -0.191 397 2HZ LYS 46 2HZ LYS 46 -3.545 10.388 -1.671 398 3HZ LYS 46 3HZ LYS 46 -1.865 10.636 -1.620 399 H GLY 47 H GLY 47 -6.554 6.139 -3.241 400 1HA GLY 47 2HA GLY 47 -8.379 7.616 -3.159 401 2HA GLY 47 1HA GLY 47 -7.376 8.813 -3.981 402 H GLY 48 H GLY 48 -7.307 8.784 -6.315 403 1HA GLY 48 2HA GLY 48 -9.325 7.051 -7.662 404 2HA GLY 48 1HA GLY 48 -9.423 8.798 -7.876 405 H SER 49 H SER 49 -6.575 6.644 -7.760 406 HA SER 49 HA SER 49 -6.045 7.099 -10.628 407 1HB SER 49 2HB SER 49 -3.728 7.953 -10.123 408 2HB SER 49 1HB SER 49 -5.011 9.075 -9.690 409 HG SER 49 HG SER 49 -3.214 7.722 -8.106 410 H VAL 50 H VAL 50 -4.857 5.419 -11.504 411 HA VAL 50 HA VAL 50 -4.359 3.092 -9.790 412 HB VAL 50 HB VAL 50 -3.765 3.500 -12.741 413 1HG1 VAL 50 1HG1 VAL 50 -3.250 1.335 -10.858 414 2HG1 VAL 50 2HG1 VAL 50 -2.696 1.522 -12.522 415 3HG1 VAL 50 3HG1 VAL 50 -4.274 0.804 -12.192 416 1HG2 VAL 50 1HG2 VAL 50 -6.060 1.885 -11.682 417 2HG2 VAL 50 2HG2 VAL 50 -5.904 2.724 -13.224 418 3HG2 VAL 50 3HG2 VAL 50 -6.226 3.639 -11.752 419 H LEU 51 H LEU 51 -2.408 2.511 -8.948 420 HA LEU 51 HA LEU 51 -0.109 4.305 -9.376 421 1HB LEU 51 2HB LEU 51 -0.314 1.860 -7.591 422 2HB LEU 51 1HB LEU 51 0.920 3.116 -7.521 423 HG LEU 51 HG LEU 51 -2.042 3.484 -6.972 424 1HD1 LEU 51 1HD1 LEU 51 -0.179 2.442 -5.298 425 2HD1 LEU 51 2HD1 LEU 51 -1.536 3.421 -4.745 426 3HD1 LEU 51 3HD1 LEU 51 0.046 4.161 -4.976 427 1HD2 LEU 51 1HD2 LEU 51 0.154 5.376 -7.562 428 2HD2 LEU 51 2HD2 LEU 51 -0.781 5.762 -6.119 429 3HD2 LEU 51 3HD2 LEU 51 -1.590 5.607 -7.679 430 H LYS 52 H LYS 52 1.374 3.885 -10.915 431 HA LYS 52 HA LYS 52 1.605 1.105 -11.972 432 1HB LYS 52 2HB LYS 52 1.595 3.722 -13.190 433 2HB LYS 52 1HB LYS 52 3.109 2.897 -13.564 434 1HG LYS 52 2HG LYS 52 0.731 1.171 -13.752 435 2HG LYS 52 1HG LYS 52 0.743 2.502 -14.909 436 1HD LYS 52 2HD LYS 52 2.349 1.507 -16.139 437 2HD LYS 52 1HD LYS 52 3.370 1.288 -14.717 438 1HE LYS 52 2HE LYS 52 1.472 -0.595 -14.242 439 2HE LYS 52 1HE LYS 52 1.498 -0.613 -16.004 440 1HZ LYS 52 1HZ LYS 52 3.861 -0.971 -15.961 441 2HZ LYS 52 2HZ LYS 52 3.101 -2.161 -15.017 442 3HZ LYS 52 3HZ LYS 52 3.895 -0.857 -14.269 443 H ASP 53 H ASP 53 3.598 0.066 -12.008 444 HA ASP 53 HA ASP 53 5.518 0.717 -9.993 445 1HB ASP 53 2HB ASP 53 6.055 -1.034 -12.401 446 2HB ASP 53 1HB ASP 53 6.782 -1.146 -10.799 447 H HIS 54 H HIS 54 5.242 1.762 -13.312 448 HA HIS 54 HA HIS 54 8.022 2.526 -13.656 449 1HB HIS 54 2HB HIS 54 5.457 3.070 -15.125 450 2HB HIS 54 1HB HIS 54 6.903 4.000 -15.518 451 HD1 HIS 54 HD1 HIS 54 5.329 0.698 -15.989 452 HD2 HIS 54 HD2 HIS 54 9.132 2.340 -16.438 453 HE1 HIS 54 HE1 HIS 54 6.658 -0.946 -17.384 454 H ILE 55 H ILE 55 5.459 3.916 -11.840 455 HA ILE 55 HA ILE 55 6.808 6.587 -11.899 456 HB ILE 55 HB ILE 55 3.965 5.850 -11.129 457 1HG1 ILE 55 2HG1 ILE 55 3.792 7.686 -13.125 458 2HG1 ILE 55 1HG1 ILE 55 5.293 6.881 -13.578 459 1HG2 ILE 55 1HG2 ILE 55 4.862 8.677 -11.466 460 2HG2 ILE 55 2HG2 ILE 55 5.314 7.862 -9.971 461 3HG2 ILE 55 3HG2 ILE 55 3.614 8.014 -10.413 462 1HD1 ILE 55 1HD1 ILE 55 2.516 5.798 -13.477 463 2HD1 ILE 55 2HD1 ILE 55 3.829 4.702 -13.044 464 3HD1 ILE 55 3HD1 ILE 55 3.808 5.470 -14.631 465 H SER 56 H SER 56 7.437 7.525 -9.943 466 HA SER 56 HA SER 56 7.898 5.674 -7.739 467 1HB SER 56 2HB SER 56 9.333 7.748 -8.647 468 2HB SER 56 1HB SER 56 8.412 8.587 -7.401 469 HG SER 56 HG SER 56 10.303 7.718 -6.522 470 H LEU 57 H LEU 57 7.163 5.983 -5.552 471 HA LEU 57 HA LEU 57 4.395 6.610 -5.258 472 1HB LEU 57 2HB LEU 57 6.628 6.355 -3.224 473 2HB LEU 57 1HB LEU 57 4.942 6.600 -2.769 474 HG LEU 57 HG LEU 57 5.766 4.358 -4.618 475 1HD1 LEU 57 1HD1 LEU 57 5.699 4.411 -1.590 476 2HD1 LEU 57 2HD1 LEU 57 7.052 3.959 -2.628 477 3HD1 LEU 57 3HD1 LEU 57 5.633 2.918 -2.525 478 1HD2 LEU 57 1HD2 LEU 57 3.311 5.325 -4.039 479 2HD2 LEU 57 2HD2 LEU 57 3.498 4.201 -2.692 480 3HD2 LEU 57 3HD2 LEU 57 3.606 3.615 -4.351 481 H GLU 58 H GLU 58 7.307 8.564 -4.819 482 HA GLU 58 HA GLU 58 6.173 10.783 -3.449 483 1HB GLU 58 2HB GLU 58 8.661 10.131 -4.573 484 2HB GLU 58 1HB GLU 58 8.152 11.590 -5.423 485 1HG GLU 58 2HG GLU 58 7.794 11.507 -2.457 486 2HG GLU 58 1HG GLU 58 9.426 11.730 -3.085 487 H ASP 59 H ASP 59 6.271 9.978 -6.909 488 HA ASP 59 HA ASP 59 5.229 12.458 -7.899 489 1HB ASP 59 2HB ASP 59 5.018 9.640 -9.005 490 2HB ASP 59 1HB ASP 59 4.547 11.089 -9.892 491 H TYR 60 H TYR 60 3.624 9.440 -6.870 492 HA TYR 60 HA TYR 60 0.944 10.373 -7.445 493 1HB TYR 60 2HB TYR 60 2.044 8.118 -5.756 494 2HB TYR 60 1HB TYR 60 0.314 8.437 -5.882 495 HD1 TYR 60 HD1 TYR 60 -0.560 8.789 -8.380 496 HD2 TYR 60 HD2 TYR 60 3.005 6.652 -7.295 497 HE1 TYR 60 HE1 TYR 60 -0.628 7.581 -10.542 498 HE2 TYR 60 HE2 TYR 60 2.938 5.443 -9.459 499 HH TYR 60 HH TYR 60 1.135 6.412 -12.051 500 H GLU 61 H GLU 61 3.158 10.961 -4.848 501 HA GLU 61 HA GLU 61 2.973 12.351 -2.984 502 1HB GLU 61 2HB GLU 61 0.945 13.274 -4.703 503 2HB GLU 61 1HB GLU 61 0.161 13.065 -3.138 504 1HG GLU 61 2HG GLU 61 1.043 15.276 -3.100 505 2HG GLU 61 1HG GLU 61 2.169 14.315 -2.141 506 H VAL 62 H VAL 62 3.027 9.956 -2.201 507 HA VAL 62 HA VAL 62 0.526 9.105 -0.866 508 HB VAL 62 HB VAL 62 3.280 7.823 -0.933 509 1HG1 VAL 62 1HG1 VAL 62 2.339 5.955 0.147 510 2HG1 VAL 62 2HG1 VAL 62 0.689 6.461 -0.216 511 3HG1 VAL 62 3HG1 VAL 62 1.621 7.311 1.016 512 1HG2 VAL 62 1HG2 VAL 62 0.868 6.718 -2.323 513 2HG2 VAL 62 2HG2 VAL 62 2.573 6.571 -2.752 514 3HG2 VAL 62 3HG2 VAL 62 1.711 8.075 -3.074 515 H HIS 63 H HIS 63 0.097 9.713 1.196 516 HA HIS 63 HA HIS 63 2.288 10.920 2.811 517 1HB HIS 63 2HB HIS 63 -0.100 11.970 2.302 518 2HB HIS 63 1HB HIS 63 -0.582 10.966 3.669 519 HD1 HIS 63 HD1 HIS 63 -0.211 11.981 5.917 520 HD2 HIS 63 HD2 HIS 63 2.273 13.688 3.039 521 HE1 HIS 63 HE1 HIS 63 1.054 13.842 7.077 522 H ASP 64 H ASP 64 2.311 10.409 5.168 523 HA ASP 64 HA ASP 64 2.271 7.551 5.620 524 1HB ASP 64 2HB ASP 64 2.881 8.137 7.957 525 2HB ASP 64 1HB ASP 64 3.893 8.980 6.786 526 H GLN 65 H GLN 65 0.824 6.334 6.872 527 HA GLN 65 HA GLN 65 -1.261 5.715 7.734 528 1HB GLN 65 2HB GLN 65 -1.331 8.618 8.631 529 2HB GLN 65 1HB GLN 65 -2.370 7.329 9.236 530 1HG GLN 65 2HG GLN 65 0.653 7.227 9.394 531 2HG GLN 65 1HG GLN 65 -0.361 7.850 10.695 532 1HE2 GLN 65 1HE2 GLN 65 0.839 4.949 9.198 533 2HE2 GLN 65 2HE2 GLN 65 -0.003 3.847 10.177 534 H THR 66 H THR 66 -1.095 6.617 4.970 535 HA THR 66 HA THR 66 -3.622 8.109 4.544 536 HB THR 66 HB THR 66 -1.485 8.614 3.245 537 HG1 THR 66 HG1 THR 66 -3.034 9.455 2.121 538 1HG2 THR 66 1HG2 THR 66 -2.134 6.384 1.395 539 2HG2 THR 66 2HG2 THR 66 -1.304 5.940 2.886 540 3HG2 THR 66 3HG2 THR 66 -0.575 7.108 1.785 541 H ASN 67 H ASN 67 -5.172 7.216 2.896 542 HA ASN 67 HA ASN 67 -5.525 4.297 3.347 543 1HB ASN 67 2HB ASN 67 -7.324 6.593 2.950 544 2HB ASN 67 1HB ASN 67 -7.793 5.150 2.052 545 1HD2 ASN 67 1HD2 ASN 67 -8.270 3.179 3.298 546 2HD2 ASN 67 2HD2 ASN 67 -8.598 3.261 4.962 547 H LEU 68 H LEU 68 -5.258 2.871 1.724 548 HA LEU 68 HA LEU 68 -5.052 3.906 -1.079 549 1HB LEU 68 2HB LEU 68 -3.088 2.573 0.524 550 2HB LEU 68 1HB LEU 68 -3.572 1.478 -0.771 551 HG LEU 68 HG LEU 68 -3.176 4.272 -1.632 552 1HD1 LEU 68 1HD1 LEU 68 -0.875 4.437 -1.315 553 2HD1 LEU 68 2HD1 LEU 68 -0.674 2.696 -1.121 554 3HD1 LEU 68 3HD1 LEU 68 -1.361 3.655 0.189 555 1HD2 LEU 68 1HD2 LEU 68 -3.109 1.598 -2.676 556 2HD2 LEU 68 2HD2 LEU 68 -1.557 2.369 -3.004 557 3HD2 LEU 68 3HD2 LEU 68 -3.051 3.120 -3.564 558 H GLU 69 H GLU 69 -5.644 2.301 -2.737 559 HA GLU 69 HA GLU 69 -7.722 0.404 -1.732 560 1HB GLU 69 2HB GLU 69 -7.338 1.807 -4.383 561 2HB GLU 69 1HB GLU 69 -8.457 0.458 -4.189 562 1HG GLU 69 2HG GLU 69 -9.934 2.120 -3.653 563 2HG GLU 69 1HG GLU 69 -9.187 1.972 -2.062 564 H LEU 70 H LEU 70 -7.800 -1.733 -2.637 565 HA LEU 70 HA LEU 70 -5.347 -2.616 -4.087 566 1HB LEU 70 2HB LEU 70 -5.076 -3.116 -1.669 567 2HB LEU 70 1HB LEU 70 -6.584 -4.027 -1.699 568 HG LEU 70 HG LEU 70 -5.627 -5.575 -3.364 569 1HD1 LEU 70 1HD1 LEU 70 -3.946 -4.763 -4.640 570 2HD1 LEU 70 2HD1 LEU 70 -2.885 -5.093 -3.271 571 3HD1 LEU 70 3HD1 LEU 70 -3.582 -3.487 -3.480 572 1HD2 LEU 70 1HD2 LEU 70 -4.384 -6.805 -1.825 573 2HD2 LEU 70 2HD2 LEU 70 -5.223 -5.683 -0.753 574 3HD2 LEU 70 3HD2 LEU 70 -3.546 -5.382 -1.209 575 H TYR 71 H TYR 71 -5.797 -3.987 -5.751 576 HA TYR 71 HA TYR 71 -8.445 -5.359 -5.815 577 1HB TYR 71 2HB TYR 71 -7.240 -3.625 -7.989 578 2HB TYR 71 1HB TYR 71 -8.567 -4.751 -8.274 579 HD1 TYR 71 HD1 TYR 71 -10.770 -4.397 -7.220 580 HD2 TYR 71 HD2 TYR 71 -7.564 -1.581 -6.731 581 HE1 TYR 71 HE1 TYR 71 -12.382 -2.707 -6.388 582 HE2 TYR 71 HE2 TYR 71 -9.175 0.109 -5.900 583 HH TYR 71 HH TYR 71 -11.844 -0.343 -4.673 584 H TYR 72 H TYR 72 -8.428 -7.329 -6.992 585 HA TYR 72 HA TYR 72 -5.694 -8.391 -7.516 586 1HB TYR 72 2HB TYR 72 -8.360 -9.726 -6.989 587 2HB TYR 72 1HB TYR 72 -6.952 -10.623 -7.559 588 HD1 TYR 72 HD1 TYR 72 -4.718 -10.196 -6.219 589 HD2 TYR 72 HD2 TYR 72 -8.660 -9.440 -4.684 590 HE1 TYR 72 HE1 TYR 72 -3.841 -10.291 -3.906 591 HE2 TYR 72 HE2 TYR 72 -7.777 -9.536 -2.368 592 HH TYR 72 HH TYR 72 -5.225 -9.079 -1.354 593 H LEU 73 HN LEU 73 -5.102 -8.135 -9.617 594 HA LEU 73 HA LEU 73 -6.871 -9.190 -11.729 595 1HB LEU 73 2HB LEU 73 -6.766 -6.412 -11.199 596 2HB LEU 73 1HB LEU 73 -5.815 -6.669 -12.661 597 HG LEU 73 HG LEU 73 -8.187 -8.288 -12.792 598 1HD1 LEU 73 1HD1 LEU 73 -9.695 -6.137 -13.014 599 2HD1 LEU 73 2HD1 LEU 73 -8.528 -5.446 -11.887 600 3HD1 LEU 73 3HD1 LEU 73 -9.452 -6.879 -11.433 601 1HD2 LEU 73 1HD2 LEU 73 -8.474 -6.322 -14.676 602 2HD2 LEU 73 2HD2 LEU 73 -7.459 -7.750 -14.887 603 3HD2 LEU 73 3HD2 LEU 73 -6.743 -6.230 -14.351 Start of MODEL 6 1 H MET 1 1H MET 1 11.340 5.999 5.810 2 HA MET 1 HA MET 1 9.326 5.098 4.769 3 1HB MET 1 2HB MET 1 10.962 3.936 6.642 4 2HB MET 1 1HB MET 1 9.369 3.668 7.351 5 1HG MET 1 2HG MET 1 8.612 2.438 5.493 6 2HG MET 1 1HG MET 1 9.865 3.088 4.437 7 1HE MET 1 1HE MET 1 9.897 0.292 3.830 8 2HE MET 1 2HE MET 1 11.586 -0.107 4.124 9 3HE MET 1 3HE MET 1 11.164 1.479 3.483 10 H ILE 2 H ILE 2 7.107 4.953 4.786 11 HA ILE 2 HA ILE 2 5.692 6.066 7.180 12 HB ILE 2 HB ILE 2 3.942 6.861 5.614 13 1HG1 ILE 2 2HG1 ILE 2 5.845 6.190 3.361 14 2HG1 ILE 2 1HG1 ILE 2 4.579 5.067 3.859 15 1HG2 ILE 2 1HG2 ILE 2 6.667 7.822 4.710 16 2HG2 ILE 2 2HG2 ILE 2 5.964 8.260 6.267 17 3HG2 ILE 2 3HG2 ILE 2 5.165 8.744 4.771 18 1HD1 ILE 2 1HD1 ILE 2 3.021 7.176 3.648 19 2HD1 ILE 2 2HD1 ILE 2 3.486 6.285 2.199 20 3HD1 ILE 2 3HD1 ILE 2 4.314 7.786 2.614 21 H GLU 3 H GLU 3 3.455 5.212 7.462 22 HA GLU 3 HA GLU 3 3.294 2.348 6.601 23 1HB GLU 3 2HB GLU 3 3.317 3.361 9.169 24 2HB GLU 3 1HB GLU 3 1.591 3.183 8.854 25 1HG GLU 3 2HG GLU 3 3.550 0.967 8.238 26 2HG GLU 3 1HG GLU 3 2.815 1.137 9.832 27 H VAL 4 H VAL 4 1.953 2.328 4.845 28 HA VAL 4 HA VAL 4 -0.467 4.063 4.868 29 HB VAL 4 HB VAL 4 -0.622 3.584 2.472 30 1HG1 VAL 4 1HG1 VAL 4 0.941 5.153 2.031 31 2HG1 VAL 4 2HG1 VAL 4 2.256 4.081 2.511 32 3HG1 VAL 4 3HG1 VAL 4 1.404 5.032 3.729 33 1HG2 VAL 4 1HG2 VAL 4 0.916 2.121 1.343 34 2HG2 VAL 4 2HG2 VAL 4 0.271 1.213 2.709 35 3HG2 VAL 4 3HG2 VAL 4 1.887 1.914 2.799 36 H VAL 5 H VAL 5 -2.541 3.126 4.242 37 HA VAL 5 HA VAL 5 -2.814 0.307 5.192 38 HB VAL 5 HB VAL 5 -4.978 2.412 4.869 39 1HG1 VAL 5 1HG1 VAL 5 -6.081 0.359 4.952 40 2HG1 VAL 5 2HG1 VAL 5 -5.985 0.765 6.666 41 3HG1 VAL 5 3HG1 VAL 5 -4.841 -0.380 5.966 42 1HG2 VAL 5 1HG2 VAL 5 -3.313 1.615 7.277 43 2HG2 VAL 5 2HG2 VAL 5 -4.812 2.536 7.393 44 3HG2 VAL 5 3HG2 VAL 5 -3.425 3.213 6.540 45 H VAL 6 H VAL 6 -3.699 -1.244 3.831 46 HA VAL 6 HA VAL 6 -4.639 -0.335 1.136 47 HB VAL 6 HB VAL 6 -2.899 -2.762 1.700 48 1HG1 VAL 6 1HG1 VAL 6 -4.348 -1.708 -0.690 49 2HG1 VAL 6 2HG1 VAL 6 -4.026 -3.377 -0.215 50 3HG1 VAL 6 3HG1 VAL 6 -2.750 -2.407 -0.950 51 1HG2 VAL 6 1HG2 VAL 6 -2.098 -0.338 0.091 52 2HG2 VAL 6 2HG2 VAL 6 -1.066 -1.565 0.825 53 3HG2 VAL 6 3HG2 VAL 6 -1.868 -0.367 1.840 54 H ASN 7 H ASN 7 -6.741 -0.899 0.983 55 HA ASN 7 HA ASN 7 -7.606 -3.488 2.213 56 1HB ASN 7 2HB ASN 7 -9.847 -2.469 2.480 57 2HB ASN 7 1HB ASN 7 -8.618 -1.562 3.358 58 1HD2 ASN 7 1HD2 ASN 7 -8.012 0.570 2.522 59 2HD2 ASN 7 2HD2 ASN 7 -8.953 1.357 1.349 60 H ASP 8 H ASP 8 -8.890 -4.853 0.953 61 HA ASP 8 HA ASP 8 -8.703 -4.497 -1.932 62 1HB ASP 8 2HB ASP 8 -9.590 -6.634 -0.068 63 2HB ASP 8 1HB ASP 8 -10.328 -6.646 -1.669 64 H ARG 9 H ARG 9 -10.974 -3.472 0.404 65 HA ARG 9 HA ARG 9 -13.013 -2.356 0.177 66 1HB ARG 9 2HB ARG 9 -11.718 -1.844 -2.204 67 2HB ARG 9 1HB ARG 9 -13.231 -2.569 -2.749 68 1HG ARG 9 2HG ARG 9 -14.388 -0.712 -2.213 69 2HG ARG 9 1HG ARG 9 -13.720 -0.708 -0.580 70 1HD ARG 9 2HD ARG 9 -11.550 0.175 -1.826 71 2HD ARG 9 1HD ARG 9 -12.726 0.684 -3.038 72 HE ARG 9 HE ARG 9 -13.890 1.787 -0.940 73 1HH1 ARG 9 1HH2 ARG 9 -11.676 1.301 0.950 74 2HH1 ARG 9 2HH2 ARG 9 -10.705 2.727 0.791 75 1HH2 ARG 9 2HH1 ARG 9 -12.142 3.687 -2.226 76 2HH2 ARG 9 1HH1 ARG 9 -10.970 4.082 -1.014 77 H LEU 10 H LEU 10 -12.653 -5.426 0.019 78 HA LEU 10 HA LEU 10 -15.483 -5.987 -0.740 79 1HB LEU 10 2HB LEU 10 -13.209 -6.938 -2.135 80 2HB LEU 10 1HB LEU 10 -13.796 -8.301 -1.186 81 HG LEU 10 HG LEU 10 -14.887 -8.260 -3.386 82 1HD1 LEU 10 1HD1 LEU 10 -16.125 -8.668 -1.031 83 2HD1 LEU 10 2HD1 LEU 10 -16.965 -8.796 -2.575 84 3HD1 LEU 10 3HD1 LEU 10 -17.093 -7.318 -1.623 85 1HD2 LEU 10 1HD2 LEU 10 -15.767 -6.386 -4.339 86 2HD2 LEU 10 2HD2 LEU 10 -14.747 -5.534 -3.182 87 3HD2 LEU 10 3HD2 LEU 10 -16.449 -5.814 -2.816 88 H GLY 11 H GLY 11 -12.603 -7.497 0.779 89 1HA GLY 11 2HA GLY 11 -13.822 -7.712 3.371 90 2HA GLY 11 1HA GLY 11 -13.948 -9.256 2.525 91 H LYS 12 H LYS 12 -11.340 -6.802 2.538 92 HA LYS 12 HA LYS 12 -9.536 -8.590 4.015 93 1HB LYS 12 2HB LYS 12 -9.657 -8.734 1.179 94 2HB LYS 12 1HB LYS 12 -8.157 -7.899 1.586 95 1HG LYS 12 2HG LYS 12 -7.644 -9.730 3.215 96 2HG LYS 12 1HG LYS 12 -9.067 -10.593 2.633 97 1HD LYS 12 2HD LYS 12 -7.777 -11.470 1.006 98 2HD LYS 12 1HD LYS 12 -7.660 -9.851 0.317 99 1HE LYS 12 2HE LYS 12 -5.863 -10.604 2.599 100 2HE LYS 12 1HE LYS 12 -5.461 -11.147 0.968 101 1HZ LYS 12 1HZ LYS 12 -5.610 -8.839 0.225 102 2HZ LYS 12 2HZ LYS 12 -4.429 -9.036 1.426 103 3HZ LYS 12 3HZ LYS 12 -5.931 -8.338 1.815 104 H LYS 13 H LYS 13 -7.932 -7.402 5.023 105 HA LYS 13 HA LYS 13 -7.376 -4.647 4.043 106 1HB LYS 13 2HB LYS 13 -9.176 -4.704 5.890 107 2HB LYS 13 1HB LYS 13 -7.871 -5.191 6.972 108 1HG LYS 13 2HG LYS 13 -6.800 -3.042 5.556 109 2HG LYS 13 1HG LYS 13 -8.467 -2.558 5.867 110 1HD LYS 13 2HD LYS 13 -8.098 -2.323 8.089 111 2HD LYS 13 1HD LYS 13 -7.181 -3.827 8.180 112 1HE LYS 13 2HE LYS 13 -5.821 -1.659 6.717 113 2HE LYS 13 1HE LYS 13 -6.078 -1.327 8.427 114 1HZ LYS 13 1HZ LYS 13 -5.228 -3.913 8.391 115 2HZ LYS 13 2HZ LYS 13 -4.272 -2.557 8.755 116 3HZ LYS 13 3HZ LYS 13 -4.291 -3.186 7.177 117 H VAL 14 H VAL 14 -5.222 -4.546 3.781 118 HA VAL 14 HA VAL 14 -3.461 -5.924 5.775 119 HB VAL 14 HB VAL 14 -2.869 -5.574 2.819 120 1HG1 VAL 14 1HG1 VAL 14 -0.803 -5.793 3.896 121 2HG1 VAL 14 2HG1 VAL 14 -1.199 -7.471 3.529 122 3HG1 VAL 14 3HG1 VAL 14 -1.458 -6.840 5.155 123 1HG2 VAL 14 1HG2 VAL 14 -4.689 -7.142 2.993 124 2HG2 VAL 14 2HG2 VAL 14 -3.945 -7.941 4.377 125 3HG2 VAL 14 3HG2 VAL 14 -3.218 -8.089 2.778 126 H ARG 15 H ARG 15 -1.638 -4.763 6.429 127 HA ARG 15 HA ARG 15 -1.524 -1.913 5.530 128 1HB ARG 15 2HB ARG 15 -0.438 -1.482 7.740 129 2HB ARG 15 1HB ARG 15 -2.073 -2.119 7.899 130 1HG ARG 15 2HG ARG 15 -1.349 -3.986 8.948 131 2HG ARG 15 1HG ARG 15 -0.075 -4.248 7.759 132 1HD ARG 15 2HD ARG 15 0.647 -1.954 9.286 133 2HD ARG 15 1HD ARG 15 0.168 -3.218 10.418 134 HE ARG 15 HE ARG 15 1.883 -4.676 9.375 135 1HH1 ARG 15 1HH2 ARG 15 3.201 -2.121 10.449 136 2HH1 ARG 15 2HH2 ARG 15 4.276 -1.738 9.147 137 1HH2 ARG 15 2HH1 ARG 15 2.707 -3.850 6.881 138 2HH2 ARG 15 1HH1 ARG 15 3.995 -2.718 7.122 139 H VAL 16 H VAL 16 0.460 -1.106 4.817 140 HA VAL 16 HA VAL 16 2.841 -2.873 5.001 141 HB VAL 16 HB VAL 16 1.667 -3.408 2.870 142 1HG1 VAL 16 1HG1 VAL 16 1.682 -1.668 1.074 143 2HG1 VAL 16 2HG1 VAL 16 2.185 -0.479 2.274 144 3HG1 VAL 16 3HG1 VAL 16 0.612 -1.263 2.415 145 1HG2 VAL 16 1HG2 VAL 16 4.125 -1.897 2.063 146 2HG2 VAL 16 2HG2 VAL 16 3.631 -3.538 1.647 147 3HG2 VAL 16 3HG2 VAL 16 4.290 -3.194 3.245 148 H LYS 17 H LYS 17 4.783 -1.731 5.071 149 HA LYS 17 HA LYS 17 4.509 1.242 5.098 150 1HB LYS 17 2HB LYS 17 6.393 1.297 6.624 151 2HB LYS 17 1HB LYS 17 5.209 0.149 7.241 152 1HG LYS 17 2HG LYS 17 6.565 -1.648 5.975 153 2HG LYS 17 1HG LYS 17 7.835 -0.428 5.867 154 1HD LYS 17 2HD LYS 17 8.046 -0.287 8.236 155 2HD LYS 17 1HD LYS 17 6.535 -1.162 8.496 156 1HE LYS 17 2HE LYS 17 7.724 -3.091 7.185 157 2HE LYS 17 1HE LYS 17 9.204 -2.229 7.600 158 1HZ LYS 17 1HZ LYS 17 7.186 -2.859 9.660 159 2HZ LYS 17 2HZ LYS 17 8.837 -2.514 9.854 160 3HZ LYS 17 3HZ LYS 17 8.350 -4.006 9.203 161 H CYS 18 H CYS 18 5.993 2.508 3.956 162 HA CYS 18 HA CYS 18 8.271 1.356 2.548 163 1HB CYS 18 2HB CYS 18 5.704 1.346 1.246 164 2HB CYS 18 1HB CYS 18 6.760 2.490 0.419 165 HG CYS 18 HG CYS 18 6.975 -0.447 0.122 166 H LEU 19 H LEU 19 9.486 3.051 1.384 167 HA LEU 19 HA LEU 19 9.222 5.659 2.688 168 1HB LEU 19 2HB LEU 19 11.223 4.271 0.996 169 2HB LEU 19 1HB LEU 19 11.157 6.021 0.803 170 HG LEU 19 HG LEU 19 11.061 5.129 3.607 171 1HD1 LEU 19 1HD1 LEU 19 13.198 4.220 3.800 172 2HD1 LEU 19 2HD1 LEU 19 13.742 4.913 2.273 173 3HD1 LEU 19 3HD1 LEU 19 12.664 3.518 2.273 174 1HD2 LEU 19 1HD2 LEU 19 11.921 7.371 2.005 175 2HD2 LEU 19 2HD2 LEU 19 13.250 6.845 3.037 176 3HD2 LEU 19 3HD2 LEU 19 11.702 7.287 3.754 177 H ALA 20 H ALA 20 8.682 7.616 1.641 178 HA ALA 20 HA ALA 20 6.793 7.463 -0.521 179 1HB ALA 20 1HB ALA 20 8.294 9.974 0.228 180 2HB ALA 20 2HB ALA 20 7.051 9.304 1.285 181 3HB ALA 20 3HB ALA 20 6.635 9.817 -0.349 182 H GLU 21 H GLU 21 10.265 7.716 -0.434 183 HA GLU 21 HA GLU 21 10.497 8.730 -3.183 184 1HB GLU 21 2HB GLU 21 12.908 8.467 -2.848 185 2HB GLU 21 1HB GLU 21 12.200 9.281 -1.454 186 1HG GLU 21 2HG GLU 21 12.063 7.028 -0.314 187 2HG GLU 21 1HG GLU 21 12.987 6.359 -1.656 188 H ASP 22 H ASP 22 10.165 5.646 -1.636 189 HA ASP 22 HA ASP 22 11.524 3.987 -3.520 190 1HB ASP 22 2HB ASP 22 9.571 3.627 -1.358 191 2HB ASP 22 1HB ASP 22 9.362 2.472 -2.673 192 H SER 23 H SER 23 10.618 2.734 -5.281 193 HA SER 23 HA SER 23 8.679 4.269 -6.852 194 1HB SER 23 2HB SER 23 9.171 2.633 -8.631 195 2HB SER 23 1HB SER 23 10.656 3.277 -7.940 196 HG SER 23 HG SER 23 10.864 1.068 -8.032 197 H VAL 24 H VAL 24 6.766 3.214 -7.855 198 HA VAL 24 HA VAL 24 5.074 1.935 -5.940 199 HB VAL 24 HB VAL 24 4.879 2.077 -8.963 200 1HG1 VAL 24 1HG1 VAL 24 3.365 0.391 -8.629 201 2HG1 VAL 24 2HG1 VAL 24 2.327 1.724 -8.126 202 3HG1 VAL 24 3HG1 VAL 24 3.174 0.761 -6.916 203 1HG2 VAL 24 1HG2 VAL 24 4.466 4.248 -8.397 204 2HG2 VAL 24 2HG2 VAL 24 4.163 3.848 -6.706 205 3HG2 VAL 24 3HG2 VAL 24 2.889 3.634 -7.906 206 H GLY 25 H GLY 25 7.180 0.656 -8.495 207 1HA GLY 25 2HA GLY 25 6.345 -2.058 -8.479 208 2HA GLY 25 1HA GLY 25 7.982 -1.521 -8.860 209 H ASP 26 H ASP 26 8.767 -0.386 -6.447 210 HA ASP 26 HA ASP 26 9.464 -2.694 -4.870 211 1HB ASP 26 2HB ASP 26 10.800 -0.548 -5.022 212 2HB ASP 26 1HB ASP 26 9.574 0.214 -4.010 213 H PHE 27 H PHE 27 7.030 -0.128 -4.514 214 HA PHE 27 HA PHE 27 6.086 -0.811 -1.909 215 1HB PHE 27 2HB PHE 27 5.492 1.282 -3.135 216 2HB PHE 27 1HB PHE 27 4.500 0.327 -4.236 217 HD1 PHE 27 HD1 PHE 27 2.325 -0.430 -3.612 218 HD2 PHE 27 HD2 PHE 27 4.907 1.367 -0.689 219 HE1 PHE 27 HE1 PHE 27 0.436 -0.321 -2.011 220 HE2 PHE 27 HE2 PHE 27 3.017 1.475 0.912 221 HZ PHE 27 HZ PHE 27 0.782 0.630 0.249 222 H LYS 28 H LYS 28 5.139 -1.973 -5.143 223 HA LYS 28 HA LYS 28 3.032 -3.714 -4.196 224 1HB LYS 28 2HB LYS 28 4.552 -3.409 -6.775 225 2HB LYS 28 1HB LYS 28 3.509 -4.813 -6.535 226 1HG LYS 28 2HG LYS 28 1.677 -3.180 -5.861 227 2HG LYS 28 1HG LYS 28 2.723 -1.894 -6.459 228 1HD LYS 28 2HD LYS 28 2.830 -3.151 -8.659 229 2HD LYS 28 1HD LYS 28 1.561 -4.203 -8.034 230 1HE LYS 28 2HE LYS 28 -0.048 -2.624 -8.303 231 2HE LYS 28 1HE LYS 28 0.990 -1.336 -7.699 232 1HZ LYS 28 1HZ LYS 28 0.272 -1.744 -10.300 233 2HZ LYS 28 2HZ LYS 28 1.865 -2.329 -10.234 234 3HZ LYS 28 3HZ LYS 28 1.520 -0.735 -9.755 235 H LYS 29 H LYS 29 6.511 -4.060 -4.597 236 HA LYS 29 HA LYS 29 6.600 -6.943 -4.451 237 1HB LYS 29 2HB LYS 29 8.597 -4.729 -4.061 238 2HB LYS 29 1HB LYS 29 9.024 -6.382 -3.621 239 1HG LYS 29 2HG LYS 29 8.214 -7.050 -5.957 240 2HG LYS 29 1HG LYS 29 8.225 -5.327 -6.334 241 1HD LYS 29 2HD LYS 29 10.664 -5.490 -5.258 242 2HD LYS 29 1HD LYS 29 10.516 -7.163 -5.795 243 1HE LYS 29 2HE LYS 29 11.127 -6.451 -7.845 244 2HE LYS 29 1HE LYS 29 9.557 -5.654 -7.947 245 1HZ LYS 29 1HZ LYS 29 12.062 -4.472 -6.875 246 2HZ LYS 29 2HZ LYS 29 10.545 -3.704 -6.879 247 3HZ LYS 29 3HZ LYS 29 11.315 -4.077 -8.347 248 H VAL 30 H VAL 30 6.859 -4.351 -2.011 249 HA VAL 30 HA VAL 30 7.331 -6.166 0.202 250 HB VAL 30 HB VAL 30 6.256 -3.324 0.246 251 1HG1 VAL 30 1HG1 VAL 30 7.125 -5.282 2.325 252 2HG1 VAL 30 2HG1 VAL 30 5.890 -4.027 2.410 253 3HG1 VAL 30 3HG1 VAL 30 7.594 -3.597 2.555 254 1HG2 VAL 30 1HG2 VAL 30 8.551 -2.621 0.535 255 2HG2 VAL 30 2HG2 VAL 30 8.495 -3.646 -0.898 256 3HG2 VAL 30 3HG2 VAL 30 9.106 -4.292 0.623 257 H LEU 31 H LEU 31 4.447 -4.609 -1.183 258 HA LEU 31 HA LEU 31 2.616 -5.553 0.840 259 1HB LEU 31 2HB LEU 31 2.086 -3.651 -0.653 260 2HB LEU 31 1HB LEU 31 2.081 -4.744 -2.037 261 HG LEU 31 HG LEU 31 0.283 -6.080 -0.814 262 1HD1 LEU 31 1HD1 LEU 31 -0.431 -5.433 1.227 263 2HD1 LEU 31 2HD1 LEU 31 -0.605 -3.758 0.708 264 3HD1 LEU 31 3HD1 LEU 31 0.957 -4.348 1.275 265 1HD2 LEU 31 1HD2 LEU 31 -0.200 -4.539 -2.696 266 2HD2 LEU 31 2HD2 LEU 31 -0.350 -3.204 -1.553 267 3HD2 LEU 31 3HD2 LEU 31 -1.504 -4.537 -1.508 268 H SER 32 H SER 32 3.473 -6.754 -2.420 269 HA SER 32 HA SER 32 1.718 -8.980 -2.502 270 1HB SER 32 2HB SER 32 3.235 -9.897 -4.198 271 2HB SER 32 1HB SER 32 2.996 -8.173 -4.455 272 HG SER 32 HG SER 32 5.201 -8.749 -4.575 273 H LEU 33 H LEU 33 4.716 -8.561 -0.724 274 HA LEU 33 HA LEU 33 5.303 -11.350 -0.310 275 1HB LEU 33 2HB LEU 33 6.139 -8.769 0.932 276 2HB LEU 33 1HB LEU 33 6.398 -10.237 1.873 277 HG LEU 33 HG LEU 33 7.227 -10.142 -1.018 278 1HD1 LEU 33 1HD1 LEU 33 8.149 -8.172 0.473 279 2HD1 LEU 33 2HD1 LEU 33 9.253 -9.085 -0.557 280 3HD1 LEU 33 3HD1 LEU 33 9.161 -9.439 1.169 281 1HD2 LEU 33 1HD2 LEU 33 8.520 -11.531 1.336 282 2HD2 LEU 33 2HD2 LEU 33 8.678 -11.916 -0.378 283 3HD2 LEU 33 3HD2 LEU 33 7.165 -12.249 0.463 284 H GLN 34 H GLN 34 3.254 -9.016 1.410 285 HA GLN 34 HA GLN 34 2.658 -10.881 3.589 286 1HB GLN 34 2HB GLN 34 1.427 -8.220 2.809 287 2HB GLN 34 1HB GLN 34 1.009 -9.123 4.266 288 1HG GLN 34 2HG GLN 34 3.259 -8.930 5.120 289 2HG GLN 34 1HG GLN 34 3.833 -8.247 3.598 290 1HE2 GLN 34 1HE2 GLN 34 2.715 -6.086 2.958 291 2HE2 GLN 34 2HE2 GLN 34 2.329 -5.018 4.220 292 H ILE 35 H ILE 35 0.830 -9.533 0.812 293 HA ILE 35 HA ILE 35 -1.495 -11.205 1.330 294 HB ILE 35 HB ILE 35 -2.242 -10.429 -0.942 295 1HG1 ILE 35 2HG1 ILE 35 0.384 -8.906 -0.869 296 2HG1 ILE 35 1HG1 ILE 35 0.005 -10.229 -1.965 297 1HG2 ILE 35 1HG2 ILE 35 -1.251 -8.043 0.582 298 2HG2 ILE 35 2HG2 ILE 35 -2.414 -9.138 1.331 299 3HG2 ILE 35 3HG2 ILE 35 -2.822 -8.313 -0.174 300 1HD1 ILE 35 1HD1 ILE 35 -1.821 -7.847 -1.842 301 2HD1 ILE 35 2HD1 ILE 35 -1.533 -8.961 -3.177 302 3HD1 ILE 35 3HD1 ILE 35 -0.322 -7.748 -2.766 303 H GLY 36 H GLY 36 1.476 -11.652 -0.463 304 1HA GLY 36 2HA GLY 36 2.281 -13.541 -1.612 305 2HA GLY 36 1HA GLY 36 0.927 -14.449 -0.927 306 H THR 37 H THR 37 0.912 -11.558 -2.996 307 HA THR 37 HA THR 37 -0.649 -13.103 -5.032 308 HB THR 37 HB THR 37 -0.969 -10.137 -4.596 309 HG1 THR 37 HG1 THR 37 -2.649 -10.626 -3.158 310 1HG2 THR 37 1HG2 THR 37 -3.399 -11.172 -5.237 311 2HG2 THR 37 2HG2 THR 37 -2.330 -12.312 -6.054 312 3HG2 THR 37 3HG2 THR 37 -2.232 -10.590 -6.424 313 H GLN 38 H GLN 38 2.331 -11.925 -4.609 314 HA GLN 38 HA GLN 38 4.038 -11.276 -6.061 315 1HB GLN 38 2HB GLN 38 1.897 -12.098 -8.013 316 2HB GLN 38 1HB GLN 38 3.375 -11.334 -8.593 317 1HG GLN 38 2HG GLN 38 4.718 -13.107 -7.927 318 2HG GLN 38 1HG GLN 38 3.606 -13.603 -6.650 319 1HE2 GLN 38 1HE2 GLN 38 3.521 -13.268 -10.260 320 2HE2 GLN 38 2HE2 GLN 38 2.684 -14.722 -10.511 321 HA PRO 39 HA PRO 39 3.361 -6.975 -6.698 322 1HB PRO 39 2HB PRO 39 5.581 -6.418 -8.224 323 2HB PRO 39 1HB PRO 39 5.638 -6.712 -6.478 324 1HG PRO 39 2HG PRO 39 6.472 -8.504 -8.710 325 2HG PRO 39 1HG PRO 39 7.050 -8.451 -7.037 326 1HD PRO 39 2HD PRO 39 5.222 -10.332 -8.099 327 2HD PRO 39 1HD PRO 39 5.553 -10.056 -6.376 328 H ASN 40 H ASN 40 3.323 -9.202 -9.327 329 HA ASN 40 HA ASN 40 2.549 -7.086 -11.277 330 1HB ASN 40 2HB ASN 40 3.513 -9.929 -11.555 331 2HB ASN 40 1HB ASN 40 2.687 -9.122 -12.887 332 1HD2 ASN 40 1HD2 ASN 40 3.762 -7.249 -13.879 333 2HD2 ASN 40 2HD2 ASN 40 5.411 -6.947 -13.615 334 H LYS 41 H LYS 41 1.061 -9.178 -9.099 335 HA LYS 41 HA LYS 41 -1.358 -9.412 -10.847 336 1HB LYS 41 2HB LYS 41 0.019 -11.379 -9.320 337 2HB LYS 41 1HB LYS 41 -1.526 -11.087 -8.519 338 1HG LYS 41 2HG LYS 41 -2.577 -12.280 -10.109 339 2HG LYS 41 1HG LYS 41 -2.004 -11.145 -11.333 340 1HD LYS 41 2HD LYS 41 0.262 -12.521 -11.007 341 2HD LYS 41 1HD LYS 41 -0.868 -13.783 -10.515 342 1HE LYS 41 2HE LYS 41 -0.979 -14.198 -12.755 343 2HE LYS 41 1HE LYS 41 -2.115 -12.849 -12.743 344 1HZ LYS 41 1HZ LYS 41 0.707 -12.892 -13.567 345 2HZ LYS 41 2HZ LYS 41 0.033 -11.444 -12.983 346 3HZ LYS 41 3HZ LYS 41 -0.630 -12.206 -14.350 347 H ILE 42 H ILE 42 -0.411 -7.162 -8.967 348 HA ILE 42 HA ILE 42 -2.955 -7.023 -7.408 349 HB ILE 42 HB ILE 42 -1.633 -5.700 -5.675 350 1HG1 ILE 42 2HG1 ILE 42 0.730 -7.077 -6.992 351 2HG1 ILE 42 1HG1 ILE 42 0.363 -5.365 -7.187 352 1HG2 ILE 42 1HG2 ILE 42 -1.612 -8.611 -6.185 353 2HG2 ILE 42 2HG2 ILE 42 -2.135 -7.718 -4.758 354 3HG2 ILE 42 3HG2 ILE 42 -0.423 -8.054 -5.009 355 1HD1 ILE 42 1HD1 ILE 42 1.838 -5.284 -5.395 356 2HD1 ILE 42 2HD1 ILE 42 1.300 -6.833 -4.748 357 3HD1 ILE 42 3HD1 ILE 42 0.297 -5.396 -4.544 358 H VAL 43 H VAL 43 -4.040 -5.131 -7.579 359 HA VAL 43 HA VAL 43 -2.759 -2.934 -9.156 360 HB VAL 43 HB VAL 43 -5.698 -3.670 -8.879 361 1HG1 VAL 43 1HG1 VAL 43 -5.972 -1.466 -9.372 362 2HG1 VAL 43 2HG1 VAL 43 -5.467 -1.931 -10.996 363 3HG1 VAL 43 3HG1 VAL 43 -4.289 -1.272 -9.862 364 1HG2 VAL 43 1HG2 VAL 43 -4.068 -5.095 -10.343 365 2HG2 VAL 43 2HG2 VAL 43 -4.067 -3.696 -11.416 366 3HG2 VAL 43 3HG2 VAL 43 -5.577 -4.536 -11.066 367 H LEU 44 H LEU 44 -2.146 -1.338 -7.771 368 HA LEU 44 HA LEU 44 -3.728 -0.902 -5.291 369 1HB LEU 44 2HB LEU 44 -0.944 -0.146 -6.158 370 2HB LEU 44 1HB LEU 44 -1.709 0.643 -4.778 371 HG LEU 44 HG LEU 44 -1.821 -2.340 -4.906 372 1HD1 LEU 44 1HD1 LEU 44 0.636 -0.995 -5.187 373 2HD1 LEU 44 2HD1 LEU 44 0.395 -2.686 -4.746 374 3HD1 LEU 44 3HD1 LEU 44 0.546 -1.462 -3.489 375 1HD2 LEU 44 1HD2 LEU 44 -1.736 -2.107 -2.492 376 2HD2 LEU 44 2HD2 LEU 44 -2.903 -0.939 -3.114 377 3HD2 LEU 44 3HD2 LEU 44 -1.294 -0.405 -2.628 378 H GLN 45 H GLN 45 -4.966 0.908 -5.016 379 HA GLN 45 HA GLN 45 -4.681 3.093 -7.036 380 1HB GLN 45 2HB GLN 45 -7.324 2.410 -5.768 381 2HB GLN 45 1HB GLN 45 -7.012 3.277 -7.271 382 1HG GLN 45 2HG GLN 45 -5.854 0.897 -7.864 383 2HG GLN 45 1HG GLN 45 -7.113 0.351 -6.755 384 1HE2 GLN 45 1HE2 GLN 45 -9.405 1.172 -7.299 385 2HE2 GLN 45 2HE2 GLN 45 -9.798 1.371 -8.939 386 H LYS 46 H LYS 46 -4.143 4.991 -6.068 387 HA LYS 46 HA LYS 46 -4.633 5.292 -3.149 388 1HB LYS 46 2HB LYS 46 -2.384 5.774 -4.529 389 2HB LYS 46 1HB LYS 46 -3.144 7.353 -4.716 390 1HG LYS 46 2HG LYS 46 -3.553 7.220 -2.153 391 2HG LYS 46 1HG LYS 46 -2.329 5.949 -2.172 392 1HD LYS 46 2HD LYS 46 -1.124 7.953 -1.742 393 2HD LYS 46 1HD LYS 46 -0.853 7.618 -3.454 394 1HE LYS 46 2HE LYS 46 -1.556 9.756 -3.775 395 2HE LYS 46 1HE LYS 46 -3.172 9.091 -3.533 396 1HZ LYS 46 1HZ LYS 46 -3.158 9.713 -1.285 397 2HZ LYS 46 2HZ LYS 46 -2.552 11.066 -2.120 398 3HZ LYS 46 3HZ LYS 46 -1.491 10.033 -1.285 399 H GLY 47 H GLY 47 -6.838 5.852 -3.116 400 1HA GLY 47 2HA GLY 47 -8.654 7.334 -3.142 401 2HA GLY 47 1HA GLY 47 -7.495 8.617 -3.480 402 H GLY 48 H GLY 48 -8.427 5.722 -5.373 403 1HA GLY 48 2HA GLY 48 -9.419 5.560 -7.503 404 2HA GLY 48 1HA GLY 48 -9.856 7.264 -7.377 405 H SER 49 H SER 49 -6.634 5.726 -7.255 406 HA SER 49 HA SER 49 -5.933 7.036 -9.833 407 1HB SER 49 2HB SER 49 -5.285 8.477 -7.783 408 2HB SER 49 1HB SER 49 -4.092 7.226 -7.441 409 HG SER 49 HG SER 49 -3.761 9.218 -9.026 410 H VAL 50 H VAL 50 -4.953 5.517 -11.094 411 HA VAL 50 HA VAL 50 -4.146 2.966 -9.925 412 HB VAL 50 HB VAL 50 -3.536 2.349 -12.263 413 1HG1 VAL 50 1HG1 VAL 50 -5.856 2.108 -11.397 414 2HG1 VAL 50 2HG1 VAL 50 -5.814 2.409 -13.133 415 3HG1 VAL 50 3HG1 VAL 50 -6.232 3.714 -12.023 416 1HG2 VAL 50 1HG2 VAL 50 -2.828 4.171 -13.470 417 2HG2 VAL 50 2HG2 VAL 50 -3.897 5.285 -12.619 418 3HG2 VAL 50 3HG2 VAL 50 -4.534 4.257 -13.903 419 H LEU 51 H LEU 51 -2.195 2.527 -9.119 420 HA LEU 51 HA LEU 51 0.062 4.378 -9.656 421 1HB LEU 51 2HB LEU 51 0.067 2.046 -7.728 422 2HB LEU 51 1HB LEU 51 1.086 3.483 -7.701 423 HG LEU 51 HG LEU 51 -1.917 3.495 -7.276 424 1HD1 LEU 51 1HD1 LEU 51 -0.936 2.434 -5.372 425 2HD1 LEU 51 2HD1 LEU 51 -1.201 4.114 -4.907 426 3HD1 LEU 51 3HD1 LEU 51 0.417 3.567 -5.352 427 1HD2 LEU 51 1HD2 LEU 51 -0.032 5.718 -6.549 428 2HD2 LEU 51 2HD2 LEU 51 -1.748 5.798 -6.948 429 3HD2 LEU 51 3HD2 LEU 51 -0.558 5.554 -8.226 430 H LYS 52 H LYS 52 1.624 3.817 -11.086 431 HA LYS 52 HA LYS 52 1.748 0.977 -12.000 432 1HB LYS 52 2HB LYS 52 1.914 3.554 -13.352 433 2HB LYS 52 1HB LYS 52 3.301 2.532 -13.730 434 1HG LYS 52 2HG LYS 52 1.822 1.745 -15.315 435 2HG LYS 52 1HG LYS 52 1.398 0.675 -13.979 436 1HD LYS 52 2HD LYS 52 -0.720 1.434 -14.293 437 2HD LYS 52 1HD LYS 52 -0.163 2.883 -13.457 438 1HE LYS 52 2HE LYS 52 0.660 3.085 -16.185 439 2HE LYS 52 1HE LYS 52 -1.042 2.629 -16.174 440 1HZ LYS 52 1HZ LYS 52 -0.572 4.606 -14.212 441 2HZ LYS 52 2HZ LYS 52 -1.585 4.673 -15.575 442 3HZ LYS 52 3HZ LYS 52 0.044 5.138 -15.700 443 H ASP 53 H ASP 53 3.704 -0.123 -11.965 444 HA ASP 53 HA ASP 53 5.629 0.540 -9.978 445 1HB ASP 53 2HB ASP 53 6.252 -1.207 -12.365 446 2HB ASP 53 1HB ASP 53 6.863 -1.350 -10.719 447 H HIS 54 H HIS 54 5.448 1.410 -13.378 448 HA HIS 54 HA HIS 54 8.184 2.202 -13.749 449 1HB HIS 54 2HB HIS 54 5.614 2.562 -15.168 450 2HB HIS 54 1HB HIS 54 6.799 3.840 -15.444 451 HD1 HIS 54 HD1 HIS 54 9.077 3.148 -16.536 452 HD2 HIS 54 HD2 HIS 54 6.312 0.043 -16.259 453 HE1 HIS 54 HE1 HIS 54 9.950 1.281 -18.005 454 H ILE 55 H ILE 55 5.497 3.759 -12.134 455 HA ILE 55 HA ILE 55 6.987 6.340 -12.059 456 HB ILE 55 HB ILE 55 4.126 5.644 -11.318 457 1HG1 ILE 55 2HG1 ILE 55 4.074 7.595 -13.247 458 2HG1 ILE 55 1HG1 ILE 55 5.501 6.676 -13.723 459 1HG2 ILE 55 1HG2 ILE 55 3.907 8.170 -11.140 460 2HG2 ILE 55 2HG2 ILE 55 5.669 8.246 -11.143 461 3HG2 ILE 55 3HG2 ILE 55 4.825 7.409 -9.840 462 1HD1 ILE 55 1HD1 ILE 55 3.283 4.936 -12.961 463 2HD1 ILE 55 2HD1 ILE 55 4.255 4.932 -14.431 464 3HD1 ILE 55 3HD1 ILE 55 2.862 6.005 -14.298 465 H SER 56 H SER 56 7.344 7.383 -9.993 466 HA SER 56 HA SER 56 7.859 5.434 -7.841 467 1HB SER 56 2HB SER 56 9.401 7.428 -8.717 468 2HB SER 56 1HB SER 56 8.482 8.336 -7.520 469 HG SER 56 HG SER 56 10.519 7.079 -6.913 470 H LEU 57 H LEU 57 7.197 5.861 -5.625 471 HA LEU 57 HA LEU 57 4.433 6.504 -5.329 472 1HB LEU 57 2HB LEU 57 6.650 6.406 -3.260 473 2HB LEU 57 1HB LEU 57 4.934 6.508 -2.871 474 HG LEU 57 HG LEU 57 5.971 4.320 -4.670 475 1HD1 LEU 57 1HD1 LEU 57 5.700 4.084 -1.665 476 2HD1 LEU 57 2HD1 LEU 57 7.242 4.404 -2.457 477 3HD1 LEU 57 3HD1 LEU 57 6.378 2.904 -2.786 478 1HD2 LEU 57 1HD2 LEU 57 3.634 4.323 -4.692 479 2HD2 LEU 57 2HD2 LEU 57 3.519 4.881 -3.023 480 3HD2 LEU 57 3HD2 LEU 57 3.965 3.209 -3.365 481 H GLU 58 H GLU 58 7.371 8.444 -4.813 482 HA GLU 58 HA GLU 58 6.172 10.731 -3.621 483 1HB GLU 58 2HB GLU 58 8.728 10.024 -4.422 484 2HB GLU 58 1HB GLU 58 8.331 11.351 -5.512 485 1HG GLU 58 2HG GLU 58 8.345 12.896 -3.841 486 2HG GLU 58 1HG GLU 58 7.555 11.808 -2.701 487 H ASP 59 H ASP 59 6.408 9.730 -7.014 488 HA ASP 59 HA ASP 59 5.554 12.202 -8.197 489 1HB ASP 59 2HB ASP 59 6.549 10.086 -9.333 490 2HB ASP 59 1HB ASP 59 4.892 9.484 -9.330 491 H TYR 60 H TYR 60 3.750 9.308 -7.128 492 HA TYR 60 HA TYR 60 1.149 10.407 -7.821 493 1HB TYR 60 2HB TYR 60 2.036 8.074 -6.109 494 2HB TYR 60 1HB TYR 60 0.338 8.500 -6.314 495 HD1 TYR 60 HD1 TYR 60 -0.416 8.880 -8.842 496 HD2 TYR 60 HD2 TYR 60 2.995 6.576 -7.613 497 HE1 TYR 60 HE1 TYR 60 -0.460 7.665 -11.001 498 HE2 TYR 60 HE2 TYR 60 2.952 5.361 -9.774 499 HH TYR 60 HH TYR 60 0.671 6.245 -12.345 500 H GLU 61 H GLU 61 3.320 10.849 -5.177 501 HA GLU 61 HA GLU 61 3.174 12.218 -3.294 502 1HB GLU 61 2HB GLU 61 1.444 13.434 -4.980 503 2HB GLU 61 1HB GLU 61 0.314 12.929 -3.724 504 1HG GLU 61 2HG GLU 61 2.899 14.350 -3.062 505 2HG GLU 61 1HG GLU 61 1.420 15.236 -3.430 506 H VAL 62 H VAL 62 3.178 9.883 -2.470 507 HA VAL 62 HA VAL 62 0.624 9.011 -1.258 508 HB VAL 62 HB VAL 62 3.400 7.776 -1.244 509 1HG1 VAL 62 1HG1 VAL 62 2.232 5.768 -0.343 510 2HG1 VAL 62 2HG1 VAL 62 0.754 6.719 -0.197 511 3HG1 VAL 62 3HG1 VAL 62 2.168 7.132 0.773 512 1HG2 VAL 62 1HG2 VAL 62 2.726 6.504 -3.040 513 2HG2 VAL 62 2HG2 VAL 62 1.719 7.919 -3.346 514 3HG2 VAL 62 3HG2 VAL 62 1.034 6.506 -2.542 515 H HIS 63 H HIS 63 0.073 9.636 0.759 516 HA HIS 63 HA HIS 63 2.142 10.887 2.490 517 1HB HIS 63 2HB HIS 63 -0.423 11.669 1.865 518 2HB HIS 63 1HB HIS 63 -0.648 10.893 3.432 519 HD1 HIS 63 HD1 HIS 63 1.549 13.546 1.807 520 HD2 HIS 63 HD2 HIS 63 0.163 12.452 5.581 521 HE1 HIS 63 HE1 HIS 63 2.314 15.357 3.402 522 H ASP 64 H ASP 64 2.057 10.373 4.848 523 HA ASP 64 HA ASP 64 2.129 7.519 5.299 524 1HB ASP 64 2HB ASP 64 2.614 8.099 7.637 525 2HB ASP 64 1HB ASP 64 3.575 9.100 6.551 526 H GLN 65 H GLN 65 0.661 6.210 6.414 527 HA GLN 65 HA GLN 65 -1.434 5.476 7.154 528 1HB GLN 65 2HB GLN 65 -1.217 8.252 8.256 529 2HB GLN 65 1HB GLN 65 -2.788 7.455 8.330 530 1HG GLN 65 2HG GLN 65 -1.860 6.725 10.326 531 2HG GLN 65 1HG GLN 65 -1.354 5.424 9.248 532 1HE2 GLN 65 1HE2 GLN 65 0.914 5.257 8.720 533 2HE2 GLN 65 2HE2 GLN 65 2.092 6.225 9.464 534 H THR 66 H THR 66 -1.154 6.465 4.407 535 HA THR 66 HA THR 66 -3.656 7.897 3.814 536 HB THR 66 HB THR 66 -1.541 8.269 2.498 537 HG1 THR 66 HG1 THR 66 -3.017 8.905 1.170 538 1HG2 THR 66 1HG2 THR 66 -1.097 6.517 0.707 539 2HG2 THR 66 2HG2 THR 66 -2.116 5.425 1.644 540 3HG2 THR 66 3HG2 THR 66 -0.630 6.064 2.345 541 H ASN 67 H ASN 67 -5.253 6.941 2.271 542 HA ASN 67 HA ASN 67 -5.698 4.074 2.927 543 1HB ASN 67 2HB ASN 67 -7.470 5.911 3.295 544 2HB ASN 67 1HB ASN 67 -7.658 5.907 1.541 545 1HD2 ASN 67 1HD2 ASN 67 -7.908 3.799 4.430 546 2HD2 ASN 67 2HD2 ASN 67 -8.956 2.673 3.712 547 H LEU 68 H LEU 68 -5.130 2.605 1.441 548 HA LEU 68 HA LEU 68 -5.105 3.399 -1.446 549 1HB LEU 68 2HB LEU 68 -3.228 1.800 0.228 550 2HB LEU 68 1HB LEU 68 -3.502 1.233 -1.419 551 HG LEU 68 HG LEU 68 -3.101 4.140 -1.231 552 1HD1 LEU 68 1HD1 LEU 68 -1.566 3.015 0.573 553 2HD1 LEU 68 2HD1 LEU 68 -0.864 4.182 -0.548 554 3HD1 LEU 68 3HD1 LEU 68 -0.645 2.453 -0.822 555 1HD2 LEU 68 1HD2 LEU 68 -3.009 3.319 -3.403 556 2HD2 LEU 68 2HD2 LEU 68 -2.233 1.814 -2.913 557 3HD2 LEU 68 3HD2 LEU 68 -1.294 3.304 -2.991 558 H GLU 69 H GLU 69 -5.907 1.862 -2.949 559 HA GLU 69 HA GLU 69 -7.728 -0.179 -1.752 560 1HB GLU 69 2HB GLU 69 -7.761 1.280 -4.406 561 2HB GLU 69 1HB GLU 69 -8.811 -0.093 -4.056 562 1HG GLU 69 2HG GLU 69 -10.219 1.575 -3.339 563 2HG GLU 69 1HG GLU 69 -9.294 1.375 -1.850 564 H LEU 70 H LEU 70 -7.591 -2.327 -2.438 565 HA LEU 70 HA LEU 70 -5.307 -2.984 -4.251 566 1HB LEU 70 2HB LEU 70 -4.911 -3.608 -1.864 567 2HB LEU 70 1HB LEU 70 -6.343 -4.631 -1.922 568 HG LEU 70 HG LEU 70 -5.330 -5.994 -3.693 569 1HD1 LEU 70 1HD1 LEU 70 -2.616 -5.011 -3.526 570 2HD1 LEU 70 2HD1 LEU 70 -3.688 -3.718 -4.063 571 3HD1 LEU 70 3HD1 LEU 70 -3.623 -5.239 -4.956 572 1HD2 LEU 70 1HD2 LEU 70 -3.021 -5.970 -1.897 573 2HD2 LEU 70 2HD2 LEU 70 -4.233 -7.225 -2.144 574 3HD2 LEU 70 3HD2 LEU 70 -4.551 -5.902 -1.023 575 H TYR 71 H TYR 71 -5.823 -4.185 -6.001 576 HA TYR 71 HA TYR 71 -8.373 -5.733 -5.994 577 1HB TYR 71 2HB TYR 71 -7.492 -3.609 -7.946 578 2HB TYR 71 1HB TYR 71 -8.599 -4.888 -8.441 579 HD1 TYR 71 HD1 TYR 71 -10.766 -5.209 -7.161 580 HD2 TYR 71 HD2 TYR 71 -8.240 -1.774 -6.630 581 HE1 TYR 71 HE1 TYR 71 -12.649 -3.987 -6.105 582 HE2 TYR 71 HE2 TYR 71 -10.123 -0.553 -5.575 583 HH TYR 71 HH TYR 71 -13.041 -1.059 -5.875 584 H TYR 72 H TYR 72 -8.260 -7.648 -7.215 585 HA TYR 72 HA TYR 72 -5.526 -8.339 -8.194 586 1HB TYR 72 2HB TYR 72 -7.826 -10.180 -7.469 587 2HB TYR 72 1HB TYR 72 -6.189 -10.679 -7.896 588 HD1 TYR 72 HD1 TYR 72 -4.468 -8.816 -6.485 589 HD2 TYR 72 HD2 TYR 72 -8.149 -10.616 -5.194 590 HE1 TYR 72 HE1 TYR 72 -3.777 -8.533 -4.120 591 HE2 TYR 72 HE2 TYR 72 -7.457 -10.335 -2.831 592 HH TYR 72 HH TYR 72 -4.568 -9.959 -1.791 593 H LEU 73 HN LEU 73 -5.210 -8.536 -10.334 594 HA LEU 73 HA LEU 73 -7.606 -8.758 -12.106 595 1HB LEU 73 2HB LEU 73 -5.951 -6.765 -12.267 596 2HB LEU 73 1HB LEU 73 -4.853 -7.924 -13.017 597 HG LEU 73 HG LEU 73 -7.438 -8.248 -14.205 598 1HD1 LEU 73 1HD1 LEU 73 -7.907 -5.956 -13.454 599 2HD1 LEU 73 2HD1 LEU 73 -7.713 -6.000 -15.205 600 3HD1 LEU 73 3HD1 LEU 73 -6.405 -5.395 -14.189 601 1HD2 LEU 73 1HD2 LEU 73 -5.054 -6.896 -15.476 602 2HD2 LEU 73 2HD2 LEU 73 -6.218 -7.996 -16.214 603 3HD2 LEU 73 3HD2 LEU 73 -5.020 -8.615 -15.079 Start of MODEL 7 1 H MET 1 1H MET 1 11.516 5.659 5.944 2 HA MET 1 HA MET 1 9.498 4.901 4.870 3 1HB MET 1 2HB MET 1 10.545 3.710 7.381 4 2HB MET 1 1HB MET 1 9.007 3.070 6.806 5 1HG MET 1 2HG MET 1 10.045 2.721 4.558 6 2HG MET 1 1HG MET 1 11.592 3.228 5.234 7 1HE MET 1 1HE MET 1 11.323 0.995 3.719 8 2HE MET 1 2HE MET 1 11.241 -0.618 4.423 9 3HE MET 1 3HE MET 1 12.693 0.357 4.637 10 H ILE 2 H ILE 2 7.246 4.759 4.869 11 HA ILE 2 HA ILE 2 5.853 6.001 7.210 12 HB ILE 2 HB ILE 2 4.182 6.885 5.622 13 1HG1 ILE 2 2HG1 ILE 2 6.025 6.209 3.343 14 2HG1 ILE 2 1HG1 ILE 2 4.863 5.004 3.894 15 1HG2 ILE 2 1HG2 ILE 2 6.145 8.257 6.268 16 2HG2 ILE 2 2HG2 ILE 2 5.601 8.628 4.633 17 3HG2 ILE 2 3HG2 ILE 2 7.029 7.624 4.880 18 1HD1 ILE 2 1HD1 ILE 2 4.369 7.163 2.152 19 2HD1 ILE 2 2HD1 ILE 2 3.587 7.591 3.674 20 3HD1 ILE 2 3HD1 ILE 2 3.175 6.080 2.865 21 H GLU 3 H GLU 3 3.624 5.258 7.523 22 HA GLU 3 HA GLU 3 3.336 2.388 6.771 23 1HB GLU 3 2HB GLU 3 3.081 3.646 9.216 24 2HB GLU 3 1HB GLU 3 1.405 3.514 8.685 25 1HG GLU 3 2HG GLU 3 3.277 1.154 8.521 26 2HG GLU 3 1HG GLU 3 2.408 1.525 10.009 27 H VAL 4 H VAL 4 1.678 1.755 5.440 28 HA VAL 4 HA VAL 4 -0.493 3.719 4.852 29 HB VAL 4 HB VAL 4 -0.327 2.818 2.417 30 1HG1 VAL 4 1HG1 VAL 4 0.319 4.958 2.201 31 2HG1 VAL 4 2HG1 VAL 4 1.984 4.431 2.442 32 3HG1 VAL 4 3HG1 VAL 4 1.020 4.962 3.818 33 1HG2 VAL 4 1HG2 VAL 4 1.339 1.372 1.974 34 2HG2 VAL 4 2HG2 VAL 4 1.876 1.457 3.644 35 3HG2 VAL 4 3HG2 VAL 4 2.519 2.588 2.457 36 H VAL 5 H VAL 5 -2.507 2.778 4.354 37 HA VAL 5 HA VAL 5 -2.663 -0.167 4.873 38 HB VAL 5 HB VAL 5 -5.008 0.291 5.634 39 1HG1 VAL 5 1HG1 VAL 5 -2.673 0.536 7.016 40 2HG1 VAL 5 2HG1 VAL 5 -4.267 0.650 7.761 41 3HG1 VAL 5 3HG1 VAL 5 -3.394 2.117 7.317 42 1HG2 VAL 5 1HG2 VAL 5 -4.130 3.187 5.344 43 2HG2 VAL 5 2HG2 VAL 5 -5.612 2.652 6.133 44 3HG2 VAL 5 3HG2 VAL 5 -5.390 2.390 4.404 45 H VAL 6 H VAL 6 -3.597 -1.438 3.316 46 HA VAL 6 HA VAL 6 -4.812 -0.030 0.969 47 HB VAL 6 HB VAL 6 -4.105 -2.039 -0.358 48 1HG1 VAL 6 1HG1 VAL 6 -2.255 -0.141 0.992 49 2HG1 VAL 6 2HG1 VAL 6 -2.573 -0.372 -0.725 50 3HG1 VAL 6 3HG1 VAL 6 -1.512 -1.489 0.132 51 1HG2 VAL 6 1HG2 VAL 6 -3.965 -3.575 1.643 52 2HG2 VAL 6 2HG2 VAL 6 -2.494 -2.730 2.119 53 3HG2 VAL 6 3HG2 VAL 6 -2.544 -3.625 0.603 54 H ASN 7 H ASN 7 -6.840 -0.677 0.295 55 HA ASN 7 HA ASN 7 -8.218 -2.677 2.018 56 1HB ASN 7 2HB ASN 7 -9.100 -0.307 0.419 57 2HB ASN 7 1HB ASN 7 -10.250 -1.623 0.658 58 1HD2 ASN 7 1HD2 ASN 7 -8.157 0.674 2.459 59 2HD2 ASN 7 2HD2 ASN 7 -9.064 0.612 3.894 60 H ASP 8 H ASP 8 -8.168 -4.691 1.184 61 HA ASP 8 HA ASP 8 -7.749 -5.331 -1.585 62 1HB ASP 8 2HB ASP 8 -8.784 -6.961 0.750 63 2HB ASP 8 1HB ASP 8 -8.515 -7.646 -0.851 64 H ARG 9 H ARG 9 -9.284 -6.339 -3.058 65 HA ARG 9 HA ARG 9 -11.828 -4.979 -3.158 66 1HB ARG 9 2HB ARG 9 -10.276 -6.103 -5.043 67 2HB ARG 9 1HB ARG 9 -11.412 -7.429 -4.796 68 1HG ARG 9 2HG ARG 9 -12.916 -5.003 -4.870 69 2HG ARG 9 1HG ARG 9 -11.822 -5.003 -6.254 70 1HD ARG 9 2HD ARG 9 -12.863 -7.634 -6.041 71 2HD ARG 9 1HD ARG 9 -14.228 -6.529 -5.873 72 HE ARG 9 HE ARG 9 -13.621 -5.566 -8.064 73 1HH1 ARG 9 2HH1 ARG 9 -14.028 -8.577 -8.413 74 2HH1 ARG 9 1HH1 ARG 9 -12.675 -8.979 -9.419 75 1HH2 ARG 9 1HH2 ARG 9 -10.986 -6.009 -8.785 76 2HH2 ARG 9 2HH2 ARG 9 -10.949 -7.520 -9.629 77 H LEU 10 H LEU 10 -10.833 -8.190 -2.039 78 HA LEU 10 HA LEU 10 -13.445 -9.378 -1.938 79 1HB LEU 10 2HB LEU 10 -10.804 -9.921 -0.629 80 2HB LEU 10 1HB LEU 10 -12.239 -10.717 0.017 81 HG LEU 10 HG LEU 10 -12.250 -10.857 -2.871 82 1HD1 LEU 10 1HD1 LEU 10 -9.765 -10.670 -2.520 83 2HD1 LEU 10 2HD1 LEU 10 -10.269 -12.201 -3.236 84 3HD1 LEU 10 3HD1 LEU 10 -9.848 -12.126 -1.525 85 1HD2 LEU 10 1HD2 LEU 10 -13.539 -12.369 -1.503 86 2HD2 LEU 10 2HD2 LEU 10 -12.104 -12.873 -0.610 87 3HD2 LEU 10 3HD2 LEU 10 -12.297 -13.329 -2.303 88 H GLY 11 H GLY 11 -11.548 -7.619 0.527 89 1HA GLY 11 2HA GLY 11 -13.169 -6.004 1.810 90 2HA GLY 11 1HA GLY 11 -13.965 -7.509 2.273 91 H LYS 12 H LYS 12 -10.554 -6.464 2.044 92 HA LYS 12 HA LYS 12 -10.185 -6.924 4.942 93 1HB LYS 12 2HB LYS 12 -9.640 -8.975 3.122 94 2HB LYS 12 1HB LYS 12 -8.064 -8.237 3.415 95 1HG LYS 12 2HG LYS 12 -8.712 -8.335 5.922 96 2HG LYS 12 1HG LYS 12 -9.955 -9.479 5.413 97 1HD LYS 12 2HD LYS 12 -8.420 -11.123 5.347 98 2HD LYS 12 1HD LYS 12 -7.500 -10.219 4.143 99 1HE LYS 12 2HE LYS 12 -7.248 -9.240 6.928 100 2HE LYS 12 1HE LYS 12 -6.536 -10.823 6.618 101 1HZ LYS 12 1HZ LYS 12 -4.863 -9.275 6.137 102 2HZ LYS 12 2HZ LYS 12 -5.921 -8.244 5.300 103 3HZ LYS 12 3HZ LYS 12 -5.462 -9.732 4.618 104 H LYS 13 H LYS 13 -8.187 -5.907 5.715 105 HA LYS 13 HA LYS 13 -6.939 -4.100 3.679 106 1HB LYS 13 2HB LYS 13 -6.743 -2.370 5.358 107 2HB LYS 13 1HB LYS 13 -8.421 -2.905 5.306 108 1HG LYS 13 2HG LYS 13 -7.606 -4.583 7.186 109 2HG LYS 13 1HG LYS 13 -6.346 -3.370 7.415 110 1HD LYS 13 2HD LYS 13 -7.801 -1.821 8.248 111 2HD LYS 13 1HD LYS 13 -9.095 -2.303 7.151 112 1HE LYS 13 2HE LYS 13 -9.730 -4.133 8.520 113 2HE LYS 13 1HE LYS 13 -8.226 -4.072 9.439 114 1HZ LYS 13 1HZ LYS 13 -10.347 -1.994 9.443 115 2HZ LYS 13 2HZ LYS 13 -8.891 -1.920 10.315 116 3HZ LYS 13 3HZ LYS 13 -10.049 -3.105 10.689 117 H VAL 14 H VAL 14 -4.707 -3.765 3.813 118 HA VAL 14 HA VAL 14 -3.233 -5.529 5.733 119 HB VAL 14 HB VAL 14 -2.355 -4.870 2.904 120 1HG1 VAL 14 1HG1 VAL 14 -1.386 -6.740 5.072 121 2HG1 VAL 14 2HG1 VAL 14 -0.471 -5.510 4.201 122 3HG1 VAL 14 3HG1 VAL 14 -0.964 -6.988 3.378 123 1HG2 VAL 14 1HG2 VAL 14 -3.115 -7.110 2.285 124 2HG2 VAL 14 2HG2 VAL 14 -4.474 -6.198 2.940 125 3HG2 VAL 14 3HG2 VAL 14 -3.664 -7.407 3.934 126 H ARG 15 H ARG 15 -1.359 -4.658 6.639 127 HA ARG 15 HA ARG 15 -0.972 -1.727 6.215 128 1HB ARG 15 2HB ARG 15 -0.649 -3.549 8.582 129 2HB ARG 15 1HB ARG 15 0.337 -2.091 8.486 130 1HG ARG 15 2HG ARG 15 -1.601 -1.396 9.654 131 2HG ARG 15 1HG ARG 15 -1.875 -0.847 8.001 132 1HD ARG 15 2HD ARG 15 -3.774 -2.053 7.928 133 2HD ARG 15 1HD ARG 15 -2.835 -3.526 8.172 134 HE ARG 15 HE ARG 15 -3.137 -3.174 10.633 135 1HH1 ARG 15 2HH1 ARG 15 -4.031 -0.343 10.640 136 2HH1 ARG 15 1HH1 ARG 15 -5.751 -0.484 10.803 137 1HH2 ARG 15 1HH2 ARG 15 -5.829 -3.835 9.874 138 2HH2 ARG 15 2HH2 ARG 15 -6.771 -2.468 10.367 139 H VAL 16 H VAL 16 0.827 -1.179 5.107 140 HA VAL 16 HA VAL 16 3.206 -2.980 5.249 141 HB VAL 16 HB VAL 16 1.980 -3.305 3.114 142 1HG1 VAL 16 1HG1 VAL 16 0.997 -1.032 2.979 143 2HG1 VAL 16 2HG1 VAL 16 1.838 -1.472 1.494 144 3HG1 VAL 16 3HG1 VAL 16 2.597 -0.372 2.644 145 1HG2 VAL 16 1HG2 VAL 16 3.889 -3.114 1.678 146 2HG2 VAL 16 2HG2 VAL 16 4.523 -3.398 3.297 147 3HG2 VAL 16 3HG2 VAL 16 4.547 -1.772 2.615 148 H LYS 17 H LYS 17 5.179 -1.917 5.414 149 HA LYS 17 HA LYS 17 5.032 1.057 5.659 150 1HB LYS 17 2HB LYS 17 5.711 -0.373 7.667 151 2HB LYS 17 1HB LYS 17 7.193 -0.734 6.785 152 1HG LYS 17 2HG LYS 17 8.005 1.415 6.987 153 2HG LYS 17 1HG LYS 17 6.394 2.130 6.996 154 1HD LYS 17 2HD LYS 17 6.066 1.097 9.292 155 2HD LYS 17 1HD LYS 17 7.783 0.701 9.273 156 1HE LYS 17 2HE LYS 17 8.345 2.819 9.811 157 2HE LYS 17 1HE LYS 17 7.369 3.461 8.493 158 1HZ LYS 17 1HZ LYS 17 5.395 3.045 9.994 159 2HZ LYS 17 2HZ LYS 17 6.437 4.311 10.452 160 3HZ LYS 17 3HZ LYS 17 6.511 2.814 11.250 161 H CYS 18 H CYS 18 6.081 2.227 4.127 162 HA CYS 18 HA CYS 18 8.543 1.187 2.868 163 1HB CYS 18 2HB CYS 18 5.954 1.097 1.552 164 2HB CYS 18 1HB CYS 18 7.070 2.139 0.671 165 HG CYS 18 HG CYS 18 7.188 -0.693 0.323 166 H LEU 19 H LEU 19 9.731 2.872 1.755 167 HA LEU 19 HA LEU 19 9.279 5.531 2.891 168 1HB LEU 19 2HB LEU 19 11.473 4.100 1.683 169 2HB LEU 19 1HB LEU 19 11.268 5.648 0.865 170 HG LEU 19 HG LEU 19 11.123 5.654 3.845 171 1HD1 LEU 19 1HD1 LEU 19 13.055 4.316 3.721 172 2HD1 LEU 19 2HD1 LEU 19 13.709 5.952 3.751 173 3HD1 LEU 19 3HD1 LEU 19 13.598 5.074 2.226 174 1HD2 LEU 19 1HD2 LEU 19 11.487 7.505 1.651 175 2HD2 LEU 19 2HD2 LEU 19 12.835 7.640 2.780 176 3HD2 LEU 19 3HD2 LEU 19 11.181 7.856 3.352 177 H ALA 20 H ALA 20 8.831 7.438 1.667 178 HA ALA 20 HA ALA 20 6.957 7.104 -0.495 179 1HB ALA 20 1HB ALA 20 7.657 9.735 -0.659 180 2HB ALA 20 2HB ALA 20 8.159 9.364 0.989 181 3HB ALA 20 3HB ALA 20 6.487 9.101 0.499 182 H GLU 21 H GLU 21 10.415 7.346 -0.417 183 HA GLU 21 HA GLU 21 10.721 8.316 -3.154 184 1HB GLU 21 2HB GLU 21 13.113 7.785 -2.820 185 2HB GLU 21 1HB GLU 21 12.476 8.730 -1.474 186 1HG GLU 21 2HG GLU 21 13.343 7.112 -0.143 187 2HG GLU 21 1HG GLU 21 11.980 6.128 -0.669 188 H ASP 22 H ASP 22 10.051 5.259 -1.702 189 HA ASP 22 HA ASP 22 11.316 3.557 -3.644 190 1HB ASP 22 2HB ASP 22 9.122 3.187 -1.620 191 2HB ASP 22 1HB ASP 22 9.450 1.920 -2.801 192 H SER 23 H SER 23 10.419 2.553 -5.484 193 HA SER 23 HA SER 23 8.400 4.119 -6.894 194 1HB SER 23 2HB SER 23 8.814 2.549 -8.750 195 2HB SER 23 1HB SER 23 10.331 3.151 -8.089 196 HG SER 23 HG SER 23 10.300 0.858 -8.397 197 H VAL 24 H VAL 24 6.496 3.013 -7.946 198 HA VAL 24 HA VAL 24 4.811 1.763 -6.002 199 HB VAL 24 HB VAL 24 4.590 1.871 -9.025 200 1HG1 VAL 24 1HG1 VAL 24 3.035 0.410 -7.054 201 2HG1 VAL 24 2HG1 VAL 24 2.898 0.395 -8.813 202 3HG1 VAL 24 3HG1 VAL 24 2.041 1.614 -7.872 203 1HG2 VAL 24 1HG2 VAL 24 2.746 3.407 -7.313 204 2HG2 VAL 24 2HG2 VAL 24 3.630 3.914 -8.752 205 3HG2 VAL 24 3HG2 VAL 24 4.431 3.908 -7.182 206 H GLY 25 H GLY 25 6.874 0.430 -8.571 207 1HA GLY 25 2HA GLY 25 5.984 -2.274 -8.484 208 2HA GLY 25 1HA GLY 25 7.612 -1.772 -8.942 209 H ASP 26 H ASP 26 8.526 -0.606 -6.601 210 HA ASP 26 HA ASP 26 9.264 -2.876 -4.997 211 1HB ASP 26 2HB ASP 26 10.593 -0.732 -5.242 212 2HB ASP 26 1HB ASP 26 9.408 0.047 -4.196 213 H PHE 27 H PHE 27 6.888 -0.267 -4.573 214 HA PHE 27 HA PHE 27 6.023 -0.891 -1.935 215 1HB PHE 27 2HB PHE 27 5.417 1.174 -3.220 216 2HB PHE 27 1HB PHE 27 4.351 0.195 -4.225 217 HD1 PHE 27 HD1 PHE 27 2.110 0.123 -3.635 218 HD2 PHE 27 HD2 PHE 27 5.056 0.757 -0.574 219 HE1 PHE 27 HE1 PHE 27 0.308 0.342 -1.947 220 HE2 PHE 27 HE2 PHE 27 3.254 0.974 1.113 221 HZ PHE 27 HZ PHE 27 0.880 0.767 0.424 222 H LYS 28 H LYS 28 4.954 -2.136 -5.101 223 HA LYS 28 HA LYS 28 2.859 -3.822 -4.027 224 1HB LYS 28 2HB LYS 28 4.239 -3.518 -6.665 225 2HB LYS 28 1HB LYS 28 3.341 -5.006 -6.367 226 1HG LYS 28 2HG LYS 28 1.529 -3.223 -5.471 227 2HG LYS 28 1HG LYS 28 2.342 -2.219 -6.671 228 1HD LYS 28 2HD LYS 28 1.841 -4.895 -7.699 229 2HD LYS 28 1HD LYS 28 0.348 -4.123 -7.168 230 1HE LYS 28 2HE LYS 28 2.286 -2.524 -8.804 231 2HE LYS 28 1HE LYS 28 1.273 -3.714 -9.618 232 1HZ LYS 28 1HZ LYS 28 -0.674 -2.667 -8.590 233 2HZ LYS 28 2HZ LYS 28 0.178 -1.589 -9.589 234 3HZ LYS 28 3HZ LYS 28 0.327 -1.484 -7.901 235 H LYS 29 H LYS 29 6.307 -4.279 -4.707 236 HA LYS 29 HA LYS 29 6.374 -7.131 -4.443 237 1HB LYS 29 2HB LYS 29 8.440 -4.960 -4.096 238 2HB LYS 29 1HB LYS 29 8.833 -6.649 -3.776 239 1HG LYS 29 2HG LYS 29 8.244 -7.282 -6.034 240 2HG LYS 29 1HG LYS 29 7.620 -5.667 -6.370 241 1HD LYS 29 2HD LYS 29 10.105 -4.997 -5.589 242 2HD LYS 29 1HD LYS 29 10.438 -6.612 -6.215 243 1HE LYS 29 2HE LYS 29 9.762 -6.058 -8.383 244 2HE LYS 29 1HE LYS 29 8.769 -4.709 -7.834 245 1HZ LYS 29 1HZ LYS 29 11.161 -3.907 -7.013 246 2HZ LYS 29 2HZ LYS 29 10.532 -3.530 -8.545 247 3HZ LYS 29 3HZ LYS 29 11.625 -4.817 -8.366 248 H VAL 30 H VAL 30 6.819 -4.518 -2.042 249 HA VAL 30 HA VAL 30 7.381 -6.250 0.181 250 HB VAL 30 HB VAL 30 6.107 -3.490 0.200 251 1HG1 VAL 30 1HG1 VAL 30 5.840 -4.684 2.332 252 2HG1 VAL 30 2HG1 VAL 30 7.029 -3.394 2.504 253 3HG1 VAL 30 3HG1 VAL 30 7.560 -5.068 2.348 254 1HG2 VAL 30 1HG2 VAL 30 8.252 -3.410 -0.937 255 2HG2 VAL 30 2HG2 VAL 30 8.999 -4.405 0.309 256 3HG2 VAL 30 3HG2 VAL 30 8.474 -2.766 0.688 257 H LEU 31 H LEU 31 4.343 -4.884 -1.100 258 HA LEU 31 HA LEU 31 2.634 -5.969 0.955 259 1HB LEU 31 2HB LEU 31 2.259 -4.801 -1.769 260 2HB LEU 31 1HB LEU 31 0.939 -5.774 -1.119 261 HG LEU 31 HG LEU 31 2.174 -3.741 0.686 262 1HD1 LEU 31 1HD1 LEU 31 0.580 -2.029 -0.264 263 2HD1 LEU 31 2HD1 LEU 31 0.327 -3.110 -1.633 264 3HD1 LEU 31 3HD1 LEU 31 1.926 -2.430 -1.330 265 1HD2 LEU 31 1HD2 LEU 31 -0.751 -4.008 0.365 266 2HD2 LEU 31 2HD2 LEU 31 0.223 -4.020 1.834 267 3HD2 LEU 31 3HD2 LEU 31 0.066 -5.487 0.869 268 H SER 32 H SER 32 3.719 -7.178 -2.205 269 HA SER 32 HA SER 32 2.097 -9.528 -2.304 270 1HB SER 32 2HB SER 32 4.787 -8.865 -3.522 271 2HB SER 32 1HB SER 32 3.934 -10.368 -3.856 272 HG SER 32 HG SER 32 3.570 -7.985 -4.957 273 H LEU 33 H LEU 33 5.173 -8.855 -0.690 274 HA LEU 33 HA LEU 33 5.742 -11.637 -0.058 275 1HB LEU 33 2HB LEU 33 6.826 -8.981 0.867 276 2HB LEU 33 1HB LEU 33 7.292 -10.470 1.688 277 HG LEU 33 HG LEU 33 7.447 -10.344 -1.308 278 1HD1 LEU 33 1HD1 LEU 33 9.493 -9.225 0.632 279 2HD1 LEU 33 2HD1 LEU 33 8.611 -8.320 -0.597 280 3HD1 LEU 33 3HD1 LEU 33 9.798 -9.531 -1.077 281 1HD2 LEU 33 1HD2 LEU 33 9.358 -11.637 0.637 282 2HD2 LEU 33 2HD2 LEU 33 9.010 -12.090 -1.031 283 3HD2 LEU 33 3HD2 LEU 33 7.826 -12.412 0.235 284 H GLN 34 H GLN 34 3.781 -9.125 1.384 285 HA GLN 34 HA GLN 34 3.626 -10.419 4.007 286 1HB GLN 34 2HB GLN 34 2.224 -8.067 2.735 287 2HB GLN 34 1HB GLN 34 1.757 -8.681 4.322 288 1HG GLN 34 2HG GLN 34 4.203 -8.460 4.994 289 2HG GLN 34 1HG GLN 34 4.446 -7.566 3.491 290 1HE2 GLN 34 1HE2 GLN 34 2.650 -5.717 3.205 291 2HE2 GLN 34 2HE2 GLN 34 2.345 -4.799 4.600 292 H ILE 35 H ILE 35 1.373 -9.998 1.235 293 HA ILE 35 HA ILE 35 -0.445 -11.967 2.532 294 HB ILE 35 HB ILE 35 -2.108 -11.251 0.833 295 1HG1 ILE 35 2HG1 ILE 35 0.061 -9.290 -0.002 296 2HG1 ILE 35 1HG1 ILE 35 -0.515 -10.645 -0.971 297 1HG2 ILE 35 1HG2 ILE 35 -2.660 -9.313 1.980 298 2HG2 ILE 35 2HG2 ILE 35 -0.997 -8.725 2.003 299 3HG2 ILE 35 3HG2 ILE 35 -1.491 -10.018 3.096 300 1HD1 ILE 35 1HD1 ILE 35 -2.132 -8.245 -0.068 301 2HD1 ILE 35 2HD1 ILE 35 -2.820 -9.652 -0.878 302 3HD1 ILE 35 3HD1 ILE 35 -1.651 -8.634 -1.718 303 H GLY 36 H GLY 36 1.397 -11.504 -0.483 304 1HA GLY 36 2HA GLY 36 2.389 -13.385 -1.657 305 2HA GLY 36 1HA GLY 36 1.151 -14.433 -0.963 306 H THR 37 H THR 37 1.081 -11.395 -2.857 307 HA THR 37 HA THR 37 -0.953 -12.671 -4.649 308 HB THR 37 HB THR 37 -1.275 -10.078 -5.221 309 HG1 THR 37 HG1 THR 37 0.224 -9.225 -3.876 310 1HG2 THR 37 1HG2 THR 37 -3.139 -11.302 -4.480 311 2HG2 THR 37 2HG2 THR 37 -2.960 -10.044 -3.258 312 3HG2 THR 37 3HG2 THR 37 -2.390 -11.681 -2.929 313 H GLN 38 H GLN 38 2.163 -11.093 -4.524 314 HA GLN 38 HA GLN 38 3.824 -10.871 -6.163 315 1HB GLN 38 2HB GLN 38 1.891 -12.200 -8.088 316 2HB GLN 38 1HB GLN 38 3.638 -12.053 -8.261 317 1HG GLN 38 2HG GLN 38 2.586 -13.407 -5.809 318 2HG GLN 38 1HG GLN 38 2.528 -14.292 -7.332 319 1HE2 GLN 38 1HE2 GLN 38 4.679 -12.969 -4.876 320 2HE2 GLN 38 2HE2 GLN 38 6.107 -13.644 -5.498 321 HA PRO 39 HA PRO 39 2.558 -7.143 -8.107 322 1HB PRO 39 2HB PRO 39 4.641 -6.824 -9.890 323 2HB PRO 39 1HB PRO 39 4.777 -6.513 -8.151 324 1HG PRO 39 2HG PRO 39 5.806 -8.828 -9.730 325 2HG PRO 39 1HG PRO 39 6.428 -8.130 -8.225 326 1HD PRO 39 2HD PRO 39 4.895 -10.486 -8.418 327 2HD PRO 39 1HD PRO 39 5.186 -9.561 -6.930 328 H ASN 40 H ASN 40 0.720 -8.418 -9.061 329 HA ASN 40 HA ASN 40 0.487 -8.008 -11.894 330 1HB ASN 40 2HB ASN 40 1.871 -10.305 -11.403 331 2HB ASN 40 1HB ASN 40 0.218 -10.920 -11.392 332 1HD2 ASN 40 1HD2 ASN 40 -1.014 -10.806 -13.398 333 2HD2 ASN 40 2HD2 ASN 40 -0.274 -10.429 -14.878 334 H LYS 41 H LYS 41 -0.708 -9.877 -9.082 335 HA LYS 41 HA LYS 41 -3.483 -9.629 -10.096 336 1HB LYS 41 2HB LYS 41 -2.074 -11.410 -8.245 337 2HB LYS 41 1HB LYS 41 -3.625 -10.854 -7.612 338 1HG LYS 41 2HG LYS 41 -3.818 -11.558 -10.432 339 2HG LYS 41 1HG LYS 41 -3.241 -12.913 -9.462 340 1HD LYS 41 2HD LYS 41 -5.157 -12.381 -7.845 341 2HD LYS 41 1HD LYS 41 -5.801 -11.342 -9.118 342 1HE LYS 41 2HE LYS 41 -6.580 -13.113 -10.278 343 2HE LYS 41 1HE LYS 41 -5.036 -13.953 -10.160 344 1HZ LYS 41 1HZ LYS 41 -6.978 -13.809 -7.923 345 2HZ LYS 41 2HZ LYS 41 -5.607 -14.807 -8.049 346 3HZ LYS 41 3HZ LYS 41 -6.951 -15.080 -9.047 347 H ILE 42 H ILE 42 -1.383 -7.785 -8.193 348 HA ILE 42 HA ILE 42 -3.632 -6.708 -6.553 349 HB ILE 42 HB ILE 42 -1.617 -5.420 -5.440 350 1HG1 ILE 42 2HG1 ILE 42 -0.182 -7.906 -6.412 351 2HG1 ILE 42 1HG1 ILE 42 -0.011 -6.347 -7.216 352 1HG2 ILE 42 1HG2 ILE 42 -1.795 -6.933 -3.724 353 2HG2 ILE 42 2HG2 ILE 42 -1.601 -8.324 -4.788 354 3HG2 ILE 42 3HG2 ILE 42 -3.150 -7.489 -4.707 355 1HD1 ILE 42 1HD1 ILE 42 0.689 -5.360 -5.011 356 2HD1 ILE 42 2HD1 ILE 42 1.805 -6.579 -5.627 357 3HD1 ILE 42 3HD1 ILE 42 0.678 -6.989 -4.334 358 H VAL 43 H VAL 43 -4.573 -4.913 -7.287 359 HA VAL 43 HA VAL 43 -3.013 -3.070 -9.057 360 HB VAL 43 HB VAL 43 -6.027 -3.352 -8.765 361 1HG1 VAL 43 1HG1 VAL 43 -5.263 -1.076 -9.378 362 2HG1 VAL 43 2HG1 VAL 43 -6.105 -1.853 -10.717 363 3HG1 VAL 43 3HG1 VAL 43 -4.345 -1.754 -10.723 364 1HG2 VAL 43 1HG2 VAL 43 -4.019 -4.611 -10.566 365 2HG2 VAL 43 2HG2 VAL 43 -5.498 -4.029 -11.329 366 3HG2 VAL 43 3HG2 VAL 43 -5.586 -5.216 -10.029 367 H LEU 44 H LEU 44 -2.301 -1.309 -7.919 368 HA LEU 44 HA LEU 44 -3.808 -0.480 -5.495 369 1HB LEU 44 2HB LEU 44 -1.019 0.010 -6.510 370 2HB LEU 44 1HB LEU 44 -1.715 1.079 -5.293 371 HG LEU 44 HG LEU 44 -1.942 -1.874 -4.866 372 1HD1 LEU 44 1HD1 LEU 44 0.345 -1.906 -5.321 373 2HD1 LEU 44 2HD1 LEU 44 0.334 -1.559 -3.593 374 3HD1 LEU 44 3HD1 LEU 44 0.587 -0.256 -4.752 375 1HD2 LEU 44 1HD2 LEU 44 -3.005 -0.540 -3.213 376 2HD2 LEU 44 2HD2 LEU 44 -1.672 0.615 -3.170 377 3HD2 LEU 44 3HD2 LEU 44 -1.466 -0.996 -2.483 378 H GLN 45 H GLN 45 -4.946 1.419 -5.422 379 HA GLN 45 HA GLN 45 -4.608 3.352 -7.675 380 1HB GLN 45 2HB GLN 45 -7.274 2.492 -6.504 381 2HB GLN 45 1HB GLN 45 -7.027 3.627 -7.830 382 1HG GLN 45 2HG GLN 45 -5.688 1.565 -8.868 383 2HG GLN 45 1HG GLN 45 -6.765 0.649 -7.812 384 1HE2 GLN 45 1HE2 GLN 45 -8.679 0.062 -8.839 385 2HE2 GLN 45 2HE2 GLN 45 -9.445 0.953 -10.063 386 H LYS 46 H LYS 46 -4.415 5.435 -6.987 387 HA LYS 46 HA LYS 46 -4.533 5.999 -4.106 388 1HB LYS 46 2HB LYS 46 -3.391 7.261 -6.503 389 2HB LYS 46 1HB LYS 46 -4.089 8.422 -5.374 390 1HG LYS 46 2HG LYS 46 -2.624 6.459 -3.875 391 2HG LYS 46 1HG LYS 46 -1.589 7.068 -5.167 392 1HD LYS 46 2HD LYS 46 -1.506 9.180 -4.294 393 2HD LYS 46 1HD LYS 46 -3.175 9.116 -3.720 394 1HE LYS 46 2HE LYS 46 -1.477 7.201 -2.320 395 2HE LYS 46 1HE LYS 46 -0.878 8.849 -2.150 396 1HZ LYS 46 1HZ LYS 46 -2.385 8.814 -0.471 397 2HZ LYS 46 2HZ LYS 46 -3.396 7.679 -1.231 398 3HZ LYS 46 3HZ LYS 46 -3.420 9.306 -1.718 399 H GLY 47 H GLY 47 -5.924 7.786 -6.902 400 1HA GLY 47 2HA GLY 47 -8.518 7.951 -5.459 401 2HA GLY 47 1HA GLY 47 -7.727 9.465 -5.903 402 H GLY 48 H GLY 48 -8.797 6.375 -7.353 403 1HA GLY 48 2HA GLY 48 -10.039 6.052 -9.342 404 2HA GLY 48 1HA GLY 48 -10.055 7.799 -9.580 405 H SER 49 H SER 49 -7.052 6.077 -8.999 406 HA SER 49 HA SER 49 -6.377 5.958 -11.867 407 1HB SER 49 2HB SER 49 -5.591 8.185 -10.199 408 2HB SER 49 1HB SER 49 -4.164 7.281 -10.691 409 HG SER 49 HG SER 49 -4.771 8.865 -12.234 410 H VAL 50 H VAL 50 -4.983 4.272 -12.221 411 HA VAL 50 HA VAL 50 -4.167 2.645 -9.932 412 HB VAL 50 HB VAL 50 -3.219 1.122 -11.667 413 1HG1 VAL 50 1HG1 VAL 50 -6.018 2.118 -12.272 414 2HG1 VAL 50 2HG1 VAL 50 -5.599 0.977 -10.995 415 3HG1 VAL 50 3HG1 VAL 50 -5.372 0.530 -12.685 416 1HG2 VAL 50 1HG2 VAL 50 -3.257 1.648 -13.965 417 2HG2 VAL 50 2HG2 VAL 50 -2.719 3.153 -13.223 418 3HG2 VAL 50 3HG2 VAL 50 -4.395 2.975 -13.738 419 H LEU 51 H LEU 51 -1.979 2.093 -9.403 420 HA LEU 51 HA LEU 51 -0.041 4.256 -10.067 421 1HB LEU 51 2HB LEU 51 0.351 2.146 -7.943 422 2HB LEU 51 1HB LEU 51 1.078 3.747 -8.044 423 HG LEU 51 HG LEU 51 -1.858 3.173 -7.533 424 1HD1 LEU 51 1HD1 LEU 51 0.273 4.291 -5.690 425 2HD1 LEU 51 2HD1 LEU 51 -0.323 2.633 -5.639 426 3HD1 LEU 51 3HD1 LEU 51 -1.411 3.971 -5.274 427 1HD2 LEU 51 1HD2 LEU 51 -0.811 5.410 -8.715 428 2HD2 LEU 51 2HD2 LEU 51 -0.718 5.854 -7.012 429 3HD2 LEU 51 3HD2 LEU 51 -2.269 5.411 -7.724 430 H LYS 52 H LYS 52 1.776 3.811 -11.252 431 HA LYS 52 HA LYS 52 2.250 0.953 -12.013 432 1HB LYS 52 2HB LYS 52 2.487 3.539 -13.518 433 2HB LYS 52 1HB LYS 52 3.528 2.190 -13.967 434 1HG LYS 52 2HG LYS 52 1.818 1.042 -14.908 435 2HG LYS 52 1HG LYS 52 0.734 1.396 -13.562 436 1HD LYS 52 2HD LYS 52 1.436 3.647 -15.397 437 2HD LYS 52 1HD LYS 52 0.313 2.425 -15.993 438 1HE LYS 52 2HE LYS 52 -1.331 3.016 -14.516 439 2HE LYS 52 1HE LYS 52 -0.184 3.406 -13.236 440 1HZ LYS 52 1HZ LYS 52 0.419 5.356 -14.823 441 2HZ LYS 52 2HZ LYS 52 -0.945 5.469 -13.817 442 3HZ LYS 52 3HZ LYS 52 -1.128 5.078 -15.460 443 H ASP 53 H ASP 53 4.456 0.243 -12.182 444 HA ASP 53 HA ASP 53 6.210 1.134 -10.120 445 1HB ASP 53 2HB ASP 53 6.461 -1.109 -10.921 446 2HB ASP 53 1HB ASP 53 6.670 -0.564 -12.583 447 H HIS 54 H HIS 54 5.866 2.142 -13.470 448 HA HIS 54 HA HIS 54 8.383 3.448 -13.811 449 1HB HIS 54 2HB HIS 54 5.704 3.574 -15.099 450 2HB HIS 54 1HB HIS 54 6.764 4.961 -15.349 451 HD1 HIS 54 HD1 HIS 54 6.496 1.272 -16.043 452 HD2 HIS 54 HD2 HIS 54 9.079 4.427 -16.908 453 HE1 HIS 54 HE1 HIS 54 8.094 0.423 -17.813 454 H ILE 55 H ILE 55 5.757 4.253 -11.734 455 HA ILE 55 HA ILE 55 6.806 7.047 -11.466 456 HB ILE 55 HB ILE 55 4.023 5.993 -10.853 457 1HG1 ILE 55 2HG1 ILE 55 3.721 7.954 -12.718 458 2HG1 ILE 55 1HG1 ILE 55 5.280 7.293 -13.210 459 1HG2 ILE 55 1HG2 ILE 55 5.307 8.720 -10.571 460 2HG2 ILE 55 2HG2 ILE 55 4.513 7.766 -9.318 461 3HG2 ILE 55 3HG2 ILE 55 3.559 8.491 -10.612 462 1HD1 ILE 55 1HD1 ILE 55 2.665 6.189 -13.629 463 2HD1 ILE 55 2HD1 ILE 55 3.587 5.086 -12.608 464 3HD1 ILE 55 3HD1 ILE 55 4.219 5.567 -14.182 465 H SER 56 H SER 56 7.287 7.773 -9.379 466 HA SER 56 HA SER 56 7.666 5.658 -7.357 467 1HB SER 56 2HB SER 56 9.205 7.794 -8.066 468 2HB SER 56 1HB SER 56 8.358 8.452 -6.670 469 HG SER 56 HG SER 56 9.835 7.378 -5.614 470 H LEU 57 H LEU 57 6.985 6.005 -5.104 471 HA LEU 57 HA LEU 57 4.216 6.653 -4.844 472 1HB LEU 57 2HB LEU 57 6.384 6.425 -2.733 473 2HB LEU 57 1HB LEU 57 4.661 6.535 -2.377 474 HG LEU 57 HG LEU 57 5.718 4.423 -4.256 475 1HD1 LEU 57 1HD1 LEU 57 5.554 4.321 -1.231 476 2HD1 LEU 57 2HD1 LEU 57 6.994 4.103 -2.223 477 3HD1 LEU 57 3HD1 LEU 57 5.711 2.893 -2.254 478 1HD2 LEU 57 1HD2 LEU 57 3.292 4.816 -4.202 479 2HD2 LEU 57 2HD2 LEU 57 3.287 4.634 -2.447 480 3HD2 LEU 57 3HD2 LEU 57 3.666 3.253 -3.476 481 H GLU 58 H GLU 58 7.132 8.599 -4.399 482 HA GLU 58 HA GLU 58 5.944 10.812 -3.019 483 1HB GLU 58 2HB GLU 58 8.485 10.172 -4.161 484 2HB GLU 58 1HB GLU 58 7.992 11.742 -4.796 485 1HG GLU 58 2HG GLU 58 7.910 12.725 -2.681 486 2HG GLU 58 1HG GLU 58 7.680 11.181 -1.860 487 H ASP 59 H ASP 59 6.180 9.985 -6.463 488 HA ASP 59 HA ASP 59 5.198 12.495 -7.478 489 1HB ASP 59 2HB ASP 59 5.103 9.702 -8.661 490 2HB ASP 59 1HB ASP 59 4.699 11.173 -9.546 491 H TYR 60 H TYR 60 3.593 9.430 -6.609 492 HA TYR 60 HA TYR 60 0.939 10.336 -7.333 493 1HB TYR 60 2HB TYR 60 2.006 8.033 -5.703 494 2HB TYR 60 1HB TYR 60 0.274 8.351 -5.801 495 HD1 TYR 60 HD1 TYR 60 -0.518 8.939 -8.344 496 HD2 TYR 60 HD2 TYR 60 2.848 6.504 -7.247 497 HE1 TYR 60 HE1 TYR 60 -0.601 7.827 -10.559 498 HE2 TYR 60 HE2 TYR 60 2.764 5.393 -9.462 499 HH TYR 60 HH TYR 60 1.065 6.600 -12.064 500 H GLU 61 H GLU 61 2.984 10.949 -4.627 501 HA GLU 61 HA GLU 61 2.656 12.377 -2.805 502 1HB GLU 61 2HB GLU 61 0.726 13.263 -4.486 503 2HB GLU 61 1HB GLU 61 -0.283 12.638 -3.181 504 1HG GLU 61 2HG GLU 61 0.092 14.709 -2.280 505 2HG GLU 61 1HG GLU 61 1.588 13.956 -1.726 506 H VAL 62 H VAL 62 2.969 9.965 -2.055 507 HA VAL 62 HA VAL 62 0.590 8.949 -0.593 508 HB VAL 62 HB VAL 62 3.376 7.773 -0.910 509 1HG1 VAL 62 1HG1 VAL 62 2.185 5.677 -0.123 510 2HG1 VAL 62 2HG1 VAL 62 0.820 6.703 0.316 511 3HG1 VAL 62 3HG1 VAL 62 2.379 6.923 1.110 512 1HG2 VAL 62 1HG2 VAL 62 0.879 6.653 -2.146 513 2HG2 VAL 62 2HG2 VAL 62 2.551 6.501 -2.681 514 3HG2 VAL 62 3HG2 VAL 62 1.682 8.012 -2.931 515 H HIS 63 H HIS 63 0.283 9.798 1.410 516 HA HIS 63 HA HIS 63 2.634 10.812 2.930 517 1HB HIS 63 2HB HIS 63 -0.345 11.210 3.340 518 2HB HIS 63 1HB HIS 63 0.907 11.898 4.374 519 HD1 HIS 63 HD1 HIS 63 2.682 13.513 3.085 520 HD2 HIS 63 HD2 HIS 63 -0.882 12.724 1.073 521 HE1 HIS 63 HE1 HIS 63 2.481 15.267 1.270 522 H ASP 64 H ASP 64 2.417 10.489 5.397 523 HA ASP 64 HA ASP 64 2.434 7.653 5.953 524 1HB ASP 64 2HB ASP 64 3.832 9.404 7.133 525 2HB ASP 64 1HB ASP 64 2.367 9.919 7.967 526 H GLN 65 H GLN 65 0.882 6.384 6.908 527 HA GLN 65 HA GLN 65 -1.212 5.700 7.680 528 1HB GLN 65 2HB GLN 65 -0.640 8.171 9.035 529 2HB GLN 65 1HB GLN 65 -2.361 8.115 8.658 530 1HG GLN 65 2HG GLN 65 -2.364 6.951 10.656 531 2HG GLN 65 1HG GLN 65 -2.115 5.614 9.534 532 1HE2 GLN 65 1HE2 GLN 65 0.094 4.738 9.338 533 2HE2 GLN 65 2HE2 GLN 65 1.254 5.036 10.542 534 H THR 66 H THR 66 -0.910 6.700 4.931 535 HA THR 66 HA THR 66 -3.463 8.092 4.388 536 HB THR 66 HB THR 66 -1.288 8.636 3.166 537 HG1 THR 66 HG1 THR 66 -2.712 9.432 1.878 538 1HG2 THR 66 1HG2 THR 66 -1.586 6.672 1.108 539 2HG2 THR 66 2HG2 THR 66 -1.393 5.835 2.647 540 3HG2 THR 66 3HG2 THR 66 -0.177 6.994 2.116 541 H ASN 67 H ASN 67 -4.964 7.156 2.745 542 HA ASN 67 HA ASN 67 -5.215 4.219 3.163 543 1HB ASN 67 2HB ASN 67 -7.083 6.428 3.061 544 2HB ASN 67 1HB ASN 67 -7.525 5.195 1.879 545 1HD2 ASN 67 1HD2 ASN 67 -8.028 3.021 2.685 546 2HD2 ASN 67 2HD2 ASN 67 -8.364 2.755 4.328 547 H LEU 68 H LEU 68 -4.852 2.846 1.515 548 HA LEU 68 HA LEU 68 -4.751 3.939 -1.273 549 1HB LEU 68 2HB LEU 68 -2.894 2.268 0.258 550 2HB LEU 68 1HB LEU 68 -3.345 1.528 -1.276 551 HG LEU 68 HG LEU 68 -1.347 2.958 -1.528 552 1HD1 LEU 68 1HD1 LEU 68 -2.365 4.548 -3.296 553 2HD1 LEU 68 2HD1 LEU 68 -3.909 3.814 -2.872 554 3HD1 LEU 68 3HD1 LEU 68 -2.609 2.816 -3.519 555 1HD2 LEU 68 1HD2 LEU 68 -2.002 4.549 0.321 556 2HD2 LEU 68 2HD2 LEU 68 -3.170 5.265 -0.787 557 3HD2 LEU 68 3HD2 LEU 68 -1.447 5.345 -1.151 558 H GLU 69 H GLU 69 -5.666 2.612 -2.934 559 HA GLU 69 HA GLU 69 -7.691 0.673 -1.929 560 1HB GLU 69 2HB GLU 69 -8.458 2.548 -3.380 561 2HB GLU 69 1HB GLU 69 -7.419 1.947 -4.671 562 1HG GLU 69 2HG GLU 69 -9.056 -0.200 -3.617 563 2HG GLU 69 1HG GLU 69 -10.068 1.154 -4.117 564 H LEU 70 H LEU 70 -7.600 -1.485 -2.487 565 HA LEU 70 HA LEU 70 -5.453 -2.316 -4.394 566 1HB LEU 70 2HB LEU 70 -4.825 -2.804 -2.029 567 2HB LEU 70 1HB LEU 70 -6.284 -3.778 -1.868 568 HG LEU 70 HG LEU 70 -5.507 -5.283 -3.646 569 1HD1 LEU 70 1HD1 LEU 70 -3.435 -5.004 -4.778 570 2HD1 LEU 70 2HD1 LEU 70 -2.899 -3.751 -3.659 571 3HD1 LEU 70 3HD1 LEU 70 -4.185 -3.411 -4.815 572 1HD2 LEU 70 1HD2 LEU 70 -4.286 -4.932 -1.088 573 2HD2 LEU 70 2HD2 LEU 70 -3.025 -5.419 -2.219 574 3HD2 LEU 70 3HD2 LEU 70 -4.459 -6.424 -2.013 575 H TYR 71 H TYR 71 -6.388 -3.217 -6.135 576 HA TYR 71 HA TYR 71 -8.980 -4.674 -5.801 577 1HB TYR 71 2HB TYR 71 -7.997 -2.733 -7.744 578 2HB TYR 71 1HB TYR 71 -8.577 -4.202 -8.528 579 HD1 TYR 71 HD1 TYR 71 -10.703 -3.692 -9.389 580 HD2 TYR 71 HD2 TYR 71 -9.719 -2.529 -5.371 581 HE1 TYR 71 HE1 TYR 71 -13.045 -2.969 -9.023 582 HE2 TYR 71 HE2 TYR 71 -12.062 -1.808 -5.006 583 HH TYR 71 HH TYR 71 -14.206 -1.242 -7.420 584 H TYR 72 H TYR 72 -9.257 -6.600 -7.213 585 HA TYR 72 HA TYR 72 -6.660 -8.033 -7.581 586 1HB TYR 72 2HB TYR 72 -9.427 -8.917 -6.837 587 2HB TYR 72 1HB TYR 72 -8.359 -10.056 -7.657 588 HD1 TYR 72 HD1 TYR 72 -8.888 -8.064 -4.603 589 HD2 TYR 72 HD2 TYR 72 -6.309 -10.860 -6.602 590 HE1 TYR 72 HE1 TYR 72 -7.701 -8.494 -2.469 591 HE2 TYR 72 HE2 TYR 72 -5.122 -11.289 -4.468 592 HH TYR 72 HH TYR 72 -5.085 -9.414 -1.976 593 H LEU 73 HN LEU 73 -6.014 -8.037 -9.672 594 HA LEU 73 HA LEU 73 -8.103 -8.401 -11.786 595 1HB LEU 73 2HB LEU 73 -6.209 -6.292 -11.476 596 2HB LEU 73 1HB LEU 73 -5.707 -7.244 -12.871 597 HG LEU 73 HG LEU 73 -7.271 -5.444 -13.523 598 1HD1 LEU 73 1HD1 LEU 73 -8.002 -6.833 -15.133 599 2HD1 LEU 73 2HD1 LEU 73 -9.131 -7.590 -14.010 600 3HD1 LEU 73 3HD1 LEU 73 -7.483 -8.199 -14.147 601 1HD2 LEU 73 1HD2 LEU 73 -8.551 -6.082 -11.133 602 2HD2 LEU 73 2HD2 LEU 73 -9.656 -6.688 -12.365 603 3HD2 LEU 73 3HD2 LEU 73 -9.169 -4.992 -12.373 Start of MODEL 8 1 H MET 1 1H MET 1 11.936 5.398 5.939 2 HA MET 1 HA MET 1 9.899 4.670 4.864 3 1HB MET 1 2HB MET 1 10.915 3.488 7.400 4 2HB MET 1 1HB MET 1 9.381 2.857 6.800 5 1HG MET 1 2HG MET 1 10.464 2.503 4.566 6 2HG MET 1 1HG MET 1 12.003 2.980 5.285 7 1HE MET 1 1HE MET 1 11.592 0.695 3.730 8 2HE MET 1 2HE MET 1 11.628 -0.894 4.488 9 3HE MET 1 3HE MET 1 13.028 0.170 4.614 10 H ILE 2 H ILE 2 7.642 4.553 4.878 11 HA ILE 2 HA ILE 2 6.286 5.861 7.201 12 HB ILE 2 HB ILE 2 4.620 6.747 5.595 13 1HG1 ILE 2 2HG1 ILE 2 6.440 6.126 3.305 14 2HG1 ILE 2 1HG1 ILE 2 5.400 4.828 3.888 15 1HG2 ILE 2 1HG2 ILE 2 7.425 7.490 4.734 16 2HG2 ILE 2 2HG2 ILE 2 6.722 8.007 6.267 17 3HG2 ILE 2 3HG2 ILE 2 5.995 8.520 4.745 18 1HD1 ILE 2 1HD1 ILE 2 4.333 7.583 3.260 19 2HD1 ILE 2 2HD1 ILE 2 3.421 6.089 3.477 20 3HD1 ILE 2 3HD1 ILE 2 4.425 6.310 2.045 21 H GLU 3 H GLU 3 4.026 5.188 7.513 22 HA GLU 3 HA GLU 3 3.698 2.289 6.915 23 1HB GLU 3 2HB GLU 3 2.297 4.106 8.904 24 2HB GLU 3 1HB GLU 3 1.952 2.389 8.701 25 1HG GLU 3 2HG GLU 3 3.522 2.153 10.345 26 2HG GLU 3 1HG GLU 3 4.649 2.291 8.997 27 H VAL 4 H VAL 4 2.017 1.569 5.626 28 HA VAL 4 HA VAL 4 0.022 3.610 4.725 29 HB VAL 4 HB VAL 4 1.088 1.447 2.904 30 1HG1 VAL 4 1HG1 VAL 4 0.427 3.528 1.330 31 2HG1 VAL 4 2HG1 VAL 4 -0.644 3.862 2.690 32 3HG1 VAL 4 3HG1 VAL 4 -0.754 2.321 1.840 33 1HG2 VAL 4 1HG2 VAL 4 3.061 2.701 3.495 34 2HG2 VAL 4 2HG2 VAL 4 2.192 4.232 3.390 35 3HG2 VAL 4 3HG2 VAL 4 2.529 3.309 1.927 36 H VAL 5 H VAL 5 -2.028 2.694 4.017 37 HA VAL 5 HA VAL 5 -2.544 -0.088 4.971 38 HB VAL 5 HB VAL 5 -4.944 1.163 5.471 39 1HG1 VAL 5 1HG1 VAL 5 -2.589 0.456 7.202 40 2HG1 VAL 5 2HG1 VAL 5 -4.131 -0.384 7.028 41 3HG1 VAL 5 3HG1 VAL 5 -4.048 1.137 7.917 42 1HG2 VAL 5 1HG2 VAL 5 -4.713 3.301 6.267 43 2HG2 VAL 5 2HG2 VAL 5 -3.339 3.336 5.166 44 3HG2 VAL 5 3HG2 VAL 5 -3.088 3.007 6.880 45 H VAL 6 H VAL 6 -3.058 -1.163 3.145 46 HA VAL 6 HA VAL 6 -4.634 0.248 1.043 47 HB VAL 6 HB VAL 6 -3.391 -2.468 0.654 48 1HG1 VAL 6 1HG1 VAL 6 -3.497 -1.916 -1.614 49 2HG1 VAL 6 2HG1 VAL 6 -3.460 -0.181 -1.298 50 3HG1 VAL 6 3HG1 VAL 6 -4.930 -1.104 -0.985 51 1HG2 VAL 6 1HG2 VAL 6 -1.823 -0.422 1.600 52 2HG2 VAL 6 2HG2 VAL 6 -1.743 -0.134 -0.138 53 3HG2 VAL 6 3HG2 VAL 6 -1.243 -1.691 0.522 54 H ASN 7 H ASN 7 -6.746 -0.265 0.809 55 HA ASN 7 HA ASN 7 -7.745 -2.762 2.123 56 1HB ASN 7 2HB ASN 7 -10.019 -1.441 1.879 57 2HB ASN 7 1HB ASN 7 -8.921 -1.074 3.205 58 1HD2 ASN 7 1HD2 ASN 7 -7.824 0.991 3.183 59 2HD2 ASN 7 2HD2 ASN 7 -8.190 2.198 2.047 60 H ASP 8 H ASP 8 -8.529 -4.314 0.809 61 HA ASP 8 HA ASP 8 -8.633 -3.892 -2.074 62 1HB ASP 8 2HB ASP 8 -7.999 -6.053 -0.683 63 2HB ASP 8 1HB ASP 8 -9.735 -6.357 -0.766 64 H ARG 9 H ARG 9 -10.505 -4.132 -3.406 65 HA ARG 9 HA ARG 9 -12.877 -2.858 -2.432 66 1HB ARG 9 2HB ARG 9 -11.900 -3.288 -4.904 67 2HB ARG 9 1HB ARG 9 -13.076 -4.602 -4.841 68 1HG ARG 9 2HG ARG 9 -14.595 -3.034 -5.458 69 2HG ARG 9 1HG ARG 9 -14.504 -2.486 -3.785 70 1HD ARG 9 2HD ARG 9 -12.489 -1.488 -5.779 71 2HD ARG 9 1HD ARG 9 -14.099 -0.771 -5.740 72 HE ARG 9 HE ARG 9 -12.274 -0.812 -3.365 73 1HH1 ARG 9 2HH1 ARG 9 -12.326 1.663 -5.042 74 2HH1 ARG 9 1HH1 ARG 9 -13.521 2.627 -4.240 75 1HH2 ARG 9 1HH2 ARG 9 -14.850 -0.042 -2.447 76 2HH2 ARG 9 2HH2 ARG 9 -14.956 1.658 -2.763 77 H LEU 10 H LEU 10 -12.032 -6.288 -2.887 78 HA LEU 10 HA LEU 10 -14.659 -7.349 -2.394 79 1HB LEU 10 2HB LEU 10 -11.893 -8.401 -2.500 80 2HB LEU 10 1HB LEU 10 -12.987 -9.307 -1.454 81 HG LEU 10 HG LEU 10 -14.536 -8.842 -3.704 82 1HD1 LEU 10 1HD1 LEU 10 -11.669 -8.818 -4.423 83 2HD1 LEU 10 2HD1 LEU 10 -13.063 -8.237 -5.331 84 3HD1 LEU 10 3HD1 LEU 10 -12.651 -9.952 -5.351 85 1HD2 LEU 10 1HD2 LEU 10 -12.759 -11.230 -3.093 86 2HD2 LEU 10 2HD2 LEU 10 -14.173 -11.250 -4.149 87 3HD2 LEU 10 3HD2 LEU 10 -14.364 -10.947 -2.421 88 H GLY 11 H GLY 11 -11.870 -6.774 -0.226 89 1HA GLY 11 2HA GLY 11 -12.834 -5.697 1.992 90 2HA GLY 11 1HA GLY 11 -13.602 -7.281 2.143 91 H LYS 12 H LYS 12 -10.375 -5.841 1.571 92 HA LYS 12 HA LYS 12 -9.234 -7.721 3.557 93 1HB LYS 12 2HB LYS 12 -9.086 -8.247 0.800 94 2HB LYS 12 1HB LYS 12 -7.507 -7.583 1.218 95 1HG LYS 12 2HG LYS 12 -8.168 -9.350 3.317 96 2HG LYS 12 1HG LYS 12 -8.598 -10.194 1.827 97 1HD LYS 12 2HD LYS 12 -6.338 -9.637 0.913 98 2HD LYS 12 1HD LYS 12 -5.916 -8.933 2.473 99 1HE LYS 12 2HE LYS 12 -6.311 -11.104 3.569 100 2HE LYS 12 1HE LYS 12 -6.750 -11.812 2.015 101 1HZ LYS 12 1HZ LYS 12 -4.411 -12.211 2.679 102 2HZ LYS 12 2HZ LYS 12 -4.128 -10.541 2.582 103 3HZ LYS 12 3HZ LYS 12 -4.561 -11.416 1.190 104 H LYS 13 H LYS 13 -8.308 -6.253 4.931 105 HA LYS 13 HA LYS 13 -6.959 -3.852 3.801 106 1HB LYS 13 2HB LYS 13 -8.597 -4.193 6.031 107 2HB LYS 13 1HB LYS 13 -6.975 -4.069 6.718 108 1HG LYS 13 2HG LYS 13 -6.740 -2.062 5.016 109 2HG LYS 13 1HG LYS 13 -8.503 -2.062 5.090 110 1HD LYS 13 2HD LYS 13 -7.854 -2.267 7.745 111 2HD LYS 13 1HD LYS 13 -6.534 -1.267 7.137 112 1HE LYS 13 2HE LYS 13 -9.229 -0.534 6.146 113 2HE LYS 13 1HE LYS 13 -8.960 -0.262 7.868 114 1HZ LYS 13 1HZ LYS 13 -7.426 0.838 5.587 115 2HZ LYS 13 2HZ LYS 13 -6.830 0.867 7.180 116 3HZ LYS 13 3HZ LYS 13 -8.265 1.687 6.791 117 H VAL 14 H VAL 14 -4.778 -3.813 3.628 118 HA VAL 14 HA VAL 14 -3.175 -5.699 5.316 119 HB VAL 14 HB VAL 14 -2.446 -4.845 2.501 120 1HG1 VAL 14 1HG1 VAL 14 -0.528 -5.918 2.979 121 2HG1 VAL 14 2HG1 VAL 14 -1.438 -7.400 3.270 122 3HG1 VAL 14 3HG1 VAL 14 -1.119 -6.285 4.599 123 1HG2 VAL 14 1HG2 VAL 14 -3.483 -6.759 1.618 124 2HG2 VAL 14 2HG2 VAL 14 -4.663 -6.215 2.807 125 3HG2 VAL 14 3HG2 VAL 14 -3.580 -7.552 3.190 126 H ARG 15 H ARG 15 -1.266 -4.858 6.190 127 HA ARG 15 HA ARG 15 -0.871 -1.914 5.856 128 1HB ARG 15 2HB ARG 15 -0.715 -3.764 8.167 129 2HB ARG 15 1HB ARG 15 0.573 -2.562 8.081 130 1HG ARG 15 2HG ARG 15 -1.426 -0.906 7.581 131 2HG ARG 15 1HG ARG 15 -2.384 -2.152 8.383 132 1HD ARG 15 2HD ARG 15 -1.752 -0.792 10.181 133 2HD ARG 15 1HD ARG 15 -0.510 -2.044 10.212 134 HE ARG 15 HE ARG 15 1.064 -0.452 9.291 135 1HH1 ARG 15 1HH2 ARG 15 -0.283 1.164 11.480 136 2HH1 ARG 15 2HH2 ARG 15 -0.613 2.651 10.656 137 1HH2 ARG 15 2HH1 ARG 15 -0.143 1.301 7.485 138 2HH2 ARG 15 1HH1 ARG 15 -0.532 2.729 8.383 139 H VAL 16 H VAL 16 1.130 -1.167 5.173 140 HA VAL 16 HA VAL 16 3.397 -3.081 5.031 141 HB VAL 16 HB VAL 16 2.196 -3.292 2.885 142 1HG1 VAL 16 1HG1 VAL 16 1.167 -1.473 2.053 143 2HG1 VAL 16 2HG1 VAL 16 2.754 -0.846 1.607 144 3HG1 VAL 16 3HG1 VAL 16 2.036 -0.410 3.158 145 1HG2 VAL 16 1HG2 VAL 16 4.717 -1.682 2.430 146 2HG2 VAL 16 2HG2 VAL 16 4.089 -3.013 1.459 147 3HG2 VAL 16 3HG2 VAL 16 4.751 -3.327 3.063 148 H LYS 17 H LYS 17 5.393 -2.087 5.256 149 HA LYS 17 HA LYS 17 5.355 0.878 5.638 150 1HB LYS 17 2HB LYS 17 6.057 -0.806 7.525 151 2HB LYS 17 1HB LYS 17 7.571 -0.906 6.623 152 1HG LYS 17 2HG LYS 17 7.948 1.463 6.835 153 2HG LYS 17 1HG LYS 17 6.328 1.719 7.485 154 1HD LYS 17 2HD LYS 17 6.898 0.378 9.473 155 2HD LYS 17 1HD LYS 17 8.518 0.099 8.829 156 1HE LYS 17 2HE LYS 17 9.126 2.381 9.056 157 2HE LYS 17 1HE LYS 17 7.450 2.897 9.238 158 1HZ LYS 17 1HZ LYS 17 9.110 1.393 11.179 159 2HZ LYS 17 2HZ LYS 17 7.424 1.533 11.330 160 3HZ LYS 17 3HZ LYS 17 8.401 2.921 11.382 161 H CYS 18 H CYS 18 6.442 2.085 4.165 162 HA CYS 18 HA CYS 18 8.903 1.122 2.896 163 1HB CYS 18 2HB CYS 18 7.856 1.622 0.560 164 2HB CYS 18 1HB CYS 18 7.524 0.061 1.308 165 HG CYS 18 HG CYS 18 5.470 2.311 0.869 166 H LEU 19 H LEU 19 9.996 2.859 1.726 167 HA LEU 19 HA LEU 19 9.452 5.488 2.847 168 1HB LEU 19 2HB LEU 19 11.575 4.209 1.278 169 2HB LEU 19 1HB LEU 19 11.272 5.875 0.790 170 HG LEU 19 HG LEU 19 11.346 5.421 3.712 171 1HD1 LEU 19 1HD1 LEU 19 13.814 5.131 1.974 172 2HD1 LEU 19 2HD1 LEU 19 13.149 3.919 3.069 173 3HD1 LEU 19 3HD1 LEU 19 13.851 5.401 3.717 174 1HD2 LEU 19 1HD2 LEU 19 12.920 7.478 3.371 175 2HD2 LEU 19 2HD2 LEU 19 11.200 7.676 3.041 176 3HD2 LEU 19 3HD2 LEU 19 12.333 7.448 1.709 177 H ALA 20 H ALA 20 8.717 7.345 1.731 178 HA ALA 20 HA ALA 20 6.766 6.913 -0.346 179 1HB ALA 20 1HB ALA 20 6.644 9.402 -0.416 180 2HB ALA 20 2HB ALA 20 8.050 9.477 0.647 181 3HB ALA 20 3HB ALA 20 6.542 8.770 1.228 182 H GLU 21 H GLU 21 10.188 7.403 -0.444 183 HA GLU 21 HA GLU 21 10.278 8.528 -3.138 184 1HB GLU 21 2HB GLU 21 12.714 8.126 -2.967 185 2HB GLU 21 1HB GLU 21 12.104 8.966 -1.544 186 1HG GLU 21 2HG GLU 21 13.144 7.343 -0.348 187 2HG GLU 21 1HG GLU 21 11.806 6.307 -0.840 188 H ASP 22 H ASP 22 9.861 5.372 -1.820 189 HA ASP 22 HA ASP 22 11.112 3.836 -3.902 190 1HB ASP 22 2HB ASP 22 9.042 3.261 -1.800 191 2HB ASP 22 1HB ASP 22 9.348 2.076 -3.068 192 H SER 23 H SER 23 10.053 2.692 -5.645 193 HA SER 23 HA SER 23 8.013 4.306 -6.982 194 1HB SER 23 2HB SER 23 8.292 2.658 -8.825 195 2HB SER 23 1HB SER 23 9.829 3.337 -8.299 196 HG SER 23 HG SER 23 9.574 0.924 -8.554 197 H VAL 24 H VAL 24 6.069 3.184 -7.978 198 HA VAL 24 HA VAL 24 4.430 2.001 -5.948 199 HB VAL 24 HB VAL 24 4.096 2.022 -8.967 200 1HG1 VAL 24 1HG1 VAL 24 2.762 0.279 -7.586 201 2HG1 VAL 24 2HG1 VAL 24 1.854 1.337 -8.664 202 3HG1 VAL 24 3HG1 VAL 24 1.895 1.667 -6.931 203 1HG2 VAL 24 1HG2 VAL 24 2.313 3.714 -7.439 204 2HG2 VAL 24 2HG2 VAL 24 3.441 4.167 -8.716 205 3HG2 VAL 24 3HG2 VAL 24 3.989 4.089 -7.041 206 H GLY 25 H GLY 25 6.437 0.612 -8.519 207 1HA GLY 25 2HA GLY 25 5.525 -2.092 -8.345 208 2HA GLY 25 1HA GLY 25 7.134 -1.604 -8.882 209 H ASP 26 H ASP 26 8.032 -0.304 -6.541 210 HA ASP 26 HA ASP 26 8.955 -2.505 -4.946 211 1HB ASP 26 2HB ASP 26 9.848 -0.002 -5.258 212 2HB ASP 26 1HB ASP 26 8.891 0.263 -3.802 213 H PHE 27 H PHE 27 6.288 -0.204 -4.582 214 HA PHE 27 HA PHE 27 5.523 -0.853 -1.901 215 1HB PHE 27 2HB PHE 27 4.704 1.110 -3.289 216 2HB PHE 27 1HB PHE 27 3.683 -0.026 -4.168 217 HD1 PHE 27 HD1 PHE 27 4.028 1.983 -1.198 218 HD2 PHE 27 HD2 PHE 27 1.995 -1.425 -2.844 219 HE1 PHE 27 HE1 PHE 27 2.309 2.148 0.578 220 HE2 PHE 27 HE2 PHE 27 0.277 -1.259 -1.065 221 HZ PHE 27 HZ PHE 27 0.433 0.529 0.645 222 H LYS 28 H LYS 28 4.443 -2.148 -5.054 223 HA LYS 28 HA LYS 28 2.592 -4.061 -3.954 224 1HB LYS 28 2HB LYS 28 4.026 -3.945 -6.624 225 2HB LYS 28 1HB LYS 28 2.769 -5.122 -6.234 226 1HG LYS 28 2HG LYS 28 1.099 -3.581 -6.386 227 2HG LYS 28 1HG LYS 28 2.063 -2.320 -5.623 228 1HD LYS 28 2HD LYS 28 2.467 -1.413 -7.636 229 2HD LYS 28 1HD LYS 28 3.255 -2.904 -8.150 230 1HE LYS 28 2HE LYS 28 1.159 -3.830 -8.915 231 2HE LYS 28 1HE LYS 28 0.254 -2.489 -8.213 232 1HZ LYS 28 1HZ LYS 28 2.339 -2.074 -10.271 233 2HZ LYS 28 2HZ LYS 28 1.121 -0.997 -9.774 234 3HZ LYS 28 3HZ LYS 28 0.722 -2.378 -10.680 235 H LYS 29 H LYS 29 6.067 -4.128 -4.526 236 HA LYS 29 HA LYS 29 6.394 -6.992 -4.357 237 1HB LYS 29 2HB LYS 29 8.269 -4.654 -3.974 238 2HB LYS 29 1HB LYS 29 8.803 -6.316 -3.726 239 1HG LYS 29 2HG LYS 29 8.206 -6.903 -6.007 240 2HG LYS 29 1HG LYS 29 7.503 -5.306 -6.270 241 1HD LYS 29 2HD LYS 29 9.560 -4.271 -6.429 242 2HD LYS 29 1HD LYS 29 10.336 -5.416 -5.333 243 1HE LYS 29 2HE LYS 29 10.643 -7.018 -7.011 244 2HE LYS 29 1HE LYS 29 9.351 -6.360 -8.014 245 1HZ LYS 29 1HZ LYS 29 12.134 -5.587 -7.842 246 2HZ LYS 29 2HZ LYS 29 11.045 -4.282 -7.873 247 3HZ LYS 29 3HZ LYS 29 11.040 -5.427 -9.131 248 H VAL 30 H VAL 30 6.835 -4.370 -1.941 249 HA VAL 30 HA VAL 30 7.400 -6.147 0.257 250 HB VAL 30 HB VAL 30 6.169 -3.370 0.394 251 1HG1 VAL 30 1HG1 VAL 30 7.898 -4.854 2.393 252 2HG1 VAL 30 2HG1 VAL 30 6.138 -4.802 2.476 253 3HG1 VAL 30 3HG1 VAL 30 7.072 -3.316 2.637 254 1HG2 VAL 30 1HG2 VAL 30 8.261 -3.336 -0.914 255 2HG2 VAL 30 2HG2 VAL 30 9.085 -4.228 0.365 256 3HG2 VAL 30 3HG2 VAL 30 8.511 -2.586 0.663 257 H LEU 31 H LEU 31 4.412 -4.723 -1.031 258 HA LEU 31 HA LEU 31 2.656 -5.672 1.034 259 1HB LEU 31 2HB LEU 31 2.173 -3.916 -0.785 260 2HB LEU 31 1HB LEU 31 1.881 -5.280 -1.864 261 HG LEU 31 HG LEU 31 0.245 -6.148 -0.100 262 1HD1 LEU 31 1HD1 LEU 31 0.964 -4.830 1.805 263 2HD1 LEU 31 2HD1 LEU 31 -0.677 -4.330 1.389 264 3HD1 LEU 31 3HD1 LEU 31 0.697 -3.327 0.922 265 1HD2 LEU 31 1HD2 LEU 31 -1.552 -4.660 -0.880 266 2HD2 LEU 31 2HD2 LEU 31 -0.457 -5.040 -2.208 267 3HD2 LEU 31 3HD2 LEU 31 -0.357 -3.473 -1.406 268 H SER 32 H SER 32 3.752 -7.084 -2.048 269 HA SER 32 HA SER 32 2.085 -9.357 -2.179 270 1HB SER 32 2HB SER 32 3.580 -8.797 -4.007 271 2HB SER 32 1HB SER 32 4.992 -9.038 -2.984 272 HG SER 32 HG SER 32 4.856 -10.978 -3.841 273 H LEU 33 H LEU 33 4.831 -8.755 -0.043 274 HA LEU 33 HA LEU 33 5.243 -11.515 0.714 275 1HB LEU 33 2HB LEU 33 6.243 -8.882 1.543 276 2HB LEU 33 1HB LEU 33 6.079 -10.009 2.886 277 HG LEU 33 HG LEU 33 8.319 -10.158 1.836 278 1HD1 LEU 33 1HD1 LEU 33 6.990 -12.174 2.801 279 2HD1 LEU 33 2HD1 LEU 33 8.425 -12.509 1.832 280 3HD1 LEU 33 3HD1 LEU 33 6.820 -12.673 1.118 281 1HD2 LEU 33 1HD2 LEU 33 8.650 -10.476 -0.414 282 2HD2 LEU 33 2HD2 LEU 33 7.067 -9.706 -0.520 283 3HD2 LEU 33 3HD2 LEU 33 7.200 -11.463 -0.595 284 H GLN 34 H GLN 34 3.140 -8.926 1.906 285 HA GLN 34 HA GLN 34 2.270 -10.470 4.242 286 1HB GLN 34 2HB GLN 34 1.426 -7.838 3.024 287 2HB GLN 34 1HB GLN 34 0.546 -8.560 4.370 288 1HG GLN 34 2HG GLN 34 2.051 -7.434 5.657 289 2HG GLN 34 1HG GLN 34 3.124 -8.776 5.259 290 1HE2 GLN 34 1HE2 GLN 34 2.081 -5.621 3.804 291 2HE2 GLN 34 2HE2 GLN 34 3.620 -5.233 3.205 292 H ILE 35 H ILE 35 0.759 -9.466 1.140 293 HA ILE 35 HA ILE 35 -1.614 -11.109 1.716 294 HB ILE 35 HB ILE 35 -2.326 -10.372 -0.606 295 1HG1 ILE 35 2HG1 ILE 35 0.146 -8.623 -0.374 296 2HG1 ILE 35 1HG1 ILE 35 -0.022 -9.980 -1.486 297 1HG2 ILE 35 1HG2 ILE 35 -1.550 -8.094 1.224 298 2HG2 ILE 35 2HG2 ILE 35 -2.888 -9.194 1.562 299 3HG2 ILE 35 3HG2 ILE 35 -2.927 -8.172 0.125 300 1HD1 ILE 35 1HD1 ILE 35 -2.232 -8.021 -1.588 301 2HD1 ILE 35 2HD1 ILE 35 -1.361 -8.805 -2.904 302 3HD1 ILE 35 3HD1 ILE 35 -0.666 -7.395 -2.105 303 H GLY 36 H GLY 36 1.350 -11.454 -0.140 304 1HA GLY 36 2HA GLY 36 2.206 -13.341 -1.263 305 2HA GLY 36 1HA GLY 36 0.890 -14.281 -0.552 306 H THR 37 H THR 37 0.773 -11.423 -2.660 307 HA THR 37 HA THR 37 -0.931 -12.980 -4.562 308 HB THR 37 HB THR 37 -0.832 -9.972 -4.237 309 HG1 THR 37 HG1 THR 37 -2.548 -11.865 -2.997 310 1HG2 THR 37 1HG2 THR 37 -2.233 -11.818 -5.967 311 2HG2 THR 37 2HG2 THR 37 -2.182 -10.057 -6.024 312 3HG2 THR 37 3HG2 THR 37 -3.372 -10.873 -5.010 313 H GLN 38 H GLN 38 2.161 -11.655 -4.270 314 HA GLN 38 HA GLN 38 3.876 -11.309 -5.816 315 1HB GLN 38 2HB GLN 38 1.829 -12.611 -7.620 316 2HB GLN 38 1HB GLN 38 3.378 -12.041 -8.234 317 1HG GLN 38 2HG GLN 38 4.037 -14.162 -7.670 318 2HG GLN 38 1HG GLN 38 4.246 -13.421 -6.084 319 1HE2 GLN 38 1HE2 GLN 38 1.857 -15.270 -8.045 320 2HE2 GLN 38 2HE2 GLN 38 1.062 -15.948 -6.707 321 HA PRO 39 HA PRO 39 3.063 -7.326 -7.463 322 1HB PRO 39 2HB PRO 39 5.144 -7.111 -9.254 323 2HB PRO 39 1HB PRO 39 5.332 -6.968 -7.497 324 1HG PRO 39 2HG PRO 39 6.040 -9.258 -9.285 325 2HG PRO 39 1HG PRO 39 6.782 -8.756 -7.756 326 1HD PRO 39 2HD PRO 39 4.983 -10.893 -8.054 327 2HD PRO 39 1HD PRO 39 5.387 -10.099 -6.516 328 H ASN 40 H ASN 40 2.875 -10.118 -9.462 329 HA ASN 40 HA ASN 40 2.082 -8.649 -11.894 330 1HB ASN 40 2HB ASN 40 2.691 -11.465 -11.174 331 2HB ASN 40 1HB ASN 40 1.475 -11.241 -12.434 332 1HD2 ASN 40 1HD2 ASN 40 2.156 -10.196 -14.452 333 2HD2 ASN 40 2HD2 ASN 40 3.799 -10.010 -14.834 334 H LYS 41 H LYS 41 0.550 -9.983 -9.066 335 HA LYS 41 HA LYS 41 -2.104 -9.769 -10.432 336 1HB LYS 41 2HB LYS 41 -1.236 -12.015 -9.366 337 2HB LYS 41 1HB LYS 41 -1.747 -11.259 -7.857 338 1HG LYS 41 2HG LYS 41 -3.847 -11.927 -8.333 339 2HG LYS 41 1HG LYS 41 -3.844 -10.759 -9.654 340 1HD LYS 41 2HD LYS 41 -3.274 -12.364 -11.254 341 2HD LYS 41 1HD LYS 41 -2.582 -13.458 -10.055 342 1HE LYS 41 2HE LYS 41 -4.588 -14.423 -9.609 343 2HE LYS 41 1HE LYS 41 -5.431 -12.876 -9.617 344 1HZ LYS 41 1HZ LYS 41 -6.263 -13.537 -11.556 345 2HZ LYS 41 2HZ LYS 41 -5.147 -14.807 -11.718 346 3HZ LYS 41 3HZ LYS 41 -4.733 -13.237 -12.223 347 H ILE 42 H ILE 42 -0.248 -7.840 -8.621 348 HA ILE 42 HA ILE 42 -2.442 -7.043 -6.754 349 HB ILE 42 HB ILE 42 0.524 -6.393 -6.735 350 1HG1 ILE 42 2HG1 ILE 42 -1.171 -7.757 -4.624 351 2HG1 ILE 42 1HG1 ILE 42 -0.338 -8.657 -5.892 352 1HG2 ILE 42 1HG2 ILE 42 -0.487 -4.405 -5.948 353 2HG2 ILE 42 2HG2 ILE 42 -0.171 -5.317 -4.471 354 3HG2 ILE 42 3HG2 ILE 42 -1.796 -5.280 -5.155 355 1HD1 ILE 42 1HD1 ILE 42 1.080 -6.709 -4.058 356 2HD1 ILE 42 2HD1 ILE 42 1.811 -7.890 -5.145 357 3HD1 ILE 42 3HD1 ILE 42 0.945 -8.432 -3.708 358 H VAL 43 H VAL 43 -3.537 -5.191 -7.156 359 HA VAL 43 HA VAL 43 -2.378 -3.227 -9.097 360 HB VAL 43 HB VAL 43 -5.299 -4.035 -8.833 361 1HG1 VAL 43 1HG1 VAL 43 -4.355 -2.489 -11.171 362 2HG1 VAL 43 2HG1 VAL 43 -4.313 -1.613 -9.641 363 3HG1 VAL 43 3HG1 VAL 43 -5.828 -2.305 -10.219 364 1HG2 VAL 43 1HG2 VAL 43 -3.120 -4.765 -10.788 365 2HG2 VAL 43 2HG2 VAL 43 -4.808 -4.749 -11.298 366 3HG2 VAL 43 3HG2 VAL 43 -4.290 -5.819 -9.994 367 H LEU 44 H LEU 44 -1.939 -1.402 -7.925 368 HA LEU 44 HA LEU 44 -3.613 -0.786 -5.542 369 1HB LEU 44 2HB LEU 44 -0.829 -0.307 -6.313 370 2HB LEU 44 1HB LEU 44 -1.612 1.138 -5.675 371 HG LEU 44 HG LEU 44 -2.475 -0.868 -3.953 372 1HD1 LEU 44 1HD1 LEU 44 0.484 -1.241 -4.499 373 2HD1 LEU 44 2HD1 LEU 44 -0.769 -2.372 -5.010 374 3HD1 LEU 44 3HD1 LEU 44 -0.479 -2.092 -3.292 375 1HD2 LEU 44 1HD2 LEU 44 -1.016 0.250 -2.332 376 2HD2 LEU 44 2HD2 LEU 44 -1.739 1.451 -3.401 377 3HD2 LEU 44 3HD2 LEU 44 -0.065 0.953 -3.640 378 H GLN 45 H GLN 45 -4.773 1.142 -5.353 379 HA GLN 45 HA GLN 45 -4.806 2.955 -7.732 380 1HB GLN 45 2HB GLN 45 -7.336 2.280 -6.230 381 2HB GLN 45 1HB GLN 45 -7.162 2.967 -7.843 382 1HG GLN 45 2HG GLN 45 -5.856 0.571 -8.137 383 2HG GLN 45 1HG GLN 45 -7.121 0.141 -6.986 384 1HE2 GLN 45 1HE2 GLN 45 -6.500 1.116 -10.311 385 2HE2 GLN 45 2HE2 GLN 45 -8.105 0.975 -10.850 386 H LYS 46 H LYS 46 -4.816 5.120 -7.194 387 HA LYS 46 HA LYS 46 -4.609 5.819 -4.336 388 1HB LYS 46 2HB LYS 46 -3.847 7.040 -6.901 389 2HB LYS 46 1HB LYS 46 -4.502 8.198 -5.744 390 1HG LYS 46 2HG LYS 46 -2.459 6.198 -4.820 391 2HG LYS 46 1HG LYS 46 -1.929 7.629 -5.706 392 1HD LYS 46 2HD LYS 46 -2.818 9.108 -4.073 393 2HD LYS 46 1HD LYS 46 -3.791 7.835 -3.336 394 1HE LYS 46 2HE LYS 46 -1.341 6.736 -3.037 395 2HE LYS 46 1HE LYS 46 -0.898 8.443 -2.998 396 1HZ LYS 46 1HZ LYS 46 -2.022 8.789 -1.076 397 2HZ LYS 46 2HZ LYS 46 -1.674 7.143 -0.851 398 3HZ LYS 46 3HZ LYS 46 -3.207 7.623 -1.407 399 H GLY 47 H GLY 47 -6.408 7.362 -7.028 400 1HA GLY 47 2HA GLY 47 -8.892 7.337 -5.416 401 2HA GLY 47 1HA GLY 47 -8.242 8.923 -5.841 402 H GLY 48 H GLY 48 -9.171 5.817 -7.334 403 1HA GLY 48 2HA GLY 48 -10.478 5.466 -9.278 404 2HA GLY 48 1HA GLY 48 -10.599 7.216 -9.479 405 H SER 49 H SER 49 -7.529 5.539 -9.049 406 HA SER 49 HA SER 49 -6.907 5.563 -11.921 407 1HB SER 49 2HB SER 49 -4.914 7.046 -11.607 408 2HB SER 49 1HB SER 49 -6.441 7.889 -11.371 409 HG SER 49 HG SER 49 -5.000 8.373 -9.694 410 H VAL 50 H VAL 50 -5.404 3.989 -12.369 411 HA VAL 50 HA VAL 50 -4.478 2.315 -10.157 412 HB VAL 50 HB VAL 50 -5.256 1.392 -12.367 413 1HG1 VAL 50 1HG1 VAL 50 -3.625 3.296 -13.473 414 2HG1 VAL 50 2HG1 VAL 50 -4.219 1.877 -14.334 415 3HG1 VAL 50 3HG1 VAL 50 -2.615 1.856 -13.605 416 1HG2 VAL 50 1HG2 VAL 50 -3.649 0.238 -10.703 417 2HG2 VAL 50 2HG2 VAL 50 -2.376 0.636 -11.855 418 3HG2 VAL 50 3HG2 VAL 50 -3.711 -0.407 -12.343 419 H LEU 51 H LEU 51 -2.385 2.113 -9.404 420 HA LEU 51 HA LEU 51 -0.514 4.283 -10.131 421 1HB LEU 51 2HB LEU 51 -0.070 2.126 -8.052 422 2HB LEU 51 1HB LEU 51 0.687 3.715 -8.144 423 HG LEU 51 HG LEU 51 -2.249 3.171 -7.585 424 1HD1 LEU 51 1HD1 LEU 51 -1.826 3.684 -5.358 425 2HD1 LEU 51 2HD1 LEU 51 -0.360 4.587 -5.735 426 3HD1 LEU 51 3HD1 LEU 51 -0.348 2.823 -5.789 427 1HD2 LEU 51 1HD2 LEU 51 -2.669 5.420 -7.750 428 2HD2 LEU 51 2HD2 LEU 51 -1.309 5.367 -8.870 429 3HD2 LEU 51 3HD2 LEU 51 -1.055 5.868 -7.198 430 H LYS 52 H LYS 52 1.602 3.872 -10.934 431 HA LYS 52 HA LYS 52 2.045 1.109 -12.006 432 1HB LYS 52 2HB LYS 52 1.500 3.424 -13.487 433 2HB LYS 52 1HB LYS 52 3.248 3.220 -13.616 434 1HG LYS 52 2HG LYS 52 2.972 1.516 -15.063 435 2HG LYS 52 1HG LYS 52 1.978 0.648 -13.891 436 1HD LYS 52 2HD LYS 52 0.013 2.002 -14.609 437 2HD LYS 52 1HD LYS 52 1.015 2.771 -15.836 438 1HE LYS 52 2HE LYS 52 1.255 0.780 -17.068 439 2HE LYS 52 1HE LYS 52 0.813 -0.232 -15.695 440 1HZ LYS 52 1HZ LYS 52 -1.162 -0.269 -16.732 441 2HZ LYS 52 2HZ LYS 52 -0.880 1.174 -17.589 442 3HZ LYS 52 3HZ LYS 52 -1.395 1.230 -15.971 443 H ASP 53 H ASP 53 4.238 0.436 -12.143 444 HA ASP 53 HA ASP 53 5.999 1.388 -10.102 445 1HB ASP 53 2HB ASP 53 6.225 -0.884 -10.889 446 2HB ASP 53 1HB ASP 53 6.509 -0.339 -12.541 447 H HIS 54 H HIS 54 5.545 2.351 -13.438 448 HA HIS 54 HA HIS 54 8.047 3.683 -13.865 449 1HB HIS 54 2HB HIS 54 5.350 3.696 -15.109 450 2HB HIS 54 1HB HIS 54 6.313 5.150 -15.365 451 HD1 HIS 54 HD1 HIS 54 8.424 4.945 -16.828 452 HD2 HIS 54 HD2 HIS 54 6.480 1.305 -16.239 453 HE1 HIS 54 HE1 HIS 54 9.467 3.305 -18.452 454 H ILE 55 H ILE 55 5.447 4.435 -11.740 455 HA ILE 55 HA ILE 55 6.412 7.260 -11.511 456 HB ILE 55 HB ILE 55 3.687 6.119 -10.808 457 1HG1 ILE 55 2HG1 ILE 55 3.255 8.011 -12.711 458 2HG1 ILE 55 1HG1 ILE 55 4.833 7.415 -13.224 459 1HG2 ILE 55 1HG2 ILE 55 4.914 8.872 -10.581 460 2HG2 ILE 55 2HG2 ILE 55 4.099 7.935 -9.329 461 3HG2 ILE 55 3HG2 ILE 55 3.168 8.636 -10.651 462 1HD1 ILE 55 1HD1 ILE 55 2.588 6.240 -14.044 463 2HD1 ILE 55 2HD1 ILE 55 2.744 5.399 -12.501 464 3HD1 ILE 55 3HD1 ILE 55 4.037 5.295 -13.696 465 H SER 56 H SER 56 6.959 8.000 -9.456 466 HA SER 56 HA SER 56 7.516 5.939 -7.443 467 1HB SER 56 2HB SER 56 8.782 8.276 -8.149 468 2HB SER 56 1HB SER 56 7.937 8.753 -6.678 469 HG SER 56 HG SER 56 10.102 7.764 -6.452 470 H LEU 57 H LEU 57 6.773 6.089 -5.221 471 HA LEU 57 HA LEU 57 3.969 6.558 -4.933 472 1HB LEU 57 2HB LEU 57 6.154 6.317 -2.840 473 2HB LEU 57 1HB LEU 57 4.430 6.328 -2.470 474 HG LEU 57 HG LEU 57 5.583 4.375 -4.462 475 1HD1 LEU 57 1HD1 LEU 57 6.647 4.356 -2.053 476 2HD1 LEU 57 2HD1 LEU 57 6.122 2.839 -2.787 477 3HD1 LEU 57 3HD1 LEU 57 5.104 3.639 -1.589 478 1HD2 LEU 57 1HD2 LEU 57 3.559 3.190 -4.108 479 2HD2 LEU 57 2HD2 LEU 57 3.060 4.881 -4.149 480 3HD2 LEU 57 3HD2 LEU 57 3.222 4.047 -2.603 481 H GLU 58 H GLU 58 6.778 8.624 -4.359 482 HA GLU 58 HA GLU 58 5.476 10.686 -2.856 483 1HB GLU 58 2HB GLU 58 8.016 10.307 -3.388 484 2HB GLU 58 1HB GLU 58 7.678 11.271 -4.825 485 1HG GLU 58 2HG GLU 58 8.183 12.999 -3.400 486 2HG GLU 58 1HG GLU 58 6.478 12.829 -2.981 487 H ASP 59 H ASP 59 5.744 10.075 -6.341 488 HA ASP 59 HA ASP 59 4.644 12.583 -7.225 489 1HB ASP 59 2HB ASP 59 4.709 9.840 -8.517 490 2HB ASP 59 1HB ASP 59 4.141 11.291 -9.340 491 H TYR 60 H TYR 60 3.172 9.405 -6.535 492 HA TYR 60 HA TYR 60 0.472 10.247 -7.166 493 1HB TYR 60 2HB TYR 60 1.668 7.879 -5.734 494 2HB TYR 60 1HB TYR 60 -0.077 8.129 -5.757 495 HD1 TYR 60 HD1 TYR 60 2.421 6.386 -7.347 496 HD2 TYR 60 HD2 TYR 60 -0.872 8.983 -8.289 497 HE1 TYR 60 HE1 TYR 60 2.317 5.429 -9.631 498 HE2 TYR 60 HE2 TYR 60 -0.973 8.025 -10.572 499 HH TYR 60 HH TYR 60 -0.307 6.147 -11.814 500 H GLU 61 H GLU 61 2.525 10.757 -4.453 501 HA GLU 61 HA GLU 61 2.141 12.102 -2.568 502 1HB GLU 61 2HB GLU 61 0.059 12.910 -4.023 503 2HB GLU 61 1HB GLU 61 -0.838 11.962 -2.837 504 1HG GLU 61 2HG GLU 61 1.260 13.793 -1.777 505 2HG GLU 61 1HG GLU 61 -0.197 14.545 -2.426 506 H VAL 62 H VAL 62 2.897 9.932 -1.783 507 HA VAL 62 HA VAL 62 0.775 8.537 -0.198 508 HB VAL 62 HB VAL 62 3.478 7.506 -1.139 509 1HG1 VAL 62 1HG1 VAL 62 1.226 5.976 0.193 510 2HG1 VAL 62 2HG1 VAL 62 2.612 6.614 1.078 511 3HG1 VAL 62 3HG1 VAL 62 2.851 5.395 -0.174 512 1HG2 VAL 62 1HG2 VAL 62 1.448 7.826 -2.786 513 2HG2 VAL 62 2HG2 VAL 62 0.796 6.411 -1.958 514 3HG2 VAL 62 3HG2 VAL 62 2.343 6.307 -2.799 515 H HIS 63 H HIS 63 0.821 9.558 1.772 516 HA HIS 63 HA HIS 63 3.472 10.167 3.002 517 1HB HIS 63 2HB HIS 63 0.764 11.370 3.158 518 2HB HIS 63 1HB HIS 63 1.671 11.331 4.669 519 HD1 HIS 63 HD1 HIS 63 2.158 12.432 1.050 520 HD2 HIS 63 HD2 HIS 63 3.590 13.322 4.863 521 HE1 HIS 63 HE1 HIS 63 3.692 14.429 0.791 522 H ASP 64 H ASP 64 3.188 10.070 5.588 523 HA ASP 64 HA ASP 64 2.992 7.286 6.266 524 1HB ASP 64 2HB ASP 64 4.247 9.314 7.442 525 2HB ASP 64 1HB ASP 64 2.755 9.397 8.380 526 H GLN 65 H GLN 65 1.322 6.120 7.142 527 HA GLN 65 HA GLN 65 -0.854 5.553 7.774 528 1HB GLN 65 2HB GLN 65 -0.223 7.981 9.157 529 2HB GLN 65 1HB GLN 65 -1.909 8.062 8.648 530 1HG GLN 65 2HG GLN 65 -1.839 6.989 10.816 531 2HG GLN 65 1HG GLN 65 -2.235 5.759 9.616 532 1HE2 GLN 65 1HE2 GLN 65 0.552 7.094 11.467 533 2HE2 GLN 65 2HE2 GLN 65 1.451 5.654 11.436 534 H THR 66 H THR 66 -0.361 6.393 5.050 535 HA THR 66 HA THR 66 -2.766 7.960 4.303 536 HB THR 66 HB THR 66 -0.520 8.362 3.207 537 HG1 THR 66 HG1 THR 66 -1.814 9.109 1.762 538 1HG2 THR 66 1HG2 THR 66 0.406 6.799 1.704 539 2HG2 THR 66 2HG2 THR 66 -1.071 5.837 1.655 540 3HG2 THR 66 3HG2 THR 66 -0.054 5.820 3.096 541 H ASN 67 H ASN 67 -4.455 7.075 3.022 542 HA ASN 67 HA ASN 67 -4.699 4.119 3.230 543 1HB ASN 67 2HB ASN 67 -6.623 6.400 3.006 544 2HB ASN 67 1HB ASN 67 -7.125 4.826 2.391 545 1HD2 ASN 67 1HD2 ASN 67 -7.116 2.986 3.968 546 2HD2 ASN 67 2HD2 ASN 67 -7.252 3.307 5.629 547 H LEU 68 H LEU 68 -4.830 2.810 1.453 548 HA LEU 68 HA LEU 68 -4.929 4.084 -1.250 549 1HB LEU 68 2HB LEU 68 -2.858 2.299 -0.076 550 2HB LEU 68 1HB LEU 68 -3.337 1.955 -1.739 551 HG LEU 68 HG LEU 68 -2.725 4.786 -0.936 552 1HD1 LEU 68 1HD1 LEU 68 -0.832 3.305 -0.165 553 2HD1 LEU 68 2HD1 LEU 68 -0.374 4.470 -1.407 554 3HD1 LEU 68 3HD1 LEU 68 -0.638 2.780 -1.837 555 1HD2 LEU 68 1HD2 LEU 68 -2.190 5.005 -3.281 556 2HD2 LEU 68 2HD2 LEU 68 -3.716 4.125 -3.177 557 3HD2 LEU 68 3HD2 LEU 68 -2.217 3.257 -3.505 558 H GLU 69 H GLU 69 -5.567 2.483 -2.962 559 HA GLU 69 HA GLU 69 -7.576 0.568 -1.868 560 1HB GLU 69 2HB GLU 69 -7.783 2.493 -3.855 561 2HB GLU 69 1HB GLU 69 -7.575 1.000 -4.770 562 1HG GLU 69 2HG GLU 69 -9.443 0.785 -2.492 563 2HG GLU 69 1HG GLU 69 -9.974 1.876 -3.771 564 H LEU 70 H LEU 70 -7.521 -1.615 -2.441 565 HA LEU 70 HA LEU 70 -5.109 -2.512 -3.975 566 1HB LEU 70 2HB LEU 70 -5.089 -3.084 -1.527 567 2HB LEU 70 1HB LEU 70 -6.554 -4.029 -1.781 568 HG LEU 70 HG LEU 70 -5.365 -5.450 -3.412 569 1HD1 LEU 70 1HD1 LEU 70 -2.682 -4.988 -3.051 570 2HD1 LEU 70 2HD1 LEU 70 -3.322 -3.345 -3.079 571 3HD1 LEU 70 3HD1 LEU 70 -3.611 -4.428 -4.441 572 1HD2 LEU 70 1HD2 LEU 70 -3.835 -6.558 -1.806 573 2HD2 LEU 70 2HD2 LEU 70 -5.354 -6.099 -1.036 574 3HD2 LEU 70 3HD2 LEU 70 -3.903 -5.133 -0.771 575 H TYR 71 H TYR 71 -5.405 -4.123 -5.517 576 HA TYR 71 HA TYR 71 -8.113 -5.273 -5.894 577 1HB TYR 71 2HB TYR 71 -7.036 -3.127 -7.489 578 2HB TYR 71 1HB TYR 71 -7.181 -4.574 -8.486 579 HD1 TYR 71 HD1 TYR 71 -9.438 -5.938 -8.146 580 HD2 TYR 71 HD2 TYR 71 -8.920 -1.776 -7.216 581 HE1 TYR 71 HE1 TYR 71 -11.891 -5.605 -8.280 582 HE2 TYR 71 HE2 TYR 71 -11.374 -1.442 -7.351 583 HH TYR 71 HH TYR 71 -13.378 -3.070 -8.799 584 H TYR 72 H TYR 72 -8.049 -7.303 -6.940 585 HA TYR 72 HA TYR 72 -5.306 -8.418 -7.268 586 1HB TYR 72 2HB TYR 72 -7.978 -9.795 -6.864 587 2HB TYR 72 1HB TYR 72 -6.445 -10.636 -7.087 588 HD1 TYR 72 HD1 TYR 72 -4.532 -9.084 -5.559 589 HD2 TYR 72 HD2 TYR 72 -8.614 -10.034 -4.613 590 HE1 TYR 72 HE1 TYR 72 -4.034 -8.811 -3.148 591 HE2 TYR 72 HE2 TYR 72 -8.115 -9.760 -2.198 592 HH TYR 72 HH TYR 72 -5.938 -8.196 -0.937 593 H LEU 73 HN LEU 73 -4.668 -8.154 -9.346 594 HA LEU 73 HA LEU 73 -6.235 -9.467 -11.464 595 1HB LEU 73 2HB LEU 73 -6.536 -6.709 -11.079 596 2HB LEU 73 1HB LEU 73 -5.386 -6.841 -12.410 597 HG LEU 73 HG LEU 73 -7.445 -8.788 -12.823 598 1HD1 LEU 73 1HD1 LEU 73 -9.434 -7.427 -12.913 599 2HD1 LEU 73 2HD1 LEU 73 -8.526 -5.975 -12.494 600 3HD1 LEU 73 3HD1 LEU 73 -8.752 -7.250 -11.296 601 1HD2 LEU 73 1HD2 LEU 73 -7.417 -6.271 -14.406 602 2HD2 LEU 73 2HD2 LEU 73 -7.342 -7.946 -14.954 603 3HD2 LEU 73 3HD2 LEU 73 -5.893 -7.156 -14.337 Start of MODEL 9 1 H MET 1 1H MET 1 10.423 6.904 6.888 2 HA MET 1 HA MET 1 9.550 5.271 4.598 3 1HB MET 1 2HB MET 1 11.071 4.253 6.771 4 2HB MET 1 1HB MET 1 9.395 3.777 7.052 5 1HG MET 1 2HG MET 1 9.270 2.543 5.088 6 2HG MET 1 1HG MET 1 10.534 3.483 4.296 7 1HE MET 1 1HE MET 1 12.434 1.742 3.534 8 2HE MET 1 2HE MET 1 10.813 1.047 3.535 9 3HE MET 1 3HE MET 1 12.168 0.112 4.165 10 H ILE 2 H ILE 2 7.321 4.920 4.694 11 HA ILE 2 HA ILE 2 5.882 6.179 6.996 12 HB ILE 2 HB ILE 2 4.122 6.886 5.389 13 1HG1 ILE 2 2HG1 ILE 2 6.003 6.399 3.107 14 2HG1 ILE 2 1HG1 ILE 2 5.038 5.045 3.692 15 1HG2 ILE 2 1HG2 ILE 2 6.783 7.935 4.426 16 2HG2 ILE 2 2HG2 ILE 2 6.176 8.304 6.041 17 3HG2 ILE 2 3HG2 ILE 2 5.262 8.808 4.620 18 1HD1 ILE 2 1HD1 ILE 2 3.069 6.805 3.578 19 2HD1 ILE 2 2HD1 ILE 2 3.588 5.954 2.124 20 3HD1 ILE 2 3HD1 ILE 2 4.135 7.604 2.422 21 H GLU 3 H GLU 3 3.638 5.328 7.258 22 HA GLU 3 HA GLU 3 3.508 2.432 6.510 23 1HB GLU 3 2HB GLU 3 3.571 3.444 9.027 24 2HB GLU 3 1HB GLU 3 1.833 3.471 8.735 25 1HG GLU 3 2HG GLU 3 3.529 1.024 8.198 26 2HG GLU 3 1HG GLU 3 2.758 1.319 9.756 27 H VAL 4 H VAL 4 1.933 1.985 5.037 28 HA VAL 4 HA VAL 4 -0.404 3.852 4.879 29 HB VAL 4 HB VAL 4 -0.583 3.240 2.504 30 1HG1 VAL 4 1HG1 VAL 4 2.300 3.852 2.611 31 2HG1 VAL 4 2HG1 VAL 4 1.303 4.885 3.637 32 3HG1 VAL 4 3HG1 VAL 4 0.976 4.780 1.908 33 1HG2 VAL 4 1HG2 VAL 4 0.678 1.605 1.485 34 2HG2 VAL 4 2HG2 VAL 4 0.662 0.933 3.113 35 3HG2 VAL 4 3HG2 VAL 4 2.059 1.851 2.553 36 H VAL 5 H VAL 5 -2.490 2.921 4.504 37 HA VAL 5 HA VAL 5 -2.686 0.067 5.377 38 HB VAL 5 HB VAL 5 -4.899 2.142 5.385 39 1HG1 VAL 5 1HG1 VAL 5 -4.526 -0.649 6.415 40 2HG1 VAL 5 2HG1 VAL 5 -5.934 0.080 5.641 41 3HG1 VAL 5 3HG1 VAL 5 -5.560 0.456 7.323 42 1HG2 VAL 5 1HG2 VAL 5 -3.481 3.133 6.928 43 2HG2 VAL 5 2HG2 VAL 5 -2.682 1.613 7.328 44 3HG2 VAL 5 3HG2 VAL 5 -4.282 1.966 7.978 45 H VAL 6 H VAL 6 -3.171 -1.353 3.774 46 HA VAL 6 HA VAL 6 -4.557 -0.312 1.332 47 HB VAL 6 HB VAL 6 -2.888 -2.830 1.636 48 1HG1 VAL 6 1HG1 VAL 6 -4.400 -1.528 -0.589 49 2HG1 VAL 6 2HG1 VAL 6 -4.170 -3.241 -0.238 50 3HG1 VAL 6 3HG1 VAL 6 -2.869 -2.312 -0.983 51 1HG2 VAL 6 1HG2 VAL 6 -2.180 -0.105 0.496 52 2HG2 VAL 6 2HG2 VAL 6 -1.172 -1.545 0.356 53 3HG2 VAL 6 3HG2 VAL 6 -1.487 -0.841 1.942 54 H ASN 7 H ASN 7 -6.629 -0.980 1.040 55 HA ASN 7 HA ASN 7 -7.468 -3.551 2.313 56 1HB ASN 7 2HB ASN 7 -9.718 -2.433 2.713 57 2HB ASN 7 1HB ASN 7 -8.397 -1.854 3.724 58 1HD2 ASN 7 1HD2 ASN 7 -7.399 0.272 3.101 59 2HD2 ASN 7 2HD2 ASN 7 -8.308 1.388 2.202 60 H ASP 8 H ASP 8 -8.425 -4.929 0.913 61 HA ASP 8 HA ASP 8 -8.805 -4.165 -1.866 62 1HB ASP 8 2HB ASP 8 -8.191 -6.509 -0.724 63 2HB ASP 8 1HB ASP 8 -9.939 -6.721 -0.818 64 H ARG 9 H ARG 9 -10.768 -4.034 -3.010 65 HA ARG 9 HA ARG 9 -13.011 -2.920 -1.598 66 1HB ARG 9 2HB ARG 9 -12.384 -2.450 -4.002 67 2HB ARG 9 1HB ARG 9 -13.010 -4.046 -4.413 68 1HG ARG 9 2HG ARG 9 -15.171 -3.376 -4.234 69 2HG ARG 9 1HG ARG 9 -14.851 -2.442 -2.772 70 1HD ARG 9 2HD ARG 9 -13.566 -1.232 -5.078 71 2HD ARG 9 1HD ARG 9 -15.301 -1.412 -5.342 72 HE ARG 9 HE ARG 9 -15.589 -0.195 -3.128 73 1HH1 ARG 9 2HH1 ARG 9 -14.836 1.823 -5.091 74 2HH1 ARG 9 1HH1 ARG 9 -13.430 2.563 -4.401 75 1HH2 ARG 9 1HH2 ARG 9 -12.841 -0.023 -2.159 76 2HH2 ARG 9 2HH2 ARG 9 -12.304 1.519 -2.734 77 H LEU 10 H LEU 10 -12.313 -6.185 -2.810 78 HA LEU 10 HA LEU 10 -14.933 -7.286 -2.551 79 1HB LEU 10 2HB LEU 10 -12.156 -8.374 -2.640 80 2HB LEU 10 1HB LEU 10 -13.414 -9.440 -2.014 81 HG LEU 10 HG LEU 10 -14.585 -8.288 -4.266 82 1HD1 LEU 10 1HD1 LEU 10 -12.864 -8.785 -6.044 83 2HD1 LEU 10 2HD1 LEU 10 -11.661 -8.916 -4.763 84 3HD1 LEU 10 3HD1 LEU 10 -12.484 -7.384 -5.045 85 1HD2 LEU 10 1HD2 LEU 10 -14.775 -10.489 -4.956 86 2HD2 LEU 10 2HD2 LEU 10 -14.328 -10.759 -3.272 87 3HD2 LEU 10 3HD2 LEU 10 -13.105 -10.877 -4.538 88 H GLY 11 H GLY 11 -12.217 -7.240 -0.221 89 1HA GLY 11 2HA GLY 11 -13.454 -6.623 2.120 90 2HA GLY 11 1HA GLY 11 -13.918 -8.315 1.928 91 H LYS 12 H LYS 12 -11.041 -6.205 1.920 92 HA LYS 12 HA LYS 12 -9.585 -8.201 3.539 93 1HB LYS 12 2HB LYS 12 -9.323 -8.413 0.844 94 2HB LYS 12 1HB LYS 12 -8.047 -7.246 1.189 95 1HG LYS 12 2HG LYS 12 -7.338 -8.859 3.073 96 2HG LYS 12 1HG LYS 12 -8.364 -10.045 2.267 97 1HD LYS 12 2HD LYS 12 -6.569 -10.500 0.968 98 2HD LYS 12 1HD LYS 12 -6.896 -8.957 0.178 99 1HE LYS 12 2HE LYS 12 -5.261 -9.079 2.708 100 2HE LYS 12 1HE LYS 12 -4.514 -9.350 1.135 101 1HZ LYS 12 1HZ LYS 12 -5.882 -7.147 0.613 102 2HZ LYS 12 2HZ LYS 12 -4.299 -7.117 1.229 103 3HZ LYS 12 3HZ LYS 12 -5.622 -6.907 2.272 104 H LYS 13 H LYS 13 -7.746 -7.264 4.630 105 HA LYS 13 HA LYS 13 -7.147 -4.413 4.119 106 1HB LYS 13 2HB LYS 13 -9.136 -4.763 5.827 107 2HB LYS 13 1HB LYS 13 -7.825 -5.138 6.949 108 1HG LYS 13 2HG LYS 13 -6.920 -3.000 6.826 109 2HG LYS 13 1HG LYS 13 -7.606 -2.691 5.232 110 1HD LYS 13 2HD LYS 13 -9.582 -1.947 6.084 111 2HD LYS 13 1HD LYS 13 -9.600 -3.156 7.360 112 1HE LYS 13 2HE LYS 13 -9.101 -1.443 8.752 113 2HE LYS 13 1HE LYS 13 -7.468 -1.579 8.100 114 1HZ LYS 13 1HZ LYS 13 -9.347 0.519 7.785 115 2HZ LYS 13 2HZ LYS 13 -8.891 -0.092 6.260 116 3HZ LYS 13 3HZ LYS 13 -7.709 0.472 7.346 117 H VAL 14 H VAL 14 -4.992 -4.173 4.249 118 HA VAL 14 HA VAL 14 -3.446 -5.695 6.281 119 HB VAL 14 HB VAL 14 -1.687 -6.114 4.480 120 1HG1 VAL 14 1HG1 VAL 14 -2.610 -8.202 3.962 121 2HG1 VAL 14 2HG1 VAL 14 -4.239 -7.550 3.796 122 3HG1 VAL 14 3HG1 VAL 14 -3.528 -7.746 5.397 123 1HG2 VAL 14 1HG2 VAL 14 -2.586 -4.519 2.810 124 2HG2 VAL 14 2HG2 VAL 14 -4.048 -5.494 2.672 125 3HG2 VAL 14 3HG2 VAL 14 -2.499 -6.151 2.146 126 H ARG 15 H ARG 15 -1.280 -4.733 6.645 127 HA ARG 15 HA ARG 15 -1.176 -1.848 5.842 128 1HB ARG 15 2HB ARG 15 -0.872 -3.170 8.471 129 2HB ARG 15 1HB ARG 15 0.368 -1.970 8.102 130 1HG ARG 15 2HG ARG 15 -1.267 -0.257 7.739 131 2HG ARG 15 1HG ARG 15 -2.589 -1.423 7.766 132 1HD ARG 15 2HD ARG 15 -1.457 -1.915 10.189 133 2HD ARG 15 1HD ARG 15 -1.108 -0.196 10.019 134 HE ARG 15 HE ARG 15 -3.521 0.214 9.859 135 1HH1 ARG 15 1HH2 ARG 15 -2.865 -1.706 12.273 136 2HH1 ARG 15 2HH2 ARG 15 -4.243 -2.750 12.188 137 1HH2 ARG 15 2HH1 ARG 15 -5.170 -1.699 9.006 138 2HH2 ARG 15 1HH1 ARG 15 -5.555 -2.743 10.334 139 H VAL 16 H VAL 16 0.695 -1.169 4.889 140 HA VAL 16 HA VAL 16 3.099 -2.917 5.014 141 HB VAL 16 HB VAL 16 1.873 -3.514 2.956 142 1HG1 VAL 16 1HG1 VAL 16 0.593 -1.561 2.484 143 2HG1 VAL 16 2HG1 VAL 16 1.743 -1.706 1.156 144 3HG1 VAL 16 3HG1 VAL 16 2.029 -0.539 2.444 145 1HG2 VAL 16 1HG2 VAL 16 4.315 -3.567 2.877 146 2HG2 VAL 16 2HG2 VAL 16 4.365 -1.854 2.463 147 3HG2 VAL 16 3HG2 VAL 16 3.684 -3.018 1.325 148 H LYS 17 H LYS 17 4.997 -1.746 5.101 149 HA LYS 17 HA LYS 17 4.696 1.224 5.062 150 1HB LYS 17 2HB LYS 17 6.803 1.199 6.453 151 2HB LYS 17 1HB LYS 17 5.406 0.450 7.222 152 1HG LYS 17 2HG LYS 17 6.551 -1.469 7.452 153 2HG LYS 17 1HG LYS 17 6.761 -1.562 5.705 154 1HD LYS 17 2HD LYS 17 8.629 0.292 6.241 155 2HD LYS 17 1HD LYS 17 8.633 -0.553 7.789 156 1HE LYS 17 2HE LYS 17 8.574 -2.621 5.939 157 2HE LYS 17 1HE LYS 17 9.644 -1.438 5.188 158 1HZ LYS 17 1HZ LYS 17 11.135 -2.479 6.508 159 2HZ LYS 17 2HZ LYS 17 9.979 -2.947 7.663 160 3HZ LYS 17 3HZ LYS 17 10.574 -1.355 7.647 161 H CYS 18 H CYS 18 6.046 2.481 3.803 162 HA CYS 18 HA CYS 18 8.354 1.321 2.399 163 1HB CYS 18 2HB CYS 18 7.458 1.844 0.137 164 2HB CYS 18 1HB CYS 18 6.515 0.594 0.945 165 HG CYS 18 HG CYS 18 4.634 2.307 1.391 166 H LEU 19 H LEU 19 9.439 3.056 1.017 167 HA LEU 19 HA LEU 19 9.288 5.644 2.434 168 1HB LEU 19 2HB LEU 19 11.312 4.170 0.963 169 2HB LEU 19 1HB LEU 19 11.180 5.817 0.351 170 HG LEU 19 HG LEU 19 11.166 5.514 3.309 171 1HD1 LEU 19 1HD1 LEU 19 13.785 5.356 1.812 172 2HD1 LEU 19 2HD1 LEU 19 12.939 3.901 2.340 173 3HD1 LEU 19 3HD1 LEU 19 13.485 5.084 3.529 174 1HD2 LEU 19 1HD2 LEU 19 11.216 7.747 2.736 175 2HD2 LEU 19 2HD2 LEU 19 12.059 7.447 1.217 176 3HD2 LEU 19 3HD2 LEU 19 12.953 7.443 2.737 177 H ALA 20 H ALA 20 8.724 7.604 1.416 178 HA ALA 20 HA ALA 20 6.805 7.486 -0.709 179 1HB ALA 20 1HB ALA 20 6.756 9.875 -0.594 180 2HB ALA 20 2HB ALA 20 8.386 9.944 0.078 181 3HB ALA 20 3HB ALA 20 7.056 9.319 1.053 182 H GLU 21 H GLU 21 10.284 7.729 -0.717 183 HA GLU 21 HA GLU 21 10.438 8.704 -3.483 184 1HB GLU 21 2HB GLU 21 12.874 8.367 -3.215 185 2HB GLU 21 1HB GLU 21 12.207 9.306 -1.882 186 1HG GLU 21 2HG GLU 21 13.234 7.811 -0.522 187 2HG GLU 21 1HG GLU 21 11.946 6.699 -0.979 188 H ASP 22 H ASP 22 10.167 5.630 -1.887 189 HA ASP 22 HA ASP 22 11.455 3.970 -3.833 190 1HB ASP 22 2HB ASP 22 9.619 3.590 -1.562 191 2HB ASP 22 1HB ASP 22 9.430 2.390 -2.841 192 H SER 23 H SER 23 10.499 2.710 -5.535 193 HA SER 23 HA SER 23 8.401 4.150 -6.986 194 1HB SER 23 2HB SER 23 8.849 2.505 -8.780 195 2HB SER 23 1HB SER 23 10.336 3.250 -8.203 196 HG SER 23 HG SER 23 10.281 0.866 -8.431 197 H VAL 24 H VAL 24 6.514 2.968 -7.915 198 HA VAL 24 HA VAL 24 4.961 1.660 -5.898 199 HB VAL 24 HB VAL 24 4.585 1.690 -8.909 200 1HG1 VAL 24 1HG1 VAL 24 2.402 0.891 -8.583 201 2HG1 VAL 24 2HG1 VAL 24 2.406 1.299 -6.867 202 3HG1 VAL 24 3HG1 VAL 24 3.336 -0.081 -7.448 203 1HG2 VAL 24 1HG2 VAL 24 3.818 3.799 -8.667 204 2HG2 VAL 24 2HG2 VAL 24 4.461 3.774 -7.026 205 3HG2 VAL 24 3HG2 VAL 24 2.782 3.324 -7.321 206 H GLY 25 H GLY 25 7.051 0.422 -8.477 207 1HA GLY 25 2HA GLY 25 6.270 -2.309 -8.465 208 2HA GLY 25 1HA GLY 25 7.899 -1.739 -8.840 209 H ASP 26 H ASP 26 8.696 -0.608 -6.456 210 HA ASP 26 HA ASP 26 9.370 -2.907 -4.843 211 1HB ASP 26 2HB ASP 26 10.783 -0.835 -5.039 212 2HB ASP 26 1HB ASP 26 9.570 0.030 -4.095 213 H PHE 27 H PHE 27 6.981 -0.302 -4.565 214 HA PHE 27 HA PHE 27 6.047 -0.831 -1.927 215 1HB PHE 27 2HB PHE 27 5.439 1.185 -3.235 216 2HB PHE 27 1HB PHE 27 4.497 0.183 -4.335 217 HD1 PHE 27 HD1 PHE 27 2.244 0.675 -3.994 218 HD2 PHE 27 HD2 PHE 27 4.810 0.129 -0.593 219 HE1 PHE 27 HE1 PHE 27 0.285 0.858 -2.488 220 HE2 PHE 27 HE2 PHE 27 2.850 0.311 0.912 221 HZ PHE 27 HZ PHE 27 0.587 0.675 -0.035 222 H LYS 28 H LYS 28 5.110 -2.223 -5.072 223 HA LYS 28 HA LYS 28 3.014 -3.912 -3.981 224 1HB LYS 28 2HB LYS 28 4.511 -3.849 -6.607 225 2HB LYS 28 1HB LYS 28 3.343 -5.120 -6.239 226 1HG LYS 28 2HG LYS 28 1.697 -3.243 -5.673 227 2HG LYS 28 1HG LYS 28 2.846 -2.145 -6.436 228 1HD LYS 28 2HD LYS 28 2.529 -4.344 -8.203 229 2HD LYS 28 1HD LYS 28 0.911 -3.869 -7.689 230 1HE LYS 28 2HE LYS 28 1.118 -1.713 -8.559 231 2HE LYS 28 1HE LYS 28 2.880 -1.753 -8.504 232 1HZ LYS 28 1HZ LYS 28 2.586 -2.117 -10.701 233 2HZ LYS 28 2HZ LYS 28 1.054 -2.826 -10.510 234 3HZ LYS 28 3HZ LYS 28 2.459 -3.728 -10.191 235 H LYS 29 H LYS 29 6.485 -4.260 -4.539 236 HA LYS 29 HA LYS 29 6.681 -7.100 -4.232 237 1HB LYS 29 2HB LYS 29 8.595 -4.810 -3.813 238 2HB LYS 29 1HB LYS 29 9.063 -6.454 -3.382 239 1HG LYS 29 2HG LYS 29 8.586 -7.207 -5.670 240 2HG LYS 29 1HG LYS 29 8.078 -5.577 -6.111 241 1HD LYS 29 2HD LYS 29 10.404 -4.819 -5.321 242 2HD LYS 29 1HD LYS 29 10.841 -6.527 -5.354 243 1HE LYS 29 2HE LYS 29 10.959 -6.561 -7.612 244 2HE LYS 29 1HE LYS 29 9.440 -5.683 -7.781 245 1HZ LYS 29 1HZ LYS 29 10.850 -4.112 -8.556 246 2HZ LYS 29 2HZ LYS 29 12.174 -4.670 -7.650 247 3HZ LYS 29 3HZ LYS 29 10.970 -3.726 -6.908 248 H VAL 30 H VAL 30 6.889 -4.436 -1.860 249 HA VAL 30 HA VAL 30 7.327 -6.137 0.428 250 HB VAL 30 HB VAL 30 6.047 -3.382 0.391 251 1HG1 VAL 30 1HG1 VAL 30 5.818 -4.475 2.538 252 2HG1 VAL 30 2HG1 VAL 30 7.110 -3.283 2.676 253 3HG1 VAL 30 3HG1 VAL 30 7.503 -4.995 2.505 254 1HG2 VAL 30 1HG2 VAL 30 8.302 -3.572 -0.802 255 2HG2 VAL 30 2HG2 VAL 30 8.982 -4.041 0.754 256 3HG2 VAL 30 3HG2 VAL 30 8.251 -2.449 0.556 257 H LEU 31 H LEU 31 4.421 -4.869 -1.170 258 HA LEU 31 HA LEU 31 2.528 -5.752 0.813 259 1HB LEU 31 2HB LEU 31 2.434 -4.758 -1.977 260 2HB LEU 31 1HB LEU 31 1.098 -5.810 -1.513 261 HG LEU 31 HG LEU 31 1.883 -3.676 0.418 262 1HD1 LEU 31 1HD1 LEU 31 0.979 -3.185 -2.349 263 2HD1 LEU 31 2HD1 LEU 31 1.744 -2.085 -1.203 264 3HD1 LEU 31 3HD1 LEU 31 0.009 -2.384 -1.111 265 1HD2 LEU 31 1HD2 LEU 31 -0.838 -3.670 0.143 266 2HD2 LEU 31 2HD2 LEU 31 0.032 -4.718 1.261 267 3HD2 LEU 31 3HD2 LEU 31 -0.464 -5.330 -0.316 268 H SER 32 H SER 32 3.814 -7.244 -2.158 269 HA SER 32 HA SER 32 2.263 -9.557 -2.344 270 1HB SER 32 2HB SER 32 3.990 -8.974 -3.981 271 2HB SER 32 1HB SER 32 5.251 -9.289 -2.793 272 HG SER 32 HG SER 32 5.146 -11.251 -3.544 273 H LEU 33 H LEU 33 4.618 -8.809 0.151 274 HA LEU 33 HA LEU 33 5.094 -11.523 1.008 275 1HB LEU 33 2HB LEU 33 5.411 -8.832 2.341 276 2HB LEU 33 1HB LEU 33 5.760 -10.335 3.193 277 HG LEU 33 HG LEU 33 6.954 -10.118 0.491 278 1HD1 LEU 33 1HD1 LEU 33 8.791 -8.657 1.294 279 2HD1 LEU 33 2HD1 LEU 33 7.910 -8.394 2.799 280 3HD1 LEU 33 3HD1 LEU 33 7.247 -7.807 1.273 281 1HD2 LEU 33 1HD2 LEU 33 8.337 -11.668 1.390 282 2HD2 LEU 33 2HD2 LEU 33 7.265 -11.676 2.790 283 3HD2 LEU 33 3HD2 LEU 33 8.693 -10.642 2.780 284 H GLN 34 H GLN 34 2.807 -8.997 2.138 285 HA GLN 34 HA GLN 34 1.617 -10.840 4.082 286 1HB GLN 34 2HB GLN 34 0.148 -8.990 4.671 287 2HB GLN 34 1HB GLN 34 1.807 -8.410 4.550 288 1HG GLN 34 2HG GLN 34 0.892 -8.065 1.974 289 2HG GLN 34 1HG GLN 34 -0.547 -7.711 2.925 290 1HE2 GLN 34 1HE2 GLN 34 2.998 -6.968 3.116 291 2HE2 GLN 34 2HE2 GLN 34 2.773 -5.345 3.558 292 H ILE 35 H ILE 35 0.767 -9.688 0.825 293 HA ILE 35 HA ILE 35 -1.850 -11.087 1.026 294 HB ILE 35 HB ILE 35 -2.154 -10.170 -1.354 295 1HG1 ILE 35 2HG1 ILE 35 0.179 -8.426 -0.525 296 2HG1 ILE 35 1HG1 ILE 35 0.314 -9.740 -1.692 297 1HG2 ILE 35 1HG2 ILE 35 -3.253 -8.445 -0.398 298 2HG2 ILE 35 2HG2 ILE 35 -1.781 -7.788 0.320 299 3HG2 ILE 35 3HG2 ILE 35 -2.650 -9.091 1.129 300 1HD1 ILE 35 1HD1 ILE 35 -0.714 -7.046 -2.063 301 2HD1 ILE 35 2HD1 ILE 35 -1.911 -8.253 -2.534 302 3HD1 ILE 35 3HD1 ILE 35 -0.311 -8.260 -3.275 303 H GLY 36 H GLY 36 1.268 -11.399 -0.610 304 1HA GLY 36 2HA GLY 36 2.178 -13.277 -1.714 305 2HA GLY 36 1HA GLY 36 0.754 -14.196 -1.211 306 H THR 37 H THR 37 0.954 -11.204 -3.121 307 HA THR 37 HA THR 37 -0.559 -12.584 -5.299 308 HB THR 37 HB THR 37 -0.461 -9.608 -4.764 309 HG1 THR 37 HG1 THR 37 -2.308 -9.883 -3.572 310 1HG2 THR 37 1HG2 THR 37 -1.330 -9.930 -6.905 311 2HG2 THR 37 2HG2 THR 37 -2.785 -9.926 -5.911 312 3HG2 THR 37 3HG2 THR 37 -2.103 -11.454 -6.469 313 H GLN 38 H GLN 38 2.489 -11.305 -4.572 314 HA GLN 38 HA GLN 38 4.381 -10.934 -5.888 315 1HB GLN 38 2HB GLN 38 2.524 -12.209 -7.872 316 2HB GLN 38 1HB GLN 38 4.008 -11.457 -8.452 317 1HG GLN 38 2HG GLN 38 5.246 -13.176 -7.709 318 2HG GLN 38 1HG GLN 38 4.534 -13.061 -6.100 319 1HE2 GLN 38 1HE2 GLN 38 2.888 -14.575 -5.540 320 2HE2 GLN 38 2HE2 GLN 38 2.326 -15.775 -6.602 321 HA PRO 39 HA PRO 39 3.784 -6.835 -7.380 322 1HB PRO 39 2HB PRO 39 6.253 -6.481 -8.552 323 2HB PRO 39 1HB PRO 39 5.982 -6.437 -6.802 324 1HG PRO 39 2HG PRO 39 7.216 -8.592 -8.458 325 2HG PRO 39 1HG PRO 39 7.492 -8.189 -6.756 326 1HD PRO 39 2HD PRO 39 5.903 -10.320 -7.697 327 2HD PRO 39 1HD PRO 39 5.893 -9.669 -6.044 328 H ASN 40 H ASN 40 2.296 -8.274 -8.970 329 HA ASN 40 HA ASN 40 2.769 -7.259 -11.669 330 1HB ASN 40 2HB ASN 40 3.518 -9.981 -10.969 331 2HB ASN 40 1HB ASN 40 2.247 -9.976 -12.190 332 1HD2 ASN 40 1HD2 ASN 40 5.630 -9.300 -11.619 333 2HD2 ASN 40 2HD2 ASN 40 5.998 -8.799 -13.198 334 H LYS 41 H LYS 41 0.858 -9.467 -9.596 335 HA LYS 41 HA LYS 41 -1.576 -8.799 -11.178 336 1HB LYS 41 2HB LYS 41 -0.718 -11.189 -10.118 337 2HB LYS 41 1HB LYS 41 -1.866 -10.640 -8.895 338 1HG LYS 41 2HG LYS 41 -3.410 -10.117 -10.939 339 2HG LYS 41 1HG LYS 41 -2.347 -11.222 -11.809 340 1HD LYS 41 2HD LYS 41 -3.899 -12.741 -11.022 341 2HD LYS 41 1HD LYS 41 -2.781 -12.745 -9.657 342 1HE LYS 41 2HE LYS 41 -4.226 -10.804 -8.731 343 2HE LYS 41 1HE LYS 41 -5.428 -11.318 -9.913 344 1HZ LYS 41 1HZ LYS 41 -5.307 -12.319 -7.481 345 2HZ LYS 41 2HZ LYS 41 -4.240 -13.397 -8.247 346 3HZ LYS 41 3HZ LYS 41 -5.834 -13.230 -8.810 347 H ILE 42 H ILE 42 -0.031 -7.188 -8.895 348 HA ILE 42 HA ILE 42 -2.354 -6.770 -7.082 349 HB ILE 42 HB ILE 42 0.458 -5.635 -6.914 350 1HG1 ILE 42 2HG1 ILE 42 -0.786 -7.779 -5.175 351 2HG1 ILE 42 1HG1 ILE 42 0.171 -8.170 -6.604 352 1HG2 ILE 42 1HG2 ILE 42 -1.985 -5.492 -5.146 353 2HG2 ILE 42 2HG2 ILE 42 -0.979 -4.167 -5.733 354 3HG2 ILE 42 3HG2 ILE 42 -0.365 -5.258 -4.491 355 1HD1 ILE 42 1HD1 ILE 42 1.957 -8.076 -5.200 356 2HD1 ILE 42 2HD1 ILE 42 1.053 -7.195 -3.970 357 3HD1 ILE 42 3HD1 ILE 42 1.774 -6.326 -5.324 358 H VAL 43 H VAL 43 -3.649 -5.034 -7.330 359 HA VAL 43 HA VAL 43 -2.712 -2.787 -9.076 360 HB VAL 43 HB VAL 43 -5.556 -3.793 -8.701 361 1HG1 VAL 43 1HG1 VAL 43 -5.942 -2.272 -10.698 362 2HG1 VAL 43 2HG1 VAL 43 -4.322 -1.630 -10.427 363 3HG1 VAL 43 3HG1 VAL 43 -5.564 -1.438 -9.191 364 1HG2 VAL 43 1HG2 VAL 43 -3.695 -4.048 -11.089 365 2HG2 VAL 43 2HG2 VAL 43 -5.359 -4.624 -11.003 366 3HG2 VAL 43 3HG2 VAL 43 -4.117 -5.365 -9.994 367 H LEU 44 H LEU 44 -2.224 -1.130 -7.684 368 HA LEU 44 HA LEU 44 -3.864 -0.799 -5.224 369 1HB LEU 44 2HB LEU 44 -1.203 0.343 -6.098 370 2HB LEU 44 1HB LEU 44 -2.053 0.909 -4.659 371 HG LEU 44 HG LEU 44 -1.806 -2.033 -4.898 372 1HD1 LEU 44 1HD1 LEU 44 0.553 -0.203 -4.867 373 2HD1 LEU 44 2HD1 LEU 44 0.396 -1.827 -5.540 374 3HD1 LEU 44 3HD1 LEU 44 0.600 -1.609 -3.801 375 1HD2 LEU 44 1HD2 LEU 44 -1.307 -0.006 -2.692 376 2HD2 LEU 44 2HD2 LEU 44 -1.274 -1.756 -2.478 377 3HD2 LEU 44 3HD2 LEU 44 -2.778 -0.951 -2.924 378 H GLN 45 H GLN 45 -5.185 0.960 -4.907 379 HA GLN 45 HA GLN 45 -5.253 3.018 -7.078 380 1HB GLN 45 2HB GLN 45 -7.676 2.217 -5.466 381 2HB GLN 45 1HB GLN 45 -7.616 3.065 -7.009 382 1HG GLN 45 2HG GLN 45 -6.288 0.609 -7.437 383 2HG GLN 45 1HG GLN 45 -7.735 0.219 -6.508 384 1HE2 GLN 45 1HE2 GLN 45 -9.845 1.215 -7.407 385 2HE2 GLN 45 2HE2 GLN 45 -9.981 1.353 -9.093 386 H LYS 46 H LYS 46 -4.701 4.988 -6.308 387 HA LYS 46 HA LYS 46 -5.102 5.544 -3.401 388 1HB LYS 46 2HB LYS 46 -2.767 5.671 -4.502 389 2HB LYS 46 1HB LYS 46 -3.352 7.146 -5.272 390 1HG LYS 46 2HG LYS 46 -3.199 8.335 -3.353 391 2HG LYS 46 1HG LYS 46 -3.948 7.052 -2.404 392 1HD LYS 46 2HD LYS 46 -1.787 7.095 -1.517 393 2HD LYS 46 1HD LYS 46 -1.647 5.832 -2.739 394 1HE LYS 46 2HE LYS 46 -1.100 8.059 -4.228 395 2HE LYS 46 1HE LYS 46 -0.430 8.525 -2.665 396 1HZ LYS 46 1HZ LYS 46 0.775 6.397 -2.635 397 2HZ LYS 46 2HZ LYS 46 1.231 7.385 -3.940 398 3HZ LYS 46 3HZ LYS 46 0.200 6.059 -4.196 399 H GLY 47 H GLY 47 -7.295 6.210 -3.566 400 1HA GLY 47 2HA GLY 47 -9.004 7.796 -3.805 401 2HA GLY 47 1HA GLY 47 -7.739 8.982 -4.121 402 H GLY 48 H GLY 48 -8.813 6.064 -5.909 403 1HA GLY 48 2HA GLY 48 -9.655 5.859 -8.099 404 2HA GLY 48 1HA GLY 48 -9.930 7.601 -8.103 405 H SER 49 H SER 49 -6.878 5.807 -7.628 406 HA SER 49 HA SER 49 -5.881 6.799 -10.243 407 1HB SER 49 2HB SER 49 -5.278 8.125 -7.839 408 2HB SER 49 1HB SER 49 -3.855 7.145 -8.182 409 HG SER 49 HG SER 49 -3.574 9.003 -9.310 410 H VAL 50 H VAL 50 -4.932 5.081 -11.225 411 HA VAL 50 HA VAL 50 -4.280 2.679 -9.693 412 HB VAL 50 HB VAL 50 -5.266 2.590 -11.988 413 1HG1 VAL 50 1HG1 VAL 50 -2.605 3.132 -13.212 414 2HG1 VAL 50 2HG1 VAL 50 -3.530 4.533 -12.671 415 3HG1 VAL 50 3HG1 VAL 50 -4.221 3.424 -13.854 416 1HG2 VAL 50 1HG2 VAL 50 -4.367 0.525 -11.696 417 2HG2 VAL 50 2HG2 VAL 50 -2.845 1.171 -11.084 418 3HG2 VAL 50 3HG2 VAL 50 -3.126 1.075 -12.823 419 H LEU 51 H LEU 51 -2.320 2.149 -8.886 420 HA LEU 51 HA LEU 51 -0.031 3.952 -9.455 421 1HB LEU 51 2HB LEU 51 -0.106 1.723 -7.409 422 2HB LEU 51 1HB LEU 51 0.953 3.132 -7.442 423 HG LEU 51 HG LEU 51 -2.052 3.203 -7.021 424 1HD1 LEU 51 1HD1 LEU 51 -0.303 2.366 -5.184 425 2HD1 LEU 51 2HD1 LEU 51 -1.666 3.399 -4.759 426 3HD1 LEU 51 3HD1 LEU 51 -0.066 4.103 -4.982 427 1HD2 LEU 51 1HD2 LEU 51 -0.022 5.439 -6.754 428 2HD2 LEU 51 2HD2 LEU 51 -1.778 5.572 -6.653 429 3HD2 LEU 51 3HD2 LEU 51 -1.011 5.195 -8.195 430 H LYS 52 H LYS 52 1.361 3.320 -11.015 431 HA LYS 52 HA LYS 52 1.626 0.400 -11.592 432 1HB LYS 52 2HB LYS 52 1.133 2.530 -13.310 433 2HB LYS 52 1HB LYS 52 2.856 2.222 -13.522 434 1HG LYS 52 2HG LYS 52 1.852 0.761 -15.069 435 2HG LYS 52 1HG LYS 52 2.176 -0.276 -13.681 436 1HD LYS 52 2HD LYS 52 -0.341 0.859 -13.171 437 2HD LYS 52 1HD LYS 52 -0.371 0.431 -14.881 438 1HE LYS 52 2HE LYS 52 -0.477 -1.773 -14.411 439 2HE LYS 52 1HE LYS 52 0.890 -1.660 -13.304 440 1HZ LYS 52 1HZ LYS 52 -1.273 -2.360 -12.287 441 2HZ LYS 52 2HZ LYS 52 -1.851 -0.792 -12.582 442 3HZ LYS 52 3HZ LYS 52 -0.529 -1.025 -11.542 443 H ASP 53 H ASP 53 3.696 -0.522 -11.743 444 HA ASP 53 HA ASP 53 5.700 0.399 -9.964 445 1HB ASP 53 2HB ASP 53 7.152 -1.310 -10.999 446 2HB ASP 53 1HB ASP 53 5.535 -1.948 -10.709 447 H HIS 54 H HIS 54 5.160 1.154 -13.349 448 HA HIS 54 HA HIS 54 7.777 2.174 -13.958 449 1HB HIS 54 2HB HIS 54 5.060 2.814 -15.141 450 2HB HIS 54 1HB HIS 54 6.591 3.359 -15.824 451 HD1 HIS 54 HD1 HIS 54 4.398 0.373 -15.504 452 HD2 HIS 54 HD2 HIS 54 8.243 1.220 -16.876 453 HE1 HIS 54 HE1 HIS 54 5.154 -1.656 -16.816 454 H ILE 55 H ILE 55 5.193 3.470 -12.043 455 HA ILE 55 HA ILE 55 6.428 6.191 -12.153 456 HB ILE 55 HB ILE 55 3.681 5.369 -11.148 457 1HG1 ILE 55 2HG1 ILE 55 3.213 6.968 -13.275 458 2HG1 ILE 55 1HG1 ILE 55 4.734 6.243 -13.795 459 1HG2 ILE 55 1HG2 ILE 55 4.685 8.155 -11.756 460 2HG2 ILE 55 2HG2 ILE 55 4.834 7.445 -10.149 461 3HG2 ILE 55 3HG2 ILE 55 3.241 7.688 -10.860 462 1HD1 ILE 55 1HD1 ILE 55 2.733 4.373 -12.652 463 2HD1 ILE 55 2HD1 ILE 55 3.818 4.160 -14.026 464 3HD1 ILE 55 3HD1 ILE 55 2.325 5.080 -14.216 465 H SER 56 H SER 56 6.985 7.215 -10.178 466 HA SER 56 HA SER 56 7.619 5.349 -7.994 467 1HB SER 56 2HB SER 56 8.859 7.273 -7.037 468 2HB SER 56 1HB SER 56 9.332 6.951 -8.702 469 HG SER 56 HG SER 56 8.541 9.215 -7.761 470 H LEU 57 H LEU 57 7.063 5.821 -5.746 471 HA LEU 57 HA LEU 57 4.297 6.409 -5.331 472 1HB LEU 57 2HB LEU 57 6.668 6.211 -3.469 473 2HB LEU 57 1HB LEU 57 5.062 6.619 -2.868 474 HG LEU 57 HG LEU 57 5.459 4.213 -4.637 475 1HD1 LEU 57 1HD1 LEU 57 5.385 3.106 -2.170 476 2HD1 LEU 57 2HD1 LEU 57 6.280 4.580 -1.803 477 3HD1 LEU 57 3HD1 LEU 57 6.893 3.456 -3.016 478 1HD2 LEU 57 1HD2 LEU 57 3.461 5.030 -2.505 479 2HD2 LEU 57 2HD2 LEU 57 3.470 3.451 -3.288 480 3HD2 LEU 57 3HD2 LEU 57 3.167 4.905 -4.239 481 H GLU 58 H GLU 58 7.220 8.411 -5.011 482 HA GLU 58 HA GLU 58 6.061 10.700 -3.796 483 1HB GLU 58 2HB GLU 58 8.561 10.109 -4.490 484 2HB GLU 58 1HB GLU 58 8.142 11.046 -5.924 485 1HG GLU 58 2HG GLU 58 9.037 12.630 -4.386 486 2HG GLU 58 1HG GLU 58 7.289 12.848 -4.311 487 H ASP 59 H ASP 59 6.059 9.622 -7.172 488 HA ASP 59 HA ASP 59 5.069 12.046 -8.343 489 1HB ASP 59 2HB ASP 59 6.012 9.936 -9.516 490 2HB ASP 59 1HB ASP 59 4.385 9.279 -9.346 491 H TYR 60 H TYR 60 3.401 9.148 -7.078 492 HA TYR 60 HA TYR 60 0.737 10.215 -7.572 493 1HB TYR 60 2HB TYR 60 1.740 7.917 -5.870 494 2HB TYR 60 1HB TYR 60 0.032 8.303 -6.074 495 HD1 TYR 60 HD1 TYR 60 2.706 6.386 -7.334 496 HD2 TYR 60 HD2 TYR 60 -0.726 8.631 -8.616 497 HE1 TYR 60 HE1 TYR 60 2.675 5.122 -9.465 498 HE2 TYR 60 HE2 TYR 60 -0.755 7.368 -10.748 499 HH TYR 60 HH TYR 60 0.379 5.919 -12.054 500 H GLU 61 H GLU 61 3.112 10.688 -5.115 501 HA GLU 61 HA GLU 61 3.108 12.067 -3.236 502 1HB GLU 61 2HB GLU 61 1.020 13.096 -4.794 503 2HB GLU 61 1HB GLU 61 0.301 12.855 -3.202 504 1HG GLU 61 2HG GLU 61 1.246 15.045 -3.150 505 2HG GLU 61 1HG GLU 61 2.367 14.026 -2.247 506 H VAL 62 H VAL 62 3.286 9.914 -2.195 507 HA VAL 62 HA VAL 62 0.823 8.925 -0.877 508 HB VAL 62 HB VAL 62 2.555 7.375 -1.933 509 1HG1 VAL 62 1HG1 VAL 62 4.569 6.887 -0.656 510 2HG1 VAL 62 2HG1 VAL 62 4.118 8.068 0.572 511 3HG1 VAL 62 3HG1 VAL 62 4.545 8.605 -1.052 512 1HG2 VAL 62 1HG2 VAL 62 1.968 5.702 -0.460 513 2HG2 VAL 62 2HG2 VAL 62 0.845 6.949 0.081 514 3HG2 VAL 62 3HG2 VAL 62 2.347 6.674 0.961 515 H HIS 63 H HIS 63 0.512 9.022 1.376 516 HA HIS 63 HA HIS 63 2.520 10.642 2.901 517 1HB HIS 63 2HB HIS 63 -0.506 10.780 3.027 518 2HB HIS 63 1HB HIS 63 0.576 11.613 4.144 519 HD1 HIS 63 HD1 HIS 63 2.330 13.328 2.950 520 HD2 HIS 63 HD2 HIS 63 -0.962 12.175 0.666 521 HE1 HIS 63 HE1 HIS 63 2.155 14.996 1.053 522 H ASP 64 H ASP 64 2.303 10.343 5.311 523 HA ASP 64 HA ASP 64 2.360 7.534 5.987 524 1HB ASP 64 2HB ASP 64 3.474 9.713 7.113 525 2HB ASP 64 1HB ASP 64 2.057 9.562 8.151 526 H GLN 65 H GLN 65 0.834 6.294 7.065 527 HA GLN 65 HA GLN 65 -1.291 5.591 7.737 528 1HB GLN 65 2HB GLN 65 -1.473 8.486 8.637 529 2HB GLN 65 1HB GLN 65 -2.610 7.218 9.095 530 1HG GLN 65 2HG GLN 65 0.372 7.094 9.629 531 2HG GLN 65 1HG GLN 65 -0.820 7.629 10.812 532 1HE2 GLN 65 1HE2 GLN 65 0.632 4.830 9.339 533 2HE2 GLN 65 2HE2 GLN 65 -0.308 3.665 10.140 534 H THR 66 H THR 66 -0.979 6.390 5.002 535 HA THR 66 HA THR 66 -3.413 7.909 4.303 536 HB THR 66 HB THR 66 -1.218 8.173 3.059 537 HG1 THR 66 HG1 THR 66 -2.544 8.866 1.617 538 1HG2 THR 66 1HG2 THR 66 -0.399 6.489 1.649 539 2HG2 THR 66 2HG2 THR 66 -1.930 5.612 1.649 540 3HG2 THR 66 3HG2 THR 66 -0.897 5.583 3.078 541 H ASN 67 H ASN 67 -5.086 6.989 2.944 542 HA ASN 67 HA ASN 67 -5.495 4.089 3.475 543 1HB ASN 67 2HB ASN 67 -7.222 6.417 3.336 544 2HB ASN 67 1HB ASN 67 -7.791 5.155 2.245 545 1HD2 ASN 67 1HD2 ASN 67 -8.659 3.222 3.179 546 2HD2 ASN 67 2HD2 ASN 67 -8.834 3.004 4.853 547 H LEU 68 H LEU 68 -5.002 2.711 1.864 548 HA LEU 68 HA LEU 68 -5.145 3.695 -0.960 549 1HB LEU 68 2HB LEU 68 -3.101 2.223 0.522 550 2HB LEU 68 1HB LEU 68 -3.570 1.396 -0.965 551 HG LEU 68 HG LEU 68 -3.170 4.337 -1.166 552 1HD1 LEU 68 1HD1 LEU 68 -0.962 2.367 -0.569 553 2HD1 LEU 68 2HD1 LEU 68 -1.241 3.953 0.147 554 3HD1 LEU 68 3HD1 LEU 68 -0.658 3.827 -1.512 555 1HD2 LEU 68 1HD2 LEU 68 -3.413 2.094 -2.878 556 2HD2 LEU 68 2HD2 LEU 68 -1.754 2.668 -3.052 557 3HD2 LEU 68 3HD2 LEU 68 -3.102 3.766 -3.345 558 H GLU 69 H GLU 69 -5.806 2.083 -2.567 559 HA GLU 69 HA GLU 69 -7.741 0.110 -1.425 560 1HB GLU 69 2HB GLU 69 -7.985 2.096 -3.458 561 2HB GLU 69 1HB GLU 69 -8.114 0.522 -4.241 562 1HG GLU 69 2HG GLU 69 -10.326 0.971 -3.587 563 2HG GLU 69 1HG GLU 69 -9.732 -0.064 -2.288 564 H LEU 70 H LEU 70 -7.716 -2.031 -2.177 565 HA LEU 70 HA LEU 70 -5.332 -2.775 -3.825 566 1HB LEU 70 2HB LEU 70 -5.415 -3.594 -1.410 567 2HB LEU 70 1HB LEU 70 -6.789 -4.588 -1.887 568 HG LEU 70 HG LEU 70 -5.417 -5.707 -3.593 569 1HD1 LEU 70 1HD1 LEU 70 -3.524 -3.544 -2.847 570 2HD1 LEU 70 2HD1 LEU 70 -3.758 -4.351 -4.398 571 3HD1 LEU 70 3HD1 LEU 70 -2.806 -5.130 -3.134 572 1HD2 LEU 70 1HD2 LEU 70 -5.445 -6.519 -1.203 573 2HD2 LEU 70 2HD2 LEU 70 -3.935 -5.644 -0.947 574 3HD2 LEU 70 3HD2 LEU 70 -3.997 -6.977 -2.100 575 H TYR 71 H TYR 71 -5.641 -4.105 -5.578 576 HA TYR 71 HA TYR 71 -8.309 -5.301 -6.071 577 1HB TYR 71 2HB TYR 71 -7.320 -2.908 -7.382 578 2HB TYR 71 1HB TYR 71 -7.542 -4.207 -8.554 579 HD1 TYR 71 HD1 TYR 71 -9.776 -5.514 -8.474 580 HD2 TYR 71 HD2 TYR 71 -9.183 -1.702 -6.584 581 HE1 TYR 71 HE1 TYR 71 -12.230 -5.171 -8.397 582 HE2 TYR 71 HE2 TYR 71 -11.638 -1.359 -6.506 583 HH TYR 71 HH TYR 71 -13.821 -3.665 -6.752 584 H TYR 72 H TYR 72 -8.206 -7.062 -7.583 585 HA TYR 72 HA TYR 72 -5.420 -8.030 -8.066 586 1HB TYR 72 2HB TYR 72 -8.036 -9.556 -7.868 587 2HB TYR 72 1HB TYR 72 -6.470 -10.289 -8.218 588 HD1 TYR 72 HD1 TYR 72 -4.548 -9.212 -6.499 589 HD2 TYR 72 HD2 TYR 72 -8.709 -9.861 -5.649 590 HE1 TYR 72 HE1 TYR 72 -4.042 -9.285 -4.075 591 HE2 TYR 72 HE2 TYR 72 -8.199 -9.937 -3.222 592 HH TYR 72 HH TYR 72 -5.784 -8.753 -1.813 593 H LEU 73 HN LEU 73 -4.738 -8.385 -10.130 594 HA LEU 73 HA LEU 73 -6.363 -7.422 -12.342 595 1HB LEU 73 2HB LEU 73 -3.590 -8.045 -11.867 596 2HB LEU 73 1HB LEU 73 -4.121 -8.856 -13.341 597 HG LEU 73 HG LEU 73 -5.071 -6.071 -13.057 598 1HD1 LEU 73 1HD1 LEU 73 -2.131 -6.670 -13.521 599 2HD1 LEU 73 2HD1 LEU 73 -2.800 -5.871 -12.099 600 3HD1 LEU 73 3HD1 LEU 73 -2.897 -5.089 -13.676 601 1HD2 LEU 73 1HD2 LEU 73 -3.555 -7.417 -15.311 602 2HD2 LEU 73 2HD2 LEU 73 -4.639 -6.029 -15.416 603 3HD2 LEU 73 3HD2 LEU 73 -5.290 -7.632 -15.071 Start of MODEL 10 1 H MET 1 1H MET 1 11.613 5.784 5.891 2 HA MET 1 HA MET 1 9.577 4.915 4.664 3 1HB MET 1 2HB MET 1 11.249 3.810 6.563 4 2HB MET 1 1HB MET 1 9.651 3.475 7.229 5 1HG MET 1 2HG MET 1 9.353 1.826 5.732 6 2HG MET 1 1HG MET 1 9.582 2.965 4.406 7 1HE MET 1 1HE MET 1 11.650 -0.432 4.134 8 2HE MET 1 2HE MET 1 10.017 0.078 4.561 9 3HE MET 1 3HE MET 1 11.160 -0.361 5.831 10 H ILE 2 H ILE 2 7.354 4.595 4.770 11 HA ILE 2 HA ILE 2 5.953 5.685 7.179 12 HB ILE 2 HB ILE 2 4.187 6.536 5.676 13 1HG1 ILE 2 2HG1 ILE 2 6.036 5.921 3.362 14 2HG1 ILE 2 1HG1 ILE 2 4.772 4.795 3.856 15 1HG2 ILE 2 1HG2 ILE 2 7.018 7.442 5.082 16 2HG2 ILE 2 2HG2 ILE 2 5.905 8.115 6.274 17 3HG2 ILE 2 3HG2 ILE 2 5.587 8.327 4.552 18 1HD1 ILE 2 1HD1 ILE 2 3.855 7.582 3.594 19 2HD1 ILE 2 2HD1 ILE 2 3.116 6.094 3.003 20 3HD1 ILE 2 3HD1 ILE 2 4.410 6.861 2.082 21 H GLU 3 H GLU 3 3.727 4.788 7.439 22 HA GLU 3 HA GLU 3 3.583 1.968 6.438 23 1HB GLU 3 2HB GLU 3 3.739 2.781 9.052 24 2HB GLU 3 1HB GLU 3 1.993 2.694 8.827 25 1HG GLU 3 2HG GLU 3 3.804 0.442 7.948 26 2HG GLU 3 1HG GLU 3 3.200 0.543 9.601 27 H VAL 4 H VAL 4 2.084 1.889 4.828 28 HA VAL 4 HA VAL 4 -0.380 3.564 5.118 29 HB VAL 4 HB VAL 4 -0.594 3.417 2.664 30 1HG1 VAL 4 1HG1 VAL 4 0.623 5.319 3.504 31 2HG1 VAL 4 2HG1 VAL 4 1.497 4.718 2.095 32 3HG1 VAL 4 3HG1 VAL 4 2.086 4.357 3.718 33 1HG2 VAL 4 1HG2 VAL 4 2.066 2.473 2.056 34 2HG2 VAL 4 2HG2 VAL 4 0.517 1.858 1.478 35 3HG2 VAL 4 3HG2 VAL 4 1.202 1.247 2.983 36 H VAL 5 H VAL 5 -2.402 2.576 4.390 37 HA VAL 5 HA VAL 5 -2.368 -0.409 4.623 38 HB VAL 5 HB VAL 5 -4.651 -0.202 5.611 39 1HG1 VAL 5 1HG1 VAL 5 -2.563 1.433 7.082 40 2HG1 VAL 5 2HG1 VAL 5 -2.572 -0.329 7.008 41 3HG1 VAL 5 3HG1 VAL 5 -3.894 0.528 7.803 42 1HG2 VAL 5 1HG2 VAL 5 -4.436 2.453 4.643 43 2HG2 VAL 5 2HG2 VAL 5 -4.444 2.574 6.402 44 3HG2 VAL 5 3HG2 VAL 5 -5.768 1.759 5.568 45 H VAL 6 H VAL 6 -3.671 -1.576 3.175 46 HA VAL 6 HA VAL 6 -4.962 0.045 1.015 47 HB VAL 6 HB VAL 6 -4.336 -1.773 -0.565 48 1HG1 VAL 6 1HG1 VAL 6 -2.884 0.297 -0.003 49 2HG1 VAL 6 2HG1 VAL 6 -2.120 -1.032 -0.874 50 3HG1 VAL 6 3HG1 VAL 6 -1.846 -0.840 0.857 51 1HG2 VAL 6 1HG2 VAL 6 -4.145 -3.648 0.971 52 2HG2 VAL 6 2HG2 VAL 6 -2.854 -2.839 1.861 53 3HG2 VAL 6 3HG2 VAL 6 -2.575 -3.394 0.210 54 H ASN 7 H ASN 7 -7.034 -0.495 0.488 55 HA ASN 7 HA ASN 7 -8.223 -2.882 1.851 56 1HB ASN 7 2HB ASN 7 -9.346 -0.161 1.178 57 2HB ASN 7 1HB ASN 7 -10.409 -1.538 1.471 58 1HD2 ASN 7 1HD2 ASN 7 -7.886 0.488 3.009 59 2HD2 ASN 7 2HD2 ASN 7 -8.311 0.085 4.602 60 H ASP 8 H ASP 8 -9.300 -4.373 0.568 61 HA ASP 8 HA ASP 8 -8.970 -4.114 -2.333 62 1HB ASP 8 2HB ASP 8 -9.799 -6.290 -0.458 63 2HB ASP 8 1HB ASP 8 -10.292 -6.418 -2.146 64 H ARG 9 H ARG 9 -11.832 -4.833 -0.268 65 HA ARG 9 HA ARG 9 -13.458 -2.910 -1.741 66 1HB ARG 9 2HB ARG 9 -13.300 -5.035 -3.212 67 2HB ARG 9 1HB ARG 9 -14.321 -5.793 -1.991 68 1HG ARG 9 2HG ARG 9 -15.842 -4.949 -3.609 69 2HG ARG 9 1HG ARG 9 -15.892 -3.777 -2.292 70 1HD ARG 9 2HD ARG 9 -13.768 -3.048 -4.080 71 2HD ARG 9 1HD ARG 9 -15.235 -3.306 -5.024 72 HE ARG 9 HE ARG 9 -16.337 -1.695 -3.351 73 1HH1 ARG 9 1HH2 ARG 9 -14.698 -0.229 -5.365 74 2HH1 ARG 9 2HH2 ARG 9 -13.696 0.776 -4.372 75 1HH2 ARG 9 2HH1 ARG 9 -14.297 -1.043 -1.465 76 2HH2 ARG 9 1HH1 ARG 9 -13.467 0.313 -2.154 77 H LEU 10 H LEU 10 -14.053 -5.985 0.032 78 HA LEU 10 HA LEU 10 -15.314 -4.418 2.226 79 1HB LEU 10 2HB LEU 10 -16.717 -6.110 0.296 80 2HB LEU 10 1HB LEU 10 -16.977 -6.641 1.957 81 HG LEU 10 HG LEU 10 -17.139 -3.790 1.933 82 1HD1 LEU 10 1HD1 LEU 10 -18.819 -3.322 0.315 83 2HD1 LEU 10 2HD1 LEU 10 -19.082 -5.035 -0.020 84 3HD1 LEU 10 3HD1 LEU 10 -17.595 -4.250 -0.554 85 1HD2 LEU 10 1HD2 LEU 10 -18.981 -4.243 3.209 86 2HD2 LEU 10 2HD2 LEU 10 -18.370 -5.898 3.160 87 3HD2 LEU 10 3HD2 LEU 10 -19.633 -5.389 2.038 88 H GLY 11 H GLY 11 -14.693 -5.210 4.179 89 1HA GLY 11 2HA GLY 11 -13.730 -6.610 5.791 90 2HA GLY 11 1HA GLY 11 -14.382 -7.960 4.863 91 H LYS 12 H LYS 12 -12.013 -5.545 3.753 92 HA LYS 12 HA LYS 12 -9.861 -7.587 3.842 93 1HB LYS 12 2HB LYS 12 -11.229 -6.633 1.409 94 2HB LYS 12 1HB LYS 12 -9.470 -6.532 1.339 95 1HG LYS 12 2HG LYS 12 -10.308 -9.045 2.527 96 2HG LYS 12 1HG LYS 12 -11.031 -8.829 0.933 97 1HD LYS 12 2HD LYS 12 -8.734 -8.214 0.078 98 2HD LYS 12 1HD LYS 12 -8.090 -8.720 1.641 99 1HE LYS 12 2HE LYS 12 -9.623 -10.875 1.047 100 2HE LYS 12 1HE LYS 12 -9.173 -10.363 -0.580 101 1HZ LYS 12 1HZ LYS 12 -7.423 -11.183 1.649 102 2HZ LYS 12 2HZ LYS 12 -6.821 -10.218 0.384 103 3HZ LYS 12 3HZ LYS 12 -7.455 -11.761 0.051 104 H LYS 13 H LYS 13 -8.272 -6.522 4.908 105 HA LYS 13 HA LYS 13 -7.433 -3.859 3.915 106 1HB LYS 13 2HB LYS 13 -9.066 -3.610 5.877 107 2HB LYS 13 1HB LYS 13 -7.806 -4.331 6.879 108 1HG LYS 13 2HG LYS 13 -6.480 -2.372 5.376 109 2HG LYS 13 1HG LYS 13 -8.003 -1.618 5.845 110 1HD LYS 13 2HD LYS 13 -7.179 -1.289 7.913 111 2HD LYS 13 1HD LYS 13 -7.055 -3.037 8.119 112 1HE LYS 13 2HE LYS 13 -4.878 -2.321 6.477 113 2HE LYS 13 1HE LYS 13 -4.939 -1.092 7.741 114 1HZ LYS 13 1HZ LYS 13 -5.002 -2.862 9.394 115 2HZ LYS 13 2HZ LYS 13 -3.608 -2.971 8.431 116 3HZ LYS 13 3HZ LYS 13 -4.910 -4.032 8.168 117 H VAL 14 H VAL 14 -5.305 -4.082 3.501 118 HA VAL 14 HA VAL 14 -3.667 -5.870 5.265 119 HB VAL 14 HB VAL 14 -2.995 -5.091 2.417 120 1HG1 VAL 14 1HG1 VAL 14 -2.123 -7.432 4.141 121 2HG1 VAL 14 2HG1 VAL 14 -1.176 -5.964 3.889 122 3HG1 VAL 14 3HG1 VAL 14 -1.522 -7.035 2.530 123 1HG2 VAL 14 1HG2 VAL 14 -4.831 -7.208 3.472 124 2HG2 VAL 14 2HG2 VAL 14 -3.797 -7.615 2.101 125 3HG2 VAL 14 3HG2 VAL 14 -4.937 -6.274 1.979 126 H ARG 15 H ARG 15 -1.648 -5.061 5.982 127 HA ARG 15 HA ARG 15 -1.275 -2.117 5.624 128 1HB ARG 15 2HB ARG 15 0.102 -2.258 7.706 129 2HB ARG 15 1HB ARG 15 -1.572 -2.747 7.957 130 1HG ARG 15 2HG ARG 15 -0.984 -4.871 8.488 131 2HG ARG 15 1HG ARG 15 0.160 -4.975 7.152 132 1HD ARG 15 2HD ARG 15 1.176 -3.128 9.108 133 2HD ARG 15 1HD ARG 15 0.747 -4.640 9.907 134 HE ARG 15 HE ARG 15 2.216 -5.785 8.190 135 1HH1 ARG 15 1HH2 ARG 15 3.860 -4.141 10.124 136 2HH1 ARG 15 2HH2 ARG 15 4.911 -3.283 9.046 137 1HH2 ARG 15 2HH1 ARG 15 2.983 -3.938 6.224 138 2HH2 ARG 15 1HH1 ARG 15 4.411 -3.165 6.826 139 H VAL 16 H VAL 16 0.701 -1.336 4.890 140 HA VAL 16 HA VAL 16 2.961 -3.194 4.498 141 HB VAL 16 HB VAL 16 1.664 -3.579 2.485 142 1HG1 VAL 16 1HG1 VAL 16 1.614 -1.230 1.040 143 2HG1 VAL 16 2HG1 VAL 16 1.231 -0.678 2.671 144 3HG1 VAL 16 3HG1 VAL 16 0.241 -1.919 1.905 145 1HG2 VAL 16 1HG2 VAL 16 4.246 -2.147 2.392 146 2HG2 VAL 16 2HG2 VAL 16 3.355 -2.139 0.869 147 3HG2 VAL 16 3HG2 VAL 16 3.773 -3.670 1.638 148 H LYS 17 H LYS 17 4.896 -2.108 4.687 149 HA LYS 17 HA LYS 17 4.749 0.859 4.950 150 1HB LYS 17 2HB LYS 17 6.834 0.693 6.225 151 2HB LYS 17 1HB LYS 17 5.633 -0.405 6.898 152 1HG LYS 17 2HG LYS 17 6.659 -2.262 5.557 153 2HG LYS 17 1HG LYS 17 7.927 -1.144 5.056 154 1HD LYS 17 2HD LYS 17 8.823 -0.979 7.217 155 2HD LYS 17 1HD LYS 17 7.322 -1.508 7.983 156 1HE LYS 17 2HE LYS 17 7.833 -3.719 6.547 157 2HE LYS 17 1HE LYS 17 9.489 -3.139 6.735 158 1HZ LYS 17 1HZ LYS 17 8.947 -4.567 8.559 159 2HZ LYS 17 2HZ LYS 17 7.537 -3.686 8.906 160 3HZ LYS 17 3HZ LYS 17 9.066 -2.980 9.144 161 H CYS 18 H CYS 18 6.221 2.207 3.845 162 HA CYS 18 HA CYS 18 8.267 1.151 2.059 163 1HB CYS 18 2HB CYS 18 7.163 2.066 -0.029 164 2HB CYS 18 1HB CYS 18 6.388 0.627 0.631 165 HG CYS 18 HG CYS 18 5.154 3.436 0.543 166 H LEU 19 H LEU 19 9.467 2.915 1.006 167 HA LEU 19 HA LEU 19 9.325 5.420 2.568 168 1HB LEU 19 2HB LEU 19 11.393 3.929 1.251 169 2HB LEU 19 1HB LEU 19 11.339 5.542 0.543 170 HG LEU 19 HG LEU 19 11.195 5.291 3.525 171 1HD1 LEU 19 1HD1 LEU 19 13.608 4.778 1.797 172 2HD1 LEU 19 2HD1 LEU 19 13.076 3.916 3.242 173 3HD1 LEU 19 3HD1 LEU 19 13.794 5.521 3.387 174 1HD2 LEU 19 1HD2 LEU 19 10.946 7.494 2.512 175 2HD2 LEU 19 2HD2 LEU 19 12.420 7.264 1.569 176 3HD2 LEU 19 3HD2 LEU 19 12.510 7.419 3.324 177 H ALA 20 H ALA 20 9.024 7.488 1.593 178 HA ALA 20 HA ALA 20 7.160 7.613 -0.583 179 1HB ALA 20 1HB ALA 20 8.084 10.143 -0.521 180 2HB ALA 20 2HB ALA 20 8.700 9.587 1.036 181 3HB ALA 20 3HB ALA 20 6.970 9.515 0.695 182 H GLU 21 H GLU 21 10.654 7.576 -0.498 183 HA GLU 21 HA GLU 21 10.980 8.644 -3.206 184 1HB GLU 21 2HB GLU 21 13.357 8.030 -2.910 185 2HB GLU 21 1HB GLU 21 12.762 8.952 -1.530 186 1HG GLU 21 2HG GLU 21 13.559 7.274 -0.239 187 2HG GLU 21 1HG GLU 21 12.201 6.319 -0.830 188 H ASP 22 H ASP 22 10.378 5.532 -1.767 189 HA ASP 22 HA ASP 22 11.458 3.912 -3.892 190 1HB ASP 22 2HB ASP 22 9.627 3.470 -1.575 191 2HB ASP 22 1HB ASP 22 9.580 2.288 -2.882 192 H SER 23 H SER 23 10.304 2.887 -5.619 193 HA SER 23 HA SER 23 8.069 4.513 -6.649 194 1HB SER 23 2HB SER 23 8.402 3.231 -8.734 195 2HB SER 23 1HB SER 23 9.917 3.925 -8.166 196 HG SER 23 HG SER 23 9.931 1.627 -8.803 197 H VAL 24 H VAL 24 6.290 3.184 -7.846 198 HA VAL 24 HA VAL 24 4.813 1.702 -5.893 199 HB VAL 24 HB VAL 24 4.449 1.768 -8.902 200 1HG1 VAL 24 1HG1 VAL 24 2.804 0.277 -8.549 201 2HG1 VAL 24 2HG1 VAL 24 1.989 1.485 -7.556 202 3HG1 VAL 24 3HG1 VAL 24 3.083 0.319 -6.808 203 1HG2 VAL 24 1HG2 VAL 24 3.790 3.633 -6.685 204 2HG2 VAL 24 2HG2 VAL 24 2.534 3.379 -7.895 205 3HG2 VAL 24 3HG2 VAL 24 4.118 3.977 -8.384 206 H GLY 25 H GLY 25 7.161 0.715 -8.321 207 1HA GLY 25 2HA GLY 25 6.558 -2.069 -8.479 208 2HA GLY 25 1HA GLY 25 8.167 -1.376 -8.705 209 H ASP 26 H ASP 26 8.673 -0.254 -6.237 210 HA ASP 26 HA ASP 26 9.349 -2.558 -4.614 211 1HB ASP 26 2HB ASP 26 10.730 -0.489 -4.663 212 2HB ASP 26 1HB ASP 26 9.410 0.398 -3.904 213 H PHE 27 H PHE 27 6.796 -0.106 -4.555 214 HA PHE 27 HA PHE 27 5.707 -0.656 -1.976 215 1HB PHE 27 2HB PHE 27 5.098 1.282 -3.488 216 2HB PHE 27 1HB PHE 27 4.163 0.151 -4.462 217 HD1 PHE 27 HD1 PHE 27 4.574 0.334 -0.741 218 HD2 PHE 27 HD2 PHE 27 1.913 0.709 -4.093 219 HE1 PHE 27 HE1 PHE 27 2.655 0.576 0.807 220 HE2 PHE 27 HE2 PHE 27 -0.007 0.952 -2.542 221 HZ PHE 27 HZ PHE 27 0.364 0.884 -0.093 222 H LYS 28 H LYS 28 4.979 -2.050 -5.183 223 HA LYS 28 HA LYS 28 3.010 -3.928 -4.182 224 1HB LYS 28 2HB LYS 28 4.580 -3.745 -6.765 225 2HB LYS 28 1HB LYS 28 3.425 -5.042 -6.450 226 1HG LYS 28 2HG LYS 28 1.692 -3.278 -5.972 227 2HG LYS 28 1HG LYS 28 2.852 -2.069 -6.521 228 1HD LYS 28 2HD LYS 28 3.003 -3.270 -8.708 229 2HD LYS 28 1HD LYS 28 1.736 -4.367 -8.153 230 1HE LYS 28 2HE LYS 28 0.090 -2.799 -8.382 231 2HE LYS 28 1HE LYS 28 1.138 -1.476 -7.871 232 1HZ LYS 28 1HZ LYS 28 2.295 -1.835 -10.096 233 2HZ LYS 28 2HZ LYS 28 0.768 -1.088 -10.118 234 3HZ LYS 28 3HZ LYS 28 0.921 -2.728 -10.539 235 H LYS 29 H LYS 29 6.509 -3.957 -4.565 236 HA LYS 29 HA LYS 29 6.929 -6.791 -4.371 237 1HB LYS 29 2HB LYS 29 8.628 -4.364 -3.817 238 2HB LYS 29 1HB LYS 29 9.218 -5.973 -3.401 239 1HG LYS 29 2HG LYS 29 8.140 -6.166 -6.018 240 2HG LYS 29 1HG LYS 29 9.132 -4.707 -5.989 241 1HD LYS 29 2HD LYS 29 11.073 -5.867 -5.680 242 2HD LYS 29 1HD LYS 29 10.307 -7.077 -4.647 243 1HE LYS 29 2HE LYS 29 9.098 -7.622 -7.028 244 2HE LYS 29 1HE LYS 29 10.672 -7.057 -7.591 245 1HZ LYS 29 1HZ LYS 29 10.662 -8.933 -5.350 246 2HZ LYS 29 2HZ LYS 29 11.740 -8.799 -6.657 247 3HZ LYS 29 3HZ LYS 29 10.232 -9.554 -6.869 248 H VAL 30 H VAL 30 6.709 -4.222 -1.894 249 HA VAL 30 HA VAL 30 7.224 -6.028 0.328 250 HB VAL 30 HB VAL 30 5.857 -3.316 0.380 251 1HG1 VAL 30 1HG1 VAL 30 5.517 -4.429 2.465 252 2HG1 VAL 30 2HG1 VAL 30 6.886 -3.345 2.726 253 3HG1 VAL 30 3HG1 VAL 30 7.161 -5.070 2.472 254 1HG2 VAL 30 1HG2 VAL 30 8.752 -3.762 1.046 255 2HG2 VAL 30 2HG2 VAL 30 7.948 -2.290 0.495 256 3HG2 VAL 30 3HG2 VAL 30 8.282 -3.593 -0.646 257 H LEU 31 H LEU 31 4.312 -4.758 -1.269 258 HA LEU 31 HA LEU 31 2.413 -5.809 0.619 259 1HB LEU 31 2HB LEU 31 2.337 -4.636 -2.097 260 2HB LEU 31 1HB LEU 31 1.019 -5.750 -1.732 261 HG LEU 31 HG LEU 31 1.736 -3.727 0.345 262 1HD1 LEU 31 1HD1 LEU 31 0.216 -2.081 -0.770 263 2HD1 LEU 31 2HD1 LEU 31 0.212 -3.111 -2.202 264 3HD1 LEU 31 3HD1 LEU 31 1.712 -2.356 -1.663 265 1HD2 LEU 31 1HD2 LEU 31 -0.094 -5.610 0.377 266 2HD2 LEU 31 2HD2 LEU 31 -1.009 -4.486 -0.630 267 3HD2 LEU 31 3HD2 LEU 31 -0.499 -4.005 0.990 268 H SER 32 H SER 32 3.686 -7.106 -2.463 269 HA SER 32 HA SER 32 2.152 -9.470 -2.608 270 1HB SER 32 2HB SER 32 4.011 -10.386 -3.970 271 2HB SER 32 1HB SER 32 3.591 -8.745 -4.444 272 HG SER 32 HG SER 32 5.866 -9.093 -4.203 273 H LEU 33 H LEU 33 4.781 -8.711 -0.421 274 HA LEU 33 HA LEU 33 5.401 -11.472 0.255 275 1HB LEU 33 2HB LEU 33 6.302 -8.812 1.055 276 2HB LEU 33 1HB LEU 33 6.143 -9.892 2.438 277 HG LEU 33 HG LEU 33 8.400 -10.045 1.461 278 1HD1 LEU 33 1HD1 LEU 33 7.084 -12.609 0.641 279 2HD1 LEU 33 2HD1 LEU 33 6.954 -12.095 2.324 280 3HD1 LEU 33 3HD1 LEU 33 8.542 -12.354 1.602 281 1HD2 LEU 33 1HD2 LEU 33 7.783 -11.472 -0.955 282 2HD2 LEU 33 2HD2 LEU 33 8.695 -9.972 -0.770 283 3HD2 LEU 33 3HD2 LEU 33 6.945 -9.919 -0.988 284 H GLN 34 H GLN 34 3.185 -9.004 1.514 285 HA GLN 34 HA GLN 34 2.410 -10.631 3.827 286 1HB GLN 34 2HB GLN 34 1.467 -8.010 2.670 287 2HB GLN 34 1HB GLN 34 0.577 -8.805 3.968 288 1HG GLN 34 2HG GLN 34 1.999 -7.729 5.367 289 2HG GLN 34 1HG GLN 34 3.182 -8.939 4.872 290 1HE2 GLN 34 1HE2 GLN 34 1.843 -5.872 3.468 291 2HE2 GLN 34 2HE2 GLN 34 3.357 -5.270 2.993 292 H ILE 35 H ILE 35 0.758 -9.560 0.819 293 HA ILE 35 HA ILE 35 -1.507 -11.348 1.343 294 HB ILE 35 HB ILE 35 -2.179 -10.631 -1.038 295 1HG1 ILE 35 2HG1 ILE 35 0.013 -8.591 -0.575 296 2HG1 ILE 35 1HG1 ILE 35 0.177 -9.961 -1.673 297 1HG2 ILE 35 1HG2 ILE 35 -2.140 -8.071 0.151 298 2HG2 ILE 35 2HG2 ILE 35 -2.216 -9.230 1.480 299 3HG2 ILE 35 3HG2 ILE 35 -3.439 -9.262 0.209 300 1HD1 ILE 35 1HD1 ILE 35 -2.147 -9.012 -2.588 301 2HD1 ILE 35 2HD1 ILE 35 -0.602 -8.386 -3.163 302 3HD1 ILE 35 3HD1 ILE 35 -1.504 -7.508 -1.928 303 H GLY 36 H GLY 36 1.490 -11.564 -0.456 304 1HA GLY 36 2HA GLY 36 2.438 -13.417 -1.561 305 2HA GLY 36 1HA GLY 36 1.104 -14.393 -0.942 306 H THR 37 H THR 37 0.908 -11.467 -2.937 307 HA THR 37 HA THR 37 -0.546 -13.060 -5.009 308 HB THR 37 HB THR 37 -0.705 -10.063 -4.670 309 HG1 THR 37 HG1 THR 37 -2.280 -12.052 -3.392 310 1HG2 THR 37 1HG2 THR 37 -2.817 -11.992 -5.625 311 2HG2 THR 37 2HG2 THR 37 -1.598 -11.333 -6.717 312 3HG2 THR 37 3HG2 THR 37 -2.721 -10.251 -5.893 313 H GLN 38 H GLN 38 2.409 -11.524 -4.456 314 HA GLN 38 HA GLN 38 4.193 -11.004 -5.867 315 1HB GLN 38 2HB GLN 38 2.362 -12.401 -7.818 316 2HB GLN 38 1HB GLN 38 3.865 -11.660 -8.357 317 1HG GLN 38 2HG GLN 38 4.627 -13.790 -7.857 318 2HG GLN 38 1HG GLN 38 4.871 -13.004 -6.296 319 1HE2 GLN 38 1HE2 GLN 38 2.573 -15.095 -8.091 320 2HE2 GLN 38 2HE2 GLN 38 1.858 -15.766 -6.705 321 HA PRO 39 HA PRO 39 3.221 -7.012 -7.394 322 1HB PRO 39 2HB PRO 39 5.418 -6.569 -8.995 323 2HB PRO 39 1HB PRO 39 5.454 -6.504 -7.225 324 1HG PRO 39 2HG PRO 39 6.476 -8.636 -9.048 325 2HG PRO 39 1HG PRO 39 7.034 -8.180 -7.430 326 1HD PRO 39 2HD PRO 39 5.414 -10.404 -8.033 327 2HD PRO 39 1HD PRO 39 5.651 -9.707 -6.416 328 H ASN 40 H ASN 40 3.277 -9.703 -9.497 329 HA ASN 40 HA ASN 40 2.673 -8.175 -11.945 330 1HB ASN 40 2HB ASN 40 2.872 -11.127 -11.312 331 2HB ASN 40 1HB ASN 40 2.310 -10.537 -12.875 332 1HD2 ASN 40 1HD2 ASN 40 3.874 -9.384 -14.248 333 2HD2 ASN 40 2HD2 ASN 40 5.541 -9.489 -13.947 334 H LYS 41 H LYS 41 0.957 -9.957 -9.419 335 HA LYS 41 HA LYS 41 -1.598 -9.576 -10.911 336 1HB LYS 41 2HB LYS 41 -0.627 -11.563 -8.924 337 2HB LYS 41 1HB LYS 41 -2.329 -11.114 -8.822 338 1HG LYS 41 2HG LYS 41 -2.847 -12.100 -10.820 339 2HG LYS 41 1HG LYS 41 -1.314 -11.638 -11.557 340 1HD LYS 41 2HD LYS 41 -1.552 -13.811 -9.462 341 2HD LYS 41 1HD LYS 41 -1.600 -14.127 -11.197 342 1HE LYS 41 2HE LYS 41 0.622 -13.150 -11.476 343 2HE LYS 41 1HE LYS 41 0.672 -12.711 -9.770 344 1HZ LYS 41 1HZ LYS 41 1.885 -14.757 -10.187 345 2HZ LYS 41 2HZ LYS 41 0.494 -15.476 -10.850 346 3HZ LYS 41 3HZ LYS 41 0.536 -15.058 -9.203 347 H ILE 42 H ILE 42 0.116 -7.754 -8.844 348 HA ILE 42 HA ILE 42 -2.168 -7.085 -7.051 349 HB ILE 42 HB ILE 42 0.778 -6.397 -6.984 350 1HG1 ILE 42 2HG1 ILE 42 -1.000 -7.573 -4.835 351 2HG1 ILE 42 1HG1 ILE 42 -0.195 -8.581 -6.038 352 1HG2 ILE 42 1HG2 ILE 42 0.040 -5.189 -4.789 353 2HG2 ILE 42 2HG2 ILE 42 -1.544 -5.107 -5.558 354 3HG2 ILE 42 3HG2 ILE 42 -0.153 -4.339 -6.322 355 1HD1 ILE 42 1HD1 ILE 42 1.342 -8.560 -4.258 356 2HD1 ILE 42 2HD1 ILE 42 1.037 -6.862 -3.893 357 3HD1 ILE 42 3HD1 ILE 42 1.963 -7.304 -5.328 358 H VAL 43 H VAL 43 -3.399 -5.334 -7.485 359 HA VAL 43 HA VAL 43 -2.332 -3.262 -9.368 360 HB VAL 43 HB VAL 43 -5.210 -4.193 -9.058 361 1HG1 VAL 43 1HG1 VAL 43 -5.680 -2.719 -10.934 362 2HG1 VAL 43 2HG1 VAL 43 -3.972 -2.302 -11.082 363 3HG1 VAL 43 3HG1 VAL 43 -4.888 -1.779 -9.668 364 1HG2 VAL 43 1HG2 VAL 43 -4.398 -5.906 -10.346 365 2HG2 VAL 43 2HG2 VAL 43 -2.977 -4.989 -10.852 366 3HG2 VAL 43 3HG2 VAL 43 -4.534 -4.712 -11.638 367 H LEU 44 H LEU 44 -1.765 -1.629 -7.963 368 HA LEU 44 HA LEU 44 -3.609 -0.965 -5.723 369 1HB LEU 44 2HB LEU 44 -0.741 -0.212 -6.322 370 2HB LEU 44 1HB LEU 44 -1.668 0.541 -5.024 371 HG LEU 44 HG LEU 44 -1.710 -2.435 -5.131 372 1HD1 LEU 44 1HD1 LEU 44 0.461 -2.691 -4.131 373 2HD1 LEU 44 2HD1 LEU 44 0.684 -0.944 -4.032 374 3HD1 LEU 44 3HD1 LEU 44 0.684 -1.745 -5.604 375 1HD2 LEU 44 1HD2 LEU 44 -2.160 -2.217 -2.884 376 2HD2 LEU 44 2HD2 LEU 44 -2.673 -0.608 -3.396 377 3HD2 LEU 44 3HD2 LEU 44 -1.071 -0.843 -2.693 378 H GLN 45 H GLN 45 -4.605 1.027 -5.550 379 HA GLN 45 HA GLN 45 -4.043 3.123 -7.569 380 1HB GLN 45 2HB GLN 45 -6.640 3.320 -7.824 381 2HB GLN 45 1HB GLN 45 -5.788 2.091 -8.757 382 1HG GLN 45 2HG GLN 45 -6.501 0.347 -7.343 383 2HG GLN 45 1HG GLN 45 -6.894 1.451 -6.027 384 1HE2 GLN 45 1HE2 GLN 45 -8.879 2.798 -6.282 385 2HE2 GLN 45 2HE2 GLN 45 -10.109 2.298 -7.339 386 H LYS 46 H LYS 46 -5.018 5.215 -6.967 387 HA LYS 46 HA LYS 46 -5.281 5.461 -4.011 388 1HB LYS 46 2HB LYS 46 -4.420 7.279 -6.225 389 2HB LYS 46 1HB LYS 46 -5.143 8.016 -4.794 390 1HG LYS 46 2HG LYS 46 -3.444 6.247 -3.619 391 2HG LYS 46 1HG LYS 46 -2.545 6.614 -5.089 392 1HD LYS 46 2HD LYS 46 -2.209 8.816 -4.504 393 2HD LYS 46 1HD LYS 46 -3.732 8.923 -3.616 394 1HE LYS 46 2HE LYS 46 -2.733 7.436 -1.851 395 2HE LYS 46 1HE LYS 46 -1.193 7.534 -2.704 396 1HZ LYS 46 1HZ LYS 46 -1.838 9.204 -0.784 397 2HZ LYS 46 2HZ LYS 46 -2.549 10.045 -2.078 398 3HZ LYS 46 3HZ LYS 46 -0.889 9.683 -2.108 399 H GLY 47 H GLY 47 -7.480 4.579 -5.958 400 1HA GLY 47 2HA GLY 47 -9.841 4.807 -5.594 401 2HA GLY 47 1HA GLY 47 -9.558 6.399 -4.888 402 H GLY 48 H GLY 48 -8.972 4.773 -8.041 403 1HA GLY 48 2HA GLY 48 -10.350 5.637 -9.978 404 2HA GLY 48 1HA GLY 48 -10.008 7.254 -9.367 405 H SER 49 H SER 49 -7.172 6.502 -8.697 406 HA SER 49 HA SER 49 -6.105 6.503 -11.497 407 1HB SER 49 2HB SER 49 -5.584 8.206 -9.192 408 2HB SER 49 1HB SER 49 -4.100 7.485 -9.809 409 HG SER 49 HG SER 49 -4.449 9.314 -10.997 410 H VAL 50 H VAL 50 -4.962 4.701 -12.021 411 HA VAL 50 HA VAL 50 -4.198 2.772 -9.951 412 HB VAL 50 HB VAL 50 -3.670 2.761 -12.944 413 1HG1 VAL 50 1HG1 VAL 50 -3.478 0.225 -12.408 414 2HG1 VAL 50 2HG1 VAL 50 -3.219 0.747 -10.743 415 3HG1 VAL 50 3HG1 VAL 50 -2.105 1.259 -12.013 416 1HG2 VAL 50 1HG2 VAL 50 -6.102 2.586 -11.720 417 2HG2 VAL 50 2HG2 VAL 50 -5.608 0.892 -11.699 418 3HG2 VAL 50 3HG2 VAL 50 -5.709 1.763 -13.229 419 H LEU 51 H LEU 51 -2.220 2.586 -9.028 420 HA LEU 51 HA LEU 51 -0.146 4.561 -9.672 421 1HB LEU 51 2HB LEU 51 0.137 2.263 -7.728 422 2HB LEU 51 1HB LEU 51 0.955 3.821 -7.699 423 HG LEU 51 HG LEU 51 -1.994 3.330 -7.184 424 1HD1 LEU 51 1HD1 LEU 51 0.415 3.866 -5.484 425 2HD1 LEU 51 2HD1 LEU 51 -0.947 2.784 -5.187 426 3HD1 LEU 51 3HD1 LEU 51 -1.140 4.525 -4.976 427 1HD2 LEU 51 1HD2 LEU 51 -2.237 5.693 -6.899 428 2HD2 LEU 51 2HD2 LEU 51 -1.377 5.491 -8.425 429 3HD2 LEU 51 3HD2 LEU 51 -0.494 5.953 -6.970 430 H LYS 52 H LYS 52 1.442 4.198 -11.128 431 HA LYS 52 HA LYS 52 1.876 1.443 -12.136 432 1HB LYS 52 2HB LYS 52 1.993 4.093 -13.267 433 2HB LYS 52 1HB LYS 52 3.534 3.273 -13.513 434 1HG LYS 52 2HG LYS 52 0.857 2.005 -14.135 435 2HG LYS 52 1HG LYS 52 1.828 2.863 -15.332 436 1HD LYS 52 2HD LYS 52 3.727 1.226 -14.349 437 2HD LYS 52 1HD LYS 52 2.307 0.218 -14.050 438 1HE LYS 52 2HE LYS 52 1.690 0.232 -16.357 439 2HE LYS 52 1HE LYS 52 2.829 1.529 -16.728 440 1HZ LYS 52 1HZ LYS 52 4.627 -0.032 -16.045 441 2HZ LYS 52 2HZ LYS 52 3.788 -0.510 -17.442 442 3HZ LYS 52 3HZ LYS 52 3.468 -1.267 -15.953 443 H ASP 53 H ASP 53 3.935 0.463 -12.162 444 HA ASP 53 HA ASP 53 5.651 1.031 -9.908 445 1HB ASP 53 2HB ASP 53 6.321 -0.716 -12.286 446 2HB ASP 53 1HB ASP 53 6.972 -0.832 -10.652 447 H HIS 54 H HIS 54 5.632 2.138 -13.209 448 HA HIS 54 HA HIS 54 8.453 2.852 -13.314 449 1HB HIS 54 2HB HIS 54 6.038 3.399 -15.013 450 2HB HIS 54 1HB HIS 54 7.508 4.338 -15.271 451 HD1 HIS 54 HD1 HIS 54 6.093 1.805 -16.961 452 HD2 HIS 54 HD2 HIS 54 9.726 1.909 -14.925 453 HE1 HIS 54 HE1 HIS 54 7.536 -0.023 -17.964 454 H ILE 55 H ILE 55 5.802 4.227 -11.661 455 HA ILE 55 HA ILE 55 7.110 6.918 -11.671 456 HB ILE 55 HB ILE 55 4.254 6.116 -11.026 457 1HG1 ILE 55 2HG1 ILE 55 4.140 8.038 -12.947 458 2HG1 ILE 55 1HG1 ILE 55 5.673 7.275 -13.366 459 1HG2 ILE 55 1HG2 ILE 55 5.826 8.592 -10.479 460 2HG2 ILE 55 2HG2 ILE 55 4.466 7.905 -9.589 461 3HG2 ILE 55 3HG2 ILE 55 4.182 8.805 -11.080 462 1HD1 ILE 55 1HD1 ILE 55 4.361 5.038 -13.133 463 2HD1 ILE 55 2HD1 ILE 55 4.106 6.012 -14.581 464 3HD1 ILE 55 3HD1 ILE 55 2.923 6.049 -13.274 465 H SER 56 H SER 56 7.690 7.850 -9.706 466 HA SER 56 HA SER 56 8.173 6.033 -7.494 467 1HB SER 56 2HB SER 56 9.475 8.212 -8.329 468 2HB SER 56 1HB SER 56 8.433 8.983 -7.135 469 HG SER 56 HG SER 56 10.206 8.315 -6.026 470 H LEU 57 H LEU 57 7.311 6.211 -5.348 471 HA LEU 57 HA LEU 57 4.498 6.690 -5.164 472 1HB LEU 57 2HB LEU 57 6.657 6.391 -3.062 473 2HB LEU 57 1HB LEU 57 4.957 6.600 -2.644 474 HG LEU 57 HG LEU 57 5.845 4.454 -4.575 475 1HD1 LEU 57 1HD1 LEU 57 6.012 2.889 -2.748 476 2HD1 LEU 57 2HD1 LEU 57 5.470 4.104 -1.587 477 3HD1 LEU 57 3HD1 LEU 57 7.052 4.260 -2.354 478 1HD2 LEU 57 1HD2 LEU 57 3.494 4.490 -2.672 479 2HD2 LEU 57 2HD2 LEU 57 3.715 3.498 -4.114 480 3HD2 LEU 57 3HD2 LEU 57 3.401 5.227 -4.272 481 H GLU 58 H GLU 58 7.299 8.748 -4.546 482 HA GLU 58 HA GLU 58 6.030 10.852 -3.110 483 1HB GLU 58 2HB GLU 58 8.576 10.375 -4.062 484 2HB GLU 58 1HB GLU 58 8.050 11.726 -5.067 485 1HG GLU 58 2HG GLU 58 7.486 11.883 -2.138 486 2HG GLU 58 1HG GLU 58 9.153 12.117 -2.663 487 H ASP 59 H ASP 59 6.222 10.180 -6.593 488 HA ASP 59 HA ASP 59 5.111 12.644 -7.532 489 1HB ASP 59 2HB ASP 59 4.991 9.845 -8.697 490 2HB ASP 59 1HB ASP 59 4.464 11.291 -9.556 491 H TYR 60 H TYR 60 3.574 9.558 -6.601 492 HA TYR 60 HA TYR 60 0.876 10.470 -7.140 493 1HB TYR 60 2HB TYR 60 1.964 8.161 -5.505 494 2HB TYR 60 1HB TYR 60 0.242 8.440 -5.763 495 HD1 TYR 60 HD1 TYR 60 -0.424 8.889 -8.317 496 HD2 TYR 60 HD2 TYR 60 3.077 6.766 -7.010 497 HE1 TYR 60 HE1 TYR 60 -0.274 7.776 -10.526 498 HE2 TYR 60 HE2 TYR 60 3.225 5.652 -9.222 499 HH TYR 60 HH TYR 60 1.437 6.692 -11.927 500 H GLU 61 H GLU 61 3.090 11.026 -4.557 501 HA GLU 61 HA GLU 61 2.887 12.344 -2.643 502 1HB GLU 61 2HB GLU 61 0.889 13.311 -4.288 503 2HB GLU 61 1HB GLU 61 -0.005 12.864 -2.836 504 1HG GLU 61 2HG GLU 61 0.762 15.172 -2.632 505 2HG GLU 61 1HG GLU 61 1.627 14.166 -1.472 506 H VAL 62 H VAL 62 2.903 9.726 -2.181 507 HA VAL 62 HA VAL 62 0.527 8.858 -0.683 508 HB VAL 62 HB VAL 62 3.275 7.593 -0.971 509 1HG1 VAL 62 1HG1 VAL 62 0.714 6.699 0.354 510 2HG1 VAL 62 2HG1 VAL 62 2.356 6.670 0.999 511 3HG1 VAL 62 3HG1 VAL 62 1.881 5.525 -0.256 512 1HG2 VAL 62 1HG2 VAL 62 0.647 6.816 -2.272 513 2HG2 VAL 62 2HG2 VAL 62 2.248 6.165 -2.621 514 3HG2 VAL 62 3HG2 VAL 62 1.856 7.827 -3.064 515 H HIS 63 H HIS 63 0.182 9.575 1.354 516 HA HIS 63 HA HIS 63 2.469 10.592 2.953 517 1HB HIS 63 2HB HIS 63 -0.531 10.856 3.175 518 2HB HIS 63 1HB HIS 63 0.529 11.301 4.513 519 HD1 HIS 63 HD1 HIS 63 -0.508 12.352 1.078 520 HD2 HIS 63 HD2 HIS 63 2.198 13.576 4.002 521 HE1 HIS 63 HE1 HIS 63 0.308 14.647 0.384 522 H ASP 64 H ASP 64 2.381 10.047 5.366 523 HA ASP 64 HA ASP 64 2.446 7.169 5.685 524 1HB ASP 64 2HB ASP 64 3.074 7.629 8.000 525 2HB ASP 64 1HB ASP 64 3.956 8.717 6.931 526 H GLN 65 H GLN 65 0.994 5.829 6.757 527 HA GLN 65 HA GLN 65 -1.072 5.087 7.558 528 1HB GLN 65 2HB GLN 65 -0.428 7.470 9.025 529 2HB GLN 65 1HB GLN 65 -2.164 7.452 8.722 530 1HG GLN 65 2HG GLN 65 -1.632 6.271 10.819 531 2HG GLN 65 1HG GLN 65 -2.301 5.158 9.628 532 1HE2 GLN 65 1HE2 GLN 65 0.984 6.432 10.490 533 2HE2 GLN 65 2HE2 GLN 65 1.751 4.922 10.371 534 H THR 66 H THR 66 -0.912 6.211 4.863 535 HA THR 66 HA THR 66 -3.469 7.653 4.510 536 HB THR 66 HB THR 66 -1.380 8.256 3.209 537 HG1 THR 66 HG1 THR 66 -2.920 9.047 2.049 538 1HG2 THR 66 1HG2 THR 66 -0.258 6.665 2.097 539 2HG2 THR 66 2HG2 THR 66 -1.685 6.335 1.115 540 3HG2 THR 66 3HG2 THR 66 -1.435 5.463 2.627 541 H ASN 67 H ASN 67 -5.151 6.801 3.076 542 HA ASN 67 HA ASN 67 -5.349 3.839 3.273 543 1HB ASN 67 2HB ASN 67 -7.174 5.759 3.912 544 2HB ASN 67 1HB ASN 67 -7.658 5.395 2.256 545 1HD2 ASN 67 1HD2 ASN 67 -7.444 4.076 5.526 546 2HD2 ASN 67 2HD2 ASN 67 -8.274 2.632 5.193 547 H LEU 68 H LEU 68 -4.927 2.656 1.500 548 HA LEU 68 HA LEU 68 -5.198 3.944 -1.191 549 1HB LEU 68 2HB LEU 68 -3.104 2.214 0.022 550 2HB LEU 68 1HB LEU 68 -3.515 1.872 -1.657 551 HG LEU 68 HG LEU 68 -3.132 4.734 -0.931 552 1HD1 LEU 68 1HD1 LEU 68 -1.150 2.728 -0.330 553 2HD1 LEU 68 2HD1 LEU 68 -1.048 4.477 -0.121 554 3HD1 LEU 68 3HD1 LEU 68 -0.575 3.744 -1.654 555 1HD2 LEU 68 1HD2 LEU 68 -2.420 2.936 -3.267 556 2HD2 LEU 68 2HD2 LEU 68 -1.975 4.642 -3.186 557 3HD2 LEU 68 3HD2 LEU 68 -3.676 4.174 -3.215 558 H GLU 69 H GLU 69 -5.669 2.324 -2.958 559 HA GLU 69 HA GLU 69 -7.625 0.294 -1.971 560 1HB GLU 69 2HB GLU 69 -7.461 2.027 -4.391 561 2HB GLU 69 1HB GLU 69 -8.151 0.420 -4.609 562 1HG GLU 69 2HG GLU 69 -9.132 1.824 -2.211 563 2HG GLU 69 1HG GLU 69 -9.554 2.615 -3.729 564 H LEU 70 H LEU 70 -7.480 -1.852 -2.721 565 HA LEU 70 HA LEU 70 -5.047 -2.538 -4.315 566 1HB LEU 70 2HB LEU 70 -4.552 -3.042 -1.988 567 2HB LEU 70 1HB LEU 70 -6.076 -3.909 -1.810 568 HG LEU 70 HG LEU 70 -5.313 -5.542 -3.532 569 1HD1 LEU 70 1HD1 LEU 70 -2.555 -4.357 -3.262 570 2HD1 LEU 70 2HD1 LEU 70 -3.658 -3.777 -4.510 571 3HD1 LEU 70 3HD1 LEU 70 -3.166 -5.471 -4.486 572 1HD2 LEU 70 1HD2 LEU 70 -3.033 -5.791 -1.771 573 2HD2 LEU 70 2HD2 LEU 70 -4.512 -6.751 -1.808 574 3HD2 LEU 70 3HD2 LEU 70 -4.447 -5.267 -0.856 575 H TYR 71 H TYR 71 -5.343 -4.149 -5.833 576 HA TYR 71 HA TYR 71 -7.911 -5.641 -5.860 577 1HB TYR 71 2HB TYR 71 -6.924 -3.728 -7.964 578 2HB TYR 71 1HB TYR 71 -7.924 -5.106 -8.422 579 HD1 TYR 71 HD1 TYR 71 -7.952 -1.755 -7.233 580 HD2 TYR 71 HD2 TYR 71 -10.112 -5.464 -7.014 581 HE1 TYR 71 HE1 TYR 71 -9.977 -0.532 -6.492 582 HE2 TYR 71 HE2 TYR 71 -12.138 -4.241 -6.274 583 HH TYR 71 HH TYR 71 -12.713 -1.212 -6.693 584 H TYR 72 H TYR 72 -7.760 -7.652 -6.958 585 HA TYR 72 HA TYR 72 -4.955 -8.506 -7.486 586 1HB TYR 72 2HB TYR 72 -7.447 -10.181 -7.035 587 2HB TYR 72 1HB TYR 72 -5.804 -10.801 -7.209 588 HD1 TYR 72 HD1 TYR 72 -4.146 -9.030 -5.661 589 HD2 TYR 72 HD2 TYR 72 -8.119 -10.424 -4.802 590 HE1 TYR 72 HE1 TYR 72 -3.753 -8.660 -3.243 591 HE2 TYR 72 HE2 TYR 72 -7.724 -10.055 -2.381 592 HH TYR 72 HH TYR 72 -5.812 -8.249 -1.085 593 H LEU 73 HN LEU 73 -4.393 -8.382 -9.586 594 HA LEU 73 HA LEU 73 -6.023 -9.722 -11.620 595 1HB LEU 73 2HB LEU 73 -6.527 -7.031 -11.236 596 2HB LEU 73 1HB LEU 73 -5.331 -7.010 -12.530 597 HG LEU 73 HG LEU 73 -7.185 -9.116 -13.084 598 1HD1 LEU 73 1HD1 LEU 73 -9.256 -7.740 -13.326 599 2HD1 LEU 73 2HD1 LEU 73 -8.457 -6.438 -12.440 600 3HD1 LEU 73 3HD1 LEU 73 -8.785 -7.978 -11.642 601 1HD2 LEU 73 1HD2 LEU 73 -5.801 -7.741 -14.678 602 2HD2 LEU 73 2HD2 LEU 73 -6.900 -6.391 -14.391 603 3HD2 LEU 73 3HD2 LEU 73 -7.498 -7.871 -15.145 Start of MODEL 11 1 H MET 1 1H MET 1 10.617 6.715 5.634 2 HA MET 1 HA MET 1 9.623 4.762 5.020 3 1HB MET 1 2HB MET 1 11.068 3.720 7.137 4 2HB MET 1 1HB MET 1 9.399 3.474 7.651 5 1HG MET 1 2HG MET 1 8.891 2.120 5.812 6 2HG MET 1 1HG MET 1 10.206 2.780 4.841 7 1HE MET 1 1HE MET 1 10.679 -0.547 4.665 8 2HE MET 1 2HE MET 1 12.298 0.145 4.606 9 3HE MET 1 3HE MET 1 10.933 1.062 3.974 10 H ILE 2 H ILE 2 7.385 4.468 4.979 11 HA ILE 2 HA ILE 2 5.815 5.778 7.163 12 HB ILE 2 HB ILE 2 4.211 6.547 5.402 13 1HG1 ILE 2 2HG1 ILE 2 6.256 6.247 3.275 14 2HG1 ILE 2 1HG1 ILE 2 5.460 4.754 3.771 15 1HG2 ILE 2 1HG2 ILE 2 6.778 7.598 6.059 16 2HG2 ILE 2 2HG2 ILE 2 5.341 8.483 5.544 17 3HG2 ILE 2 3HG2 ILE 2 6.501 7.909 4.345 18 1HD1 ILE 2 1HD1 ILE 2 4.263 5.909 1.911 19 2HD1 ILE 2 2HD1 ILE 2 4.003 7.290 2.977 20 3HD1 ILE 2 3HD1 ILE 2 3.267 5.733 3.356 21 H GLU 3 H GLU 3 3.549 4.996 7.272 22 HA GLU 3 HA GLU 3 3.402 2.100 6.572 23 1HB GLU 3 2HB GLU 3 2.916 3.408 8.964 24 2HB GLU 3 1HB GLU 3 1.295 3.187 8.309 25 1HG GLU 3 2HG GLU 3 3.345 0.963 8.527 26 2HG GLU 3 1HG GLU 3 2.092 1.265 9.729 27 H VAL 4 H VAL 4 1.810 1.372 5.184 28 HA VAL 4 HA VAL 4 -0.204 3.383 4.248 29 HB VAL 4 HB VAL 4 0.905 1.194 2.489 30 1HG1 VAL 4 1HG1 VAL 4 0.224 2.987 0.758 31 2HG1 VAL 4 2HG1 VAL 4 -0.633 3.759 2.091 32 3HG1 VAL 4 3HG1 VAL 4 -1.073 2.128 1.587 33 1HG2 VAL 4 1HG2 VAL 4 2.691 2.504 1.791 34 2HG2 VAL 4 2HG2 VAL 4 2.626 2.976 3.487 35 3HG2 VAL 4 3HG2 VAL 4 1.903 4.011 2.256 36 H VAL 5 H VAL 5 -2.249 2.465 3.544 37 HA VAL 5 HA VAL 5 -2.763 -0.323 4.489 38 HB VAL 5 HB VAL 5 -4.642 2.013 4.968 39 1HG1 VAL 5 1HG1 VAL 5 -5.497 0.223 6.675 40 2HG1 VAL 5 2HG1 VAL 5 -4.621 -0.920 5.655 41 3HG1 VAL 5 3HG1 VAL 5 -5.927 0.050 4.974 42 1HG2 VAL 5 1HG2 VAL 5 -3.949 1.701 7.386 43 2HG2 VAL 5 2HG2 VAL 5 -2.694 2.384 6.352 44 3HG2 VAL 5 3HG2 VAL 5 -2.630 0.682 6.810 45 H VAL 6 H VAL 6 -3.350 -1.400 2.668 46 HA VAL 6 HA VAL 6 -4.852 0.057 0.553 47 HB VAL 6 HB VAL 6 -4.267 -1.827 -0.911 48 1HG1 VAL 6 1HG1 VAL 6 -1.635 -1.419 0.338 49 2HG1 VAL 6 2HG1 VAL 6 -2.539 0.073 0.084 50 3HG1 VAL 6 3HG1 VAL 6 -2.193 -0.991 -1.279 51 1HG2 VAL 6 1HG2 VAL 6 -2.940 -2.971 1.571 52 2HG2 VAL 6 2HG2 VAL 6 -2.773 -3.624 -0.058 53 3HG2 VAL 6 3HG2 VAL 6 -4.344 -3.644 0.742 54 H ASN 7 H ASN 7 -6.937 -0.479 0.018 55 HA ASN 7 HA ASN 7 -8.270 -2.546 1.713 56 1HB ASN 7 2HB ASN 7 -9.637 -0.407 0.061 57 2HB ASN 7 1HB ASN 7 -10.318 -1.353 1.384 58 1HD2 ASN 7 1HD2 ASN 7 -9.150 -0.992 3.596 59 2HD2 ASN 7 2HD2 ASN 7 -8.620 0.585 3.930 60 H ASP 8 H ASP 8 -8.879 -4.411 0.731 61 HA ASP 8 HA ASP 8 -8.460 -4.806 -2.108 62 1HB ASP 8 2HB ASP 8 -9.548 -6.507 0.125 63 2HB ASP 8 1HB ASP 8 -9.664 -7.051 -1.549 64 H ARG 9 H ARG 9 -11.468 -5.140 -0.162 65 HA ARG 9 HA ARG 9 -12.965 -3.933 -2.439 66 1HB ARG 9 2HB ARG 9 -13.312 -6.672 -1.278 67 2HB ARG 9 1HB ARG 9 -14.757 -5.790 -1.773 68 1HG ARG 9 2HG ARG 9 -14.318 -6.574 -3.854 69 2HG ARG 9 1HG ARG 9 -13.039 -5.362 -3.896 70 1HD ARG 9 2HD ARG 9 -11.777 -7.356 -2.538 71 2HD ARG 9 1HD ARG 9 -12.847 -8.302 -3.575 72 HE ARG 9 HE ARG 9 -11.710 -6.490 -5.324 73 1HH1 ARG 9 1HH2 ARG 9 -11.078 -9.437 -5.361 74 2HH1 ARG 9 2HH2 ARG 9 -9.359 -9.435 -5.150 75 1HH2 ARG 9 2HH1 ARG 9 -9.237 -6.151 -4.013 76 2HH2 ARG 9 1HH1 ARG 9 -8.313 -7.570 -4.383 77 H LEU 10 H LEU 10 -13.747 -5.443 0.725 78 HA LEU 10 HA LEU 10 -14.496 -2.860 1.878 79 1HB LEU 10 2HB LEU 10 -16.462 -4.153 0.400 80 2HB LEU 10 1HB LEU 10 -16.804 -4.659 2.054 81 HG LEU 10 HG LEU 10 -16.143 -1.831 1.953 82 1HD1 LEU 10 1HD1 LEU 10 -18.635 -1.570 0.864 83 2HD1 LEU 10 2HD1 LEU 10 -17.991 -2.906 -0.091 84 3HD1 LEU 10 3HD1 LEU 10 -17.137 -1.363 -0.044 85 1HD2 LEU 10 1HD2 LEU 10 -18.884 -2.743 2.610 86 2HD2 LEU 10 2HD2 LEU 10 -17.772 -1.756 3.556 87 3HD2 LEU 10 3HD2 LEU 10 -17.596 -3.511 3.539 88 H GLY 11 H GLY 11 -13.490 -3.148 3.813 89 1HA GLY 11 2HA GLY 11 -13.539 -4.019 6.072 90 2HA GLY 11 1HA GLY 11 -14.232 -5.517 5.451 91 H LYS 12 H LYS 12 -12.534 -6.289 3.478 92 HA LYS 12 HA LYS 12 -10.198 -7.191 4.957 93 1HB LYS 12 2HB LYS 12 -11.534 -8.418 3.080 94 2HB LYS 12 1HB LYS 12 -10.526 -7.483 1.976 95 1HG LYS 12 2HG LYS 12 -8.505 -8.355 3.189 96 2HG LYS 12 1HG LYS 12 -9.574 -9.405 4.119 97 1HD LYS 12 2HD LYS 12 -9.476 -10.911 2.453 98 2HD LYS 12 1HD LYS 12 -10.290 -9.753 1.401 99 1HE LYS 12 2HE LYS 12 -7.834 -8.725 1.242 100 2HE LYS 12 1HE LYS 12 -7.377 -10.381 1.636 101 1HZ LYS 12 1HZ LYS 12 -8.549 -11.192 -0.242 102 2HZ LYS 12 2HZ LYS 12 -7.596 -9.896 -0.783 103 3HZ LYS 12 3HZ LYS 12 -9.262 -9.683 -0.547 104 H LYS 13 H LYS 13 -8.296 -6.125 5.112 105 HA LYS 13 HA LYS 13 -7.341 -4.448 2.862 106 1HB LYS 13 2HB LYS 13 -6.918 -2.511 4.271 107 2HB LYS 13 1HB LYS 13 -8.626 -2.932 4.392 108 1HG LYS 13 2HG LYS 13 -7.990 -4.303 6.462 109 2HG LYS 13 1HG LYS 13 -6.430 -3.483 6.397 110 1HD LYS 13 2HD LYS 13 -7.289 -1.580 7.253 111 2HD LYS 13 1HD LYS 13 -8.659 -1.613 6.141 112 1HE LYS 13 2HE LYS 13 -9.312 -3.679 7.792 113 2HE LYS 13 1HE LYS 13 -8.455 -2.625 8.917 114 1HZ LYS 13 1HZ LYS 13 -9.886 -0.791 8.182 115 2HZ LYS 13 2HZ LYS 13 -10.779 -2.060 8.871 116 3HZ LYS 13 3HZ LYS 13 -10.744 -1.861 7.184 117 H VAL 14 H VAL 14 -5.030 -4.054 2.966 118 HA VAL 14 HA VAL 14 -3.593 -5.835 4.902 119 HB VAL 14 HB VAL 14 -2.654 -5.175 2.096 120 1HG1 VAL 14 1HG1 VAL 14 -0.810 -5.947 3.307 121 2HG1 VAL 14 2HG1 VAL 14 -1.444 -7.446 2.627 122 3HG1 VAL 14 3HG1 VAL 14 -1.790 -7.023 4.305 123 1HG2 VAL 14 1HG2 VAL 14 -3.694 -7.081 1.249 124 2HG2 VAL 14 2HG2 VAL 14 -4.915 -6.525 2.392 125 3HG2 VAL 14 3HG2 VAL 14 -3.827 -7.840 2.835 126 H ARG 15 H ARG 15 -1.659 -5.014 5.789 127 HA ARG 15 HA ARG 15 -1.253 -2.082 5.412 128 1HB ARG 15 2HB ARG 15 -0.155 -2.106 7.606 129 2HB ARG 15 1HB ARG 15 -1.755 -2.835 7.730 130 1HG ARG 15 2HG ARG 15 -0.693 -4.570 8.734 131 2HG ARG 15 1HG ARG 15 -0.165 -5.008 7.111 132 1HD ARG 15 2HD ARG 15 1.909 -4.861 8.081 133 2HD ARG 15 1HD ARG 15 1.710 -3.156 7.683 134 HE ARG 15 HE ARG 15 1.111 -4.289 10.388 135 1HH1 ARG 15 1HH2 ARG 15 3.752 -2.974 10.031 136 2HH1 ARG 15 2HH2 ARG 15 3.428 -1.341 10.510 137 1HH2 ARG 15 2HH1 ARG 15 -0.020 -1.669 10.246 138 2HH2 ARG 15 1HH1 ARG 15 1.287 -0.601 10.633 139 H VAL 16 H VAL 16 0.744 -1.310 4.745 140 HA VAL 16 HA VAL 16 3.038 -3.166 4.587 141 HB VAL 16 HB VAL 16 1.855 -3.553 2.478 142 1HG1 VAL 16 1HG1 VAL 16 1.966 -0.544 2.278 143 2HG1 VAL 16 2HG1 VAL 16 0.567 -1.604 2.127 144 3HG1 VAL 16 3HG1 VAL 16 1.779 -1.557 0.848 145 1HG2 VAL 16 1HG2 VAL 16 4.542 -2.528 2.704 146 2HG2 VAL 16 2HG2 VAL 16 3.867 -2.067 1.141 147 3HG2 VAL 16 3HG2 VAL 16 3.921 -3.766 1.613 148 H LYS 17 H LYS 17 4.917 -2.083 4.993 149 HA LYS 17 HA LYS 17 4.766 0.892 5.102 150 1HB LYS 17 2HB LYS 17 6.706 0.738 6.649 151 2HB LYS 17 1HB LYS 17 5.315 -0.171 7.234 152 1HG LYS 17 2HG LYS 17 6.836 -1.928 5.579 153 2HG LYS 17 1HG LYS 17 7.961 -1.136 6.681 154 1HD LYS 17 2HD LYS 17 7.241 -2.415 8.383 155 2HD LYS 17 1HD LYS 17 5.589 -1.845 8.141 156 1HE LYS 17 2HE LYS 17 6.310 -3.728 6.061 157 2HE LYS 17 1HE LYS 17 6.574 -4.445 7.654 158 1HZ LYS 17 1HZ LYS 17 4.078 -2.996 6.993 159 2HZ LYS 17 2HZ LYS 17 4.359 -4.097 8.262 160 3HZ LYS 17 3HZ LYS 17 4.268 -4.647 6.655 161 H CYS 18 H CYS 18 6.146 2.147 3.913 162 HA CYS 18 HA CYS 18 8.566 1.055 2.668 163 1HB CYS 18 2HB CYS 18 7.837 1.534 0.348 164 2HB CYS 18 1HB CYS 18 6.841 0.280 1.086 165 HG CYS 18 HG CYS 18 4.888 1.903 1.260 166 H LEU 19 H LEU 19 9.556 2.873 1.195 167 HA LEU 19 HA LEU 19 9.323 5.405 2.707 168 1HB LEU 19 2HB LEU 19 11.334 4.182 0.871 169 2HB LEU 19 1HB LEU 19 11.256 5.942 0.928 170 HG LEU 19 HG LEU 19 11.106 4.952 3.612 171 1HD1 LEU 19 1HD1 LEU 19 13.608 4.035 2.183 172 2HD1 LEU 19 2HD1 LEU 19 12.247 2.951 2.476 173 3HD1 LEU 19 3HD1 LEU 19 13.105 3.678 3.834 174 1HD2 LEU 19 1HD2 LEU 19 12.024 7.149 2.530 175 2HD2 LEU 19 2HD2 LEU 19 13.525 6.238 2.357 176 3HD2 LEU 19 3HD2 LEU 19 12.835 6.507 3.958 177 H ALA 20 H ALA 20 8.706 7.372 1.762 178 HA ALA 20 HA ALA 20 6.805 7.273 -0.389 179 1HB ALA 20 1HB ALA 20 6.908 9.015 1.450 180 2HB ALA 20 2HB ALA 20 6.688 9.667 -0.173 181 3HB ALA 20 3HB ALA 20 8.274 9.732 0.596 182 H GLU 21 H GLU 21 10.269 7.616 -0.345 183 HA GLU 21 HA GLU 21 10.484 8.836 -2.989 184 1HB GLU 21 2HB GLU 21 12.901 8.339 -2.754 185 2HB GLU 21 1HB GLU 21 12.271 9.164 -1.331 186 1HG GLU 21 2HG GLU 21 13.161 7.479 -0.113 187 2HG GLU 21 1HG GLU 21 11.872 6.463 -0.754 188 H ASP 22 H ASP 22 10.197 5.600 -1.703 189 HA ASP 22 HA ASP 22 11.326 4.163 -3.903 190 1HB ASP 22 2HB ASP 22 9.556 3.524 -1.604 191 2HB ASP 22 1HB ASP 22 9.465 2.425 -2.979 192 H SER 23 H SER 23 10.181 3.033 -5.619 193 HA SER 23 HA SER 23 7.962 4.643 -6.706 194 1HB SER 23 2HB SER 23 8.320 3.333 -8.758 195 2HB SER 23 1HB SER 23 9.841 3.997 -8.173 196 HG SER 23 HG SER 23 9.935 1.745 -8.756 197 H VAL 24 H VAL 24 6.207 3.259 -7.910 198 HA VAL 24 HA VAL 24 4.685 1.840 -5.940 199 HB VAL 24 HB VAL 24 4.382 1.775 -8.959 200 1HG1 VAL 24 1HG1 VAL 24 1.942 1.621 -7.412 201 2HG1 VAL 24 2HG1 VAL 24 3.041 0.325 -6.941 202 3HG1 VAL 24 3HG1 VAL 24 2.555 0.500 -8.628 203 1HG2 VAL 24 1HG2 VAL 24 3.460 3.697 -6.823 204 2HG2 VAL 24 2HG2 VAL 24 2.566 3.525 -8.333 205 3HG2 VAL 24 3HG2 VAL 24 4.246 4.056 -8.360 206 H GLY 25 H GLY 25 7.039 0.780 -8.340 207 1HA GLY 25 2HA GLY 25 6.423 -2.002 -8.416 208 2HA GLY 25 1HA GLY 25 8.029 -1.321 -8.687 209 H ASP 26 H ASP 26 8.546 -0.132 -6.232 210 HA ASP 26 HA ASP 26 9.357 -2.359 -4.599 211 1HB ASP 26 2HB ASP 26 10.530 -0.161 -4.615 212 2HB ASP 26 1HB ASP 26 9.123 0.579 -3.852 213 H PHE 27 H PHE 27 6.638 -0.084 -4.458 214 HA PHE 27 HA PHE 27 5.564 -0.841 -1.923 215 1HB PHE 27 2HB PHE 27 4.880 1.140 -3.375 216 2HB PHE 27 1HB PHE 27 3.971 0.002 -4.364 217 HD1 PHE 27 HD1 PHE 27 2.232 -1.501 -3.149 218 HD2 PHE 27 HD2 PHE 27 3.918 2.061 -1.439 219 HE1 PHE 27 HE1 PHE 27 0.332 -1.362 -1.563 220 HE2 PHE 27 HE2 PHE 27 2.017 2.197 0.145 221 HZ PHE 27 HZ PHE 27 0.224 0.486 0.084 222 H LYS 28 H LYS 28 4.943 -2.086 -5.213 223 HA LYS 28 HA LYS 28 3.007 -4.066 -4.417 224 1HB LYS 28 2HB LYS 28 4.739 -3.691 -6.862 225 2HB LYS 28 1HB LYS 28 3.697 -5.103 -6.685 226 1HG LYS 28 2HG LYS 28 1.782 -3.493 -6.235 227 2HG LYS 28 1HG LYS 28 2.863 -2.194 -6.741 228 1HD LYS 28 2HD LYS 28 3.232 -3.842 -8.823 229 2HD LYS 28 1HD LYS 28 1.608 -4.357 -8.367 230 1HE LYS 28 2HE LYS 28 0.843 -2.580 -9.530 231 2HE LYS 28 1HE LYS 28 1.486 -1.573 -8.233 232 1HZ LYS 28 1HZ LYS 28 3.561 -1.391 -9.401 233 2HZ LYS 28 2HZ LYS 28 2.303 -0.933 -10.447 234 3HZ LYS 28 3HZ LYS 28 3.035 -2.458 -10.609 235 H LYS 29 H LYS 29 6.541 -4.083 -4.658 236 HA LYS 29 HA LYS 29 6.889 -6.933 -4.438 237 1HB LYS 29 2HB LYS 29 8.704 -4.589 -3.825 238 2HB LYS 29 1HB LYS 29 9.224 -6.265 -3.644 239 1HG LYS 29 2HG LYS 29 9.072 -6.699 -5.943 240 2HG LYS 29 1HG LYS 29 7.972 -5.350 -6.223 241 1HD LYS 29 2HD LYS 29 9.763 -4.129 -6.839 242 2HD LYS 29 1HD LYS 29 10.286 -4.177 -5.155 243 1HE LYS 29 2HE LYS 29 11.164 -6.596 -5.913 244 2HE LYS 29 1HE LYS 29 11.230 -5.787 -7.480 245 1HZ LYS 29 1HZ LYS 29 12.644 -4.122 -6.606 246 2HZ LYS 29 2HZ LYS 29 13.290 -5.610 -6.102 247 3HZ LYS 29 3HZ LYS 29 12.413 -4.646 -5.010 248 H VAL 30 H VAL 30 6.948 -4.318 -1.985 249 HA VAL 30 HA VAL 30 7.389 -6.131 0.234 250 HB VAL 30 HB VAL 30 6.212 -3.332 0.298 251 1HG1 VAL 30 1HG1 VAL 30 7.274 -5.250 2.346 252 2HG1 VAL 30 2HG1 VAL 30 5.885 -4.168 2.444 253 3HG1 VAL 30 3HG1 VAL 30 7.519 -3.521 2.595 254 1HG2 VAL 30 1HG2 VAL 30 8.945 -3.387 1.094 255 2HG2 VAL 30 2HG2 VAL 30 8.251 -2.589 -0.317 256 3HG2 VAL 30 3HG2 VAL 30 8.841 -4.246 -0.443 257 H LEU 31 H LEU 31 4.504 -4.664 -1.237 258 HA LEU 31 HA LEU 31 2.635 -5.618 0.740 259 1HB LEU 31 2HB LEU 31 2.116 -3.773 -0.826 260 2HB LEU 31 1HB LEU 31 2.178 -4.906 -2.175 261 HG LEU 31 HG LEU 31 0.366 -6.240 -0.965 262 1HD1 LEU 31 1HD1 LEU 31 -1.003 -4.869 0.636 263 2HD1 LEU 31 2HD1 LEU 31 0.285 -3.664 0.636 264 3HD1 LEU 31 3HD1 LEU 31 0.593 -5.286 1.258 265 1HD2 LEU 31 1HD2 LEU 31 -1.429 -4.715 -1.749 266 2HD2 LEU 31 2HD2 LEU 31 -0.113 -4.821 -2.918 267 3HD2 LEU 31 3HD2 LEU 31 -0.250 -3.408 -1.872 268 H SER 32 H SER 32 3.543 -6.864 -2.494 269 HA SER 32 HA SER 32 1.876 -9.148 -2.533 270 1HB SER 32 2HB SER 32 3.429 -10.052 -4.200 271 2HB SER 32 1HB SER 32 3.141 -8.341 -4.494 272 HG SER 32 HG SER 32 5.309 -8.542 -4.568 273 H LEU 33 H LEU 33 4.886 -8.627 -0.784 274 HA LEU 33 HA LEU 33 5.528 -11.389 -0.309 275 1HB LEU 33 2HB LEU 33 6.287 -8.772 0.930 276 2HB LEU 33 1HB LEU 33 6.637 -10.250 1.827 277 HG LEU 33 HG LEU 33 7.383 -10.030 -1.081 278 1HD1 LEU 33 1HD1 LEU 33 8.273 -8.112 0.545 279 2HD1 LEU 33 2HD1 LEU 33 9.333 -8.865 -0.646 280 3HD1 LEU 33 3HD1 LEU 33 9.393 -9.384 1.038 281 1HD2 LEU 33 1HD2 LEU 33 7.647 -12.227 -0.259 282 2HD2 LEU 33 2HD2 LEU 33 8.211 -11.666 1.316 283 3HD2 LEU 33 3HD2 LEU 33 9.263 -11.539 -0.095 284 H GLN 34 H GLN 34 3.414 -9.085 1.371 285 HA GLN 34 HA GLN 34 2.893 -10.939 3.584 286 1HB GLN 34 2HB GLN 34 1.635 -8.294 2.802 287 2HB GLN 34 1HB GLN 34 1.206 -9.202 4.253 288 1HG GLN 34 2HG GLN 34 3.335 -8.905 5.220 289 2HG GLN 34 1HG GLN 34 4.078 -8.491 3.675 290 1HE2 GLN 34 1HE2 GLN 34 3.011 -6.392 2.632 291 2HE2 GLN 34 2HE2 GLN 34 2.719 -5.117 3.713 292 H ILE 35 H ILE 35 0.981 -9.646 0.832 293 HA ILE 35 HA ILE 35 -1.294 -11.363 1.418 294 HB ILE 35 HB ILE 35 -2.061 -10.667 -0.902 295 1HG1 ILE 35 2HG1 ILE 35 0.383 -8.880 -0.769 296 2HG1 ILE 35 1HG1 ILE 35 0.265 -10.306 -1.795 297 1HG2 ILE 35 1HG2 ILE 35 -1.266 -8.229 0.649 298 2HG2 ILE 35 2HG2 ILE 35 -2.354 -9.407 1.386 299 3HG2 ILE 35 3HG2 ILE 35 -2.806 -8.612 -0.122 300 1HD1 ILE 35 1HD1 ILE 35 -0.694 -8.995 -3.356 301 2HD1 ILE 35 2HD1 ILE 35 -0.806 -7.644 -2.229 302 3HD1 ILE 35 3HD1 ILE 35 -2.089 -8.853 -2.287 303 H GLY 36 H GLY 36 1.639 -11.766 -0.447 304 1HA GLY 36 2HA GLY 36 2.480 -13.688 -1.517 305 2HA GLY 36 1HA GLY 36 1.118 -14.589 -0.842 306 H THR 37 H THR 37 0.988 -11.702 -2.892 307 HA THR 37 HA THR 37 -0.495 -13.306 -4.936 308 HB THR 37 HB THR 37 -0.796 -10.327 -4.632 309 HG1 THR 37 HG1 THR 37 -2.176 -12.311 -3.144 310 1HG2 THR 37 1HG2 THR 37 -2.389 -10.648 -6.171 311 2HG2 THR 37 2HG2 THR 37 -3.197 -11.820 -5.131 312 3HG2 THR 37 3HG2 THR 37 -1.937 -12.352 -6.244 313 H GLN 38 H GLN 38 2.479 -11.998 -4.462 314 HA GLN 38 HA GLN 38 4.215 -11.390 -5.895 315 1HB GLN 38 2HB GLN 38 2.200 -12.466 -7.861 316 2HB GLN 38 1HB GLN 38 3.678 -11.695 -8.434 317 1HG GLN 38 2HG GLN 38 5.032 -13.259 -7.113 318 2HG GLN 38 1HG GLN 38 3.568 -14.019 -6.487 319 1HE2 GLN 38 1HE2 GLN 38 5.377 -13.431 -9.533 320 2HE2 GLN 38 2HE2 GLN 38 4.722 -14.760 -10.361 321 HA PRO 39 HA PRO 39 3.381 -7.187 -6.870 322 1HB PRO 39 2HB PRO 39 5.567 -6.638 -8.446 323 2HB PRO 39 1HB PRO 39 5.637 -6.803 -6.683 324 1HG PRO 39 2HG PRO 39 6.537 -8.720 -8.786 325 2HG PRO 39 1HG PRO 39 7.136 -8.506 -7.133 326 1HD PRO 39 2HD PRO 39 5.405 -10.560 -7.995 327 2HD PRO 39 1HD PRO 39 5.708 -10.100 -6.304 328 H ASN 40 H ASN 40 3.564 -9.555 -9.406 329 HA ASN 40 HA ASN 40 2.700 -7.622 -11.480 330 1HB ASN 40 2HB ASN 40 3.620 -10.490 -11.525 331 2HB ASN 40 1HB ASN 40 2.793 -9.787 -12.916 332 1HD2 ASN 40 1HD2 ASN 40 5.789 -9.754 -11.059 333 2HD2 ASN 40 2HD2 ASN 40 6.639 -8.712 -12.095 334 H LYS 41 H LYS 41 1.186 -9.570 -9.152 335 HA LYS 41 HA LYS 41 -1.258 -9.811 -10.866 336 1HB LYS 41 2HB LYS 41 0.060 -11.817 -9.431 337 2HB LYS 41 1HB LYS 41 -1.317 -11.391 -8.412 338 1HG LYS 41 2HG LYS 41 -2.459 -11.434 -10.918 339 2HG LYS 41 1HG LYS 41 -1.273 -12.731 -11.035 340 1HD LYS 41 2HD LYS 41 -2.784 -14.035 -9.974 341 2HD LYS 41 1HD LYS 41 -2.403 -13.113 -8.520 342 1HE LYS 41 2HE LYS 41 -4.219 -11.590 -8.904 343 2HE LYS 41 1HE LYS 41 -4.491 -12.227 -10.524 344 1HZ LYS 41 1HZ LYS 41 -4.750 -14.442 -9.072 345 2HZ LYS 41 2HZ LYS 41 -6.053 -13.426 -9.466 346 3HZ LYS 41 3HZ LYS 41 -5.303 -13.299 -7.950 347 H ILE 42 H ILE 42 -0.261 -7.505 -9.116 348 HA ILE 42 HA ILE 42 -2.767 -7.254 -7.515 349 HB ILE 42 HB ILE 42 -1.404 -5.909 -5.843 350 1HG1 ILE 42 2HG1 ILE 42 0.931 -7.344 -7.148 351 2HG1 ILE 42 1HG1 ILE 42 0.577 -5.636 -7.400 352 1HG2 ILE 42 1HG2 ILE 42 -2.135 -8.098 -5.226 353 2HG2 ILE 42 2HG2 ILE 42 -0.424 -8.021 -4.807 354 3HG2 ILE 42 3HG2 ILE 42 -0.937 -8.867 -6.266 355 1HD1 ILE 42 1HD1 ILE 42 0.866 -6.769 -4.618 356 2HD1 ILE 42 2HD1 ILE 42 1.004 -5.090 -5.140 357 3HD1 ILE 42 3HD1 ILE 42 2.275 -6.245 -5.540 358 H VAL 43 H VAL 43 -3.891 -5.453 -7.975 359 HA VAL 43 HA VAL 43 -2.546 -3.297 -9.552 360 HB VAL 43 HB VAL 43 -5.497 -3.985 -9.308 361 1HG1 VAL 43 1HG1 VAL 43 -4.069 -1.650 -10.307 362 2HG1 VAL 43 2HG1 VAL 43 -5.801 -1.880 -10.064 363 3HG1 VAL 43 3HG1 VAL 43 -5.044 -2.401 -11.570 364 1HG2 VAL 43 1HG2 VAL 43 -5.251 -4.715 -11.671 365 2HG2 VAL 43 2HG2 VAL 43 -4.247 -5.676 -10.584 366 3HG2 VAL 43 3HG2 VAL 43 -3.516 -4.409 -11.572 367 H LEU 44 H LEU 44 -1.989 -1.605 -8.257 368 HA LEU 44 HA LEU 44 -3.612 -1.045 -5.827 369 1HB LEU 44 2HB LEU 44 -0.879 -0.092 -6.725 370 2HB LEU 44 1HB LEU 44 -1.691 0.515 -5.282 371 HG LEU 44 HG LEU 44 -1.408 -2.450 -5.656 372 1HD1 LEU 44 1HD1 LEU 44 0.846 -1.584 -6.062 373 2HD1 LEU 44 2HD1 LEU 44 0.775 -2.335 -4.469 374 3HD1 LEU 44 3HD1 LEU 44 0.741 -0.578 -4.617 375 1HD2 LEU 44 1HD2 LEU 44 -2.217 -2.436 -3.552 376 2HD2 LEU 44 2HD2 LEU 44 -2.377 -0.682 -3.659 377 3HD2 LEU 44 3HD2 LEU 44 -0.897 -1.394 -3.021 378 H GLN 45 H GLN 45 -4.624 0.964 -5.510 379 HA GLN 45 HA GLN 45 -4.505 2.912 -7.770 380 1HB GLN 45 2HB GLN 45 -7.133 2.381 -6.417 381 2HB GLN 45 1HB GLN 45 -6.820 3.007 -8.033 382 1HG GLN 45 2HG GLN 45 -5.796 0.644 -8.487 383 2HG GLN 45 1HG GLN 45 -6.715 0.156 -7.062 384 1HE2 GLN 45 1HE2 GLN 45 -9.142 0.683 -7.143 385 2HE2 GLN 45 2HE2 GLN 45 -9.910 0.649 -8.657 386 H LYS 46 H LYS 46 -4.691 5.082 -7.139 387 HA LYS 46 HA LYS 46 -4.409 5.584 -4.231 388 1HB LYS 46 2HB LYS 46 -3.447 6.842 -6.659 389 2HB LYS 46 1HB LYS 46 -4.265 8.024 -5.640 390 1HG LYS 46 2HG LYS 46 -2.299 6.105 -4.413 391 2HG LYS 46 1HG LYS 46 -1.720 7.548 -5.245 392 1HD LYS 46 2HD LYS 46 -2.220 8.810 -3.456 393 2HD LYS 46 1HD LYS 46 -3.906 8.304 -3.556 394 1HE LYS 46 2HE LYS 46 -3.430 6.313 -2.222 395 2HE LYS 46 1HE LYS 46 -1.712 6.713 -2.192 396 1HZ LYS 46 1HZ LYS 46 -2.097 8.575 -0.857 397 2HZ LYS 46 2HZ LYS 46 -3.103 7.381 -0.189 398 3HZ LYS 46 3HZ LYS 46 -3.762 8.593 -1.180 399 H GLY 47 H GLY 47 -6.252 7.079 -6.933 400 1HA GLY 47 2HA GLY 47 -8.682 7.161 -5.271 401 2HA GLY 47 1HA GLY 47 -8.003 8.739 -5.680 402 H GLY 48 H GLY 48 -9.032 5.678 -7.208 403 1HA GLY 48 2HA GLY 48 -10.405 5.406 -9.123 404 2HA GLY 48 1HA GLY 48 -10.452 7.160 -9.305 405 H SER 49 H SER 49 -7.366 5.552 -8.939 406 HA SER 49 HA SER 49 -6.868 5.430 -11.841 407 1HB SER 49 2HB SER 49 -6.015 7.682 -10.175 408 2HB SER 49 1HB SER 49 -4.659 6.890 -10.974 409 HG SER 49 HG SER 49 -5.515 8.425 -12.360 410 H VAL 50 H VAL 50 -5.262 3.927 -12.298 411 HA VAL 50 HA VAL 50 -4.316 2.285 -10.069 412 HB VAL 50 HB VAL 50 -3.302 0.865 -11.816 413 1HG1 VAL 50 1HG1 VAL 50 -5.481 0.499 -13.157 414 2HG1 VAL 50 2HG1 VAL 50 -6.145 1.806 -12.176 415 3HG1 VAL 50 3HG1 VAL 50 -5.563 0.331 -11.403 416 1HG2 VAL 50 1HG2 VAL 50 -2.525 2.377 -13.467 417 2HG2 VAL 50 2HG2 VAL 50 -4.085 3.189 -13.584 418 3HG2 VAL 50 3HG2 VAL 50 -3.886 1.565 -14.239 419 H LEU 51 H LEU 51 -2.162 1.982 -9.413 420 HA LEU 51 HA LEU 51 -0.341 4.245 -10.041 421 1HB LEU 51 2HB LEU 51 0.168 2.080 -7.991 422 2HB LEU 51 1HB LEU 51 0.828 3.712 -8.043 423 HG LEU 51 HG LEU 51 -2.070 2.986 -7.516 424 1HD1 LEU 51 1HD1 LEU 51 -0.068 2.749 -5.746 425 2HD1 LEU 51 2HD1 LEU 51 -1.663 3.335 -5.276 426 3HD1 LEU 51 3HD1 LEU 51 -0.359 4.481 -5.583 427 1HD2 LEU 51 1HD2 LEU 51 -1.926 5.100 -8.724 428 2HD2 LEU 51 2HD2 LEU 51 -0.645 5.661 -7.650 429 3HD2 LEU 51 3HD2 LEU 51 -2.280 5.438 -7.030 430 H LYS 52 H LYS 52 1.634 3.941 -11.067 431 HA LYS 52 HA LYS 52 2.178 1.178 -12.081 432 1HB LYS 52 2HB LYS 52 2.494 3.903 -13.305 433 2HB LYS 52 1HB LYS 52 3.528 2.580 -13.846 434 1HG LYS 52 2HG LYS 52 1.098 1.346 -13.860 435 2HG LYS 52 1HG LYS 52 0.624 3.000 -14.255 436 1HD LYS 52 2HD LYS 52 1.351 2.704 -16.361 437 2HD LYS 52 1HD LYS 52 2.977 2.399 -15.751 438 1HE LYS 52 2HE LYS 52 2.077 0.005 -15.236 439 2HE LYS 52 1HE LYS 52 0.799 0.420 -16.381 440 1HZ LYS 52 1HZ LYS 52 2.859 -0.693 -17.312 441 2HZ LYS 52 2HZ LYS 52 3.664 0.779 -17.039 442 3HZ LYS 52 3HZ LYS 52 2.340 0.716 -18.098 443 H ASP 53 H ASP 53 4.321 0.415 -12.039 444 HA ASP 53 HA ASP 53 5.962 1.244 -9.853 445 1HB ASP 53 2HB ASP 53 7.620 -0.335 -10.737 446 2HB ASP 53 1HB ASP 53 6.007 -1.042 -10.815 447 H HIS 54 H HIS 54 5.881 2.272 -13.205 448 HA HIS 54 HA HIS 54 8.517 3.428 -13.314 449 1HB HIS 54 2HB HIS 54 5.989 3.970 -14.888 450 2HB HIS 54 1HB HIS 54 7.543 4.720 -15.259 451 HD1 HIS 54 HD1 HIS 54 5.640 1.563 -15.624 452 HD2 HIS 54 HD2 HIS 54 9.595 2.808 -16.065 453 HE1 HIS 54 HE1 HIS 54 6.835 -0.277 -16.891 454 H ILE 55 H ILE 55 5.735 4.423 -11.572 455 HA ILE 55 HA ILE 55 6.746 7.238 -11.478 456 HB ILE 55 HB ILE 55 4.002 6.115 -10.831 457 1HG1 ILE 55 2HG1 ILE 55 3.598 8.012 -12.698 458 2HG1 ILE 55 1HG1 ILE 55 5.238 7.540 -13.142 459 1HG2 ILE 55 1HG2 ILE 55 5.179 8.886 -10.517 460 2HG2 ILE 55 2HG2 ILE 55 4.376 7.907 -9.289 461 3HG2 ILE 55 3HG2 ILE 55 3.442 8.602 -10.612 462 1HD1 ILE 55 1HD1 ILE 55 3.751 5.155 -12.628 463 2HD1 ILE 55 2HD1 ILE 55 4.436 5.703 -14.158 464 3HD1 ILE 55 3HD1 ILE 55 2.796 6.170 -13.710 465 H SER 56 H SER 56 7.195 8.166 -9.461 466 HA SER 56 HA SER 56 7.903 6.307 -7.335 467 1HB SER 56 2HB SER 56 8.718 8.313 -6.160 468 2HB SER 56 1HB SER 56 9.292 8.283 -7.824 469 HG SER 56 HG SER 56 8.445 10.332 -7.224 470 H LEU 57 H LEU 57 7.041 6.298 -5.187 471 HA LEU 57 HA LEU 57 4.195 6.472 -4.983 472 1HB LEU 57 2HB LEU 57 6.372 6.316 -2.882 473 2HB LEU 57 1HB LEU 57 4.656 6.288 -2.479 474 HG LEU 57 HG LEU 57 5.836 4.378 -4.500 475 1HD1 LEU 57 1HD1 LEU 57 5.839 2.723 -2.578 476 2HD1 LEU 57 2HD1 LEU 57 5.647 4.099 -1.490 477 3HD1 LEU 57 3HD1 LEU 57 7.093 3.960 -2.491 478 1HD2 LEU 57 1HD2 LEU 57 3.566 4.118 -4.703 479 2HD2 LEU 57 2HD2 LEU 57 3.245 4.784 -3.101 480 3HD2 LEU 57 3HD2 LEU 57 3.775 3.111 -3.271 481 H GLU 58 H GLU 58 6.773 8.765 -4.177 482 HA GLU 58 HA GLU 58 5.193 10.649 -2.715 483 1HB GLU 58 2HB GLU 58 7.759 10.561 -2.989 484 2HB GLU 58 1HB GLU 58 7.499 11.408 -4.514 485 1HG GLU 58 2HG GLU 58 7.865 13.139 -2.934 486 2HG GLU 58 1HG GLU 58 6.115 13.094 -3.141 487 H ASP 59 H ASP 59 5.695 10.144 -6.186 488 HA ASP 59 HA ASP 59 4.474 12.582 -7.097 489 1HB ASP 59 2HB ASP 59 5.875 10.878 -8.442 490 2HB ASP 59 1HB ASP 59 4.383 9.950 -8.582 491 H TYR 60 H TYR 60 3.186 9.330 -6.425 492 HA TYR 60 HA TYR 60 0.460 9.996 -7.184 493 1HB TYR 60 2HB TYR 60 1.762 7.691 -5.740 494 2HB TYR 60 1HB TYR 60 0.006 7.823 -5.825 495 HD1 TYR 60 HD1 TYR 60 2.685 6.291 -7.348 496 HD2 TYR 60 HD2 TYR 60 -0.764 8.644 -8.363 497 HE1 TYR 60 HE1 TYR 60 2.721 5.357 -9.644 498 HE2 TYR 60 HE2 TYR 60 -0.725 7.711 -10.659 499 HH TYR 60 HH TYR 60 1.275 6.654 -12.180 500 H GLU 61 H GLU 61 2.376 10.592 -4.390 501 HA GLU 61 HA GLU 61 1.844 11.851 -2.484 502 1HB GLU 61 2HB GLU 61 -0.240 12.567 -4.002 503 2HB GLU 61 1HB GLU 61 -1.110 11.556 -2.848 504 1HG GLU 61 2HG GLU 61 0.862 13.465 -1.699 505 2HG GLU 61 1HG GLU 61 -0.593 14.173 -2.400 506 H VAL 62 H VAL 62 2.701 9.793 -1.640 507 HA VAL 62 HA VAL 62 0.607 8.219 -0.191 508 HB VAL 62 HB VAL 62 3.348 7.302 -1.138 509 1HG1 VAL 62 1HG1 VAL 62 2.263 5.027 -0.488 510 2HG1 VAL 62 2HG1 VAL 62 1.163 6.005 0.483 511 3HG1 VAL 62 3HG1 VAL 62 2.895 6.048 0.802 512 1HG2 VAL 62 1HG2 VAL 62 2.355 6.569 -3.033 513 2HG2 VAL 62 2HG2 VAL 62 0.970 7.566 -2.590 514 3HG2 VAL 62 3HG2 VAL 62 1.013 5.863 -2.134 515 H HIS 63 H HIS 63 0.610 9.155 1.818 516 HA HIS 63 HA HIS 63 3.240 9.771 3.094 517 1HB HIS 63 2HB HIS 63 0.509 10.954 3.269 518 2HB HIS 63 1HB HIS 63 1.478 10.958 4.743 519 HD1 HIS 63 HD1 HIS 63 1.494 12.245 1.192 520 HD2 HIS 63 HD2 HIS 63 3.671 12.726 4.716 521 HE1 HIS 63 HE1 HIS 63 3.064 14.194 0.805 522 H ASP 64 H ASP 64 2.808 9.693 5.697 523 HA ASP 64 HA ASP 64 2.663 6.894 6.348 524 1HB ASP 64 2HB ASP 64 3.903 8.829 7.579 525 2HB ASP 64 1HB ASP 64 2.360 9.087 8.392 526 H GLN 65 H GLN 65 1.000 5.684 7.152 527 HA GLN 65 HA GLN 65 -1.190 5.041 7.624 528 1HB GLN 65 2HB GLN 65 -0.552 7.215 9.312 529 2HB GLN 65 1HB GLN 65 -2.186 7.524 8.725 530 1HG GLN 65 2HG GLN 65 -2.249 6.163 10.777 531 2HG GLN 65 1HG GLN 65 -2.858 5.241 9.403 532 1HE2 GLN 65 1HE2 GLN 65 0.312 5.853 11.049 533 2HE2 GLN 65 2HE2 GLN 65 0.862 4.256 10.887 534 H THR 66 H THR 66 -0.722 6.056 5.007 535 HA THR 66 HA THR 66 -3.068 7.749 4.371 536 HB THR 66 HB THR 66 -0.809 8.119 3.283 537 HG1 THR 66 HG1 THR 66 -1.912 8.911 1.696 538 1HG2 THR 66 1HG2 THR 66 -1.490 5.704 1.608 539 2HG2 THR 66 2HG2 THR 66 -0.446 5.578 3.025 540 3HG2 THR 66 3HG2 THR 66 0.025 6.605 1.672 541 H ASN 67 H ASN 67 -4.624 7.008 2.708 542 HA ASN 67 HA ASN 67 -5.149 4.093 2.989 543 1HB ASN 67 2HB ASN 67 -6.796 6.479 2.833 544 2HB ASN 67 1HB ASN 67 -7.296 5.284 1.635 545 1HD2 ASN 67 1HD2 ASN 67 -7.661 2.996 2.520 546 2HD2 ASN 67 2HD2 ASN 67 -8.240 2.842 4.108 547 H LEU 68 H LEU 68 -5.329 2.738 1.223 548 HA LEU 68 HA LEU 68 -4.981 3.872 -1.506 549 1HB LEU 68 2HB LEU 68 -2.841 2.799 -0.111 550 2HB LEU 68 1HB LEU 68 -3.413 1.428 -1.059 551 HG LEU 68 HG LEU 68 -3.425 3.808 -2.694 552 1HD1 LEU 68 1HD1 LEU 68 -0.965 4.179 -2.743 553 2HD1 LEU 68 2HD1 LEU 68 -0.795 3.107 -1.352 554 3HD1 LEU 68 3HD1 LEU 68 -1.671 4.630 -1.190 555 1HD2 LEU 68 1HD2 LEU 68 -1.374 1.836 -3.303 556 2HD2 LEU 68 2HD2 LEU 68 -2.836 2.235 -4.204 557 3HD2 LEU 68 3HD2 LEU 68 -2.903 1.056 -2.895 558 H GLU 69 H GLU 69 -5.266 2.012 -3.169 559 HA GLU 69 HA GLU 69 -7.417 0.173 -2.186 560 1HB GLU 69 2HB GLU 69 -7.029 1.513 -4.875 561 2HB GLU 69 1HB GLU 69 -8.194 0.219 -4.601 562 1HG GLU 69 2HG GLU 69 -9.604 1.943 -4.100 563 2HG GLU 69 1HG GLU 69 -8.806 1.875 -2.529 564 H LEU 70 H LEU 70 -7.335 -2.001 -2.859 565 HA LEU 70 HA LEU 70 -4.945 -2.817 -4.451 566 1HB LEU 70 2HB LEU 70 -4.382 -3.240 -2.126 567 2HB LEU 70 1HB LEU 70 -5.923 -4.053 -1.859 568 HG LEU 70 HG LEU 70 -5.279 -5.792 -3.504 569 1HD1 LEU 70 1HD1 LEU 70 -3.562 -5.488 -4.931 570 2HD1 LEU 70 2HD1 LEU 70 -2.446 -5.209 -3.595 571 3HD1 LEU 70 3HD1 LEU 70 -3.363 -3.864 -4.273 572 1HD2 LEU 70 1HD2 LEU 70 -4.752 -6.072 -1.089 573 2HD2 LEU 70 2HD2 LEU 70 -3.172 -5.340 -1.367 574 3HD2 LEU 70 3HD2 LEU 70 -3.573 -6.883 -2.120 575 H TYR 71 H TYR 71 -5.385 -4.314 -6.003 576 HA TYR 71 HA TYR 71 -7.925 -5.866 -5.852 577 1HB TYR 71 2HB TYR 71 -7.074 -3.938 -7.986 578 2HB TYR 71 1HB TYR 71 -7.953 -5.389 -8.467 579 HD1 TYR 71 HD1 TYR 71 -8.147 -2.174 -6.732 580 HD2 TYR 71 HD2 TYR 71 -10.240 -5.822 -7.616 581 HE1 TYR 71 HE1 TYR 71 -10.278 -1.128 -6.017 582 HE2 TYR 71 HE2 TYR 71 -12.368 -4.775 -6.901 583 HH TYR 71 HH TYR 71 -12.453 -1.662 -5.331 584 H TYR 72 H TYR 72 -7.870 -7.788 -7.297 585 HA TYR 72 HA TYR 72 -5.054 -8.675 -7.790 586 1HB TYR 72 2HB TYR 72 -7.520 -10.319 -7.136 587 2HB TYR 72 1HB TYR 72 -5.935 -10.993 -7.514 588 HD1 TYR 72 HD1 TYR 72 -7.793 -10.923 -4.852 589 HD2 TYR 72 HD2 TYR 72 -4.181 -8.973 -6.128 590 HE1 TYR 72 HE1 TYR 72 -7.115 -10.627 -2.489 591 HE2 TYR 72 HE2 TYR 72 -3.507 -8.678 -3.762 592 HH TYR 72 HH TYR 72 -3.984 -9.761 -1.565 593 H LEU 73 HN LEU 73 -4.561 -8.657 -9.893 594 HA LEU 73 HA LEU 73 -4.666 -9.156 -12.179 595 1HB LEU 73 2HB LEU 73 -6.222 -11.102 -11.190 596 2HB LEU 73 1HB LEU 73 -7.464 -10.185 -12.043 597 HG LEU 73 HG LEU 73 -5.093 -10.431 -13.687 598 1HD1 LEU 73 1HD1 LEU 73 -6.011 -13.075 -13.847 599 2HD1 LEU 73 2HD1 LEU 73 -5.818 -12.775 -12.120 600 3HD1 LEU 73 3HD1 LEU 73 -4.453 -12.543 -13.213 601 1HD2 LEU 73 1HD2 LEU 73 -7.735 -10.105 -14.095 602 2HD2 LEU 73 2HD2 LEU 73 -7.640 -11.854 -14.307 603 3HD2 LEU 73 3HD2 LEU 73 -6.672 -10.789 -15.326 Start of MODEL 12 1 H MET 1 1H MET 1 10.282 6.859 5.890 2 HA MET 1 HA MET 1 9.531 4.799 4.920 3 1HB MET 1 2HB MET 1 10.915 3.670 7.072 4 2HB MET 1 1HB MET 1 9.219 3.348 7.431 5 1HG MET 1 2HG MET 1 8.898 2.305 5.265 6 2HG MET 1 1HG MET 1 10.523 2.765 4.759 7 1HE MET 1 1HE MET 1 9.874 -0.726 4.759 8 2HE MET 1 2HE MET 1 11.624 -0.523 4.757 9 3HE MET 1 3HE MET 1 10.609 0.665 3.946 10 H ILE 2 H ILE 2 7.282 4.569 4.825 11 HA ILE 2 HA ILE 2 5.727 5.827 7.054 12 HB ILE 2 HB ILE 2 4.099 6.585 5.302 13 1HG1 ILE 2 2HG1 ILE 2 6.165 6.316 3.185 14 2HG1 ILE 2 1HG1 ILE 2 5.344 4.826 3.649 15 1HG2 ILE 2 1HG2 ILE 2 6.564 7.700 6.055 16 2HG2 ILE 2 2HG2 ILE 2 5.185 8.551 5.357 17 3HG2 ILE 2 3HG2 ILE 2 6.463 7.933 4.310 18 1HD1 ILE 2 1HD1 ILE 2 3.981 7.400 2.805 19 2HD1 ILE 2 2HD1 ILE 2 3.159 5.915 3.285 20 3HD1 ILE 2 3HD1 ILE 2 4.137 5.947 1.818 21 H GLU 3 H GLU 3 3.455 5.059 7.175 22 HA GLU 3 HA GLU 3 3.287 2.159 6.497 23 1HB GLU 3 2HB GLU 3 1.888 3.882 8.556 24 2HB GLU 3 1HB GLU 3 1.364 2.240 8.184 25 1HG GLU 3 2HG GLU 3 2.832 1.756 9.892 26 2HG GLU 3 1HG GLU 3 3.970 1.738 8.545 27 H VAL 4 H VAL 4 1.423 1.356 5.401 28 HA VAL 4 HA VAL 4 -0.477 3.408 4.356 29 HB VAL 4 HB VAL 4 0.591 1.221 2.574 30 1HG1 VAL 4 1HG1 VAL 4 -0.970 3.769 2.259 31 2HG1 VAL 4 2HG1 VAL 4 -1.317 2.166 1.613 32 3HG1 VAL 4 3HG1 VAL 4 -0.034 3.143 0.902 33 1HG2 VAL 4 1HG2 VAL 4 1.676 4.050 2.784 34 2HG2 VAL 4 2HG2 VAL 4 2.215 2.801 1.662 35 3HG2 VAL 4 3HG2 VAL 4 2.508 2.618 3.390 36 H VAL 5 H VAL 5 -2.522 2.527 3.677 37 HA VAL 5 HA VAL 5 -3.103 -0.213 4.738 38 HB VAL 5 HB VAL 5 -5.064 2.100 4.694 39 1HG1 VAL 5 1HG1 VAL 5 -6.323 0.164 4.919 40 2HG1 VAL 5 2HG1 VAL 5 -5.965 0.506 6.611 41 3HG1 VAL 5 3HG1 VAL 5 -5.029 -0.708 5.739 42 1HG2 VAL 5 1HG2 VAL 5 -3.302 1.137 6.975 43 2HG2 VAL 5 2HG2 VAL 5 -4.622 2.296 7.138 44 3HG2 VAL 5 3HG2 VAL 5 -3.202 2.707 6.177 45 H VAL 6 H VAL 6 -3.542 -1.511 3.009 46 HA VAL 6 HA VAL 6 -4.761 -0.269 0.585 47 HB VAL 6 HB VAL 6 -3.941 -3.051 0.258 48 1HG1 VAL 6 1HG1 VAL 6 -2.650 -0.698 -1.075 49 2HG1 VAL 6 2HG1 VAL 6 -4.354 -1.029 -1.390 50 3HG1 VAL 6 3HG1 VAL 6 -3.136 -2.248 -1.763 51 1HG2 VAL 6 1HG2 VAL 6 -1.443 -2.408 0.311 52 2HG2 VAL 6 2HG2 VAL 6 -2.215 -2.715 1.866 53 3HG2 VAL 6 3HG2 VAL 6 -1.932 -1.057 1.335 54 H ASN 7 H ASN 7 -6.936 -0.446 0.549 55 HA ASN 7 HA ASN 7 -8.244 -2.805 1.810 56 1HB ASN 7 2HB ASN 7 -9.163 -0.056 1.001 57 2HB ASN 7 1HB ASN 7 -10.347 -1.352 1.171 58 1HD2 ASN 7 1HD2 ASN 7 -7.814 0.433 2.973 59 2HD2 ASN 7 2HD2 ASN 7 -8.437 0.077 4.511 60 H ASP 8 H ASP 8 -9.020 -4.429 0.546 61 HA ASP 8 HA ASP 8 -8.696 -4.319 -2.335 62 1HB ASP 8 2HB ASP 8 -9.328 -6.349 -0.326 63 2HB ASP 8 1HB ASP 8 -10.251 -6.558 -1.814 64 H ARG 9 H ARG 9 -11.647 -4.983 -0.394 65 HA ARG 9 HA ARG 9 -13.177 -3.339 -2.355 66 1HB ARG 9 2HB ARG 9 -13.577 -6.223 -1.649 67 2HB ARG 9 1HB ARG 9 -15.002 -5.233 -1.961 68 1HG ARG 9 2HG ARG 9 -14.616 -5.731 -4.146 69 2HG ARG 9 1HG ARG 9 -13.359 -4.499 -4.036 70 1HD ARG 9 2HD ARG 9 -12.052 -6.681 -3.021 71 2HD ARG 9 1HD ARG 9 -13.105 -7.436 -4.217 72 HE ARG 9 HE ARG 9 -11.620 -5.090 -5.186 73 1HH1 ARG 9 1HH2 ARG 9 -12.689 -7.672 -6.610 74 2HH1 ARG 9 2HH2 ARG 9 -11.184 -8.384 -7.088 75 1HH2 ARG 9 2HH1 ARG 9 -9.267 -6.361 -5.014 76 2HH2 ARG 9 1HH1 ARG 9 -9.244 -7.643 -6.179 77 H LEU 10 H LEU 10 -13.905 -5.332 0.557 78 HA LEU 10 HA LEU 10 -14.510 -2.957 2.144 79 1HB LEU 10 2HB LEU 10 -16.565 -3.766 0.510 80 2HB LEU 10 1HB LEU 10 -16.913 -4.666 1.986 81 HG LEU 10 HG LEU 10 -16.130 -1.975 2.668 82 1HD1 LEU 10 1HD1 LEU 10 -16.927 -1.406 0.402 83 2HD1 LEU 10 2HD1 LEU 10 -18.022 -0.774 1.633 84 3HD1 LEU 10 3HD1 LEU 10 -18.452 -2.227 0.729 85 1HD2 LEU 10 1HD2 LEU 10 -17.454 -3.467 4.093 86 2HD2 LEU 10 2HD2 LEU 10 -18.741 -3.509 2.888 87 3HD2 LEU 10 3HD2 LEU 10 -18.379 -2.007 3.738 88 H GLY 11 H GLY 11 -13.632 -3.573 4.053 89 1HA GLY 11 2HA GLY 11 -13.761 -4.835 6.116 90 2HA GLY 11 1HA GLY 11 -14.419 -6.196 5.212 91 H LYS 12 H LYS 12 -12.271 -5.833 3.088 92 HA LYS 12 HA LYS 12 -10.132 -7.277 4.573 93 1HB LYS 12 2HB LYS 12 -11.429 -7.804 2.150 94 2HB LYS 12 1HB LYS 12 -9.840 -7.204 1.674 95 1HG LYS 12 2HG LYS 12 -10.103 -9.269 3.852 96 2HG LYS 12 1HG LYS 12 -10.109 -9.749 2.154 97 1HD LYS 12 2HD LYS 12 -7.951 -7.923 3.193 98 2HD LYS 12 1HD LYS 12 -7.833 -9.667 3.438 99 1HE LYS 12 2HE LYS 12 -7.313 -10.044 1.277 100 2HE LYS 12 1HE LYS 12 -8.595 -8.977 0.696 101 1HZ LYS 12 1HZ LYS 12 -7.222 -7.111 0.916 102 2HZ LYS 12 2HZ LYS 12 -6.222 -8.293 0.220 103 3HZ LYS 12 3HZ LYS 12 -6.091 -7.935 1.874 104 H LYS 13 H LYS 13 -8.304 -6.174 5.053 105 HA LYS 13 HA LYS 13 -7.278 -4.150 3.142 106 1HB LYS 13 2HB LYS 13 -6.993 -2.450 4.842 107 2HB LYS 13 1HB LYS 13 -8.683 -2.951 4.846 108 1HG LYS 13 2HG LYS 13 -7.800 -4.689 6.662 109 2HG LYS 13 1HG LYS 13 -6.547 -3.466 6.878 110 1HD LYS 13 2HD LYS 13 -7.988 -2.313 8.168 111 2HD LYS 13 1HD LYS 13 -8.972 -2.037 6.730 112 1HE LYS 13 2HE LYS 13 -9.302 -4.713 7.931 113 2HE LYS 13 1HE LYS 13 -9.835 -3.384 8.959 114 1HZ LYS 13 1HZ LYS 13 -11.214 -2.568 7.179 115 2HZ LYS 13 2HZ LYS 13 -11.594 -4.195 7.488 116 3HZ LYS 13 3HZ LYS 13 -10.658 -3.782 6.134 117 H VAL 14 H VAL 14 -4.994 -3.839 3.295 118 HA VAL 14 HA VAL 14 -3.576 -5.739 5.129 119 HB VAL 14 HB VAL 14 -2.691 -4.991 2.324 120 1HG1 VAL 14 1HG1 VAL 14 -1.098 -5.868 4.250 121 2HG1 VAL 14 2HG1 VAL 14 -0.955 -6.508 2.615 122 3HG1 VAL 14 3HG1 VAL 14 -1.821 -7.424 3.847 123 1HG2 VAL 14 1HG2 VAL 14 -3.446 -7.256 1.676 124 2HG2 VAL 14 2HG2 VAL 14 -4.799 -6.276 2.241 125 3HG2 VAL 14 3HG2 VAL 14 -4.095 -7.503 3.297 126 H ARG 15 H ARG 15 -1.652 -4.968 6.066 127 HA ARG 15 HA ARG 15 -1.220 -2.029 5.839 128 1HB ARG 15 2HB ARG 15 -1.616 -3.194 8.105 129 2HB ARG 15 1HB ARG 15 0.005 -3.862 7.910 130 1HG ARG 15 2HG ARG 15 0.729 -1.943 8.878 131 2HG ARG 15 1HG ARG 15 0.386 -1.186 7.323 132 1HD ARG 15 2HD ARG 15 -1.912 -0.673 8.084 133 2HD ARG 15 1HD ARG 15 -1.553 -1.410 9.645 134 HE ARG 15 HE ARG 15 0.332 0.416 9.715 135 1HH1 ARG 15 2HH1 ARG 15 -0.514 1.837 7.258 136 2HH1 ARG 15 1HH1 ARG 15 -1.592 3.048 7.866 137 1HH2 ARG 15 1HH2 ARG 15 -2.035 1.487 10.939 138 2HH2 ARG 15 2HH2 ARG 15 -2.457 2.849 9.955 139 H VAL 16 H VAL 16 0.604 -1.274 4.866 140 HA VAL 16 HA VAL 16 2.944 -3.088 4.561 141 HB VAL 16 HB VAL 16 1.573 -3.345 2.529 142 1HG1 VAL 16 1HG1 VAL 16 2.065 -0.443 1.889 143 2HG1 VAL 16 2HG1 VAL 16 0.637 -0.930 2.803 144 3HG1 VAL 16 3HG1 VAL 16 0.896 -1.554 1.175 145 1HG2 VAL 16 1HG2 VAL 16 4.193 -1.857 2.308 146 2HG2 VAL 16 2HG2 VAL 16 3.337 -2.420 0.872 147 3HG2 VAL 16 3HG2 VAL 16 3.884 -3.578 2.083 148 H LYS 17 H LYS 17 4.840 -2.014 4.919 149 HA LYS 17 HA LYS 17 4.712 0.963 5.095 150 1HB LYS 17 2HB LYS 17 6.594 0.828 6.641 151 2HB LYS 17 1HB LYS 17 5.313 -0.250 7.188 152 1HG LYS 17 2HG LYS 17 6.786 -1.896 5.532 153 2HG LYS 17 1HG LYS 17 8.033 -0.890 6.269 154 1HD LYS 17 2HD LYS 17 7.769 -1.857 8.297 155 2HD LYS 17 1HD LYS 17 6.010 -1.789 8.193 156 1HE LYS 17 2HE LYS 17 7.082 -3.714 6.300 157 2HE LYS 17 1HE LYS 17 7.615 -4.079 7.940 158 1HZ LYS 17 1HZ LYS 17 5.470 -5.102 7.372 159 2HZ LYS 17 2HZ LYS 17 4.798 -3.556 7.160 160 3HZ LYS 17 3HZ LYS 17 5.354 -4.043 8.691 161 H CYS 18 H CYS 18 6.052 2.209 3.846 162 HA CYS 18 HA CYS 18 8.426 1.091 2.531 163 1HB CYS 18 2HB CYS 18 7.624 1.605 0.232 164 2HB CYS 18 1HB CYS 18 6.669 0.332 0.990 165 HG CYS 18 HG CYS 18 4.676 1.767 0.735 166 H LEU 19 H LEU 19 9.531 2.852 1.197 167 HA LEU 19 HA LEU 19 9.269 5.424 2.624 168 1HB LEU 19 2HB LEU 19 11.371 4.012 1.192 169 2HB LEU 19 1HB LEU 19 11.237 5.679 0.638 170 HG LEU 19 HG LEU 19 11.070 5.333 3.569 171 1HD1 LEU 19 1HD1 LEU 19 12.799 3.630 2.836 172 2HD1 LEU 19 2HD1 LEU 19 13.411 4.894 3.903 173 3HD1 LEU 19 3HD1 LEU 19 13.733 4.971 2.170 174 1HD2 LEU 19 1HD2 LEU 19 11.230 7.486 2.120 175 2HD2 LEU 19 2HD2 LEU 19 12.941 7.085 1.975 176 3HD2 LEU 19 3HD2 LEU 19 12.238 7.387 3.564 177 H ALA 20 H ALA 20 8.776 7.403 1.595 178 HA ALA 20 HA ALA 20 6.883 7.323 -0.555 179 1HB ALA 20 1HB ALA 20 8.428 9.544 0.780 180 2HB ALA 20 2HB ALA 20 6.704 9.185 0.884 181 3HB ALA 20 3HB ALA 20 7.373 9.871 -0.596 182 H GLU 21 H GLU 21 10.367 7.495 -0.541 183 HA GLU 21 HA GLU 21 10.631 8.580 -3.234 184 1HB GLU 21 2HB GLU 21 13.015 7.968 -2.994 185 2HB GLU 21 1HB GLU 21 12.441 8.854 -1.582 186 1HG GLU 21 2HG GLU 21 13.252 7.146 -0.341 187 2HG GLU 21 1HG GLU 21 11.900 6.195 -0.949 188 H ASP 22 H ASP 22 10.069 5.437 -1.853 189 HA ASP 22 HA ASP 22 11.125 3.854 -4.008 190 1HB ASP 22 2HB ASP 22 9.222 3.368 -1.743 191 2HB ASP 22 1HB ASP 22 9.308 2.183 -3.046 192 H SER 23 H SER 23 9.841 2.693 -5.637 193 HA SER 23 HA SER 23 7.665 4.406 -6.699 194 1HB SER 23 2HB SER 23 7.979 3.145 -8.785 195 2HB SER 23 1HB SER 23 9.520 3.767 -8.209 196 HG SER 23 HG SER 23 9.479 1.496 -8.866 197 H VAL 24 H VAL 24 5.902 3.029 -7.929 198 HA VAL 24 HA VAL 24 4.371 1.616 -5.966 199 HB VAL 24 HB VAL 24 4.101 1.576 -8.990 200 1HG1 VAL 24 1HG1 VAL 24 2.885 -0.256 -7.772 201 2HG1 VAL 24 2HG1 VAL 24 1.810 0.871 -8.598 202 3HG1 VAL 24 3HG1 VAL 24 2.032 0.985 -6.853 203 1HG2 VAL 24 1HG2 VAL 24 2.980 3.566 -8.848 204 2HG2 VAL 24 2HG2 VAL 24 3.943 3.767 -7.385 205 3HG2 VAL 24 3HG2 VAL 24 2.285 3.178 -7.276 206 H GLY 25 H GLY 25 6.725 0.542 -8.364 207 1HA GLY 25 2HA GLY 25 6.129 -2.241 -8.418 208 2HA GLY 25 1HA GLY 25 7.736 -1.555 -8.679 209 H ASP 26 H ASP 26 8.185 -0.332 -6.203 210 HA ASP 26 HA ASP 26 9.014 -2.551 -4.560 211 1HB ASP 26 2HB ASP 26 8.759 0.405 -3.901 212 2HB ASP 26 1HB ASP 26 9.575 -0.783 -2.885 213 H PHE 27 H PHE 27 6.267 -0.310 -4.465 214 HA PHE 27 HA PHE 27 5.155 -1.014 -1.949 215 1HB PHE 27 2HB PHE 27 4.454 0.825 -3.666 216 2HB PHE 27 1HB PHE 27 3.459 -0.440 -4.382 217 HD1 PHE 27 HD1 PHE 27 3.695 2.025 -1.791 218 HD2 PHE 27 HD2 PHE 27 1.832 -1.708 -2.817 219 HE1 PHE 27 HE1 PHE 27 1.955 2.420 -0.072 220 HE2 PHE 27 HE2 PHE 27 0.093 -1.312 -1.094 221 HZ PHE 27 HZ PHE 27 0.154 0.752 0.277 222 H LYS 28 H LYS 28 4.709 -2.473 -5.172 223 HA LYS 28 HA LYS 28 2.819 -4.485 -4.320 224 1HB LYS 28 2HB LYS 28 4.650 -4.299 -6.730 225 2HB LYS 28 1HB LYS 28 3.458 -5.580 -6.511 226 1HG LYS 28 2HG LYS 28 1.644 -4.085 -6.657 227 2HG LYS 28 1HG LYS 28 2.658 -2.681 -6.328 228 1HD LYS 28 2HD LYS 28 3.749 -2.902 -8.495 229 2HD LYS 28 1HD LYS 28 2.861 -4.392 -8.823 230 1HE LYS 28 2HE LYS 28 0.802 -3.262 -9.047 231 2HE LYS 28 1HE LYS 28 1.396 -1.825 -8.212 232 1HZ LYS 28 1HZ LYS 28 1.276 -1.447 -10.582 233 2HZ LYS 28 2HZ LYS 28 2.277 -2.784 -10.883 234 3HZ LYS 28 3HZ LYS 28 2.894 -1.421 -10.078 235 H LYS 29 H LYS 29 6.358 -4.400 -4.633 236 HA LYS 29 HA LYS 29 6.864 -7.177 -4.206 237 1HB LYS 29 2HB LYS 29 8.491 -4.688 -3.664 238 2HB LYS 29 1HB LYS 29 9.111 -6.299 -3.303 239 1HG LYS 29 2HG LYS 29 8.793 -6.972 -5.639 240 2HG LYS 29 1HG LYS 29 8.113 -5.389 -6.018 241 1HD LYS 29 2HD LYS 29 10.490 -4.708 -4.812 242 2HD LYS 29 1HD LYS 29 10.927 -6.186 -5.670 243 1HE LYS 29 2HE LYS 29 10.678 -5.221 -7.719 244 2HE LYS 29 1HE LYS 29 9.259 -4.301 -7.222 245 1HZ LYS 29 1HZ LYS 29 10.763 -2.814 -5.983 246 2HZ LYS 29 2HZ LYS 29 11.059 -2.806 -7.656 247 3HZ LYS 29 3HZ LYS 29 12.094 -3.658 -6.612 248 H VAL 30 H VAL 30 6.663 -4.462 -1.873 249 HA VAL 30 HA VAL 30 7.121 -6.100 0.458 250 HB VAL 30 HB VAL 30 5.561 -3.498 0.353 251 1HG1 VAL 30 1HG1 VAL 30 7.394 -4.260 2.579 252 2HG1 VAL 30 2HG1 VAL 30 5.874 -5.146 2.459 253 3HG1 VAL 30 3HG1 VAL 30 5.860 -3.392 2.633 254 1HG2 VAL 30 1HG2 VAL 30 8.179 -2.940 1.146 255 2HG2 VAL 30 2HG2 VAL 30 7.472 -2.560 -0.424 256 3HG2 VAL 30 3HG2 VAL 30 8.379 -4.056 -0.204 257 H LEU 31 H LEU 31 4.206 -5.107 -1.308 258 HA LEU 31 HA LEU 31 2.235 -6.050 0.516 259 1HB LEU 31 2HB LEU 31 2.259 -4.954 -2.066 260 2HB LEU 31 1HB LEU 31 1.519 -6.541 -2.267 261 HG LEU 31 HG LEU 31 -0.203 -4.892 -1.770 262 1HD1 LEU 31 1HD1 LEU 31 -1.330 -6.118 -0.133 263 2HD1 LEU 31 2HD1 LEU 31 0.132 -6.381 0.818 264 3HD1 LEU 31 3HD1 LEU 31 -0.120 -7.278 -0.679 265 1HD2 LEU 31 1HD2 LEU 31 1.797 -3.843 -0.036 266 2HD2 LEU 31 2HD2 LEU 31 0.419 -4.288 0.969 267 3HD2 LEU 31 3HD2 LEU 31 0.202 -3.171 -0.377 268 H SER 32 H SER 32 3.990 -7.721 -2.084 269 HA SER 32 HA SER 32 2.651 -10.213 -2.001 270 1HB SER 32 2HB SER 32 4.425 -9.438 -3.666 271 2HB SER 32 1HB SER 32 5.625 -9.888 -2.458 272 HG SER 32 HG SER 32 5.385 -11.727 -3.541 273 H LEU 33 H LEU 33 5.116 -8.907 0.174 274 HA LEU 33 HA LEU 33 5.784 -11.405 1.449 275 1HB LEU 33 2HB LEU 33 6.066 -8.505 2.212 276 2HB LEU 33 1HB LEU 33 6.437 -9.772 3.381 277 HG LEU 33 HG LEU 33 7.610 -10.317 0.761 278 1HD1 LEU 33 1HD1 LEU 33 9.410 -8.406 1.583 279 2HD1 LEU 33 2HD1 LEU 33 7.866 -7.617 1.909 280 3HD1 LEU 33 3HD1 LEU 33 8.238 -8.189 0.283 281 1HD2 LEU 33 1HD2 LEU 33 8.253 -11.501 2.795 282 2HD2 LEU 33 2HD2 LEU 33 8.702 -9.982 3.573 283 3HD2 LEU 33 3HD2 LEU 33 9.639 -10.585 2.205 284 H GLN 34 H GLN 34 3.206 -9.040 1.928 285 HA GLN 34 HA GLN 34 2.298 -10.257 4.436 286 1HB GLN 34 2HB GLN 34 1.257 -8.053 2.659 287 2HB GLN 34 1HB GLN 34 0.305 -8.669 4.009 288 1HG GLN 34 2HG GLN 34 1.445 -7.083 5.193 289 2HG GLN 34 1HG GLN 34 2.703 -8.318 5.238 290 1HE2 GLN 34 1HE2 GLN 34 1.575 -5.780 2.905 291 2HE2 GLN 34 2HE2 GLN 34 3.141 -5.273 2.492 292 H ILE 35 H ILE 35 1.129 -10.192 1.037 293 HA ILE 35 HA ILE 35 -0.807 -12.337 1.808 294 HB ILE 35 HB ILE 35 -2.127 -11.660 -0.173 295 1HG1 ILE 35 2HG1 ILE 35 -0.039 -9.462 -0.415 296 2HG1 ILE 35 1HG1 ILE 35 -0.288 -10.774 -1.565 297 1HG2 ILE 35 1HG2 ILE 35 -3.127 -9.873 0.913 298 2HG2 ILE 35 2HG2 ILE 35 -1.583 -9.123 1.323 299 3HG2 ILE 35 3HG2 ILE 35 -2.147 -10.530 2.225 300 1HD1 ILE 35 1HD1 ILE 35 -2.316 -9.908 -2.324 301 2HD1 ILE 35 2HD1 ILE 35 -1.404 -8.432 -2.005 302 3HD1 ILE 35 3HD1 ILE 35 -2.600 -8.998 -0.841 303 H GLY 36 H GLY 36 1.429 -11.396 -0.842 304 1HA GLY 36 2HA GLY 36 2.942 -13.056 -1.811 305 2HA GLY 36 1HA GLY 36 1.765 -14.307 -1.411 306 H THR 37 H THR 37 1.631 -11.208 -3.212 307 HA THR 37 HA THR 37 0.183 -12.667 -5.385 308 HB THR 37 HB THR 37 -0.165 -9.947 -5.872 309 HG1 THR 37 HG1 THR 37 0.197 -9.055 -4.007 310 1HG2 THR 37 1HG2 THR 37 -2.435 -10.623 -4.539 311 2HG2 THR 37 2HG2 THR 37 -1.758 -12.220 -4.860 312 3HG2 THR 37 3HG2 THR 37 -2.086 -11.117 -6.197 313 H GLN 38 H GLN 38 3.042 -10.857 -4.623 314 HA GLN 38 HA GLN 38 4.970 -10.452 -5.881 315 1HB GLN 38 2HB GLN 38 3.551 -11.885 -8.148 316 2HB GLN 38 1HB GLN 38 5.278 -11.564 -8.019 317 1HG GLN 38 2HG GLN 38 4.062 -13.014 -5.731 318 2HG GLN 38 1HG GLN 38 4.150 -13.905 -7.250 319 1HE2 GLN 38 1HE2 GLN 38 6.327 -14.196 -8.229 320 2HE2 GLN 38 2HE2 GLN 38 7.714 -14.087 -7.255 321 HA PRO 39 HA PRO 39 4.009 -6.780 -8.086 322 1HB PRO 39 2HB PRO 39 6.406 -6.407 -9.396 323 2HB PRO 39 1HB PRO 39 6.167 -6.087 -7.670 324 1HG PRO 39 2HG PRO 39 7.578 -8.365 -8.980 325 2HG PRO 39 1HG PRO 39 7.835 -7.657 -7.376 326 1HD PRO 39 2HD PRO 39 6.445 -10.056 -7.911 327 2HD PRO 39 1HD PRO 39 6.406 -9.150 -6.384 328 H ASN 40 H ASN 40 2.519 -8.346 -9.372 329 HA ASN 40 HA ASN 40 2.890 -7.853 -12.212 330 1HB ASN 40 2HB ASN 40 4.043 -10.209 -11.282 331 2HB ASN 40 1HB ASN 40 2.472 -10.735 -11.885 332 1HD2 ASN 40 1HD2 ASN 40 2.003 -10.391 -14.194 333 2HD2 ASN 40 2HD2 ASN 40 3.252 -10.058 -15.296 334 H LYS 41 H LYS 41 1.122 -9.831 -9.792 335 HA LYS 41 HA LYS 41 -1.390 -9.381 -11.329 336 1HB LYS 41 2HB LYS 41 -0.477 -11.655 -10.167 337 2HB LYS 41 1HB LYS 41 -1.434 -11.000 -8.839 338 1HG LYS 41 2HG LYS 41 -3.005 -10.637 -11.155 339 2HG LYS 41 1HG LYS 41 -2.341 -12.267 -11.282 340 1HD LYS 41 2HD LYS 41 -3.135 -11.896 -8.571 341 2HD LYS 41 1HD LYS 41 -4.465 -11.334 -9.586 342 1HE LYS 41 2HE LYS 41 -3.966 -13.556 -10.927 343 2HE LYS 41 1HE LYS 41 -3.252 -14.071 -9.400 344 1HZ LYS 41 1HZ LYS 41 -5.926 -14.079 -10.081 345 2HZ LYS 41 2HZ LYS 41 -5.755 -12.810 -8.963 346 3HZ LYS 41 3HZ LYS 41 -5.258 -14.384 -8.551 347 H ILE 42 H ILE 42 0.230 -7.566 -9.201 348 HA ILE 42 HA ILE 42 -2.054 -7.019 -7.377 349 HB ILE 42 HB ILE 42 0.771 -5.904 -7.367 350 1HG1 ILE 42 2HG1 ILE 42 -0.504 -7.929 -5.503 351 2HG1 ILE 42 1HG1 ILE 42 0.522 -8.374 -6.867 352 1HG2 ILE 42 1HG2 ILE 42 -1.679 -5.200 -5.935 353 2HG2 ILE 42 2HG2 ILE 42 -0.139 -4.344 -6.003 354 3HG2 ILE 42 3HG2 ILE 42 -0.374 -5.644 -4.835 355 1HD1 ILE 42 1HD1 ILE 42 2.224 -6.694 -5.815 356 2HD1 ILE 42 2HD1 ILE 42 2.054 -8.294 -5.094 357 3HD1 ILE 42 3HD1 ILE 42 1.266 -6.903 -4.349 358 H VAL 43 H VAL 43 -3.300 -5.231 -7.604 359 HA VAL 43 HA VAL 43 -2.440 -3.133 -9.561 360 HB VAL 43 HB VAL 43 -5.265 -4.120 -9.021 361 1HG1 VAL 43 1HG1 VAL 43 -5.889 -2.162 -9.944 362 2HG1 VAL 43 2HG1 VAL 43 -5.083 -2.658 -11.433 363 3HG1 VAL 43 3HG1 VAL 43 -4.207 -1.714 -10.226 364 1HG2 VAL 43 1HG2 VAL 43 -3.894 -5.755 -10.284 365 2HG2 VAL 43 2HG2 VAL 43 -3.475 -4.496 -11.446 366 3HG2 VAL 43 3HG2 VAL 43 -5.145 -5.044 -11.305 367 H LEU 44 H LEU 44 -1.863 -1.431 -8.258 368 HA LEU 44 HA LEU 44 -3.424 -0.921 -5.777 369 1HB LEU 44 2HB LEU 44 -0.813 0.250 -6.786 370 2HB LEU 44 1HB LEU 44 -1.579 0.688 -5.261 371 HG LEU 44 HG LEU 44 -1.027 -2.203 -5.882 372 1HD1 LEU 44 1HD1 LEU 44 1.165 -1.953 -4.747 373 2HD1 LEU 44 2HD1 LEU 44 0.937 -0.204 -4.720 374 3HD1 LEU 44 3HD1 LEU 44 1.104 -1.049 -6.259 375 1HD2 LEU 44 1HD2 LEU 44 -0.769 -0.856 -3.212 376 2HD2 LEU 44 2HD2 LEU 44 -1.287 -2.499 -3.588 377 3HD2 LEU 44 3HD2 LEU 44 -2.382 -1.144 -3.864 378 H GLN 45 H GLN 45 -4.740 0.858 -5.551 379 HA GLN 45 HA GLN 45 -4.732 2.873 -7.763 380 1HB GLN 45 2HB GLN 45 -7.259 2.189 -6.277 381 2HB GLN 45 1HB GLN 45 -7.077 2.919 -7.866 382 1HG GLN 45 2HG GLN 45 -5.824 0.439 -8.127 383 2HG GLN 45 1HG GLN 45 -7.241 0.097 -7.136 384 1HE2 GLN 45 1HE2 GLN 45 -9.398 0.878 -8.053 385 2HE2 GLN 45 2HE2 GLN 45 -9.571 0.958 -9.740 386 H LYS 46 H LYS 46 -4.995 5.042 -7.122 387 HA LYS 46 HA LYS 46 -5.153 5.525 -4.173 388 1HB LYS 46 2HB LYS 46 -2.932 5.985 -5.784 389 2HB LYS 46 1HB LYS 46 -3.684 7.576 -5.664 390 1HG LYS 46 2HG LYS 46 -3.761 6.317 -3.085 391 2HG LYS 46 1HG LYS 46 -2.113 6.238 -3.704 392 1HD LYS 46 2HD LYS 46 -1.885 8.552 -3.784 393 2HD LYS 46 1HD LYS 46 -3.622 8.819 -3.940 394 1HE LYS 46 2HE LYS 46 -2.818 9.474 -1.694 395 2HE LYS 46 1HE LYS 46 -3.953 8.125 -1.602 396 1HZ LYS 46 1HZ LYS 46 -2.180 6.599 -1.323 397 2HZ LYS 46 2HZ LYS 46 -1.894 7.875 -0.238 398 3HZ LYS 46 3HZ LYS 46 -1.009 7.770 -1.684 399 H GLY 47 H GLY 47 -7.431 5.934 -4.426 400 1HA GLY 47 2HA GLY 47 -9.224 7.446 -4.540 401 2HA GLY 47 1HA GLY 47 -8.069 8.700 -4.989 402 H GLY 48 H GLY 48 -9.083 5.638 -6.567 403 1HA GLY 48 2HA GLY 48 -10.033 5.271 -8.685 404 2HA GLY 48 1HA GLY 48 -10.459 6.981 -8.728 405 H SER 49 H SER 49 -7.241 5.454 -8.461 406 HA SER 49 HA SER 49 -6.560 6.378 -11.192 407 1HB SER 49 2HB SER 49 -4.582 7.607 -10.431 408 2HB SER 49 1HB SER 49 -6.023 8.286 -9.683 409 HG SER 49 HG SER 49 -4.328 7.941 -8.174 410 H VAL 50 H VAL 50 -5.220 4.908 -12.174 411 HA VAL 50 HA VAL 50 -4.429 2.519 -10.685 412 HB VAL 50 HB VAL 50 -3.793 3.318 -13.546 413 1HG1 VAL 50 1HG1 VAL 50 -2.767 1.313 -13.778 414 2HG1 VAL 50 2HG1 VAL 50 -4.026 0.474 -12.871 415 3HG1 VAL 50 3HG1 VAL 50 -2.707 1.274 -12.016 416 1HG2 VAL 50 1HG2 VAL 50 -5.989 2.959 -13.931 417 2HG2 VAL 50 2HG2 VAL 50 -6.252 2.450 -12.263 418 3HG2 VAL 50 3HG2 VAL 50 -5.730 1.276 -13.472 419 H LEU 51 H LEU 51 -2.546 2.300 -9.617 420 HA LEU 51 HA LEU 51 -0.399 4.297 -9.989 421 1HB LEU 51 2HB LEU 51 -0.472 1.964 -8.050 422 2HB LEU 51 1HB LEU 51 0.559 3.391 -7.964 423 HG LEU 51 HG LEU 51 -2.463 3.344 -7.677 424 1HD1 LEU 51 1HD1 LEU 51 -1.268 4.523 -5.445 425 2HD1 LEU 51 2HD1 LEU 51 -0.234 3.142 -5.810 426 3HD1 LEU 51 3HD1 LEU 51 -1.957 2.902 -5.524 427 1HD2 LEU 51 1HD2 LEU 51 -0.603 5.476 -8.367 428 2HD2 LEU 51 2HD2 LEU 51 -1.444 5.823 -6.857 429 3HD2 LEU 51 3HD2 LEU 51 -2.365 5.504 -8.327 430 H LYS 52 H LYS 52 1.360 3.890 -11.241 431 HA LYS 52 HA LYS 52 1.820 1.076 -12.132 432 1HB LYS 52 2HB LYS 52 1.897 3.674 -13.478 433 2HB LYS 52 1HB LYS 52 3.342 2.708 -13.778 434 1HG LYS 52 2HG LYS 52 0.773 1.238 -13.917 435 2HG LYS 52 1HG LYS 52 1.036 2.429 -15.190 436 1HD LYS 52 2HD LYS 52 2.770 1.257 -16.116 437 2HD LYS 52 1HD LYS 52 3.353 0.682 -14.553 438 1HE LYS 52 2HE LYS 52 1.092 -0.700 -14.582 439 2HE LYS 52 1HE LYS 52 1.225 -0.467 -16.324 440 1HZ LYS 52 1HZ LYS 52 3.008 -1.806 -16.458 441 2HZ LYS 52 2HZ LYS 52 2.407 -2.451 -15.008 442 3HZ LYS 52 3HZ LYS 52 3.657 -1.303 -14.974 443 H ASP 53 H ASP 53 3.897 0.196 -12.046 444 HA ASP 53 HA ASP 53 5.598 0.984 -9.897 445 1HB ASP 53 2HB ASP 53 7.178 -0.683 -10.786 446 2HB ASP 53 1HB ASP 53 5.534 -1.319 -10.805 447 H HIS 54 H HIS 54 5.511 1.987 -13.247 448 HA HIS 54 HA HIS 54 8.210 2.992 -13.415 449 1HB HIS 54 2HB HIS 54 5.710 3.704 -14.975 450 2HB HIS 54 1HB HIS 54 7.334 4.247 -15.395 451 HD1 HIS 54 HD1 HIS 54 9.114 2.251 -15.882 452 HD2 HIS 54 HD2 HIS 54 5.091 1.160 -15.905 453 HE1 HIS 54 HE1 HIS 54 8.988 0.004 -17.041 454 H ILE 55 H ILE 55 5.492 4.149 -11.678 455 HA ILE 55 HA ILE 55 6.622 6.919 -11.639 456 HB ILE 55 HB ILE 55 3.848 5.939 -10.886 457 1HG1 ILE 55 2HG1 ILE 55 3.461 7.716 -12.872 458 2HG1 ILE 55 1HG1 ILE 55 5.066 7.147 -13.331 459 1HG2 ILE 55 1HG2 ILE 55 5.309 8.464 -10.411 460 2HG2 ILE 55 2HG2 ILE 55 3.894 7.812 -9.587 461 3HG2 ILE 55 3HG2 ILE 55 3.706 8.665 -11.118 462 1HD1 ILE 55 1HD1 ILE 55 2.676 5.887 -13.949 463 2HD1 ILE 55 2HD1 ILE 55 3.266 4.964 -12.567 464 3HD1 ILE 55 3HD1 ILE 55 4.271 5.139 -14.006 465 H SER 56 H SER 56 7.195 7.827 -9.663 466 HA SER 56 HA SER 56 7.790 5.973 -7.498 467 1HB SER 56 2HB SER 56 8.937 8.293 -8.339 468 2HB SER 56 1HB SER 56 7.994 8.878 -6.971 469 HG SER 56 HG SER 56 9.583 8.102 -5.835 470 H LEU 57 H LEU 57 6.984 6.134 -5.320 471 HA LEU 57 HA LEU 57 4.154 6.506 -5.093 472 1HB LEU 57 2HB LEU 57 6.334 6.287 -2.997 473 2HB LEU 57 1HB LEU 57 4.617 6.354 -2.598 474 HG LEU 57 HG LEU 57 5.689 4.334 -4.571 475 1HD1 LEU 57 1HD1 LEU 57 6.808 4.276 -2.226 476 2HD1 LEU 57 2HD1 LEU 57 6.113 2.781 -2.851 477 3HD1 LEU 57 3HD1 LEU 57 5.233 3.730 -1.653 478 1HD2 LEU 57 1HD2 LEU 57 3.210 4.853 -4.362 479 2HD2 LEU 57 2HD2 LEU 57 3.297 4.242 -2.709 480 3HD2 LEU 57 3HD2 LEU 57 3.640 3.168 -4.066 481 H GLU 58 H GLU 58 6.890 8.662 -4.489 482 HA GLU 58 HA GLU 58 5.536 10.683 -3.002 483 1HB GLU 58 2HB GLU 58 8.054 10.471 -3.474 484 2HB GLU 58 1HB GLU 58 7.713 11.230 -5.030 485 1HG GLU 58 2HG GLU 58 8.321 13.007 -3.540 486 2HG GLU 58 1HG GLU 58 6.571 13.102 -3.731 487 H ASP 59 H ASP 59 5.686 10.030 -6.484 488 HA ASP 59 HA ASP 59 4.503 12.497 -7.370 489 1HB ASP 59 2HB ASP 59 4.496 9.725 -8.608 490 2HB ASP 59 1HB ASP 59 3.915 11.174 -9.429 491 H TYR 60 H TYR 60 3.099 9.315 -6.556 492 HA TYR 60 HA TYR 60 0.361 10.151 -7.032 493 1HB TYR 60 2HB TYR 60 1.550 7.800 -5.535 494 2HB TYR 60 1HB TYR 60 -0.184 8.027 -5.767 495 HD1 TYR 60 HD1 TYR 60 -0.724 8.788 -8.369 496 HD2 TYR 60 HD2 TYR 60 2.540 6.328 -7.041 497 HE1 TYR 60 HE1 TYR 60 -0.551 7.794 -10.633 498 HE2 TYR 60 HE2 TYR 60 2.712 5.335 -9.306 499 HH TYR 60 HH TYR 60 0.390 6.149 -11.863 500 H GLU 61 H GLU 61 2.581 10.632 -4.444 501 HA GLU 61 HA GLU 61 2.350 11.894 -2.495 502 1HB GLU 61 2HB GLU 61 0.185 12.745 -3.978 503 2HB GLU 61 1HB GLU 61 -0.582 12.141 -2.510 504 1HG GLU 61 2HG GLU 61 -0.042 14.470 -2.154 505 2HG GLU 61 1HG GLU 61 1.065 13.505 -1.179 506 H VAL 62 H VAL 62 2.857 9.576 -1.815 507 HA VAL 62 HA VAL 62 0.618 8.378 -0.239 508 HB VAL 62 HB VAL 62 3.317 7.186 -0.974 509 1HG1 VAL 62 1HG1 VAL 62 0.890 5.679 -0.020 510 2HG1 VAL 62 2HG1 VAL 62 1.995 6.410 1.142 511 3HG1 VAL 62 3HG1 VAL 62 2.583 5.187 0.017 512 1HG2 VAL 62 1HG2 VAL 62 0.966 7.549 -2.547 513 2HG2 VAL 62 2HG2 VAL 62 1.065 5.836 -2.141 514 3HG2 VAL 62 3HG2 VAL 62 2.412 6.626 -2.961 515 H HIS 63 H HIS 63 0.607 9.127 1.831 516 HA HIS 63 HA HIS 63 3.227 9.766 3.126 517 1HB HIS 63 2HB HIS 63 0.428 10.798 3.647 518 2HB HIS 63 1HB HIS 63 1.795 11.131 4.710 519 HD1 HIS 63 HD1 HIS 63 0.128 12.378 1.735 520 HD2 HIS 63 HD2 HIS 63 4.025 12.471 3.211 521 HE1 HIS 63 HE1 HIS 63 1.329 14.213 0.469 522 H ASP 64 H ASP 64 2.827 9.635 5.710 523 HA ASP 64 HA ASP 64 2.591 6.831 6.321 524 1HB ASP 64 2HB ASP 64 3.915 8.715 7.559 525 2HB ASP 64 1HB ASP 64 2.395 8.995 8.406 526 H GLN 65 H GLN 65 0.886 5.678 7.148 527 HA GLN 65 HA GLN 65 -1.318 5.137 7.701 528 1HB GLN 65 2HB GLN 65 -0.660 7.541 9.168 529 2HB GLN 65 1HB GLN 65 -2.366 7.556 8.726 530 1HG GLN 65 2HG GLN 65 -2.527 6.314 10.656 531 2HG GLN 65 1HG GLN 65 -2.187 5.002 9.527 532 1HE2 GLN 65 1HE2 GLN 65 -0.030 4.047 9.562 533 2HE2 GLN 65 2HE2 GLN 65 1.061 4.365 10.822 534 H THR 66 H THR 66 -0.794 6.097 5.024 535 HA THR 66 HA THR 66 -3.132 7.791 4.354 536 HB THR 66 HB THR 66 -0.862 8.136 3.273 537 HG1 THR 66 HG1 THR 66 -2.242 9.044 1.986 538 1HG2 THR 66 1HG2 THR 66 -0.257 6.601 1.437 539 2HG2 THR 66 2HG2 THR 66 -1.604 5.551 1.874 540 3HG2 THR 66 3HG2 THR 66 -0.257 5.769 2.992 541 H ASN 67 H ASN 67 -4.659 7.043 2.656 542 HA ASN 67 HA ASN 67 -5.239 4.145 2.993 543 1HB ASN 67 2HB ASN 67 -6.951 6.072 3.398 544 2HB ASN 67 1HB ASN 67 -7.073 6.112 1.638 545 1HD2 ASN 67 1HD2 ASN 67 -7.319 3.819 4.411 546 2HD2 ASN 67 2HD2 ASN 67 -8.438 2.791 3.652 547 H LEU 68 H LEU 68 -5.378 2.745 1.267 548 HA LEU 68 HA LEU 68 -4.984 3.787 -1.490 549 1HB LEU 68 2HB LEU 68 -2.864 2.754 -0.018 550 2HB LEU 68 1HB LEU 68 -3.410 1.369 -0.962 551 HG LEU 68 HG LEU 68 -3.394 3.740 -2.616 552 1HD1 LEU 68 1HD1 LEU 68 -1.285 4.598 -2.370 553 2HD1 LEU 68 2HD1 LEU 68 -0.601 3.050 -1.873 554 3HD1 LEU 68 3HD1 LEU 68 -1.491 4.036 -0.712 555 1HD2 LEU 68 1HD2 LEU 68 -1.354 1.862 -3.316 556 2HD2 LEU 68 2HD2 LEU 68 -2.940 2.070 -4.059 557 3HD2 LEU 68 3HD2 LEU 68 -2.739 0.952 -2.710 558 H GLU 69 H GLU 69 -5.409 2.024 -3.126 559 HA GLU 69 HA GLU 69 -7.477 0.129 -2.077 560 1HB GLU 69 2HB GLU 69 -7.165 1.544 -4.726 561 2HB GLU 69 1HB GLU 69 -8.218 0.141 -4.548 562 1HG GLU 69 2HG GLU 69 -9.784 1.697 -3.973 563 2HG GLU 69 1HG GLU 69 -8.994 1.627 -2.396 564 H LEU 70 H LEU 70 -7.434 -2.042 -2.806 565 HA LEU 70 HA LEU 70 -4.964 -2.858 -4.284 566 1HB LEU 70 2HB LEU 70 -4.832 -3.384 -1.837 567 2HB LEU 70 1HB LEU 70 -6.273 -4.383 -2.011 568 HG LEU 70 HG LEU 70 -5.126 -5.848 -3.588 569 1HD1 LEU 70 1HD1 LEU 70 -2.627 -5.457 -3.937 570 2HD1 LEU 70 2HD1 LEU 70 -2.883 -3.836 -3.292 571 3HD1 LEU 70 3HD1 LEU 70 -3.698 -4.334 -4.774 572 1HD2 LEU 70 1HD2 LEU 70 -4.812 -6.132 -1.077 573 2HD2 LEU 70 2HD2 LEU 70 -3.251 -5.335 -1.265 574 3HD2 LEU 70 3HD2 LEU 70 -3.561 -6.869 -2.078 575 H TYR 71 H TYR 71 -5.359 -4.094 -6.042 576 HA TYR 71 HA TYR 71 -7.923 -5.605 -6.212 577 1HB TYR 71 2HB TYR 71 -6.877 -3.504 -8.080 578 2HB TYR 71 1HB TYR 71 -7.776 -4.865 -8.753 579 HD1 TYR 71 HD1 TYR 71 -7.947 -1.942 -6.498 580 HD2 TYR 71 HD2 TYR 71 -10.141 -5.171 -8.295 581 HE1 TYR 71 HE1 TYR 71 -10.078 -0.888 -5.793 582 HE2 TYR 71 HE2 TYR 71 -12.270 -4.116 -7.590 583 HH TYR 71 HH TYR 71 -12.810 -1.298 -6.970 584 H TYR 72 H TYR 72 -7.792 -7.481 -7.593 585 HA TYR 72 HA TYR 72 -4.980 -8.342 -8.123 586 1HB TYR 72 2HB TYR 72 -7.461 -10.050 -7.746 587 2HB TYR 72 1HB TYR 72 -5.816 -10.646 -7.954 588 HD1 TYR 72 HD1 TYR 72 -8.174 -10.326 -5.544 589 HD2 TYR 72 HD2 TYR 72 -4.134 -9.062 -6.287 590 HE1 TYR 72 HE1 TYR 72 -7.790 -10.112 -3.104 591 HE2 TYR 72 HE2 TYR 72 -3.752 -8.850 -3.846 592 HH TYR 72 HH TYR 72 -5.046 -10.114 -1.663 593 H LEU 73 HN LEU 73 -4.395 -8.363 -10.206 594 HA LEU 73 HA LEU 73 -4.461 -8.744 -12.516 595 1HB LEU 73 2HB LEU 73 -6.266 -10.555 -11.690 596 2HB LEU 73 1HB LEU 73 -7.355 -9.467 -12.553 597 HG LEU 73 HG LEU 73 -5.059 -9.768 -14.190 598 1HD1 LEU 73 1HD1 LEU 73 -4.902 -11.885 -12.597 599 2HD1 LEU 73 2HD1 LEU 73 -4.601 -12.035 -14.328 600 3HD1 LEU 73 3HD1 LEU 73 -6.166 -12.501 -13.662 601 1HD2 LEU 73 1HD2 LEU 73 -6.867 -9.645 -15.541 602 2HD2 LEU 73 2HD2 LEU 73 -7.948 -10.199 -14.263 603 3HD2 LEU 73 3HD2 LEU 73 -7.083 -11.372 -15.256 Start of MODEL 13 1 H MET 1 1H MET 1 10.503 6.819 6.928 2 HA MET 1 HA MET 1 9.338 5.124 4.786 3 1HB MET 1 2HB MET 1 11.161 4.278 6.612 4 2HB MET 1 1HB MET 1 9.679 4.105 7.553 5 1HG MET 1 2HG MET 1 8.783 2.520 6.106 6 2HG MET 1 1HG MET 1 9.731 3.090 4.732 7 1HE MET 1 1HE MET 1 9.987 0.498 4.293 8 2HE MET 1 2HE MET 1 11.668 0.015 4.499 9 3HE MET 1 3HE MET 1 11.290 1.569 3.761 10 H ILE 2 H ILE 2 7.134 5.003 4.909 11 HA ILE 2 HA ILE 2 5.810 6.178 7.325 12 HB ILE 2 HB ILE 2 4.019 6.997 5.832 13 1HG1 ILE 2 2HG1 ILE 2 5.813 6.267 3.506 14 2HG1 ILE 2 1HG1 ILE 2 4.534 5.189 4.060 15 1HG2 ILE 2 1HG2 ILE 2 5.165 8.910 5.178 16 2HG2 ILE 2 2HG2 ILE 2 6.558 8.002 4.591 17 3HG2 ILE 2 3HG2 ILE 2 6.318 8.224 6.325 18 1HD1 ILE 2 1HD1 ILE 2 4.045 6.982 2.174 19 2HD1 ILE 2 2HD1 ILE 2 3.863 8.065 3.554 20 3HD1 ILE 2 3HD1 ILE 2 2.839 6.637 3.413 21 H GLU 3 H GLU 3 3.589 5.331 7.692 22 HA GLU 3 HA GLU 3 3.403 2.461 6.867 23 1HB GLU 3 2HB GLU 3 3.474 3.459 9.402 24 2HB GLU 3 1HB GLU 3 1.734 3.437 9.116 25 1HG GLU 3 2HG GLU 3 3.489 1.048 8.515 26 2HG GLU 3 1HG GLU 3 2.760 1.298 10.101 27 H VAL 4 H VAL 4 1.957 2.218 5.236 28 HA VAL 4 HA VAL 4 -0.470 3.968 5.231 29 HB VAL 4 HB VAL 4 -0.588 3.490 2.790 30 1HG1 VAL 4 1HG1 VAL 4 2.167 4.490 3.547 31 2HG1 VAL 4 2HG1 VAL 4 0.706 5.445 3.798 32 3HG1 VAL 4 3HG1 VAL 4 1.183 4.975 2.166 33 1HG2 VAL 4 1HG2 VAL 4 0.627 1.285 2.950 34 2HG2 VAL 4 2HG2 VAL 4 2.123 2.188 3.185 35 3HG2 VAL 4 3HG2 VAL 4 1.227 2.343 1.674 36 H VAL 5 H VAL 5 -2.496 2.984 4.643 37 HA VAL 5 HA VAL 5 -2.591 0.048 5.230 38 HB VAL 5 HB VAL 5 -5.125 0.698 5.670 39 1HG1 VAL 5 1HG1 VAL 5 -3.278 -0.143 7.265 40 2HG1 VAL 5 2HG1 VAL 5 -4.640 0.722 7.977 41 3HG1 VAL 5 3HG1 VAL 5 -3.101 1.548 7.736 42 1HG2 VAL 5 1HG2 VAL 5 -3.829 3.264 6.573 43 2HG2 VAL 5 2HG2 VAL 5 -5.540 2.909 6.340 44 3HG2 VAL 5 3HG2 VAL 5 -4.491 3.137 4.941 45 H VAL 6 H VAL 6 -3.537 -1.287 3.738 46 HA VAL 6 HA VAL 6 -4.753 0.006 1.324 47 HB VAL 6 HB VAL 6 -3.355 -2.673 1.283 48 1HG1 VAL 6 1HG1 VAL 6 -3.439 -2.446 -1.024 49 2HG1 VAL 6 2HG1 VAL 6 -3.462 -0.684 -0.955 50 3HG1 VAL 6 3HG1 VAL 6 -4.919 -1.601 -0.569 51 1HG2 VAL 6 1HG2 VAL 6 -2.173 0.060 1.395 52 2HG2 VAL 6 2HG2 VAL 6 -1.510 -1.031 0.179 53 3HG2 VAL 6 3HG2 VAL 6 -1.478 -1.486 1.883 54 H ASN 7 H ASN 7 -6.861 -0.513 1.058 55 HA ASN 7 HA ASN 7 -7.900 -2.990 2.376 56 1HB ASN 7 2HB ASN 7 -9.108 -0.298 1.800 57 2HB ASN 7 1HB ASN 7 -10.159 -1.708 1.935 58 1HD2 ASN 7 1HD2 ASN 7 -7.570 0.036 3.743 59 2HD2 ASN 7 2HD2 ASN 7 -8.136 -0.415 5.278 60 H ASP 8 H ASP 8 -9.000 -4.499 1.132 61 HA ASP 8 HA ASP 8 -8.614 -4.371 -1.759 62 1HB ASP 8 2HB ASP 8 -9.178 -6.406 0.225 63 2HB ASP 8 1HB ASP 8 -10.248 -6.580 -1.165 64 H ARG 9 H ARG 9 -11.094 -3.242 0.275 65 HA ARG 9 HA ARG 9 -13.221 -2.385 -0.176 66 1HB ARG 9 2HB ARG 9 -11.857 -2.392 -2.787 67 2HB ARG 9 1HB ARG 9 -13.615 -2.467 -2.908 68 1HG ARG 9 2HG ARG 9 -13.183 -0.157 -2.824 69 2HG ARG 9 1HG ARG 9 -13.589 -0.549 -1.150 70 1HD ARG 9 2HD ARG 9 -11.161 -0.817 -0.663 71 2HD ARG 9 1HD ARG 9 -10.799 -0.304 -2.311 72 HE ARG 9 HE ARG 9 -12.134 1.844 -1.575 73 1HH1 ARG 9 1HH2 ARG 9 -9.170 0.878 -0.649 74 2HH1 ARG 9 2HH2 ARG 9 -9.136 1.671 0.888 75 1HH2 ARG 9 2HH1 ARG 9 -12.536 2.423 0.871 76 2HH2 ARG 9 1HH1 ARG 9 -11.052 2.553 1.754 77 H LEU 10 H LEU 10 -12.851 -5.224 0.298 78 HA LEU 10 HA LEU 10 -15.453 -6.161 -0.694 79 1HB LEU 10 2HB LEU 10 -12.991 -6.978 -1.960 80 2HB LEU 10 1HB LEU 10 -13.725 -8.364 -1.156 81 HG LEU 10 HG LEU 10 -15.817 -6.901 -2.434 82 1HD1 LEU 10 1HD1 LEU 10 -14.536 -5.906 -4.081 83 2HD1 LEU 10 2HD1 LEU 10 -14.788 -7.483 -4.830 84 3HD1 LEU 10 3HD1 LEU 10 -13.276 -7.137 -3.992 85 1HD2 LEU 10 1HD2 LEU 10 -15.462 -9.172 -3.920 86 2HD2 LEU 10 2HD2 LEU 10 -16.294 -9.132 -2.366 87 3HD2 LEU 10 3HD2 LEU 10 -14.594 -9.595 -2.444 88 H GLY 11 H GLY 11 -12.457 -7.483 0.765 89 1HA GLY 11 2HA GLY 11 -13.576 -7.740 3.395 90 2HA GLY 11 1HA GLY 11 -13.685 -9.288 2.554 91 H LYS 12 H LYS 12 -11.153 -6.762 2.466 92 HA LYS 12 HA LYS 12 -9.257 -8.505 3.885 93 1HB LYS 12 2HB LYS 12 -9.453 -8.742 1.106 94 2HB LYS 12 1HB LYS 12 -8.061 -7.689 1.358 95 1HG LYS 12 2HG LYS 12 -7.313 -9.408 3.130 96 2HG LYS 12 1HG LYS 12 -8.498 -10.489 2.391 97 1HD LYS 12 2HD LYS 12 -7.411 -10.137 0.186 98 2HD LYS 12 1HD LYS 12 -6.197 -9.124 0.966 99 1HE LYS 12 2HE LYS 12 -5.701 -11.115 2.484 100 2HE LYS 12 1HE LYS 12 -6.684 -12.079 1.382 101 1HZ LYS 12 1HZ LYS 12 -4.386 -12.208 0.740 102 2HZ LYS 12 2HZ LYS 12 -4.261 -10.515 0.676 103 3HZ LYS 12 3HZ LYS 12 -5.239 -11.340 -0.441 104 H LYS 13 H LYS 13 -7.805 -7.258 4.966 105 HA LYS 13 HA LYS 13 -7.301 -4.481 4.001 106 1HB LYS 13 2HB LYS 13 -9.031 -4.475 5.823 107 2HB LYS 13 1HB LYS 13 -7.844 -5.221 6.894 108 1HG LYS 13 2HG LYS 13 -6.736 -2.895 5.541 109 2HG LYS 13 1HG LYS 13 -8.186 -2.479 6.457 110 1HD LYS 13 2HD LYS 13 -7.264 -3.437 8.479 111 2HD LYS 13 1HD LYS 13 -5.882 -4.084 7.593 112 1HE LYS 13 2HE LYS 13 -5.438 -1.610 6.921 113 2HE LYS 13 1HE LYS 13 -6.506 -1.216 8.268 114 1HZ LYS 13 1HZ LYS 13 -5.063 -2.106 9.797 115 2HZ LYS 13 2HZ LYS 13 -3.972 -1.463 8.664 116 3HZ LYS 13 3HZ LYS 13 -4.306 -3.128 8.674 117 H VAL 14 H VAL 14 -5.152 -4.544 3.536 118 HA VAL 14 HA VAL 14 -3.332 -5.904 5.490 119 HB VAL 14 HB VAL 14 -2.802 -5.414 2.544 120 1HG1 VAL 14 1HG1 VAL 14 -0.750 -5.634 3.761 121 2HG1 VAL 14 2HG1 VAL 14 -1.047 -7.206 3.019 122 3HG1 VAL 14 3HG1 VAL 14 -1.389 -6.962 4.731 123 1HG2 VAL 14 1HG2 VAL 14 -3.028 -8.115 2.802 124 2HG2 VAL 14 2HG2 VAL 14 -4.358 -7.074 2.291 125 3HG2 VAL 14 3HG2 VAL 14 -4.234 -7.586 3.975 126 H ARG 15 H ARG 15 -1.793 -4.661 6.423 127 HA ARG 15 HA ARG 15 -1.521 -1.836 5.506 128 1HB ARG 15 2HB ARG 15 -0.665 -1.366 7.745 129 2HB ARG 15 1HB ARG 15 -2.191 -2.235 7.880 130 1HG ARG 15 2HG ARG 15 -0.307 -4.274 7.766 131 2HG ARG 15 1HG ARG 15 0.484 -3.041 8.747 132 1HD ARG 15 2HD ARG 15 -0.867 -3.467 10.496 133 2HD ARG 15 1HD ARG 15 -2.307 -3.305 9.491 134 HE ARG 15 HE ARG 15 -0.857 -5.834 10.038 135 1HH1 ARG 15 2HH1 ARG 15 -3.847 -5.088 10.463 136 2HH1 ARG 15 1HH1 ARG 15 -4.576 -6.044 9.216 137 1HH2 ARG 15 1HH2 ARG 15 -1.584 -6.645 7.559 138 2HH2 ARG 15 2HH2 ARG 15 -3.293 -6.927 7.569 139 H VAL 16 H VAL 16 0.606 -0.967 5.157 140 HA VAL 16 HA VAL 16 2.924 -2.782 5.332 141 HB VAL 16 HB VAL 16 1.746 -3.276 3.143 142 1HG1 VAL 16 1HG1 VAL 16 1.624 -1.669 1.435 143 2HG1 VAL 16 2HG1 VAL 16 2.822 -0.625 2.198 144 3HG1 VAL 16 3HG1 VAL 16 1.195 -0.741 2.871 145 1HG2 VAL 16 1HG2 VAL 16 4.155 -3.722 3.471 146 2HG2 VAL 16 2HG2 VAL 16 4.528 -2.075 2.962 147 3HG2 VAL 16 3HG2 VAL 16 3.824 -3.213 1.814 148 H LYS 17 H LYS 17 4.937 -1.655 5.155 149 HA LYS 17 HA LYS 17 4.659 1.319 5.304 150 1HB LYS 17 2HB LYS 17 6.672 1.318 6.690 151 2HB LYS 17 1HB LYS 17 5.469 0.232 7.384 152 1HG LYS 17 2HG LYS 17 6.602 -1.692 6.329 153 2HG LYS 17 1HG LYS 17 7.812 -0.602 5.649 154 1HD LYS 17 2HD LYS 17 8.990 -0.795 7.554 155 2HD LYS 17 1HD LYS 17 7.667 0.002 8.411 156 1HE LYS 17 2HE LYS 17 6.655 -2.521 8.153 157 2HE LYS 17 1HE LYS 17 8.380 -2.873 8.289 158 1HZ LYS 17 1HZ LYS 17 6.557 -1.679 10.237 159 2HZ LYS 17 2HZ LYS 17 8.159 -1.109 10.227 160 3HZ LYS 17 3HZ LYS 17 7.841 -2.758 10.478 161 H CYS 18 H CYS 18 5.994 2.598 4.027 162 HA CYS 18 HA CYS 18 8.221 1.460 2.499 163 1HB CYS 18 2HB CYS 18 5.558 1.612 1.345 164 2HB CYS 18 1HB CYS 18 6.686 2.636 0.455 165 HG CYS 18 HG CYS 18 6.919 -0.450 0.745 166 H LEU 19 H LEU 19 9.440 3.161 1.382 167 HA LEU 19 HA LEU 19 9.227 5.751 2.726 168 1HB LEU 19 2HB LEU 19 11.157 4.438 0.863 169 2HB LEU 19 1HB LEU 19 11.127 6.200 0.883 170 HG LEU 19 HG LEU 19 11.062 5.063 3.576 171 1HD1 LEU 19 1HD1 LEU 19 12.423 3.287 2.774 172 2HD1 LEU 19 2HD1 LEU 19 13.561 4.466 3.427 173 3HD1 LEU 19 3HD1 LEU 19 13.309 4.354 1.684 174 1HD2 LEU 19 1HD2 LEU 19 12.573 6.820 4.012 175 2HD2 LEU 19 2HD2 LEU 19 11.597 7.457 2.688 176 3HD2 LEU 19 3HD2 LEU 19 13.205 6.807 2.366 177 H ALA 20 H ALA 20 8.710 7.737 1.716 178 HA ALA 20 HA ALA 20 6.715 7.659 -0.342 179 1HB ALA 20 1HB ALA 20 7.388 9.505 1.487 180 2HB ALA 20 2HB ALA 20 6.509 9.925 0.017 181 3HB ALA 20 3HB ALA 20 8.253 10.176 0.105 182 H GLU 21 H GLU 21 10.198 7.816 -0.465 183 HA GLU 21 HA GLU 21 10.239 8.761 -3.258 184 1HB GLU 21 2HB GLU 21 12.676 8.578 -3.066 185 2HB GLU 21 1HB GLU 21 12.025 9.454 -1.683 186 1HG GLU 21 2HG GLU 21 11.929 6.948 -0.685 187 2HG GLU 21 1HG GLU 21 13.284 6.759 -1.796 188 H ASP 22 H ASP 22 9.976 5.745 -1.615 189 HA ASP 22 HA ASP 22 11.348 4.010 -3.416 190 1HB ASP 22 2HB ASP 22 9.435 3.743 -1.238 191 2HB ASP 22 1HB ASP 22 9.087 2.599 -2.533 192 H SER 23 H SER 23 10.548 2.783 -5.201 193 HA SER 23 HA SER 23 8.633 4.223 -6.863 194 1HB SER 23 2HB SER 23 9.149 2.500 -8.551 195 2HB SER 23 1HB SER 23 10.624 3.164 -7.855 196 HG SER 23 HG SER 23 10.673 0.881 -7.936 197 H VAL 24 H VAL 24 6.714 3.196 -7.830 198 HA VAL 24 HA VAL 24 4.991 1.965 -5.902 199 HB VAL 24 HB VAL 24 4.798 2.153 -8.921 200 1HG1 VAL 24 1HG1 VAL 24 2.359 1.643 -8.528 201 2HG1 VAL 24 2HG1 VAL 24 2.779 1.190 -6.876 202 3HG1 VAL 24 3HG1 VAL 24 3.434 0.277 -8.235 203 1HG2 VAL 24 1HG2 VAL 24 4.011 4.233 -8.546 204 2HG2 VAL 24 2HG2 VAL 24 4.479 4.050 -6.855 205 3HG2 VAL 24 3HG2 VAL 24 2.847 3.626 -7.368 206 H GLY 25 H GLY 25 7.024 0.628 -8.495 207 1HA GLY 25 2HA GLY 25 6.100 -2.061 -8.445 208 2HA GLY 25 1HA GLY 25 7.738 -1.575 -8.888 209 H ASP 26 H ASP 26 8.517 -0.377 -6.445 210 HA ASP 26 HA ASP 26 9.337 -2.665 -4.906 211 1HB ASP 26 2HB ASP 26 10.170 -0.060 -5.076 212 2HB ASP 26 1HB ASP 26 9.319 -0.042 -3.531 213 H PHE 27 H PHE 27 6.781 -0.228 -4.491 214 HA PHE 27 HA PHE 27 5.857 -1.006 -1.907 215 1HB PHE 27 2HB PHE 27 5.192 1.056 -3.281 216 2HB PHE 27 1HB PHE 27 4.092 -0.006 -4.158 217 HD1 PHE 27 HD1 PHE 27 4.668 1.850 -1.090 218 HD2 PHE 27 HD2 PHE 27 2.282 -1.234 -2.894 219 HE1 PHE 27 HE1 PHE 27 2.991 2.085 0.718 220 HE2 PHE 27 HE2 PHE 27 0.605 -0.997 -1.084 221 HZ PHE 27 HZ PHE 27 0.960 0.662 0.721 222 H LYS 28 H LYS 28 4.918 -2.119 -5.166 223 HA LYS 28 HA LYS 28 2.897 -3.963 -4.297 224 1HB LYS 28 2HB LYS 28 4.537 -3.652 -6.801 225 2HB LYS 28 1HB LYS 28 3.496 -5.062 -6.595 226 1HG LYS 28 2HG LYS 28 1.640 -3.373 -5.993 227 2HG LYS 28 1HG LYS 28 2.706 -2.150 -6.684 228 1HD LYS 28 2HD LYS 28 2.339 -4.578 -8.340 229 2HD LYS 28 1HD LYS 28 0.902 -3.574 -8.143 230 1HE LYS 28 2HE LYS 28 3.363 -2.050 -8.684 231 2HE LYS 28 1HE LYS 28 2.876 -3.118 -9.998 232 1HZ LYS 28 1HZ LYS 28 1.866 -0.656 -9.524 233 2HZ LYS 28 2HZ LYS 28 0.685 -1.663 -8.838 234 3HZ LYS 28 3HZ LYS 28 1.123 -1.851 -10.468 235 H LYS 29 H LYS 29 6.406 -4.229 -4.649 236 HA LYS 29 HA LYS 29 6.567 -7.094 -4.398 237 1HB LYS 29 2HB LYS 29 8.529 -4.852 -3.899 238 2HB LYS 29 1HB LYS 29 8.956 -6.542 -3.622 239 1HG LYS 29 2HG LYS 29 7.734 -6.570 -6.124 240 2HG LYS 29 1HG LYS 29 8.694 -5.089 -6.138 241 1HD LYS 29 2HD LYS 29 10.438 -6.849 -4.975 242 2HD LYS 29 1HD LYS 29 9.580 -7.901 -6.104 243 1HE LYS 29 2HE LYS 29 10.324 -6.744 -7.961 244 2HE LYS 29 1HE LYS 29 10.476 -5.223 -7.079 245 1HZ LYS 29 1HZ LYS 29 12.243 -7.584 -6.738 246 2HZ LYS 29 2HZ LYS 29 12.396 -6.095 -5.934 247 3HZ LYS 29 3HZ LYS 29 12.637 -6.185 -7.613 248 H VAL 30 H VAL 30 6.654 -4.435 -2.014 249 HA VAL 30 HA VAL 30 7.127 -6.173 0.258 250 HB VAL 30 HB VAL 30 5.820 -3.431 0.280 251 1HG1 VAL 30 1HG1 VAL 30 7.467 -4.907 2.359 252 2HG1 VAL 30 2HG1 VAL 30 5.710 -4.760 2.386 253 3HG1 VAL 30 3HG1 VAL 30 6.717 -3.323 2.556 254 1HG2 VAL 30 1HG2 VAL 30 8.311 -2.811 0.879 255 2HG2 VAL 30 2HG2 VAL 30 7.842 -2.978 -0.812 256 3HG2 VAL 30 3HG2 VAL 30 8.690 -4.294 0.002 257 H LEU 31 H LEU 31 4.261 -5.032 -1.451 258 HA LEU 31 HA LEU 31 2.349 -5.934 0.542 259 1HB LEU 31 2HB LEU 31 2.240 -4.381 -1.780 260 2HB LEU 31 1HB LEU 31 1.343 -5.838 -2.204 261 HG LEU 31 HG LEU 31 -0.172 -4.181 -1.226 262 1HD1 LEU 31 1HD1 LEU 31 0.253 -6.241 0.929 263 2HD1 LEU 31 2HD1 LEU 31 -0.283 -6.726 -0.679 264 3HD1 LEU 31 3HD1 LEU 31 -1.264 -5.617 0.280 265 1HD2 LEU 31 1HD2 LEU 31 1.421 -4.394 1.335 266 2HD2 LEU 31 2HD2 LEU 31 0.147 -3.241 0.937 267 3HD2 LEU 31 3HD2 LEU 31 1.722 -3.120 0.153 268 H SER 32 H SER 32 3.488 -7.253 -2.583 269 HA SER 32 HA SER 32 1.939 -9.579 -2.737 270 1HB SER 32 2HB SER 32 3.804 -10.546 -4.061 271 2HB SER 32 1HB SER 32 3.435 -8.894 -4.539 272 HG SER 32 HG SER 32 5.691 -9.289 -4.254 273 H LEU 33 H LEU 33 4.653 -8.962 -0.576 274 HA LEU 33 HA LEU 33 5.180 -11.713 0.107 275 1HB LEU 33 2HB LEU 33 5.726 -9.081 1.489 276 2HB LEU 33 1HB LEU 33 6.153 -10.623 2.233 277 HG LEU 33 HG LEU 33 6.980 -10.160 -0.604 278 1HD1 LEU 33 1HD1 LEU 33 7.661 -8.350 1.494 279 2HD1 LEU 33 2HD1 LEU 33 8.311 -8.407 -0.146 280 3HD1 LEU 33 3HD1 LEU 33 9.090 -9.322 1.146 281 1HD2 LEU 33 1HD2 LEU 33 9.064 -11.265 0.836 282 2HD2 LEU 33 2HD2 LEU 33 7.846 -12.187 -0.044 283 3HD2 LEU 33 3HD2 LEU 33 7.650 -11.889 1.683 284 H GLN 34 H GLN 34 2.983 -9.251 1.441 285 HA GLN 34 HA GLN 34 2.074 -11.017 3.597 286 1HB GLN 34 2HB GLN 34 1.135 -8.311 2.614 287 2HB GLN 34 1HB GLN 34 0.395 -9.159 3.972 288 1HG GLN 34 2HG GLN 34 2.458 -9.124 5.219 289 2HG GLN 34 1HG GLN 34 3.352 -8.521 3.823 290 1HE2 GLN 34 1HE2 GLN 34 2.676 -6.281 3.019 291 2HE2 GLN 34 2HE2 GLN 34 2.103 -5.163 4.160 292 H ILE 35 H ILE 35 0.490 -9.587 0.697 293 HA ILE 35 HA ILE 35 -1.877 -11.238 1.005 294 HB ILE 35 HB ILE 35 -2.424 -10.433 -1.328 295 1HG1 ILE 35 2HG1 ILE 35 0.132 -8.841 -0.976 296 2HG1 ILE 35 1HG1 ILE 35 -0.057 -10.191 -2.089 297 1HG2 ILE 35 1HG2 ILE 35 -3.095 -8.344 -0.559 298 2HG2 ILE 35 2HG2 ILE 35 -1.601 -8.082 0.341 299 3HG2 ILE 35 3HG2 ILE 35 -2.817 -9.201 0.956 300 1HD1 ILE 35 1HD1 ILE 35 -2.242 -8.431 -2.542 301 2HD1 ILE 35 2HD1 ILE 35 -0.890 -8.771 -3.620 302 3HD1 ILE 35 3HD1 ILE 35 -0.787 -7.437 -2.472 303 H GLY 36 H GLY 36 1.205 -11.750 -0.568 304 1HA GLY 36 2HA GLY 36 2.037 -13.664 -1.662 305 2HA GLY 36 1HA GLY 36 0.599 -14.524 -1.105 306 H THR 37 H THR 37 0.776 -11.605 -3.110 307 HA THR 37 HA THR 37 -0.760 -13.041 -5.233 308 HB THR 37 HB THR 37 -0.564 -10.045 -4.842 309 HG1 THR 37 HG1 THR 37 -2.526 -11.830 -3.833 310 1HG2 THR 37 1HG2 THR 37 -2.558 -9.972 -6.180 311 2HG2 THR 37 2HG2 THR 37 -2.724 -11.727 -6.125 312 3HG2 THR 37 3HG2 THR 37 -1.398 -10.995 -7.027 313 H GLN 38 H GLN 38 2.315 -11.749 -4.551 314 HA GLN 38 HA GLN 38 4.217 -11.518 -5.879 315 1HB GLN 38 2HB GLN 38 4.290 -13.034 -7.541 316 2HB GLN 38 1HB GLN 38 2.556 -13.272 -7.361 317 1HG GLN 38 2HG GLN 38 2.179 -11.355 -8.932 318 2HG GLN 38 1HG GLN 38 3.923 -11.262 -9.177 319 1HE2 GLN 38 1HE2 GLN 38 4.942 -12.926 -10.463 320 2HE2 GLN 38 2HE2 GLN 38 4.043 -14.080 -11.323 321 HA PRO 39 HA PRO 39 3.711 -7.434 -7.425 322 1HB PRO 39 2HB PRO 39 6.183 -7.138 -8.606 323 2HB PRO 39 1HB PRO 39 5.919 -7.081 -6.854 324 1HG PRO 39 2HG PRO 39 7.105 -9.266 -8.504 325 2HG PRO 39 1HG PRO 39 7.390 -8.864 -6.803 326 1HD PRO 39 2HD PRO 39 5.751 -10.962 -7.745 327 2HD PRO 39 1HD PRO 39 5.766 -10.317 -6.090 328 H ASN 40 H ASN 40 2.095 -8.539 -8.987 329 HA ASN 40 HA ASN 40 2.655 -7.690 -11.705 330 1HB ASN 40 2HB ASN 40 3.636 -10.175 -11.206 331 2HB ASN 40 1HB ASN 40 1.985 -10.583 -11.674 332 1HD2 ASN 40 1HD2 ASN 40 5.018 -9.157 -12.831 333 2HD2 ASN 40 2HD2 ASN 40 4.583 -9.129 -14.473 334 H LYS 41 H LYS 41 0.596 -9.743 -9.630 335 HA LYS 41 HA LYS 41 -1.796 -8.907 -11.191 336 1HB LYS 41 2HB LYS 41 -1.025 -11.292 -9.736 337 2HB LYS 41 1HB LYS 41 -2.560 -10.672 -9.128 338 1HG LYS 41 2HG LYS 41 -3.581 -11.560 -10.927 339 2HG LYS 41 1HG LYS 41 -2.678 -10.439 -11.944 340 1HD LYS 41 2HD LYS 41 -1.080 -12.736 -11.049 341 2HD LYS 41 1HD LYS 41 -2.461 -13.187 -12.053 342 1HE LYS 41 2HE LYS 41 -1.753 -11.751 -13.833 343 2HE LYS 41 1HE LYS 41 -0.548 -10.970 -12.811 344 1HZ LYS 41 1HZ LYS 41 -0.154 -13.783 -12.877 345 2HZ LYS 41 2HZ LYS 41 0.921 -12.536 -13.293 346 3HZ LYS 41 3HZ LYS 41 -0.164 -13.147 -14.449 347 H ILE 42 H ILE 42 -0.144 -7.405 -8.942 348 HA ILE 42 HA ILE 42 -2.380 -6.900 -7.046 349 HB ILE 42 HB ILE 42 0.501 -5.936 -6.990 350 1HG1 ILE 42 2HG1 ILE 42 -0.870 -8.045 -5.294 351 2HG1 ILE 42 1HG1 ILE 42 0.146 -8.417 -6.685 352 1HG2 ILE 42 1HG2 ILE 42 0.005 -4.757 -5.098 353 2HG2 ILE 42 2HG2 ILE 42 -1.157 -5.960 -4.536 354 3HG2 ILE 42 3HG2 ILE 42 -1.635 -4.770 -5.745 355 1HD1 ILE 42 1HD1 ILE 42 1.658 -6.614 -5.155 356 2HD1 ILE 42 2HD1 ILE 42 1.919 -8.352 -5.296 357 3HD1 ILE 42 3HD1 ILE 42 0.935 -7.714 -3.980 358 H VAL 43 H VAL 43 -3.668 -5.176 -7.378 359 HA VAL 43 HA VAL 43 -2.663 -2.955 -9.114 360 HB VAL 43 HB VAL 43 -5.533 -3.832 -8.632 361 1HG1 VAL 43 1HG1 VAL 43 -4.390 -1.396 -9.631 362 2HG1 VAL 43 2HG1 VAL 43 -6.094 -1.832 -9.498 363 3HG1 VAL 43 3HG1 VAL 43 -5.196 -2.225 -10.964 364 1HG2 VAL 43 1HG2 VAL 43 -3.677 -4.215 -11.004 365 2HG2 VAL 43 2HG2 VAL 43 -5.410 -4.540 -11.036 366 3HG2 VAL 43 3HG2 VAL 43 -4.355 -5.484 -9.985 367 H LEU 44 H LEU 44 -1.928 -1.464 -7.640 368 HA LEU 44 HA LEU 44 -3.571 -0.905 -5.226 369 1HB LEU 44 2HB LEU 44 -0.721 -0.563 -5.970 370 2HB LEU 44 1HB LEU 44 -1.408 0.715 -4.967 371 HG LEU 44 HG LEU 44 -2.241 -1.915 -4.039 372 1HD1 LEU 44 1HD1 LEU 44 0.642 -1.504 -3.482 373 2HD1 LEU 44 2HD1 LEU 44 0.254 -2.064 -5.107 374 3HD1 LEU 44 3HD1 LEU 44 -0.259 -3.003 -3.705 375 1HD2 LEU 44 1HD2 LEU 44 -1.704 -0.987 -1.929 376 2HD2 LEU 44 2HD2 LEU 44 -2.196 0.410 -2.889 377 3HD2 LEU 44 3HD2 LEU 44 -0.484 0.086 -2.614 378 H GLN 45 H GLN 45 -4.346 1.207 -4.783 379 HA GLN 45 HA GLN 45 -4.151 3.180 -7.017 380 1HB GLN 45 2HB GLN 45 -6.733 2.675 -5.532 381 2HB GLN 45 1HB GLN 45 -6.496 3.572 -7.029 382 1HG GLN 45 2HG GLN 45 -5.684 1.354 -8.043 383 2HG GLN 45 1HG GLN 45 -6.358 0.581 -6.607 384 1HE2 GLN 45 1HE2 GLN 45 -7.328 2.879 -9.222 385 2HE2 GLN 45 2HE2 GLN 45 -8.942 2.357 -9.279 386 H LYS 46 H LYS 46 -4.101 5.334 -6.345 387 HA LYS 46 HA LYS 46 -3.460 5.817 -3.533 388 1HB LYS 46 2HB LYS 46 -2.417 6.999 -5.565 389 2HB LYS 46 1HB LYS 46 -3.915 7.923 -5.659 390 1HG LYS 46 2HG LYS 46 -2.969 9.337 -4.168 391 2HG LYS 46 1HG LYS 46 -3.241 8.075 -2.968 392 1HD LYS 46 2HD LYS 46 -0.795 7.934 -4.699 393 2HD LYS 46 1HD LYS 46 -0.813 9.043 -3.329 394 1HE LYS 46 2HE LYS 46 -1.564 6.122 -3.067 395 2HE LYS 46 1HE LYS 46 0.085 6.704 -2.831 396 1HZ LYS 46 1HZ LYS 46 -2.341 7.390 -1.274 397 2HZ LYS 46 2HZ LYS 46 -0.923 8.323 -1.193 398 3HZ LYS 46 3HZ LYS 46 -0.900 6.693 -0.716 399 H GLY 47 H GLY 47 -5.958 7.101 -5.757 400 1HA GLY 47 2HA GLY 47 -8.067 6.867 -3.784 401 2HA GLY 47 1HA GLY 47 -7.526 8.540 -3.953 402 H GLY 48 H GLY 48 -8.196 5.805 -6.170 403 1HA GLY 48 2HA GLY 48 -10.171 5.963 -7.690 404 2HA GLY 48 1HA GLY 48 -9.827 7.687 -7.832 405 H SER 49 H SER 49 -6.818 6.819 -7.865 406 HA SER 49 HA SER 49 -6.766 6.055 -10.759 407 1HB SER 49 2HB SER 49 -5.792 8.384 -9.565 408 2HB SER 49 1HB SER 49 -4.359 7.383 -9.779 409 HG SER 49 HG SER 49 -4.924 8.694 -11.627 410 H VAL 50 H VAL 50 -5.297 4.452 -11.370 411 HA VAL 50 HA VAL 50 -4.320 2.711 -9.226 412 HB VAL 50 HB VAL 50 -3.557 1.246 -11.081 413 1HG1 VAL 50 1HG1 VAL 50 -6.360 2.358 -11.112 414 2HG1 VAL 50 2HG1 VAL 50 -5.787 0.832 -10.438 415 3HG1 VAL 50 3HG1 VAL 50 -5.890 1.040 -12.187 416 1HG2 VAL 50 1HG2 VAL 50 -4.790 2.517 -13.303 417 2HG2 VAL 50 2HG2 VAL 50 -3.076 2.165 -13.082 418 3HG2 VAL 50 3HG2 VAL 50 -3.732 3.716 -12.557 419 H LEU 51 H LEU 51 -2.113 2.133 -8.878 420 HA LEU 51 HA LEU 51 -0.176 4.261 -9.673 421 1HB LEU 51 2HB LEU 51 0.330 2.145 -7.578 422 2HB LEU 51 1HB LEU 51 1.077 3.733 -7.739 423 HG LEU 51 HG LEU 51 -1.866 3.346 -7.134 424 1HD1 LEU 51 1HD1 LEU 51 0.351 2.844 -5.425 425 2HD1 LEU 51 2HD1 LEU 51 -1.355 2.919 -4.987 426 3HD1 LEU 51 3HD1 LEU 51 -0.361 4.375 -4.912 427 1HD2 LEU 51 1HD2 LEU 51 -1.975 5.592 -7.300 428 2HD2 LEU 51 2HD2 LEU 51 -0.323 5.580 -7.915 429 3HD2 LEU 51 3HD2 LEU 51 -0.620 5.781 -6.188 430 H LYS 52 H LYS 52 1.456 3.757 -11.064 431 HA LYS 52 HA LYS 52 1.735 0.905 -11.888 432 1HB LYS 52 2HB LYS 52 1.578 3.367 -13.327 433 2HB LYS 52 1HB LYS 52 3.174 2.668 -13.612 434 1HG LYS 52 2HG LYS 52 1.756 0.433 -13.882 435 2HG LYS 52 1HG LYS 52 0.477 1.577 -14.294 436 1HD LYS 52 2HD LYS 52 1.922 2.591 -16.007 437 2HD LYS 52 1HD LYS 52 3.213 1.463 -15.589 438 1HE LYS 52 2HE LYS 52 0.775 0.003 -16.051 439 2HE LYS 52 1HE LYS 52 1.102 1.049 -17.431 440 1HZ LYS 52 1HZ LYS 52 3.523 0.104 -17.040 441 2HZ LYS 52 2HZ LYS 52 2.382 -0.720 -17.993 442 3HZ LYS 52 3HZ LYS 52 2.652 -1.195 -16.384 443 H ASP 53 H ASP 53 3.749 -0.099 -11.888 444 HA ASP 53 HA ASP 53 5.662 0.667 -9.938 445 1HB ASP 53 2HB ASP 53 7.094 -1.093 -10.892 446 2HB ASP 53 1HB ASP 53 5.426 -1.649 -10.767 447 H HIS 54 H HIS 54 5.484 1.451 -13.374 448 HA HIS 54 HA HIS 54 8.165 2.370 -13.736 449 1HB HIS 54 2HB HIS 54 5.552 3.027 -15.094 450 2HB HIS 54 1HB HIS 54 7.060 3.803 -15.578 451 HD1 HIS 54 HD1 HIS 54 5.329 0.465 -15.515 452 HD2 HIS 54 HD2 HIS 54 8.908 2.095 -16.899 453 HE1 HIS 54 HE1 HIS 54 6.398 -1.297 -16.987 454 H ILE 55 H ILE 55 5.459 3.825 -12.076 455 HA ILE 55 HA ILE 55 6.897 6.441 -11.966 456 HB ILE 55 HB ILE 55 4.031 5.725 -11.255 457 1HG1 ILE 55 2HG1 ILE 55 4.030 7.640 -13.254 458 2HG1 ILE 55 1HG1 ILE 55 5.397 6.621 -13.702 459 1HG2 ILE 55 1HG2 ILE 55 5.453 8.408 -11.293 460 2HG2 ILE 55 2HG2 ILE 55 4.903 7.556 -9.849 461 3HG2 ILE 55 3HG2 ILE 55 3.728 8.169 -11.013 462 1HD1 ILE 55 1HD1 ILE 55 2.831 5.305 -12.886 463 2HD1 ILE 55 2HD1 ILE 55 4.075 4.735 -13.999 464 3HD1 ILE 55 3HD1 ILE 55 2.953 6.000 -14.502 465 H SER 56 H SER 56 7.364 7.378 -9.917 466 HA SER 56 HA SER 56 7.695 5.399 -7.755 467 1HB SER 56 2HB SER 56 9.248 7.516 -8.645 468 2HB SER 56 1HB SER 56 8.527 8.145 -7.165 469 HG SER 56 HG SER 56 10.580 6.759 -7.138 470 H LEU 57 H LEU 57 7.049 5.902 -5.537 471 HA LEU 57 HA LEU 57 4.328 6.677 -5.268 472 1HB LEU 57 2HB LEU 57 6.575 6.452 -3.253 473 2HB LEU 57 1HB LEU 57 4.923 6.849 -2.784 474 HG LEU 57 HG LEU 57 5.469 4.442 -4.509 475 1HD1 LEU 57 1HD1 LEU 57 6.226 3.169 -2.781 476 2HD1 LEU 57 2HD1 LEU 57 5.177 3.969 -1.609 477 3HD1 LEU 57 3HD1 LEU 57 6.705 4.714 -2.077 478 1HD2 LEU 57 1HD2 LEU 57 3.246 5.576 -2.893 479 2HD2 LEU 57 2HD2 LEU 57 3.428 3.823 -2.829 480 3HD2 LEU 57 3HD2 LEU 57 3.186 4.629 -4.379 481 H GLU 58 H GLU 58 7.329 8.529 -4.789 482 HA GLU 58 HA GLU 58 6.241 10.894 -3.684 483 1HB GLU 58 2HB GLU 58 8.739 10.128 -4.356 484 2HB GLU 58 1HB GLU 58 8.398 11.197 -5.717 485 1HG GLU 58 2HG GLU 58 9.317 12.650 -4.104 486 2HG GLU 58 1HG GLU 58 7.579 12.879 -3.914 487 H ASP 59 H ASP 59 6.419 9.833 -7.076 488 HA ASP 59 HA ASP 59 5.508 12.296 -8.251 489 1HB ASP 59 2HB ASP 59 5.318 9.425 -9.211 490 2HB ASP 59 1HB ASP 59 4.875 10.818 -10.196 491 H TYR 60 H TYR 60 3.788 9.340 -7.217 492 HA TYR 60 HA TYR 60 1.155 10.343 -7.905 493 1HB TYR 60 2HB TYR 60 2.179 8.041 -6.245 494 2HB TYR 60 1HB TYR 60 0.461 8.436 -6.274 495 HD1 TYR 60 HD1 TYR 60 2.925 6.478 -7.793 496 HD2 TYR 60 HD2 TYR 60 -0.467 8.928 -8.769 497 HE1 TYR 60 HE1 TYR 60 2.688 5.291 -9.955 498 HE2 TYR 60 HE2 TYR 60 -0.703 7.742 -10.933 499 HH TYR 60 HH TYR 60 -0.053 5.450 -11.853 500 H GLU 61 H GLU 61 3.299 10.913 -5.266 501 HA GLU 61 HA GLU 61 3.094 12.332 -3.427 502 1HB GLU 61 2HB GLU 61 1.316 13.444 -5.092 503 2HB GLU 61 1HB GLU 61 0.183 12.831 -3.887 504 1HG GLU 61 2HG GLU 61 2.630 14.397 -3.069 505 2HG GLU 61 1HG GLU 61 1.139 15.215 -3.534 506 H VAL 62 H VAL 62 3.326 10.211 -2.353 507 HA VAL 62 HA VAL 62 0.860 9.029 -1.236 508 HB VAL 62 HB VAL 62 2.756 7.593 -2.050 509 1HG1 VAL 62 1HG1 VAL 62 4.365 7.884 0.358 510 2HG1 VAL 62 2HG1 VAL 62 4.318 9.385 -0.566 511 3HG1 VAL 62 3HG1 VAL 62 4.871 7.898 -1.332 512 1HG2 VAL 62 1HG2 VAL 62 1.127 6.740 -0.405 513 2HG2 VAL 62 2HG2 VAL 62 2.115 7.379 0.910 514 3HG2 VAL 62 3HG2 VAL 62 2.730 6.074 -0.102 515 H HIS 63 H HIS 63 0.246 9.229 0.917 516 HA HIS 63 HA HIS 63 1.889 11.096 2.586 517 1HB HIS 63 2HB HIS 63 -0.526 11.725 1.770 518 2HB HIS 63 1HB HIS 63 -1.047 10.622 3.043 519 HD1 HIS 63 HD1 HIS 63 -1.036 11.515 5.394 520 HD2 HIS 63 HD2 HIS 63 1.187 13.911 2.807 521 HE1 HIS 63 HE1 HIS 63 -0.354 13.561 6.721 522 H ASP 64 H ASP 64 1.989 10.636 4.876 523 HA ASP 64 HA ASP 64 2.241 7.831 5.498 524 1HB ASP 64 2HB ASP 64 2.671 8.607 7.821 525 2HB ASP 64 1HB ASP 64 3.627 9.503 6.642 526 H GLN 65 H GLN 65 0.851 6.474 6.625 527 HA GLN 65 HA GLN 65 -1.186 5.651 7.429 528 1HB GLN 65 2HB GLN 65 -0.988 8.400 8.550 529 2HB GLN 65 1HB GLN 65 -2.588 7.661 8.581 530 1HG GLN 65 2HG GLN 65 -1.754 6.841 10.572 531 2HG GLN 65 1HG GLN 65 -1.209 5.566 9.483 532 1HE2 GLN 65 1HE2 GLN 65 1.085 5.474 8.952 533 2HE2 GLN 65 2HE2 GLN 65 2.232 6.386 9.807 534 H THR 66 H THR 66 -1.026 6.602 4.674 535 HA THR 66 HA THR 66 -3.633 7.888 4.150 536 HB THR 66 HB THR 66 -1.546 8.452 2.831 537 HG1 THR 66 HG1 THR 66 -3.163 9.068 1.647 538 1HG2 THR 66 1HG2 THR 66 -2.038 5.841 1.399 539 2HG2 THR 66 2HG2 THR 66 -0.865 5.970 2.710 540 3HG2 THR 66 3HG2 THR 66 -0.660 6.933 1.247 541 H ASN 67 H ASN 67 -5.242 6.862 2.766 542 HA ASN 67 HA ASN 67 -5.352 3.923 3.203 543 1HB ASN 67 2HB ASN 67 -7.240 5.904 3.577 544 2HB ASN 67 1HB ASN 67 -7.712 5.216 2.024 545 1HD2 ASN 67 1HD2 ASN 67 -7.911 2.741 1.998 546 2HD2 ASN 67 2HD2 ASN 67 -8.461 1.980 3.411 547 H LEU 68 H LEU 68 -4.865 2.608 1.540 548 HA LEU 68 HA LEU 68 -5.041 3.678 -1.252 549 1HB LEU 68 2HB LEU 68 -3.262 1.584 0.015 550 2HB LEU 68 1HB LEU 68 -3.437 1.730 -1.732 551 HG LEU 68 HG LEU 68 -2.940 4.313 -0.457 552 1HD1 LEU 68 1HD1 LEU 68 -0.426 3.612 -0.170 553 2HD1 LEU 68 2HD1 LEU 68 -1.093 1.995 0.053 554 3HD1 LEU 68 3HD1 LEU 68 -1.564 3.301 1.142 555 1HD2 LEU 68 1HD2 LEU 68 -2.541 4.353 -2.729 556 2HD2 LEU 68 2HD2 LEU 68 -2.000 2.674 -2.768 557 3HD2 LEU 68 3HD2 LEU 68 -0.915 3.938 -2.187 558 H GLU 69 H GLU 69 -5.699 2.085 -2.914 559 HA GLU 69 HA GLU 69 -7.723 0.167 -1.837 560 1HB GLU 69 2HB GLU 69 -7.470 1.387 -4.606 561 2HB GLU 69 1HB GLU 69 -8.747 0.289 -4.087 562 1HG GLU 69 2HG GLU 69 -9.895 2.144 -3.488 563 2HG GLU 69 1HG GLU 69 -8.781 2.247 -2.125 564 H LEU 70 H LEU 70 -7.542 -2.008 -2.335 565 HA LEU 70 HA LEU 70 -5.217 -2.799 -4.037 566 1HB LEU 70 2HB LEU 70 -4.949 -3.339 -1.606 567 2HB LEU 70 1HB LEU 70 -6.395 -4.338 -1.701 568 HG LEU 70 HG LEU 70 -5.331 -5.797 -3.346 569 1HD1 LEU 70 1HD1 LEU 70 -2.653 -4.562 -3.065 570 2HD1 LEU 70 2HD1 LEU 70 -3.802 -3.638 -4.029 571 3HD1 LEU 70 3HD1 LEU 70 -3.411 -5.297 -4.476 572 1HD2 LEU 70 1HD2 LEU 70 -3.331 -5.305 -1.126 573 2HD2 LEU 70 2HD2 LEU 70 -3.717 -6.836 -1.912 574 3HD2 LEU 70 3HD2 LEU 70 -4.895 -6.070 -0.844 575 H TYR 71 H TYR 71 -5.649 -4.114 -5.724 576 HA TYR 71 HA TYR 71 -8.194 -5.646 -5.790 577 1HB TYR 71 2HB TYR 71 -7.330 -3.496 -7.718 578 2HB TYR 71 1HB TYR 71 -8.362 -4.819 -8.261 579 HD1 TYR 71 HD1 TYR 71 -8.211 -1.692 -6.457 580 HD2 TYR 71 HD2 TYR 71 -10.550 -5.250 -7.033 581 HE1 TYR 71 HE1 TYR 71 -10.183 -0.556 -5.472 582 HE2 TYR 71 HE2 TYR 71 -12.521 -4.114 -6.049 583 HH TYR 71 HH TYR 71 -13.044 -1.180 -5.860 584 H TYR 72 H TYR 72 -8.067 -7.500 -7.169 585 HA TYR 72 HA TYR 72 -5.273 -8.203 -7.941 586 1HB TYR 72 2HB TYR 72 -7.672 -10.010 -7.505 587 2HB TYR 72 1HB TYR 72 -6.027 -10.544 -7.851 588 HD1 TYR 72 HD1 TYR 72 -8.219 -10.392 -5.265 589 HD2 TYR 72 HD2 TYR 72 -4.279 -8.988 -6.246 590 HE1 TYR 72 HE1 TYR 72 -7.662 -10.266 -2.851 591 HE2 TYR 72 HE2 TYR 72 -3.722 -8.863 -3.834 592 HH TYR 72 HH TYR 72 -5.751 -8.694 -1.483 593 H LEU 73 HN LEU 73 -4.764 -8.264 -10.042 594 HA LEU 73 HA LEU 73 -4.941 -8.557 -12.357 595 1HB LEU 73 2HB LEU 73 -6.755 -10.344 -11.505 596 2HB LEU 73 1HB LEU 73 -7.852 -9.203 -12.282 597 HG LEU 73 HG LEU 73 -5.567 -9.588 -13.979 598 1HD1 LEU 73 1HD1 LEU 73 -5.676 -11.954 -14.417 599 2HD1 LEU 73 2HD1 LEU 73 -7.032 -12.155 -13.307 600 3HD1 LEU 73 3HD1 LEU 73 -5.431 -11.761 -12.682 601 1HD2 LEU 73 1HD2 LEU 73 -7.236 -9.416 -15.490 602 2HD2 LEU 73 2HD2 LEU 73 -8.368 -9.315 -14.142 603 3HD2 LEU 73 3HD2 LEU 73 -8.009 -10.878 -14.876 Start of MODEL 14 1 H MET 1 1H MET 1 10.829 6.111 6.096 2 HA MET 1 HA MET 1 9.579 4.963 4.504 3 1HB MET 1 2HB MET 1 8.925 2.618 4.779 4 2HB MET 1 1HB MET 1 10.679 2.766 4.875 5 1HG MET 1 2HG MET 1 9.718 3.118 7.514 6 2HG MET 1 1HG MET 1 8.843 1.739 6.851 7 1HE MET 1 1HE MET 1 11.429 -0.597 5.537 8 2HE MET 1 2HE MET 1 9.871 0.192 5.312 9 3HE MET 1 3HE MET 1 10.142 -0.818 6.729 10 H ILE 2 H ILE 2 7.225 4.559 4.596 11 HA ILE 2 HA ILE 2 6.056 5.481 7.193 12 HB ILE 2 HB ILE 2 4.218 6.451 5.853 13 1HG1 ILE 2 2HG1 ILE 2 5.866 5.880 3.384 14 2HG1 ILE 2 1HG1 ILE 2 4.633 4.746 3.935 15 1HG2 ILE 2 1HG2 ILE 2 6.849 7.389 4.697 16 2HG2 ILE 2 2HG2 ILE 2 6.419 7.679 6.381 17 3HG2 ILE 2 3HG2 ILE 2 5.426 8.352 5.089 18 1HD1 ILE 2 1HD1 ILE 2 4.324 7.403 2.681 19 2HD1 ILE 2 2HD1 ILE 2 3.257 7.101 4.050 20 3HD1 ILE 2 3HD1 ILE 2 3.236 6.017 2.662 21 H GLU 3 H GLU 3 3.831 4.674 7.617 22 HA GLU 3 HA GLU 3 3.512 1.871 6.619 23 1HB GLU 3 2HB GLU 3 3.732 2.698 9.205 24 2HB GLU 3 1HB GLU 3 1.982 2.761 9.002 25 1HG GLU 3 2HG GLU 3 3.664 0.351 8.259 26 2HG GLU 3 1HG GLU 3 2.861 0.534 9.819 27 H VAL 4 H VAL 4 1.889 1.644 5.158 28 HA VAL 4 HA VAL 4 -0.467 3.485 5.370 29 HB VAL 4 HB VAL 4 -0.682 3.317 2.910 30 1HG1 VAL 4 1HG1 VAL 4 0.616 5.176 3.823 31 2HG1 VAL 4 2HG1 VAL 4 1.366 4.613 2.330 32 3HG1 VAL 4 3HG1 VAL 4 2.061 4.167 3.887 33 1HG2 VAL 4 1HG2 VAL 4 0.430 1.050 2.769 34 2HG2 VAL 4 2HG2 VAL 4 1.978 1.866 2.997 35 3HG2 VAL 4 3HG2 VAL 4 0.998 2.216 1.574 36 H VAL 5 H VAL 5 -2.515 2.542 4.551 37 HA VAL 5 HA VAL 5 -2.581 -0.430 4.913 38 HB VAL 5 HB VAL 5 -4.944 -0.090 5.718 39 1HG1 VAL 5 1HG1 VAL 5 -4.296 0.586 7.950 40 2HG1 VAL 5 2HG1 VAL 5 -2.872 1.422 7.331 41 3HG1 VAL 5 3HG1 VAL 5 -2.967 -0.336 7.249 42 1HG2 VAL 5 1HG2 VAL 5 -5.400 2.097 4.731 43 2HG2 VAL 5 2HG2 VAL 5 -4.091 2.824 5.662 44 3HG2 VAL 5 3HG2 VAL 5 -5.529 2.221 6.485 45 H VAL 6 H VAL 6 -3.328 -1.567 3.199 46 HA VAL 6 HA VAL 6 -4.756 -0.069 1.037 47 HB VAL 6 HB VAL 6 -3.329 -2.706 0.653 48 1HG1 VAL 6 1HG1 VAL 6 -3.409 -2.146 -1.647 49 2HG1 VAL 6 2HG1 VAL 6 -3.747 -0.448 -1.309 50 3HG1 VAL 6 3HG1 VAL 6 -4.989 -1.669 -1.027 51 1HG2 VAL 6 1HG2 VAL 6 -2.042 -0.341 1.452 52 2HG2 VAL 6 2HG2 VAL 6 -1.849 -0.382 -0.299 53 3HG2 VAL 6 3HG2 VAL 6 -1.286 -1.735 0.680 54 H ASN 7 H ASN 7 -6.855 -0.626 0.746 55 HA ASN 7 HA ASN 7 -7.835 -3.153 1.995 56 1HB ASN 7 2HB ASN 7 -9.221 -0.578 1.213 57 2HB ASN 7 1HB ASN 7 -10.110 -2.032 1.665 58 1HD2 ASN 7 1HD2 ASN 7 -7.758 0.368 2.906 59 2HD2 ASN 7 2HD2 ASN 7 -8.065 0.056 4.545 60 H ASP 8 H ASP 8 -8.156 -4.818 0.619 61 HA ASP 8 HA ASP 8 -8.211 -4.440 -2.267 62 1HB ASP 8 2HB ASP 8 -7.227 -6.460 -1.122 63 2HB ASP 8 1HB ASP 8 -8.866 -6.951 -0.694 64 H ARG 9 H ARG 9 -10.602 -5.797 0.039 65 HA ARG 9 HA ARG 9 -12.767 -4.687 -1.695 66 1HB ARG 9 2HB ARG 9 -12.173 -7.461 -1.213 67 2HB ARG 9 1HB ARG 9 -13.726 -7.071 -0.474 68 1HG ARG 9 2HG ARG 9 -14.659 -7.193 -2.519 69 2HG ARG 9 1HG ARG 9 -13.734 -5.761 -2.969 70 1HD ARG 9 2HD ARG 9 -11.860 -7.798 -3.148 71 2HD ARG 9 1HD ARG 9 -13.333 -8.556 -3.750 72 HE ARG 9 HE ARG 9 -13.477 -6.552 -5.337 73 1HH1 ARG 9 1HH2 ARG 9 -11.352 -8.520 -6.162 74 2HH1 ARG 9 2HH2 ARG 9 -9.986 -7.486 -6.423 75 1HH2 ARG 9 2HH1 ARG 9 -11.354 -4.798 -4.694 76 2HH2 ARG 9 1HH1 ARG 9 -9.987 -5.375 -5.588 77 H LEU 10 H LEU 10 -14.974 -5.156 -0.268 78 HA LEU 10 HA LEU 10 -14.725 -3.414 2.015 79 1HB LEU 10 2HB LEU 10 -16.831 -4.428 0.450 80 2HB LEU 10 1HB LEU 10 -17.142 -5.022 2.081 81 HG LEU 10 HG LEU 10 -16.298 -2.342 2.380 82 1HD1 LEU 10 1HD1 LEU 10 -18.657 -1.948 0.753 83 2HD1 LEU 10 2HD1 LEU 10 -17.377 -2.690 -0.206 84 3HD1 LEU 10 3HD1 LEU 10 -17.082 -1.166 0.627 85 1HD2 LEU 10 1HD2 LEU 10 -19.095 -3.520 2.434 86 2HD2 LEU 10 2HD2 LEU 10 -18.574 -2.045 3.247 87 3HD2 LEU 10 3HD2 LEU 10 -17.936 -3.606 3.762 88 H GLY 11 H GLY 11 -13.649 -4.075 3.813 89 1HA GLY 11 2HA GLY 11 -13.906 -5.360 5.925 90 2HA GLY 11 1HA GLY 11 -14.327 -6.763 4.942 91 H LYS 12 H LYS 12 -12.281 -6.435 2.946 92 HA LYS 12 HA LYS 12 -10.054 -7.672 4.354 93 1HB LYS 12 2HB LYS 12 -11.013 -7.594 1.691 94 2HB LYS 12 1HB LYS 12 -9.389 -6.909 1.651 95 1HG LYS 12 2HG LYS 12 -8.945 -9.017 3.287 96 2HG LYS 12 1HG LYS 12 -10.262 -9.673 2.314 97 1HD LYS 12 2HD LYS 12 -8.474 -10.250 0.969 98 2HD LYS 12 1HD LYS 12 -8.818 -8.644 0.320 99 1HE LYS 12 2HE LYS 12 -7.122 -7.668 1.826 100 2HE LYS 12 1HE LYS 12 -6.779 -9.271 2.478 101 1HZ LYS 12 1HZ LYS 12 -5.249 -8.474 0.682 102 2HZ LYS 12 2HZ LYS 12 -6.546 -8.621 -0.403 103 3HZ LYS 12 3HZ LYS 12 -5.954 -9.991 0.408 104 H LYS 13 H LYS 13 -8.276 -6.680 5.142 105 HA LYS 13 HA LYS 13 -7.444 -4.046 4.042 106 1HB LYS 13 2HB LYS 13 -8.919 -3.737 6.104 107 2HB LYS 13 1HB LYS 13 -7.640 -4.531 7.026 108 1HG LYS 13 2HG LYS 13 -6.037 -2.810 6.032 109 2HG LYS 13 1HG LYS 13 -7.465 -1.943 5.468 110 1HD LYS 13 2HD LYS 13 -7.944 -2.587 8.184 111 2HD LYS 13 1HD LYS 13 -6.294 -1.968 8.099 112 1HE LYS 13 2HE LYS 13 -7.540 -0.183 6.486 113 2HE LYS 13 1HE LYS 13 -8.864 -0.577 7.583 114 1HZ LYS 13 1HZ LYS 13 -7.132 1.283 8.154 115 2HZ LYS 13 2HZ LYS 13 -6.227 -0.032 8.736 116 3HZ LYS 13 3HZ LYS 13 -7.774 0.283 9.363 117 H VAL 14 H VAL 14 -5.234 -3.918 3.853 118 HA VAL 14 HA VAL 14 -3.585 -5.902 5.372 119 HB VAL 14 HB VAL 14 -3.056 -5.057 2.505 120 1HG1 VAL 14 1HG1 VAL 14 -1.623 -7.173 2.637 121 2HG1 VAL 14 2HG1 VAL 14 -1.878 -7.121 4.381 122 3HG1 VAL 14 3HG1 VAL 14 -1.046 -5.794 3.571 123 1HG2 VAL 14 1HG2 VAL 14 -4.084 -7.765 3.357 124 2HG2 VAL 14 2HG2 VAL 14 -4.082 -7.044 1.748 125 3HG2 VAL 14 3HG2 VAL 14 -5.206 -6.459 2.973 126 H ARG 15 H ARG 15 -1.503 -5.161 5.999 127 HA ARG 15 HA ARG 15 -1.137 -2.198 5.798 128 1HB ARG 15 2HB ARG 15 -0.335 -4.217 7.897 129 2HB ARG 15 1HB ARG 15 0.418 -2.625 7.816 130 1HG ARG 15 2HG ARG 15 -1.319 -1.871 9.045 131 2HG ARG 15 1HG ARG 15 -2.307 -2.080 7.601 132 1HD ARG 15 2HD ARG 15 -2.056 -4.650 8.755 133 2HD ARG 15 1HD ARG 15 -2.408 -3.546 10.084 134 HE ARG 15 HE ARG 15 -4.115 -3.314 7.675 135 1HH1 ARG 15 1HH2 ARG 15 -4.745 -5.914 8.966 136 2HH1 ARG 15 2HH2 ARG 15 -5.945 -5.475 10.138 137 1HH2 ARG 15 2HH1 ARG 15 -5.196 -2.079 10.025 138 2HH2 ARG 15 1HH1 ARG 15 -6.202 -3.297 10.738 139 H VAL 16 H VAL 16 0.777 -1.394 4.974 140 HA VAL 16 HA VAL 16 3.053 -3.222 4.490 141 HB VAL 16 HB VAL 16 1.636 -3.478 2.489 142 1HG1 VAL 16 1HG1 VAL 16 0.970 -1.659 1.124 143 2HG1 VAL 16 2HG1 VAL 16 2.068 -0.542 1.934 144 3HG1 VAL 16 3HG1 VAL 16 0.630 -1.127 2.771 145 1HG2 VAL 16 1HG2 VAL 16 3.895 -1.712 1.597 146 2HG2 VAL 16 2HG2 VAL 16 3.362 -3.260 0.941 147 3HG2 VAL 16 3HG2 VAL 16 4.259 -3.207 2.458 148 H LYS 17 H LYS 17 4.967 -2.140 4.772 149 HA LYS 17 HA LYS 17 4.825 0.827 5.041 150 1HB LYS 17 2HB LYS 17 6.989 0.580 6.298 151 2HB LYS 17 1HB LYS 17 5.631 -0.247 7.054 152 1HG LYS 17 2HG LYS 17 6.958 -2.000 5.158 153 2HG LYS 17 1HG LYS 17 8.109 -1.377 6.339 154 1HD LYS 17 2HD LYS 17 7.029 -2.369 8.131 155 2HD LYS 17 1HD LYS 17 5.457 -2.342 7.331 156 1HE LYS 17 2HE LYS 17 7.069 -3.977 5.710 157 2HE LYS 17 1HE LYS 17 7.453 -4.450 7.364 158 1HZ LYS 17 1HZ LYS 17 5.398 -5.253 7.707 159 2HZ LYS 17 2HZ LYS 17 5.365 -5.382 6.015 160 3HZ LYS 17 3HZ LYS 17 4.635 -4.055 6.780 161 H CYS 18 H CYS 18 5.887 2.116 3.616 162 HA CYS 18 HA CYS 18 8.206 1.093 2.097 163 1HB CYS 18 2HB CYS 18 5.524 1.400 0.948 164 2HB CYS 18 1HB CYS 18 6.752 2.318 0.078 165 HG CYS 18 HG CYS 18 7.149 -0.734 0.642 166 H LEU 19 H LEU 19 9.469 2.822 1.169 167 HA LEU 19 HA LEU 19 9.205 5.359 2.603 168 1HB LEU 19 2HB LEU 19 11.277 3.946 1.155 169 2HB LEU 19 1HB LEU 19 11.176 5.613 0.595 170 HG LEU 19 HG LEU 19 11.015 5.268 3.529 171 1HD1 LEU 19 1HD1 LEU 19 12.691 3.564 3.039 172 2HD1 LEU 19 2HD1 LEU 19 13.486 4.982 3.723 173 3HD1 LEU 19 3HD1 LEU 19 13.559 4.682 1.987 174 1HD2 LEU 19 1HD2 LEU 19 11.585 7.442 3.376 175 2HD2 LEU 19 2HD2 LEU 19 11.624 7.283 1.620 176 3HD2 LEU 19 3HD2 LEU 19 13.089 7.014 2.561 177 H ALA 20 H ALA 20 8.800 7.403 1.648 178 HA ALA 20 HA ALA 20 6.907 7.461 -0.509 179 1HB ALA 20 1HB ALA 20 8.489 9.575 0.946 180 2HB ALA 20 2HB ALA 20 6.753 9.273 0.989 181 3HB ALA 20 3HB ALA 20 7.485 10.000 -0.440 182 H GLU 21 H GLU 21 10.388 7.520 -0.457 183 HA GLU 21 HA GLU 21 10.667 8.666 -3.140 184 1HB GLU 21 2HB GLU 21 13.064 8.095 -2.869 185 2HB GLU 21 1HB GLU 21 12.454 8.999 -1.485 186 1HG GLU 21 2HG GLU 21 13.264 7.335 -0.189 187 2HG GLU 21 1HG GLU 21 11.956 6.335 -0.814 188 H ASP 22 H ASP 22 10.176 5.505 -1.763 189 HA ASP 22 HA ASP 22 11.305 3.943 -3.894 190 1HB ASP 22 2HB ASP 22 9.439 3.444 -1.624 191 2HB ASP 22 1HB ASP 22 9.400 2.290 -2.956 192 H SER 23 H SER 23 10.066 2.727 -5.532 193 HA SER 23 HA SER 23 7.938 4.419 -6.705 194 1HB SER 23 2HB SER 23 9.983 2.617 -7.733 195 2HB SER 23 1HB SER 23 8.403 2.270 -8.428 196 HG SER 23 HG SER 23 9.031 3.887 -9.675 197 H VAL 24 H VAL 24 6.140 3.112 -7.871 198 HA VAL 24 HA VAL 24 4.580 1.726 -5.916 199 HB VAL 24 HB VAL 24 4.307 1.720 -8.938 200 1HG1 VAL 24 1HG1 VAL 24 2.898 -0.008 -8.285 201 2HG1 VAL 24 2HG1 VAL 24 1.814 1.373 -8.130 202 3HG1 VAL 24 3HG1 VAL 24 2.594 0.699 -6.699 203 1HG2 VAL 24 1HG2 VAL 24 4.194 3.982 -8.124 204 2HG2 VAL 24 2HG2 VAL 24 3.186 3.503 -6.759 205 3HG2 VAL 24 3HG2 VAL 24 2.532 3.458 -8.397 206 H GLY 25 H GLY 25 6.874 0.597 -8.353 207 1HA GLY 25 2HA GLY 25 6.196 -2.171 -8.387 208 2HA GLY 25 1HA GLY 25 7.810 -1.529 -8.705 209 H ASP 26 H ASP 26 8.410 -0.331 -6.267 210 HA ASP 26 HA ASP 26 9.203 -2.577 -4.644 211 1HB ASP 26 2HB ASP 26 10.324 -0.267 -4.797 212 2HB ASP 26 1HB ASP 26 9.060 0.297 -3.705 213 H PHE 27 H PHE 27 6.528 -0.263 -4.500 214 HA PHE 27 HA PHE 27 5.515 -0.904 -1.908 215 1HB PHE 27 2HB PHE 27 4.816 1.010 -3.472 216 2HB PHE 27 1HB PHE 27 3.824 -0.177 -4.314 217 HD1 PHE 27 HD1 PHE 27 4.048 2.039 -1.483 218 HD2 PHE 27 HD2 PHE 27 2.094 -1.496 -2.948 219 HE1 PHE 27 HE1 PHE 27 2.258 2.326 0.204 220 HE2 PHE 27 HE2 PHE 27 0.306 -1.209 -1.260 221 HZ PHE 27 HZ PHE 27 0.386 0.703 0.316 222 H LYS 28 H LYS 28 4.867 -2.322 -5.120 223 HA LYS 28 HA LYS 28 2.939 -4.257 -4.156 224 1HB LYS 28 2HB LYS 28 4.583 -4.095 -6.698 225 2HB LYS 28 1HB LYS 28 3.389 -5.359 -6.398 226 1HG LYS 28 2HG LYS 28 1.714 -3.481 -5.949 227 2HG LYS 28 1HG LYS 28 2.916 -2.379 -6.621 228 1HD LYS 28 2HD LYS 28 2.766 -4.516 -8.448 229 2HD LYS 28 1HD LYS 28 1.096 -4.156 -8.010 230 1HE LYS 28 2HE LYS 28 2.828 -1.803 -8.530 231 2HE LYS 28 1HE LYS 28 2.452 -2.802 -9.932 232 1HZ LYS 28 1HZ LYS 28 0.851 -0.877 -8.927 233 2HZ LYS 28 2HZ LYS 28 0.183 -2.274 -8.231 234 3HZ LYS 28 3HZ LYS 28 0.331 -2.151 -9.918 235 H LYS 29 H LYS 29 6.451 -4.218 -4.476 236 HA LYS 29 HA LYS 29 6.890 -7.051 -4.227 237 1HB LYS 29 2HB LYS 29 8.587 -4.608 -3.744 238 2HB LYS 29 1HB LYS 29 9.190 -6.214 -3.330 239 1HG LYS 29 2HG LYS 29 8.788 -6.970 -5.640 240 2HG LYS 29 1HG LYS 29 8.165 -5.374 -6.060 241 1HD LYS 29 2HD LYS 29 10.513 -4.603 -5.047 242 2HD LYS 29 1HD LYS 29 10.975 -6.234 -5.536 243 1HE LYS 29 2HE LYS 29 10.599 -5.814 -7.793 244 2HE LYS 29 1HE LYS 29 9.450 -4.515 -7.465 245 1HZ LYS 29 1HZ LYS 29 11.482 -3.570 -8.250 246 2HZ LYS 29 2HZ LYS 29 12.397 -4.423 -7.102 247 3HZ LYS 29 3HZ LYS 29 11.334 -3.196 -6.601 248 H VAL 30 H VAL 30 6.644 -4.427 -1.823 249 HA VAL 30 HA VAL 30 7.169 -6.224 0.429 250 HB VAL 30 HB VAL 30 5.990 -3.423 0.442 251 1HG1 VAL 30 1HG1 VAL 30 5.611 -4.512 2.554 252 2HG1 VAL 30 2HG1 VAL 30 6.999 -3.447 2.774 253 3HG1 VAL 30 3HG1 VAL 30 7.242 -5.181 2.569 254 1HG2 VAL 30 1HG2 VAL 30 8.108 -2.551 0.327 255 2HG2 VAL 30 2HG2 VAL 30 8.443 -4.049 -0.539 256 3HG2 VAL 30 3HG2 VAL 30 8.828 -3.917 1.176 257 H LEU 31 H LEU 31 4.317 -4.770 -1.116 258 HA LEU 31 HA LEU 31 2.396 -5.700 0.814 259 1HB LEU 31 2HB LEU 31 2.000 -3.892 -0.897 260 2HB LEU 31 1HB LEU 31 1.929 -5.149 -2.131 261 HG LEU 31 HG LEU 31 0.089 -6.244 -0.788 262 1HD1 LEU 31 1HD1 LEU 31 0.589 -5.203 1.382 263 2HD1 LEU 31 2HD1 LEU 31 -1.057 -4.814 0.886 264 3HD1 LEU 31 3HD1 LEU 31 0.221 -3.611 0.718 265 1HD2 LEU 31 1HD2 LEU 31 -0.502 -4.922 -2.723 266 2HD2 LEU 31 2HD2 LEU 31 -0.289 -3.420 -1.825 267 3HD2 LEU 31 3HD2 LEU 31 -1.626 -4.501 -1.431 268 H SER 32 H SER 32 3.694 -7.117 -2.188 269 HA SER 32 HA SER 32 1.948 -9.336 -2.421 270 1HB SER 32 2HB SER 32 3.793 -10.424 -3.675 271 2HB SER 32 1HB SER 32 3.541 -8.759 -4.183 272 HG SER 32 HG SER 32 5.743 -9.179 -3.849 273 H LEU 33 H LEU 33 4.545 -8.787 -0.129 274 HA LEU 33 HA LEU 33 4.899 -11.572 0.611 275 1HB LEU 33 2HB LEU 33 5.610 -8.961 1.966 276 2HB LEU 33 1HB LEU 33 5.971 -10.531 2.684 277 HG LEU 33 HG LEU 33 6.785 -10.052 -0.157 278 1HD1 LEU 33 1HD1 LEU 33 8.583 -8.699 0.335 279 2HD1 LEU 33 2HD1 LEU 33 8.717 -9.298 1.987 280 3HD1 LEU 33 3HD1 LEU 33 7.470 -8.122 1.574 281 1HD2 LEU 33 1HD2 LEU 33 7.992 -11.538 2.200 282 2HD2 LEU 33 2HD2 LEU 33 8.657 -11.523 0.567 283 3HD2 LEU 33 3HD2 LEU 33 7.086 -12.263 0.872 284 H GLN 34 H GLN 34 2.775 -8.952 1.681 285 HA GLN 34 HA GLN 34 1.772 -10.456 3.989 286 1HB GLN 34 2HB GLN 34 1.036 -7.827 2.701 287 2HB GLN 34 1HB GLN 34 0.063 -8.523 3.997 288 1HG GLN 34 2HG GLN 34 1.513 -7.339 5.319 289 2HG GLN 34 1HG GLN 34 2.515 -8.774 5.106 290 1HE2 GLN 34 1HE2 GLN 34 1.832 -5.691 3.318 291 2HE2 GLN 34 2HE2 GLN 34 3.448 -5.434 2.869 292 H ILE 35 H ILE 35 0.458 -9.511 0.783 293 HA ILE 35 HA ILE 35 -1.940 -11.164 1.284 294 HB ILE 35 HB ILE 35 -2.643 -10.349 -1.005 295 1HG1 ILE 35 2HG1 ILE 35 -0.131 -8.664 -0.712 296 2HG1 ILE 35 1HG1 ILE 35 -0.396 -9.907 -1.931 297 1HG2 ILE 35 1HG2 ILE 35 -1.905 -7.989 0.696 298 2HG2 ILE 35 2HG2 ILE 35 -2.994 -9.215 1.346 299 3HG2 ILE 35 3HG2 ILE 35 -3.425 -8.342 -0.124 300 1HD1 ILE 35 1HD1 ILE 35 -1.923 -7.310 -1.611 301 2HD1 ILE 35 2HD1 ILE 35 -2.402 -8.597 -2.717 302 3HD1 ILE 35 3HD1 ILE 35 -0.865 -7.764 -2.947 303 H GLY 36 H GLY 36 0.825 -11.166 -0.994 304 1HA GLY 36 2HA GLY 36 1.884 -13.197 -1.754 305 2HA GLY 36 1HA GLY 36 0.429 -14.091 -1.319 306 H THR 37 H THR 37 1.228 -11.346 -3.490 307 HA THR 37 HA THR 37 -0.186 -12.806 -5.684 308 HB THR 37 HB THR 37 -0.614 -10.140 -6.294 309 HG1 THR 37 HG1 THR 37 0.014 -9.564 -4.172 310 1HG2 THR 37 1HG2 THR 37 -2.888 -10.667 -6.060 311 2HG2 THR 37 2HG2 THR 37 -2.595 -11.739 -4.691 312 3HG2 THR 37 3HG2 THR 37 -2.132 -12.238 -6.318 313 H GLN 38 H GLN 38 2.735 -11.648 -4.715 314 HA GLN 38 HA GLN 38 4.726 -11.172 -5.830 315 1HB GLN 38 2HB GLN 38 3.036 -12.346 -8.017 316 2HB GLN 38 1HB GLN 38 4.582 -11.606 -8.429 317 1HG GLN 38 2HG GLN 38 5.633 -13.478 -7.761 318 2HG GLN 38 1HG GLN 38 5.019 -13.219 -6.128 319 1HE2 GLN 38 1HE2 GLN 38 3.059 -14.375 -5.488 320 2HE2 GLN 38 2HE2 GLN 38 2.457 -15.668 -6.408 321 HA PRO 39 HA PRO 39 4.303 -7.027 -7.259 322 1HB PRO 39 2HB PRO 39 6.798 -6.686 -8.374 323 2HB PRO 39 1HB PRO 39 6.502 -6.721 -6.627 324 1HG PRO 39 2HG PRO 39 7.712 -8.818 -8.368 325 2HG PRO 39 1HG PRO 39 7.961 -8.513 -6.642 326 1HD PRO 39 2HD PRO 39 6.330 -10.544 -7.743 327 2HD PRO 39 1HD PRO 39 6.327 -10.007 -6.050 328 H ASN 40 H ASN 40 2.771 -8.280 -8.932 329 HA ASN 40 HA ASN 40 3.241 -7.144 -11.556 330 1HB ASN 40 2HB ASN 40 4.461 -9.614 -11.165 331 2HB ASN 40 1HB ASN 40 2.932 -10.035 -11.939 332 1HD2 ASN 40 1HD2 ASN 40 2.840 -9.759 -14.191 333 2HD2 ASN 40 2HD2 ASN 40 3.978 -8.885 -15.103 334 H LYS 41 H LYS 41 1.472 -9.603 -9.667 335 HA LYS 41 HA LYS 41 -0.970 -9.153 -11.280 336 1HB LYS 41 2HB LYS 41 0.011 -11.418 -10.192 337 2HB LYS 41 1HB LYS 41 -1.021 -10.892 -8.863 338 1HG LYS 41 2HG LYS 41 -2.864 -10.576 -10.620 339 2HG LYS 41 1HG LYS 41 -1.821 -11.481 -11.718 340 1HD LYS 41 2HD LYS 41 -2.967 -13.264 -10.841 341 2HD LYS 41 1HD LYS 41 -1.731 -13.132 -9.590 342 1HE LYS 41 2HE LYS 41 -3.513 -13.007 -8.176 343 2HE LYS 41 1HE LYS 41 -3.561 -11.320 -8.686 344 1HZ LYS 41 1HZ LYS 41 -4.962 -13.380 -10.259 345 2HZ LYS 41 2HZ LYS 41 -5.281 -11.714 -10.145 346 3HZ LYS 41 3HZ LYS 41 -5.682 -12.747 -8.859 347 H ILE 42 H ILE 42 0.418 -7.400 -8.936 348 HA ILE 42 HA ILE 42 -2.016 -6.998 -7.278 349 HB ILE 42 HB ILE 42 0.785 -5.845 -7.029 350 1HG1 ILE 42 2HG1 ILE 42 -0.628 -7.870 -5.271 351 2HG1 ILE 42 1HG1 ILE 42 0.475 -8.324 -6.570 352 1HG2 ILE 42 1HG2 ILE 42 -1.759 -5.125 -5.795 353 2HG2 ILE 42 2HG2 ILE 42 -0.203 -4.300 -5.710 354 3HG2 ILE 42 3HG2 ILE 42 -0.565 -5.613 -4.592 355 1HD1 ILE 42 1HD1 ILE 42 2.193 -8.043 -5.146 356 2HD1 ILE 42 2HD1 ILE 42 1.107 -7.435 -3.899 357 3HD1 ILE 42 3HD1 ILE 42 1.807 -6.324 -5.076 358 H VAL 43 H VAL 43 -3.258 -5.172 -7.452 359 HA VAL 43 HA VAL 43 -2.351 -3.047 -9.360 360 HB VAL 43 HB VAL 43 -5.190 -4.031 -8.904 361 1HG1 VAL 43 1HG1 VAL 43 -5.645 -1.947 -9.695 362 2HG1 VAL 43 2HG1 VAL 43 -5.162 -2.618 -11.253 363 3HG1 VAL 43 3HG1 VAL 43 -4.001 -1.709 -10.287 364 1HG2 VAL 43 1HG2 VAL 43 -3.041 -4.863 -10.742 365 2HG2 VAL 43 2HG2 VAL 43 -4.560 -4.477 -11.549 366 3HG2 VAL 43 3HG2 VAL 43 -4.521 -5.708 -10.288 367 H LEU 44 H LEU 44 -1.976 -1.211 -8.216 368 HA LEU 44 HA LEU 44 -3.436 -0.773 -5.660 369 1HB LEU 44 2HB LEU 44 -0.904 0.344 -6.855 370 2HB LEU 44 1HB LEU 44 -1.709 1.173 -5.521 371 HG LEU 44 HG LEU 44 -1.316 -1.762 -5.219 372 1HD1 LEU 44 1HD1 LEU 44 0.970 0.182 -4.799 373 2HD1 LEU 44 2HD1 LEU 44 0.838 -0.870 -6.209 374 3HD1 LEU 44 3HD1 LEU 44 1.003 -1.570 -4.599 375 1HD2 LEU 44 1HD2 LEU 44 -0.798 0.548 -3.323 376 2HD2 LEU 44 2HD2 LEU 44 -1.042 -1.147 -2.904 377 3HD2 LEU 44 3HD2 LEU 44 -2.386 -0.193 -3.531 378 H GLN 45 H GLN 45 -4.934 0.847 -5.438 379 HA GLN 45 HA GLN 45 -5.247 2.760 -7.720 380 1HB GLN 45 2HB GLN 45 -7.586 1.903 -6.030 381 2HB GLN 45 1HB GLN 45 -7.582 2.557 -7.665 382 1HG GLN 45 2HG GLN 45 -6.099 0.241 -7.948 383 2HG GLN 45 1HG GLN 45 -7.323 -0.228 -6.768 384 1HE2 GLN 45 1HE2 GLN 45 -6.853 0.946 -10.092 385 2HE2 GLN 45 2HE2 GLN 45 -8.430 0.600 -10.618 386 H LYS 46 H LYS 46 -5.062 4.854 -7.112 387 HA LYS 46 HA LYS 46 -5.502 5.534 -4.227 388 1HB LYS 46 2HB LYS 46 -3.098 5.627 -5.259 389 2HB LYS 46 1HB LYS 46 -3.671 7.103 -6.035 390 1HG LYS 46 2HG LYS 46 -4.090 8.164 -3.946 391 2HG LYS 46 1HG LYS 46 -3.960 6.642 -3.060 392 1HD LYS 46 2HD LYS 46 -1.596 6.514 -3.456 393 2HD LYS 46 1HD LYS 46 -1.654 7.840 -4.617 394 1HE LYS 46 2HE LYS 46 -0.848 8.849 -2.635 395 2HE LYS 46 1HE LYS 46 -2.560 9.265 -2.664 396 1HZ LYS 46 1HZ LYS 46 -1.397 8.211 -0.551 397 2HZ LYS 46 2HZ LYS 46 -1.820 6.768 -1.341 398 3HZ LYS 46 3HZ LYS 46 -3.019 7.902 -0.935 399 H GLY 47 H GLY 47 -7.597 6.332 -4.373 400 1HA GLY 47 2HA GLY 47 -9.278 7.909 -4.809 401 2HA GLY 47 1HA GLY 47 -8.003 8.988 -5.370 402 H GLY 48 H GLY 48 -9.091 5.814 -6.618 403 1HA GLY 48 2HA GLY 48 -9.915 5.205 -8.729 404 2HA GLY 48 1HA GLY 48 -10.417 6.882 -8.941 405 H SER 49 H SER 49 -7.169 5.452 -8.483 406 HA SER 49 HA SER 49 -6.411 6.280 -11.231 407 1HB SER 49 2HB SER 49 -5.879 7.976 -9.133 408 2HB SER 49 1HB SER 49 -4.406 7.013 -9.191 409 HG SER 49 HG SER 49 -4.153 8.693 -10.616 410 H VAL 50 H VAL 50 -5.112 4.727 -12.130 411 HA VAL 50 HA VAL 50 -4.312 2.433 -10.497 412 HB VAL 50 HB VAL 50 -3.744 3.028 -13.421 413 1HG1 VAL 50 1HG1 VAL 50 -3.458 0.563 -11.694 414 2HG1 VAL 50 2HG1 VAL 50 -2.239 1.324 -12.715 415 3HG1 VAL 50 3HG1 VAL 50 -3.591 0.461 -13.450 416 1HG2 VAL 50 1HG2 VAL 50 -6.129 2.952 -13.090 417 2HG2 VAL 50 2HG2 VAL 50 -5.995 1.552 -12.026 418 3HG2 VAL 50 3HG2 VAL 50 -5.656 1.387 -13.749 419 H LEU 51 H LEU 51 -2.444 2.360 -9.384 420 HA LEU 51 HA LEU 51 -0.289 4.291 -9.949 421 1HB LEU 51 2HB LEU 51 -0.272 2.078 -7.876 422 2HB LEU 51 1HB LEU 51 0.695 3.552 -7.886 423 HG LEU 51 HG LEU 51 -2.319 3.397 -7.556 424 1HD1 LEU 51 1HD1 LEU 51 -1.962 3.428 -5.327 425 2HD1 LEU 51 2HD1 LEU 51 -0.760 4.710 -5.469 426 3HD1 LEU 51 3HD1 LEU 51 -0.284 3.026 -5.683 427 1HD2 LEU 51 1HD2 LEU 51 -0.520 5.575 -8.317 428 2HD2 LEU 51 2HD2 LEU 51 -1.436 5.946 -6.858 429 3HD2 LEU 51 3HD2 LEU 51 -2.281 5.519 -8.345 430 H LYS 52 H LYS 52 1.385 3.816 -11.272 431 HA LYS 52 HA LYS 52 1.854 0.958 -11.993 432 1HB LYS 52 2HB LYS 52 1.775 3.415 -13.507 433 2HB LYS 52 1HB LYS 52 3.354 2.650 -13.692 434 1HG LYS 52 2HG LYS 52 1.074 0.782 -13.819 435 2HG LYS 52 1HG LYS 52 1.126 1.960 -15.130 436 1HD LYS 52 2HD LYS 52 3.785 1.081 -14.794 437 2HD LYS 52 1HD LYS 52 2.790 -0.373 -14.721 438 1HE LYS 52 2HE LYS 52 2.261 -0.250 -16.919 439 2HE LYS 52 1HE LYS 52 1.947 1.484 -16.827 440 1HZ LYS 52 1HZ LYS 52 3.803 1.260 -18.210 441 2HZ LYS 52 2HZ LYS 52 4.544 0.114 -17.197 442 3HZ LYS 52 3HZ LYS 52 4.443 1.740 -16.715 443 H ASP 53 H ASP 53 3.978 0.120 -11.989 444 HA ASP 53 HA ASP 53 5.685 0.975 -9.861 445 1HB ASP 53 2HB ASP 53 7.262 -0.707 -10.700 446 2HB ASP 53 1HB ASP 53 5.621 -1.351 -10.726 447 H HIS 54 H HIS 54 5.603 1.821 -13.268 448 HA HIS 54 HA HIS 54 8.265 2.865 -13.498 449 1HB HIS 54 2HB HIS 54 5.697 3.261 -15.012 450 2HB HIS 54 1HB HIS 54 7.100 4.264 -15.380 451 HD1 HIS 54 HD1 HIS 54 6.070 0.610 -15.235 452 HD2 HIS 54 HD2 HIS 54 9.074 2.984 -16.886 453 HE1 HIS 54 HE1 HIS 54 7.432 -0.901 -16.742 454 H ILE 55 H ILE 55 5.540 4.075 -11.767 455 HA ILE 55 HA ILE 55 6.704 6.830 -11.757 456 HB ILE 55 HB ILE 55 3.937 5.861 -10.965 457 1HG1 ILE 55 2HG1 ILE 55 3.535 7.649 -12.934 458 2HG1 ILE 55 1HG1 ILE 55 5.136 7.086 -13.411 459 1HG2 ILE 55 1HG2 ILE 55 3.497 8.380 -10.881 460 2HG2 ILE 55 2HG2 ILE 55 5.249 8.589 -10.877 461 3HG2 ILE 55 3HG2 ILE 55 4.461 7.726 -9.557 462 1HD1 ILE 55 1HD1 ILE 55 4.407 4.885 -13.742 463 2HD1 ILE 55 2HD1 ILE 55 3.027 5.823 -14.311 464 3HD1 ILE 55 3HD1 ILE 55 2.995 5.093 -12.706 465 H SER 56 H SER 56 7.316 7.762 -9.800 466 HA SER 56 HA SER 56 7.898 5.918 -7.613 467 1HB SER 56 2HB SER 56 9.137 8.161 -8.522 468 2HB SER 56 1HB SER 56 8.239 8.824 -7.159 469 HG SER 56 HG SER 56 9.725 7.961 -5.962 470 H LEU 57 H LEU 57 7.131 6.145 -5.433 471 HA LEU 57 HA LEU 57 4.331 6.639 -5.156 472 1HB LEU 57 2HB LEU 57 6.541 6.425 -3.092 473 2HB LEU 57 1HB LEU 57 4.833 6.548 -2.671 474 HG LEU 57 HG LEU 57 5.853 4.434 -4.575 475 1HD1 LEU 57 1HD1 LEU 57 6.033 4.580 -1.616 476 2HD1 LEU 57 2HD1 LEU 57 7.007 3.656 -2.760 477 3HD1 LEU 57 3HD1 LEU 57 5.418 3.066 -2.277 478 1HD2 LEU 57 1HD2 LEU 57 3.371 5.091 -4.356 479 2HD2 LEU 57 2HD2 LEU 57 3.447 4.386 -2.743 480 3HD2 LEU 57 3HD2 LEU 57 3.758 3.382 -4.160 481 H GLU 58 H GLU 58 7.162 8.693 -4.578 482 HA GLU 58 HA GLU 58 5.868 10.829 -3.202 483 1HB GLU 58 2HB GLU 58 8.441 10.321 -4.304 484 2HB GLU 58 1HB GLU 58 7.890 11.855 -4.978 485 1HG GLU 58 2HG GLU 58 7.728 12.874 -2.886 486 2HG GLU 58 1HG GLU 58 7.544 11.337 -2.039 487 H ASP 59 H ASP 59 6.093 10.058 -6.661 488 HA ASP 59 HA ASP 59 5.034 12.543 -7.653 489 1HB ASP 59 2HB ASP 59 4.998 9.737 -8.805 490 2HB ASP 59 1HB ASP 59 4.420 11.153 -9.681 491 H TYR 60 H TYR 60 3.490 9.443 -6.780 492 HA TYR 60 HA TYR 60 0.802 10.333 -7.387 493 1HB TYR 60 2HB TYR 60 1.924 8.029 -5.777 494 2HB TYR 60 1HB TYR 60 0.188 8.314 -5.914 495 HD1 TYR 60 HD1 TYR 60 2.727 6.410 -7.244 496 HD2 TYR 60 HD2 TYR 60 -0.448 9.002 -8.533 497 HE1 TYR 60 HE1 TYR 60 2.719 5.299 -9.460 498 HE2 TYR 60 HE2 TYR 60 -0.455 7.891 -10.748 499 HH TYR 60 HH TYR 60 0.253 5.996 -11.867 500 H GLU 61 H GLU 61 2.947 10.909 -4.747 501 HA GLU 61 HA GLU 61 2.696 12.244 -2.850 502 1HB GLU 61 2HB GLU 61 0.763 13.246 -4.490 503 2HB GLU 61 1HB GLU 61 -0.227 12.660 -3.155 504 1HG GLU 61 2HG GLU 61 2.248 14.233 -2.521 505 2HG GLU 61 1HG GLU 61 0.821 15.098 -3.092 506 H VAL 62 H VAL 62 2.933 9.832 -2.152 507 HA VAL 62 HA VAL 62 0.523 8.740 -0.835 508 HB VAL 62 HB VAL 62 3.386 7.719 -0.953 509 1HG1 VAL 62 1HG1 VAL 62 2.362 6.850 1.042 510 2HG1 VAL 62 2HG1 VAL 62 2.280 5.570 -0.170 511 3HG1 VAL 62 3HG1 VAL 62 0.848 6.531 0.197 512 1HG2 VAL 62 1HG2 VAL 62 2.819 6.813 -2.940 513 2HG2 VAL 62 2HG2 VAL 62 1.301 7.707 -2.875 514 3HG2 VAL 62 3HG2 VAL 62 1.387 6.068 -2.229 515 H HIS 63 H HIS 63 0.000 9.495 1.159 516 HA HIS 63 HA HIS 63 2.097 10.753 2.838 517 1HB HIS 63 2HB HIS 63 -0.560 11.401 2.367 518 2HB HIS 63 1HB HIS 63 -0.610 10.650 3.962 519 HD1 HIS 63 HD1 HIS 63 -0.717 12.645 5.491 520 HD2 HIS 63 HD2 HIS 63 2.280 13.035 2.622 521 HE1 HIS 63 HE1 HIS 63 0.599 14.728 6.101 522 H ASP 64 H ASP 64 2.096 10.230 5.208 523 HA ASP 64 HA ASP 64 2.376 7.380 5.607 524 1HB ASP 64 2HB ASP 64 2.913 7.962 7.934 525 2HB ASP 64 1HB ASP 64 3.767 9.032 6.824 526 H GLN 65 H GLN 65 0.976 5.936 6.554 527 HA GLN 65 HA GLN 65 -1.033 5.053 7.360 528 1HB GLN 65 2HB GLN 65 -0.454 7.284 8.971 529 2HB GLN 65 1HB GLN 65 -2.153 7.463 8.539 530 1HG GLN 65 2HG GLN 65 -1.959 6.129 10.582 531 2HG GLN 65 1HG GLN 65 -2.563 5.120 9.268 532 1HE2 GLN 65 1HE2 GLN 65 0.661 6.098 10.612 533 2HE2 GLN 65 2HE2 GLN 65 1.343 4.551 10.470 534 H THR 66 H THR 66 -0.930 6.248 4.701 535 HA THR 66 HA THR 66 -3.527 7.599 4.337 536 HB THR 66 HB THR 66 -1.426 8.168 3.009 537 HG1 THR 66 HG1 THR 66 -2.829 8.940 1.685 538 1HG2 THR 66 1HG2 THR 66 -0.778 6.748 1.181 539 2HG2 THR 66 2HG2 THR 66 -2.133 5.658 1.472 540 3HG2 THR 66 3HG2 THR 66 -0.806 5.744 2.630 541 H ASN 67 H ASN 67 -5.195 6.684 2.907 542 HA ASN 67 HA ASN 67 -5.351 3.729 3.198 543 1HB ASN 67 2HB ASN 67 -7.207 5.615 3.786 544 2HB ASN 67 1HB ASN 67 -7.668 5.247 2.124 545 1HD2 ASN 67 1HD2 ASN 67 -7.525 3.953 5.396 546 2HD2 ASN 67 2HD2 ASN 67 -8.324 2.495 5.054 547 H LEU 68 H LEU 68 -4.903 2.490 1.472 548 HA LEU 68 HA LEU 68 -5.168 3.681 -1.263 549 1HB LEU 68 2HB LEU 68 -3.161 1.794 -0.056 550 2HB LEU 68 1HB LEU 68 -3.485 1.727 -1.789 551 HG LEU 68 HG LEU 68 -3.091 4.452 -0.710 552 1HD1 LEU 68 1HD1 LEU 68 -0.618 4.190 -0.632 553 2HD1 LEU 68 2HD1 LEU 68 -0.816 2.448 -0.818 554 3HD1 LEU 68 3HD1 LEU 68 -1.422 3.253 0.628 555 1HD2 LEU 68 1HD2 LEU 68 -2.017 2.867 -3.065 556 2HD2 LEU 68 2HD2 LEU 68 -1.664 4.571 -2.777 557 3HD2 LEU 68 3HD2 LEU 68 -3.320 4.055 -3.099 558 H GLU 69 H GLU 69 -5.715 2.046 -2.973 559 HA GLU 69 HA GLU 69 -7.638 0.028 -1.892 560 1HB GLU 69 2HB GLU 69 -8.030 2.041 -3.762 561 2HB GLU 69 1HB GLU 69 -7.800 0.605 -4.761 562 1HG GLU 69 2HG GLU 69 -9.528 0.160 -2.417 563 2HG GLU 69 1HG GLU 69 -10.177 1.322 -3.575 564 H LEU 70 H LEU 70 -7.428 -2.120 -2.496 565 HA LEU 70 HA LEU 70 -5.043 -2.791 -4.170 566 1HB LEU 70 2HB LEU 70 -4.831 -3.557 -1.847 567 2HB LEU 70 1HB LEU 70 -6.375 -4.397 -1.966 568 HG LEU 70 HG LEU 70 -5.423 -5.789 -3.818 569 1HD1 LEU 70 1HD1 LEU 70 -3.541 -3.871 -4.075 570 2HD1 LEU 70 2HD1 LEU 70 -3.280 -5.534 -4.598 571 3HD1 LEU 70 3HD1 LEU 70 -2.665 -4.993 -3.038 572 1HD2 LEU 70 1HD2 LEU 70 -3.586 -6.006 -1.443 573 2HD2 LEU 70 2HD2 LEU 70 -4.371 -7.293 -2.360 574 3HD2 LEU 70 3HD2 LEU 70 -5.314 -6.299 -1.250 575 H TYR 71 H TYR 71 -5.302 -4.182 -5.884 576 HA TYR 71 HA TYR 71 -7.921 -5.522 -6.290 577 1HB TYR 71 2HB TYR 71 -7.074 -3.153 -7.682 578 2HB TYR 71 1HB TYR 71 -7.109 -4.499 -8.821 579 HD1 TYR 71 HD1 TYR 71 -9.197 -5.809 -9.159 580 HD2 TYR 71 HD2 TYR 71 -9.096 -2.298 -6.684 581 HE1 TYR 71 HE1 TYR 71 -11.673 -5.689 -9.228 582 HE2 TYR 71 HE2 TYR 71 -11.573 -2.178 -6.754 583 HH TYR 71 HH TYR 71 -13.413 -3.323 -8.788 584 H TYR 72 H TYR 72 -7.771 -7.247 -7.936 585 HA TYR 72 HA TYR 72 -4.975 -8.279 -8.150 586 1HB TYR 72 2HB TYR 72 -7.619 -9.760 -8.266 587 2HB TYR 72 1HB TYR 72 -6.029 -10.509 -8.410 588 HD1 TYR 72 HD1 TYR 72 -8.557 -10.229 -6.180 589 HD2 TYR 72 HD2 TYR 72 -4.370 -9.295 -6.432 590 HE1 TYR 72 HE1 TYR 72 -8.385 -10.327 -3.708 591 HE2 TYR 72 HE2 TYR 72 -4.198 -9.393 -3.961 592 HH TYR 72 HH TYR 72 -6.957 -10.366 -1.952 593 H LEU 73 HN LEU 73 -4.096 -8.661 -10.134 594 HA LEU 73 HA LEU 73 -5.478 -7.661 -12.500 595 1HB LEU 73 2HB LEU 73 -2.841 -7.870 -11.792 596 2HB LEU 73 1HB LEU 73 -3.006 -9.237 -12.893 597 HG LEU 73 HG LEU 73 -4.380 -6.927 -13.964 598 1HD1 LEU 73 1HD1 LEU 73 -1.410 -6.555 -13.491 599 2HD1 LEU 73 2HD1 LEU 73 -2.659 -5.743 -12.547 600 3HD1 LEU 73 3HD1 LEU 73 -2.515 -5.427 -14.275 601 1HD2 LEU 73 1HD2 LEU 73 -3.740 -8.145 -15.752 602 2HD2 LEU 73 2HD2 LEU 73 -2.610 -9.079 -14.770 603 3HD2 LEU 73 3HD2 LEU 73 -2.097 -7.558 -15.499 Start of MODEL 15 1 H MET 1 1H MET 1 11.468 5.186 7.143 2 HA MET 1 HA MET 1 9.677 4.630 5.117 3 1HB MET 1 2HB MET 1 10.712 3.424 7.569 4 2HB MET 1 1HB MET 1 9.054 2.924 7.231 5 1HG MET 1 2HG MET 1 9.627 2.034 5.123 6 2HG MET 1 1HG MET 1 11.151 2.916 5.062 7 1HE MET 1 1HE MET 1 11.699 0.067 4.272 8 2HE MET 1 2HE MET 1 10.020 -0.133 4.761 9 3HE MET 1 3HE MET 1 11.258 -1.195 5.429 10 H ILE 2 H ILE 2 7.387 4.271 5.131 11 HA ILE 2 HA ILE 2 5.894 5.710 7.286 12 HB ILE 2 HB ILE 2 4.301 6.492 5.540 13 1HG1 ILE 2 2HG1 ILE 2 6.326 5.883 3.421 14 2HG1 ILE 2 1HG1 ILE 2 5.260 4.578 3.940 15 1HG2 ILE 2 1HG2 ILE 2 6.731 7.617 4.406 16 2HG2 ILE 2 2HG2 ILE 2 6.847 7.489 6.162 17 3HG2 ILE 2 3HG2 ILE 2 5.517 8.386 5.430 18 1HD1 ILE 2 1HD1 ILE 2 3.294 5.994 3.481 19 2HD1 ILE 2 2HD1 ILE 2 4.286 5.808 2.035 20 3HD1 ILE 2 3HD1 ILE 2 4.356 7.304 2.966 21 H GLU 3 H GLU 3 3.645 5.000 7.517 22 HA GLU 3 HA GLU 3 3.350 2.104 6.863 23 1HB GLU 3 2HB GLU 3 3.216 2.763 9.260 24 2HB GLU 3 1HB GLU 3 1.850 3.809 8.880 25 1HG GLU 3 2HG GLU 3 1.025 1.677 9.745 26 2HG GLU 3 1HG GLU 3 0.599 1.822 8.041 27 H VAL 4 H VAL 4 2.003 1.609 5.211 28 HA VAL 4 HA VAL 4 -0.115 3.592 4.466 29 HB VAL 4 HB VAL 4 0.968 1.460 2.628 30 1HG1 VAL 4 1HG1 VAL 4 -1.168 2.820 2.176 31 2HG1 VAL 4 2HG1 VAL 4 0.050 2.803 0.903 32 3HG1 VAL 4 3HG1 VAL 4 -0.096 4.203 1.964 33 1HG2 VAL 4 1HG2 VAL 4 2.987 2.536 2.913 34 2HG2 VAL 4 2HG2 VAL 4 2.229 4.019 3.492 35 3HG2 VAL 4 3HG2 VAL 4 2.264 3.663 1.765 36 H VAL 5 H VAL 5 -2.164 2.733 3.777 37 HA VAL 5 HA VAL 5 -2.703 -0.104 4.525 38 HB VAL 5 HB VAL 5 -4.909 0.688 5.504 39 1HG1 VAL 5 1HG1 VAL 5 -2.712 0.113 6.767 40 2HG1 VAL 5 2HG1 VAL 5 -3.980 0.967 7.644 41 3HG1 VAL 5 3HG1 VAL 5 -2.584 1.852 7.027 42 1HG2 VAL 5 1HG2 VAL 5 -3.976 3.184 4.507 43 2HG2 VAL 5 2HG2 VAL 5 -3.973 3.305 6.266 44 3HG2 VAL 5 3HG2 VAL 5 -5.454 2.873 5.413 45 H VAL 6 H VAL 6 -3.798 -1.134 2.929 46 HA VAL 6 HA VAL 6 -5.196 0.555 0.891 47 HB VAL 6 HB VAL 6 -4.717 -1.267 -0.732 48 1HG1 VAL 6 1HG1 VAL 6 -3.117 0.734 -0.083 49 2HG1 VAL 6 2HG1 VAL 6 -2.572 -0.522 -1.195 50 3HG1 VAL 6 3HG1 VAL 6 -2.076 -0.568 0.498 51 1HG2 VAL 6 1HG2 VAL 6 -4.502 -3.224 0.579 52 2HG2 VAL 6 2HG2 VAL 6 -3.365 -2.463 1.688 53 3HG2 VAL 6 3HG2 VAL 6 -2.851 -2.888 0.058 54 H ASN 7 H ASN 7 -7.313 0.083 0.446 55 HA ASN 7 HA ASN 7 -8.546 -2.122 2.026 56 1HB ASN 7 2HB ASN 7 -9.562 0.468 0.892 57 2HB ASN 7 1HB ASN 7 -10.698 -0.846 1.201 58 1HD2 ASN 7 1HD2 ASN 7 -8.239 1.216 2.811 59 2HD2 ASN 7 2HD2 ASN 7 -8.869 1.013 4.374 60 H ASP 8 H ASP 8 -9.209 -3.925 0.991 61 HA ASP 8 HA ASP 8 -9.018 -4.093 -1.931 62 1HB ASP 8 2HB ASP 8 -9.623 -6.076 0.263 63 2HB ASP 8 1HB ASP 8 -9.807 -6.504 -1.437 64 H ARG 9 H ARG 9 -10.902 -5.348 -3.058 65 HA ARG 9 HA ARG 9 -13.228 -3.714 -3.049 66 1HB ARG 9 2HB ARG 9 -14.228 -5.413 -4.514 67 2HB ARG 9 1HB ARG 9 -12.555 -5.113 -4.978 68 1HG ARG 9 2HG ARG 9 -12.055 -7.113 -3.324 69 2HG ARG 9 1HG ARG 9 -13.745 -7.513 -3.626 70 1HD ARG 9 2HD ARG 9 -12.783 -8.670 -5.374 71 2HD ARG 9 1HD ARG 9 -13.001 -7.107 -6.159 72 HE ARG 9 HE ARG 9 -10.654 -6.830 -6.153 73 1HH1 ARG 9 1HH2 ARG 9 -10.692 -9.911 -6.117 74 2HH1 ARG 9 2HH2 ARG 9 -9.506 -10.227 -4.895 75 1HH2 ARG 9 2HH1 ARG 9 -9.512 -6.976 -3.674 76 2HH2 ARG 9 1HH1 ARG 9 -8.836 -8.561 -3.508 77 H LEU 10 H LEU 10 -12.544 -6.753 -1.339 78 HA LEU 10 HA LEU 10 -15.290 -6.935 -0.316 79 1HB LEU 10 2HB LEU 10 -12.848 -8.601 -0.245 80 2HB LEU 10 1HB LEU 10 -13.844 -8.687 1.208 81 HG LEU 10 HG LEU 10 -15.744 -8.785 -0.777 82 1HD1 LEU 10 1HD1 LEU 10 -14.982 -10.358 -2.463 83 2HD1 LEU 10 2HD1 LEU 10 -13.391 -10.457 -1.706 84 3HD1 LEU 10 3HD1 LEU 10 -13.911 -8.956 -2.471 85 1HD2 LEU 10 1HD2 LEU 10 -15.661 -11.312 -0.307 86 2HD2 LEU 10 2HD2 LEU 10 -15.837 -10.254 1.094 87 3HD2 LEU 10 3HD2 LEU 10 -14.266 -10.963 0.716 88 H GLY 11 H GLY 11 -15.068 -7.525 2.333 89 1HA GLY 11 2HA GLY 11 -14.450 -4.890 3.481 90 2HA GLY 11 1HA GLY 11 -15.240 -6.225 4.317 91 H LYS 12 H LYS 12 -12.041 -5.474 2.874 92 HA LYS 12 HA LYS 12 -10.724 -6.229 5.393 93 1HB LYS 12 2HB LYS 12 -11.099 -8.352 3.965 94 2HB LYS 12 1HB LYS 12 -9.877 -7.680 2.886 95 1HG LYS 12 2HG LYS 12 -8.336 -7.482 4.858 96 2HG LYS 12 1HG LYS 12 -9.537 -8.336 5.827 97 1HD LYS 12 2HD LYS 12 -9.431 -10.225 4.176 98 2HD LYS 12 1HD LYS 12 -8.111 -9.384 3.367 99 1HE LYS 12 2HE LYS 12 -7.393 -9.383 6.073 100 2HE LYS 12 1HE LYS 12 -8.052 -10.994 5.790 101 1HZ LYS 12 1HZ LYS 12 -6.344 -10.114 3.664 102 2HZ LYS 12 2HZ LYS 12 -6.305 -11.555 4.565 103 3HZ LYS 12 3HZ LYS 12 -5.537 -10.158 5.153 104 H LYS 13 H LYS 13 -8.548 -5.452 5.498 105 HA LYS 13 HA LYS 13 -7.588 -3.899 3.145 106 1HB LYS 13 2HB LYS 13 -7.050 -1.973 4.544 107 2HB LYS 13 1HB LYS 13 -8.767 -2.340 4.683 108 1HG LYS 13 2HG LYS 13 -8.547 -2.566 6.909 109 2HG LYS 13 1HG LYS 13 -7.369 -3.856 6.672 110 1HD LYS 13 2HD LYS 13 -5.696 -1.905 6.196 111 2HD LYS 13 1HD LYS 13 -6.889 -0.906 7.026 112 1HE LYS 13 2HE LYS 13 -6.195 -1.662 9.029 113 2HE LYS 13 1HE LYS 13 -6.453 -3.332 8.527 114 1HZ LYS 13 1HZ LYS 13 -4.260 -3.056 7.285 115 2HZ LYS 13 2HZ LYS 13 -4.190 -3.205 8.975 116 3HZ LYS 13 3HZ LYS 13 -4.020 -1.680 8.247 117 H VAL 14 H VAL 14 -5.280 -3.553 3.130 118 HA VAL 14 HA VAL 14 -3.785 -5.353 5.001 119 HB VAL 14 HB VAL 14 -3.107 -4.765 2.099 120 1HG1 VAL 14 1HG1 VAL 14 -1.127 -5.316 3.381 121 2HG1 VAL 14 2HG1 VAL 14 -1.577 -6.744 2.448 122 3HG1 VAL 14 3HG1 VAL 14 -1.956 -6.661 4.168 123 1HG2 VAL 14 1HG2 VAL 14 -5.183 -6.108 2.338 124 2HG2 VAL 14 2HG2 VAL 14 -4.314 -7.250 3.363 125 3HG2 VAL 14 3HG2 VAL 14 -3.866 -7.068 1.667 126 H ARG 15 H ARG 15 -1.933 -4.524 5.929 127 HA ARG 15 HA ARG 15 -1.316 -1.656 5.350 128 1HB ARG 15 2HB ARG 15 -0.315 -1.625 7.636 129 2HB ARG 15 1HB ARG 15 -2.027 -2.050 7.663 130 1HG ARG 15 2HG ARG 15 -1.608 -4.292 8.152 131 2HG ARG 15 1HG ARG 15 0.018 -4.240 7.474 132 1HD ARG 15 2HD ARG 15 0.771 -2.839 9.359 133 2HD ARG 15 1HD ARG 15 -0.858 -2.879 10.039 134 HE ARG 15 HE ARG 15 1.085 -5.096 10.059 135 1HH1 ARG 15 1HH2 ARG 15 -1.466 -6.307 9.175 136 2HH1 ARG 15 2HH2 ARG 15 -2.267 -6.661 10.669 137 1HH2 ARG 15 2HH1 ARG 15 -0.240 -4.561 12.557 138 2HH2 ARG 15 1HH1 ARG 15 -1.570 -5.669 12.589 139 H VAL 16 H VAL 16 0.857 -1.055 4.977 140 HA VAL 16 HA VAL 16 2.956 -3.134 5.062 141 HB VAL 16 HB VAL 16 1.889 -3.419 2.845 142 1HG1 VAL 16 1HG1 VAL 16 1.615 -1.691 1.308 143 2HG1 VAL 16 2HG1 VAL 16 2.873 -0.697 2.042 144 3HG1 VAL 16 3HG1 VAL 16 1.300 -0.850 2.825 145 1HG2 VAL 16 1HG2 VAL 16 4.339 -3.776 3.130 146 2HG2 VAL 16 2HG2 VAL 16 4.618 -2.097 2.665 147 3HG2 VAL 16 3HG2 VAL 16 3.931 -3.232 1.503 148 H LYS 17 H LYS 17 4.965 -2.231 5.435 149 HA LYS 17 HA LYS 17 5.050 0.729 5.709 150 1HB LYS 17 2HB LYS 17 5.754 -1.066 7.531 151 2HB LYS 17 1HB LYS 17 7.265 -1.075 6.624 152 1HG LYS 17 2HG LYS 17 7.865 0.977 7.385 153 2HG LYS 17 1HG LYS 17 6.246 1.631 7.144 154 1HD LYS 17 2HD LYS 17 5.476 0.751 9.235 155 2HD LYS 17 1HD LYS 17 6.928 -0.230 9.430 156 1HE LYS 17 2HE LYS 17 7.440 1.573 10.805 157 2HE LYS 17 1HE LYS 17 8.154 2.107 9.284 158 1HZ LYS 17 1HZ LYS 17 6.404 3.545 10.710 159 2HZ LYS 17 2HZ LYS 17 5.351 2.769 9.627 160 3HZ LYS 17 3HZ LYS 17 6.632 3.718 9.038 161 H CYS 18 H CYS 18 6.097 1.906 4.177 162 HA CYS 18 HA CYS 18 8.466 0.796 2.802 163 1HB CYS 18 2HB CYS 18 5.816 1.044 1.547 164 2HB CYS 18 1HB CYS 18 7.097 1.860 0.652 165 HG CYS 18 HG CYS 18 6.701 -1.003 0.459 166 H LEU 19 H LEU 19 9.468 2.546 1.372 167 HA LEU 19 HA LEU 19 9.327 5.115 2.816 168 1HB LEU 19 2HB LEU 19 11.324 3.680 1.282 169 2HB LEU 19 1HB LEU 19 11.151 5.327 0.678 170 HG LEU 19 HG LEU 19 11.294 4.870 3.641 171 1HD1 LEU 19 1HD1 LEU 19 13.856 5.348 3.228 172 2HD1 LEU 19 2HD1 LEU 19 13.537 4.610 1.659 173 3HD1 LEU 19 3HD1 LEU 19 13.244 3.697 3.140 174 1HD2 LEU 19 1HD2 LEU 19 12.412 7.107 3.493 175 2HD2 LEU 19 2HD2 LEU 19 10.781 7.108 2.823 176 3HD2 LEU 19 3HD2 LEU 19 12.176 7.070 1.745 177 H ALA 20 H ALA 20 8.590 7.025 1.914 178 HA ALA 20 HA ALA 20 6.696 6.887 -0.243 179 1HB ALA 20 1HB ALA 20 6.449 8.577 1.480 180 2HB ALA 20 2HB ALA 20 6.702 9.392 -0.064 181 3HB ALA 20 3HB ALA 20 8.028 9.262 1.091 182 H GLU 21 H GLU 21 10.136 7.277 -0.221 183 HA GLU 21 HA GLU 21 10.291 8.650 -2.801 184 1HB GLU 21 2HB GLU 21 12.720 8.238 -2.610 185 2HB GLU 21 1HB GLU 21 12.078 8.948 -1.132 186 1HG GLU 21 2HG GLU 21 13.047 7.227 -0.033 187 2HG GLU 21 1HG GLU 21 11.785 6.207 -0.719 188 H ASP 22 H ASP 22 10.056 5.356 -1.684 189 HA ASP 22 HA ASP 22 11.225 4.055 -3.960 190 1HB ASP 22 2HB ASP 22 9.375 3.225 -1.752 191 2HB ASP 22 1HB ASP 22 9.543 2.167 -3.152 192 H SER 23 H SER 23 10.052 2.922 -5.685 193 HA SER 23 HA SER 23 7.814 4.557 -6.701 194 1HB SER 23 2HB SER 23 9.846 2.777 -7.857 195 2HB SER 23 1HB SER 23 8.251 2.581 -8.575 196 HG SER 23 HG SER 23 9.716 4.288 -9.443 197 H VAL 24 H VAL 24 6.026 3.255 -7.884 198 HA VAL 24 HA VAL 24 4.537 1.748 -5.970 199 HB VAL 24 HB VAL 24 4.237 1.872 -8.988 200 1HG1 VAL 24 1HG1 VAL 24 2.556 0.392 -8.777 201 2HG1 VAL 24 2HG1 VAL 24 1.771 1.445 -7.600 202 3HG1 VAL 24 3HG1 VAL 24 2.922 0.223 -7.060 203 1HG2 VAL 24 1HG2 VAL 24 2.658 3.350 -6.873 204 2HG2 VAL 24 2HG2 VAL 24 2.697 3.656 -8.609 205 3HG2 VAL 24 3HG2 VAL 24 4.104 4.035 -7.615 206 H GLY 25 H GLY 25 6.832 0.766 -8.467 207 1HA GLY 25 2HA GLY 25 6.216 -2.015 -8.586 208 2HA GLY 25 1HA GLY 25 7.807 -1.321 -8.917 209 H ASP 26 H ASP 26 8.648 -0.292 -6.586 210 HA ASP 26 HA ASP 26 9.417 -2.549 -5.008 211 1HB ASP 26 2HB ASP 26 10.655 -0.357 -5.136 212 2HB ASP 26 1HB ASP 26 9.389 0.359 -4.139 213 H PHE 27 H PHE 27 6.821 -0.159 -4.643 214 HA PHE 27 HA PHE 27 5.952 -0.854 -2.018 215 1HB PHE 27 2HB PHE 27 5.211 1.121 -3.497 216 2HB PHE 27 1HB PHE 27 4.106 -0.018 -4.264 217 HD1 PHE 27 HD1 PHE 27 5.139 1.215 -0.878 218 HD2 PHE 27 HD2 PHE 27 1.996 -0.399 -3.322 219 HE1 PHE 27 HE1 PHE 27 3.533 1.517 0.986 220 HE2 PHE 27 HE2 PHE 27 0.392 -0.095 -1.456 221 HZ PHE 27 HZ PHE 27 1.160 0.864 0.696 222 H LYS 28 H LYS 28 4.953 -2.099 -5.214 223 HA LYS 28 HA LYS 28 3.070 -4.015 -4.152 224 1HB LYS 28 2HB LYS 28 4.448 -3.688 -6.819 225 2HB LYS 28 1HB LYS 28 3.397 -5.065 -6.489 226 1HG LYS 28 2HG LYS 28 1.734 -3.185 -5.647 227 2HG LYS 28 1HG LYS 28 2.698 -2.158 -6.708 228 1HD LYS 28 2HD LYS 28 1.942 -4.743 -7.904 229 2HD LYS 28 1HD LYS 28 0.573 -3.697 -7.532 230 1HE LYS 28 2HE LYS 28 2.795 -2.232 -8.749 231 2HE LYS 28 1HE LYS 28 2.185 -3.517 -9.790 232 1HZ LYS 28 1HZ LYS 28 0.829 -1.120 -8.804 233 2HZ LYS 28 2HZ LYS 28 -0.108 -2.521 -9.030 234 3HZ LYS 28 3HZ LYS 28 0.757 -1.853 -10.331 235 H LYS 29 H LYS 29 6.531 -4.083 -4.849 236 HA LYS 29 HA LYS 29 6.907 -6.922 -4.729 237 1HB LYS 29 2HB LYS 29 8.765 -4.598 -4.160 238 2HB LYS 29 1HB LYS 29 9.296 -6.279 -4.118 239 1HG LYS 29 2HG LYS 29 8.025 -6.265 -6.508 240 2HG LYS 29 1HG LYS 29 8.560 -4.587 -6.442 241 1HD LYS 29 2HD LYS 29 10.735 -5.146 -6.731 242 2HD LYS 29 1HD LYS 29 10.628 -6.486 -5.590 243 1HE LYS 29 2HE LYS 29 9.086 -7.141 -7.924 244 2HE LYS 29 1HE LYS 29 10.696 -6.629 -8.428 245 1HZ LYS 29 1HZ LYS 29 10.067 -8.716 -6.410 246 2HZ LYS 29 2HZ LYS 29 11.633 -8.192 -6.817 247 3HZ LYS 29 3HZ LYS 29 10.671 -8.980 -7.971 248 H VAL 30 H VAL 30 7.074 -4.391 -2.208 249 HA VAL 30 HA VAL 30 7.759 -6.209 -0.068 250 HB VAL 30 HB VAL 30 6.397 -3.495 0.071 251 1HG1 VAL 30 1HG1 VAL 30 7.582 -3.553 2.376 252 2HG1 VAL 30 2HG1 VAL 30 7.673 -5.297 2.129 253 3HG1 VAL 30 3HG1 VAL 30 6.104 -4.495 2.191 254 1HG2 VAL 30 1HG2 VAL 30 8.412 -2.853 -0.803 255 2HG2 VAL 30 2HG2 VAL 30 9.199 -4.368 -0.360 256 3HG2 VAL 30 3HG2 VAL 30 8.978 -3.102 0.848 257 H LEU 31 H LEU 31 4.702 -5.075 -1.455 258 HA LEU 31 HA LEU 31 3.008 -6.167 0.623 259 1HB LEU 31 2HB LEU 31 2.617 -5.044 -2.115 260 2HB LEU 31 1HB LEU 31 1.336 -6.076 -1.479 261 HG LEU 31 HG LEU 31 2.457 -3.926 0.285 262 1HD1 LEU 31 1HD1 LEU 31 1.978 -2.882 -1.952 263 2HD1 LEU 31 2HD1 LEU 31 0.952 -2.273 -0.653 264 3HD1 LEU 31 3HD1 LEU 31 0.313 -3.446 -1.805 265 1HD2 LEU 31 1HD2 LEU 31 0.414 -4.139 1.394 266 2HD2 LEU 31 2HD2 LEU 31 0.646 -5.783 0.801 267 3HD2 LEU 31 3HD2 LEU 31 -0.433 -4.680 -0.055 268 H SER 32 H SER 32 3.868 -7.322 -2.661 269 HA SER 32 HA SER 32 2.448 -9.746 -2.661 270 1HB SER 32 2HB SER 32 4.184 -10.557 -4.263 271 2HB SER 32 1HB SER 32 3.579 -8.951 -4.654 272 HG SER 32 HG SER 32 5.938 -9.267 -4.667 273 H LEU 33 H LEU 33 5.305 -8.954 -0.795 274 HA LEU 33 HA LEU 33 6.140 -11.697 -0.330 275 1HB LEU 33 2HB LEU 33 6.788 -9.040 0.936 276 2HB LEU 33 1HB LEU 33 7.362 -10.544 1.658 277 HG LEU 33 HG LEU 33 7.774 -10.066 -1.279 278 1HD1 LEU 33 1HD1 LEU 33 10.157 -9.284 -0.226 279 2HD1 LEU 33 2HD1 LEU 33 9.048 -8.615 0.972 280 3HD1 LEU 33 3HD1 LEU 33 8.897 -8.156 -0.723 281 1HD2 LEU 33 1HD2 LEU 33 9.624 -11.578 -0.948 282 2HD2 LEU 33 2HD2 LEU 33 8.237 -12.272 -0.111 283 3HD2 LEU 33 3HD2 LEU 33 9.495 -11.443 0.804 284 H GLN 34 H GLN 34 4.174 -9.348 1.518 285 HA GLN 34 HA GLN 34 3.728 -11.268 3.686 286 1HB GLN 34 2HB GLN 34 2.252 -9.513 4.631 287 2HB GLN 34 1HB GLN 34 3.848 -8.889 4.220 288 1HG GLN 34 2HG GLN 34 2.749 -8.274 1.933 289 2HG GLN 34 1HG GLN 34 1.227 -8.446 2.802 290 1HE2 GLN 34 1HE2 GLN 34 0.711 -6.854 4.425 291 2HE2 GLN 34 2HE2 GLN 34 1.639 -5.450 4.642 292 H ILE 35 H ILE 35 1.766 -9.998 0.969 293 HA ILE 35 HA ILE 35 -0.518 -11.667 1.819 294 HB ILE 35 HB ILE 35 -1.463 -10.808 -0.471 295 1HG1 ILE 35 2HG1 ILE 35 0.623 -8.675 0.028 296 2HG1 ILE 35 1HG1 ILE 35 0.854 -9.956 -1.163 297 1HG2 ILE 35 1HG2 ILE 35 -2.159 -8.703 0.631 298 2HG2 ILE 35 2HG2 ILE 35 -0.931 -8.962 1.870 299 3HG2 ILE 35 3HG2 ILE 35 -2.279 -10.089 1.715 300 1HD1 ILE 35 1HD1 ILE 35 -0.452 -8.875 -2.645 301 2HD1 ILE 35 2HD1 ILE 35 -0.532 -7.520 -1.519 302 3HD1 ILE 35 3HD1 ILE 35 -1.768 -8.777 -1.474 303 H GLY 36 H GLY 36 2.153 -11.886 -0.419 304 1HA GLY 36 2HA GLY 36 2.853 -13.712 -1.728 305 2HA GLY 36 1HA GLY 36 1.581 -14.669 -0.966 306 H THR 37 H THR 37 1.208 -11.649 -2.788 307 HA THR 37 HA THR 37 -0.582 -13.102 -4.689 308 HB THR 37 HB THR 37 -0.555 -10.110 -4.394 309 HG1 THR 37 HG1 THR 37 -1.901 -11.939 -2.689 310 1HG2 THR 37 1HG2 THR 37 -2.301 -10.338 -5.779 311 2HG2 THR 37 2HG2 THR 37 -3.149 -11.257 -4.535 312 3HG2 THR 37 3HG2 THR 37 -2.144 -12.094 -5.720 313 H GLN 38 H GLN 38 2.504 -11.753 -4.503 314 HA GLN 38 HA GLN 38 4.114 -11.285 -6.128 315 1HB GLN 38 2HB GLN 38 1.978 -12.626 -7.756 316 2HB GLN 38 1HB GLN 38 3.284 -11.794 -8.595 317 1HG GLN 38 2HG GLN 38 4.356 -13.384 -6.430 318 2HG GLN 38 1HG GLN 38 3.353 -14.386 -7.478 319 1HE2 GLN 38 1HE2 GLN 38 3.953 -14.482 -9.809 320 2HE2 GLN 38 2HE2 GLN 38 5.530 -14.084 -10.295 321 HA PRO 39 HA PRO 39 3.155 -7.188 -7.390 322 1HB PRO 39 2HB PRO 39 5.155 -6.791 -9.243 323 2HB PRO 39 1HB PRO 39 5.412 -6.776 -7.490 324 1HG PRO 39 2HG PRO 39 6.100 -8.901 -9.474 325 2HG PRO 39 1HG PRO 39 6.881 -8.509 -7.933 326 1HD PRO 39 2HD PRO 39 5.112 -10.653 -8.353 327 2HD PRO 39 1HD PRO 39 5.562 -9.987 -6.769 328 H ASN 40 H ASN 40 3.173 -9.768 -9.731 329 HA ASN 40 HA ASN 40 2.120 -8.123 -11.926 330 1HB ASN 40 2HB ASN 40 2.547 -11.103 -11.585 331 2HB ASN 40 1HB ASN 40 1.850 -10.390 -13.039 332 1HD2 ASN 40 1HD2 ASN 40 4.835 -10.736 -11.170 333 2HD2 ASN 40 2HD2 ASN 40 5.858 -10.055 -12.340 334 H LYS 41 H LYS 41 0.815 -9.901 -9.228 335 HA LYS 41 HA LYS 41 -1.902 -9.850 -10.472 336 1HB LYS 41 2HB LYS 41 -0.668 -11.946 -9.268 337 2HB LYS 41 1HB LYS 41 -1.498 -11.240 -7.881 338 1HG LYS 41 2HG LYS 41 -3.451 -11.145 -9.821 339 2HG LYS 41 1HG LYS 41 -2.611 -12.644 -10.217 340 1HD LYS 41 2HD LYS 41 -2.774 -13.076 -7.619 341 2HD LYS 41 1HD LYS 41 -4.096 -11.912 -7.714 342 1HE LYS 41 2HE LYS 41 -4.789 -13.438 -9.798 343 2HE LYS 41 1HE LYS 41 -3.893 -14.650 -8.887 344 1HZ LYS 41 1HZ LYS 41 -5.274 -14.203 -6.970 345 2HZ LYS 41 2HZ LYS 41 -6.244 -14.621 -8.302 346 3HZ LYS 41 3HZ LYS 41 -6.118 -12.999 -7.817 347 H ILE 42 H ILE 42 -0.096 -7.824 -8.644 348 HA ILE 42 HA ILE 42 -2.299 -7.153 -6.749 349 HB ILE 42 HB ILE 42 0.643 -6.431 -6.796 350 1HG1 ILE 42 2HG1 ILE 42 -1.019 -7.705 -4.611 351 2HG1 ILE 42 1HG1 ILE 42 -0.221 -8.657 -5.862 352 1HG2 ILE 42 1HG2 ILE 42 -0.982 -4.515 -6.126 353 2HG2 ILE 42 2HG2 ILE 42 0.322 -4.917 -5.011 354 3HG2 ILE 42 3HG2 ILE 42 -1.313 -5.496 -4.700 355 1HD1 ILE 42 1HD1 ILE 42 1.223 -6.682 -4.073 356 2HD1 ILE 42 2HD1 ILE 42 1.954 -7.827 -5.197 357 3HD1 ILE 42 3HD1 ILE 42 1.131 -8.413 -3.752 358 H VAL 43 H VAL 43 -3.530 -5.390 -7.142 359 HA VAL 43 HA VAL 43 -2.559 -3.399 -9.159 360 HB VAL 43 HB VAL 43 -5.420 -4.258 -8.607 361 1HG1 VAL 43 1HG1 VAL 43 -4.341 -1.906 -9.806 362 2HG1 VAL 43 2HG1 VAL 43 -6.030 -2.404 -9.721 363 3HG1 VAL 43 3HG1 VAL 43 -5.037 -2.886 -11.096 364 1HG2 VAL 43 1HG2 VAL 43 -5.267 -5.214 -10.920 365 2HG2 VAL 43 2HG2 VAL 43 -4.209 -6.024 -9.766 366 3HG2 VAL 43 3HG2 VAL 43 -3.539 -4.861 -10.911 367 H LEU 44 H LEU 44 -1.980 -1.610 -8.008 368 HA LEU 44 HA LEU 44 -3.551 -0.869 -5.591 369 1HB LEU 44 2HB LEU 44 -0.769 -0.578 -6.422 370 2HB LEU 44 1HB LEU 44 -1.450 0.952 -5.873 371 HG LEU 44 HG LEU 44 -2.372 -1.029 -4.067 372 1HD1 LEU 44 1HD1 LEU 44 0.527 -1.319 -4.854 373 2HD1 LEU 44 2HD1 LEU 44 -0.681 -2.583 -4.621 374 3HD1 LEU 44 3HD1 LEU 44 -0.024 -1.724 -3.228 375 1HD2 LEU 44 1HD2 LEU 44 -1.648 1.479 -3.839 376 2HD2 LEU 44 2HD2 LEU 44 -0.050 0.808 -3.515 377 3HD2 LEU 44 3HD2 LEU 44 -1.410 0.395 -2.469 378 H GLN 45 H GLN 45 -4.797 0.985 -5.540 379 HA GLN 45 HA GLN 45 -4.672 2.796 -7.915 380 1HB GLN 45 2HB GLN 45 -7.266 2.030 -6.560 381 2HB GLN 45 1HB GLN 45 -7.050 2.862 -8.098 382 1HG GLN 45 2HG GLN 45 -5.649 0.527 -8.512 383 2HG GLN 45 1HG GLN 45 -6.987 -0.019 -7.501 384 1HE2 GLN 45 1HE2 GLN 45 -6.163 1.376 -10.647 385 2HE2 GLN 45 2HE2 GLN 45 -7.710 1.209 -11.325 386 H LYS 46 H LYS 46 -5.143 4.995 -7.481 387 HA LYS 46 HA LYS 46 -5.519 5.714 -4.602 388 1HB LYS 46 2HB LYS 46 -3.125 5.970 -5.317 389 2HB LYS 46 1HB LYS 46 -3.656 7.126 -6.538 390 1HG LYS 46 2HG LYS 46 -3.772 8.781 -5.015 391 2HG LYS 46 1HG LYS 46 -4.782 7.799 -3.953 392 1HD LYS 46 2HD LYS 46 -2.672 6.611 -3.209 393 2HD LYS 46 1HD LYS 46 -1.756 7.828 -4.098 394 1HE LYS 46 2HE LYS 46 -2.352 9.538 -2.644 395 2HE LYS 46 1HE LYS 46 -3.846 8.741 -2.154 396 1HZ LYS 46 1HZ LYS 46 -1.090 7.934 -1.399 397 2HZ LYS 46 2HZ LYS 46 -2.498 7.073 -0.992 398 3HZ LYS 46 3HZ LYS 46 -2.249 8.639 -0.382 399 H GLY 47 H GLY 47 -7.578 6.537 -4.655 400 1HA GLY 47 2HA GLY 47 -9.330 8.017 -5.148 401 2HA GLY 47 1HA GLY 47 -8.115 9.070 -5.870 402 H GLY 48 H GLY 48 -9.156 5.772 -6.791 403 1HA GLY 48 2HA GLY 48 -10.076 4.969 -8.796 404 2HA GLY 48 1HA GLY 48 -10.651 6.607 -9.105 405 H SER 49 H SER 49 -7.305 5.431 -8.696 406 HA SER 49 HA SER 49 -6.753 5.985 -11.562 407 1HB SER 49 2HB SER 49 -6.032 7.762 -9.427 408 2HB SER 49 1HB SER 49 -4.560 7.041 -10.071 409 HG SER 49 HG SER 49 -5.342 8.977 -11.171 410 H VAL 50 H VAL 50 -5.246 4.547 -12.379 411 HA VAL 50 HA VAL 50 -4.370 2.380 -10.624 412 HB VAL 50 HB VAL 50 -5.127 1.982 -12.966 413 1HG1 VAL 50 1HG1 VAL 50 -4.144 2.934 -14.786 414 2HG1 VAL 50 2HG1 VAL 50 -2.524 2.805 -14.103 415 3HG1 VAL 50 3HG1 VAL 50 -3.578 4.136 -13.627 416 1HG2 VAL 50 1HG2 VAL 50 -2.221 1.206 -12.607 417 2HG2 VAL 50 2HG2 VAL 50 -3.482 0.306 -13.451 418 3HG2 VAL 50 3HG2 VAL 50 -3.533 0.458 -11.695 419 H LEU 51 H LEU 51 -2.424 2.186 -9.649 420 HA LEU 51 HA LEU 51 -0.398 4.302 -10.090 421 1HB LEU 51 2HB LEU 51 -0.259 2.032 -8.087 422 2HB LEU 51 1HB LEU 51 0.605 3.568 -8.042 423 HG LEU 51 HG LEU 51 -2.400 3.229 -7.774 424 1HD1 LEU 51 1HD1 LEU 51 -0.522 2.704 -5.866 425 2HD1 LEU 51 2HD1 LEU 51 -2.143 3.303 -5.512 426 3HD1 LEU 51 3HD1 LEU 51 -0.787 4.428 -5.603 427 1HD2 LEU 51 1HD2 LEU 51 -0.573 5.603 -7.984 428 2HD2 LEU 51 2HD2 LEU 51 -2.022 5.721 -6.987 429 3HD2 LEU 51 3HD2 LEU 51 -2.163 5.354 -8.707 430 H LYS 52 H LYS 52 1.507 3.922 -11.171 431 HA LYS 52 HA LYS 52 2.021 1.101 -12.029 432 1HB LYS 52 2HB LYS 52 1.813 3.554 -13.541 433 2HB LYS 52 1HB LYS 52 3.418 2.852 -13.749 434 1HG LYS 52 2HG LYS 52 2.467 0.722 -14.421 435 2HG LYS 52 1HG LYS 52 0.838 1.285 -14.043 436 1HD LYS 52 2HD LYS 52 1.018 3.014 -15.793 437 2HD LYS 52 1HD LYS 52 2.649 2.459 -16.173 438 1HE LYS 52 2HE LYS 52 0.726 1.574 -17.651 439 2HE LYS 52 1HE LYS 52 1.873 0.391 -17.026 440 1HZ LYS 52 1HZ LYS 52 0.362 -0.313 -15.404 441 2HZ LYS 52 2HZ LYS 52 -0.579 -0.142 -16.808 442 3HZ LYS 52 3HZ LYS 52 -0.636 1.046 -15.597 443 H ASP 53 H ASP 53 4.171 0.371 -12.074 444 HA ASP 53 HA ASP 53 5.855 1.214 -9.943 445 1HB ASP 53 2HB ASP 53 7.505 -0.341 -10.878 446 2HB ASP 53 1HB ASP 53 5.896 -1.061 -10.932 447 H HIS 54 H HIS 54 5.702 2.295 -13.279 448 HA HIS 54 HA HIS 54 8.340 3.444 -13.415 449 1HB HIS 54 2HB HIS 54 5.792 4.058 -14.931 450 2HB HIS 54 1HB HIS 54 7.360 4.768 -15.319 451 HD1 HIS 54 HD1 HIS 54 5.348 1.703 -15.749 452 HD2 HIS 54 HD2 HIS 54 9.355 2.783 -16.142 453 HE1 HIS 54 HE1 HIS 54 6.466 -0.153 -17.061 454 H ILE 55 H ILE 55 5.557 4.432 -11.658 455 HA ILE 55 HA ILE 55 6.589 7.232 -11.494 456 HB ILE 55 HB ILE 55 3.852 6.096 -10.834 457 1HG1 ILE 55 2HG1 ILE 55 3.428 8.014 -12.679 458 2HG1 ILE 55 1HG1 ILE 55 5.060 7.539 -13.151 459 1HG2 ILE 55 1HG2 ILE 55 4.923 8.930 -10.638 460 2HG2 ILE 55 2HG2 ILE 55 4.430 7.911 -9.286 461 3HG2 ILE 55 3HG2 ILE 55 3.230 8.475 -10.447 462 1HD1 ILE 55 1HD1 ILE 55 3.639 6.118 -14.410 463 2HD1 ILE 55 2HD1 ILE 55 2.575 5.826 -13.034 464 3HD1 ILE 55 3HD1 ILE 55 4.187 5.114 -13.068 465 H SER 56 H SER 56 7.125 8.086 -9.480 466 HA SER 56 HA SER 56 7.783 6.169 -7.387 467 1HB SER 56 2HB SER 56 8.697 8.131 -6.199 468 2HB SER 56 1HB SER 56 9.266 8.069 -7.863 469 HG SER 56 HG SER 56 8.501 10.160 -7.189 470 H LEU 57 H LEU 57 6.967 6.206 -5.209 471 HA LEU 57 HA LEU 57 4.133 6.493 -4.956 472 1HB LEU 57 2HB LEU 57 6.329 6.274 -2.878 473 2HB LEU 57 1HB LEU 57 4.615 6.291 -2.464 474 HG LEU 57 HG LEU 57 5.752 4.341 -4.476 475 1HD1 LEU 57 1HD1 LEU 57 5.552 4.115 -1.466 476 2HD1 LEU 57 2HD1 LEU 57 6.972 3.856 -2.480 477 3HD1 LEU 57 3HD1 LEU 57 5.640 2.702 -2.518 478 1HD2 LEU 57 1HD2 LEU 57 3.140 5.003 -3.548 479 2HD2 LEU 57 2HD2 LEU 57 3.531 3.409 -2.904 480 3HD2 LEU 57 3HD2 LEU 57 3.598 3.698 -4.642 481 H GLU 58 H GLU 58 6.821 8.670 -4.175 482 HA GLU 58 HA GLU 58 5.358 10.636 -2.708 483 1HB GLU 58 2HB GLU 58 7.946 10.373 -3.194 484 2HB GLU 58 1HB GLU 58 7.586 11.429 -4.559 485 1HG GLU 58 2HG GLU 58 8.133 12.939 -2.831 486 2HG GLU 58 1HG GLU 58 6.370 12.921 -2.818 487 H ASP 59 H ASP 59 5.755 10.090 -6.189 488 HA ASP 59 HA ASP 59 4.619 12.574 -7.086 489 1HB ASP 59 2HB ASP 59 5.771 10.391 -8.318 490 2HB ASP 59 1HB ASP 59 4.076 10.213 -8.769 491 H TYR 60 H TYR 60 3.196 9.382 -6.382 492 HA TYR 60 HA TYR 60 0.489 10.167 -7.077 493 1HB TYR 60 2HB TYR 60 1.690 7.828 -5.594 494 2HB TYR 60 1HB TYR 60 -0.056 8.040 -5.706 495 HD1 TYR 60 HD1 TYR 60 2.555 6.343 -7.161 496 HD2 TYR 60 HD2 TYR 60 -0.744 8.863 -8.273 497 HE1 TYR 60 HE1 TYR 60 2.575 5.368 -9.441 498 HE2 TYR 60 HE2 TYR 60 -0.720 7.887 -10.551 499 HH TYR 60 HH TYR 60 1.054 6.735 -12.040 500 H GLU 61 H GLU 61 2.491 10.725 -4.338 501 HA GLU 61 HA GLU 61 2.048 12.070 -2.463 502 1HB GLU 61 2HB GLU 61 -0.089 12.751 -3.946 503 2HB GLU 61 1HB GLU 61 -0.920 11.832 -2.690 504 1HG GLU 61 2HG GLU 61 1.140 13.706 -1.693 505 2HG GLU 61 1HG GLU 61 -0.246 14.475 -2.465 506 H VAL 62 H VAL 62 2.827 9.741 -1.888 507 HA VAL 62 HA VAL 62 0.778 8.376 -0.191 508 HB VAL 62 HB VAL 62 3.426 7.339 -1.266 509 1HG1 VAL 62 1HG1 VAL 62 1.878 6.475 0.944 510 2HG1 VAL 62 2HG1 VAL 62 3.226 5.631 0.185 511 3HG1 VAL 62 3HG1 VAL 62 1.576 5.320 -0.354 512 1HG2 VAL 62 1HG2 VAL 62 2.295 6.585 -3.074 513 2HG2 VAL 62 2HG2 VAL 62 0.980 7.651 -2.582 514 3HG2 VAL 62 3HG2 VAL 62 0.981 5.962 -2.078 515 H HIS 63 H HIS 63 0.921 9.359 1.792 516 HA HIS 63 HA HIS 63 3.648 9.776 2.952 517 1HB HIS 63 2HB HIS 63 1.039 11.234 3.250 518 2HB HIS 63 1HB HIS 63 2.204 11.280 4.572 519 HD1 HIS 63 HD1 HIS 63 1.409 12.906 1.436 520 HD2 HIS 63 HD2 HIS 63 4.904 12.176 3.581 521 HE1 HIS 63 HE1 HIS 63 3.159 14.487 0.513 522 H ASP 64 H ASP 64 3.244 9.866 5.580 523 HA ASP 64 HA ASP 64 2.851 7.134 6.357 524 1HB ASP 64 2HB ASP 64 4.227 9.000 7.528 525 2HB ASP 64 1HB ASP 64 2.698 9.450 8.284 526 H GLN 65 H GLN 65 1.091 6.085 7.177 527 HA GLN 65 HA GLN 65 -1.138 5.637 7.699 528 1HB GLN 65 2HB GLN 65 -0.434 8.061 9.084 529 2HB GLN 65 1HB GLN 65 -2.114 8.165 8.557 530 1HG GLN 65 2HG GLN 65 -2.394 7.041 10.562 531 2HG GLN 65 1HG GLN 65 -2.197 5.670 9.470 532 1HE2 GLN 65 1HE2 GLN 65 -0.133 4.505 9.522 533 2HE2 GLN 65 2HE2 GLN 65 0.969 4.727 10.793 534 H THR 66 H THR 66 -0.517 6.450 4.990 535 HA THR 66 HA THR 66 -2.811 8.147 4.183 536 HB THR 66 HB THR 66 -0.494 8.404 3.157 537 HG1 THR 66 HG1 THR 66 -1.596 9.238 1.607 538 1HG2 THR 66 1HG2 THR 66 0.043 6.011 2.949 539 2HG2 THR 66 2HG2 THR 66 0.106 6.807 1.376 540 3HG2 THR 66 3HG2 THR 66 -1.283 5.808 1.803 541 H ASN 67 H ASN 67 -4.474 7.355 2.776 542 HA ASN 67 HA ASN 67 -4.909 4.424 3.024 543 1HB ASN 67 2HB ASN 67 -6.607 6.479 3.542 544 2HB ASN 67 1HB ASN 67 -7.033 6.141 1.865 545 1HD2 ASN 67 1HD2 ASN 67 -6.945 4.736 5.134 546 2HD2 ASN 67 2HD2 ASN 67 -7.935 3.406 4.772 547 H LEU 68 H LEU 68 -5.125 3.099 1.255 548 HA LEU 68 HA LEU 68 -5.050 4.307 -1.468 549 1HB LEU 68 2HB LEU 68 -2.970 2.650 -0.164 550 2HB LEU 68 1HB LEU 68 -3.417 2.136 -1.790 551 HG LEU 68 HG LEU 68 -3.004 5.057 -1.391 552 1HD1 LEU 68 1HD1 LEU 68 -1.107 4.285 -0.138 553 2HD1 LEU 68 2HD1 LEU 68 -0.513 4.691 -1.747 554 3HD1 LEU 68 3HD1 LEU 68 -0.778 3.004 -1.306 555 1HD2 LEU 68 1HD2 LEU 68 -2.295 4.954 -3.644 556 2HD2 LEU 68 2HD2 LEU 68 -3.576 3.746 -3.556 557 3HD2 LEU 68 3HD2 LEU 68 -1.886 3.243 -3.528 558 H GLU 69 H GLU 69 -5.302 2.358 -3.125 559 HA GLU 69 HA GLU 69 -7.454 0.570 -2.051 560 1HB GLU 69 2HB GLU 69 -7.051 1.773 -4.802 561 2HB GLU 69 1HB GLU 69 -8.214 0.490 -4.475 562 1HG GLU 69 2HG GLU 69 -9.665 2.153 -3.969 563 2HG GLU 69 1HG GLU 69 -8.752 2.323 -2.472 564 H LEU 70 H LEU 70 -7.407 -1.637 -2.662 565 HA LEU 70 HA LEU 70 -5.016 -2.554 -4.194 566 1HB LEU 70 2HB LEU 70 -4.465 -2.793 -1.818 567 2HB LEU 70 1HB LEU 70 -5.965 -3.673 -1.537 568 HG LEU 70 HG LEU 70 -5.212 -5.456 -3.073 569 1HD1 LEU 70 1HD1 LEU 70 -2.568 -5.191 -3.507 570 2HD1 LEU 70 2HD1 LEU 70 -3.023 -3.488 -3.538 571 3HD1 LEU 70 3HD1 LEU 70 -3.775 -4.622 -4.661 572 1HD2 LEU 70 1HD2 LEU 70 -4.584 -6.100 -0.949 573 2HD2 LEU 70 2HD2 LEU 70 -3.631 -4.641 -0.676 574 3HD2 LEU 70 3HD2 LEU 70 -2.977 -5.950 -1.661 575 H TYR 71 H TYR 71 -5.529 -4.070 -5.697 576 HA TYR 71 HA TYR 71 -8.029 -5.659 -5.361 577 1HB TYR 71 2HB TYR 71 -7.228 -4.100 -7.841 578 2HB TYR 71 1HB TYR 71 -8.546 -5.271 -7.781 579 HD1 TYR 71 HD1 TYR 71 -7.559 -1.869 -7.134 580 HD2 TYR 71 HD2 TYR 71 -10.436 -4.883 -6.089 581 HE1 TYR 71 HE1 TYR 71 -9.074 -0.118 -6.249 582 HE2 TYR 71 HE2 TYR 71 -11.950 -3.132 -5.205 583 HH TYR 71 HH TYR 71 -12.040 -0.269 -5.886 584 H TYR 72 H TYR 72 -7.899 -7.745 -6.279 585 HA TYR 72 HA TYR 72 -5.144 -8.586 -7.024 586 1HB TYR 72 2HB TYR 72 -7.599 -10.142 -6.160 587 2HB TYR 72 1HB TYR 72 -6.111 -10.913 -6.699 588 HD1 TYR 72 HD1 TYR 72 -6.759 -11.757 -4.141 589 HD2 TYR 72 HD2 TYR 72 -5.002 -7.981 -5.219 590 HE1 TYR 72 HE1 TYR 72 -5.821 -11.535 -1.857 591 HE2 TYR 72 HE2 TYR 72 -4.070 -7.763 -2.937 592 HH TYR 72 HH TYR 72 -4.794 -8.773 -0.547 593 H LEU 73 HN LEU 73 -4.659 -8.993 -9.098 594 HA LEU 73 HA LEU 73 -4.863 -9.618 -11.342 595 1HB LEU 73 2HB LEU 73 -6.620 -11.282 -10.229 596 2HB LEU 73 1HB LEU 73 -7.775 -10.255 -11.080 597 HG LEU 73 HG LEU 73 -5.429 -11.029 -12.693 598 1HD1 LEU 73 1HD1 LEU 73 -5.550 -13.269 -12.508 599 2HD1 LEU 73 2HD1 LEU 73 -7.301 -13.244 -12.708 600 3HD1 LEU 73 3HD1 LEU 73 -6.593 -13.040 -11.105 601 1HD2 LEU 73 1HD2 LEU 73 -7.068 -11.187 -14.415 602 2HD2 LEU 73 2HD2 LEU 73 -7.601 -9.843 -13.404 603 3HD2 LEU 73 3HD2 LEU 73 -8.377 -11.419 -13.256 Start of MODEL 16 1 H MET 1 1H MET 1 11.660 5.696 5.526 2 HA MET 1 HA MET 1 9.649 4.657 4.599 3 1HB MET 1 2HB MET 1 11.505 3.514 6.112 4 2HB MET 1 1HB MET 1 10.161 3.333 7.240 5 1HG MET 1 2HG MET 1 8.833 2.236 5.446 6 2HG MET 1 1HG MET 1 10.221 2.362 4.366 7 1HE MET 1 1HE MET 1 11.619 -0.892 4.651 8 2HE MET 1 2HE MET 1 11.254 0.600 3.785 9 3HE MET 1 3HE MET 1 9.961 -0.540 4.148 10 H ILE 2 H ILE 2 7.451 4.474 4.717 11 HA ILE 2 HA ILE 2 6.122 5.301 7.271 12 HB ILE 2 HB ILE 2 4.296 6.242 5.906 13 1HG1 ILE 2 2HG1 ILE 2 6.052 5.790 3.481 14 2HG1 ILE 2 1HG1 ILE 2 4.791 4.646 3.943 15 1HG2 ILE 2 1HG2 ILE 2 6.943 7.320 4.907 16 2HG2 ILE 2 2HG2 ILE 2 6.367 7.584 6.553 17 3HG2 ILE 2 3HG2 ILE 2 5.448 8.214 5.186 18 1HD1 ILE 2 1HD1 ILE 2 4.547 7.350 2.772 19 2HD1 ILE 2 2HD1 ILE 2 3.415 6.997 4.076 20 3HD1 ILE 2 3HD1 ILE 2 3.461 5.967 2.646 21 H GLU 3 H GLU 3 3.917 4.360 7.543 22 HA GLU 3 HA GLU 3 3.735 1.647 6.290 23 1HB GLU 3 2HB GLU 3 2.481 1.013 8.414 24 2HB GLU 3 1HB GLU 3 4.202 1.333 8.621 25 1HG GLU 3 2HG GLU 3 3.815 3.112 9.966 26 2HG GLU 3 1HG GLU 3 2.565 3.749 8.899 27 H VAL 4 H VAL 4 2.125 1.669 4.816 28 HA VAL 4 HA VAL 4 -0.310 3.311 5.390 29 HB VAL 4 HB VAL 4 -0.685 3.319 2.952 30 1HG1 VAL 4 1HG1 VAL 4 0.718 5.086 3.993 31 2HG1 VAL 4 2HG1 VAL 4 1.212 4.744 2.336 32 3HG1 VAL 4 3HG1 VAL 4 2.152 4.107 3.686 33 1HG2 VAL 4 1HG2 VAL 4 0.405 1.093 2.543 34 2HG2 VAL 4 2HG2 VAL 4 1.973 1.869 2.773 35 3HG2 VAL 4 3HG2 VAL 4 0.939 2.352 1.430 36 H VAL 5 H VAL 5 -2.346 2.354 4.327 37 HA VAL 5 HA VAL 5 -2.357 -0.628 4.576 38 HB VAL 5 HB VAL 5 -4.710 -0.353 5.513 39 1HG1 VAL 5 1HG1 VAL 5 -2.231 0.557 6.972 40 2HG1 VAL 5 2HG1 VAL 5 -3.058 -1.000 7.066 41 3HG1 VAL 5 3HG1 VAL 5 -3.784 0.430 7.802 42 1HG2 VAL 5 1HG2 VAL 5 -5.232 1.830 6.546 43 2HG2 VAL 5 2HG2 VAL 5 -5.041 1.995 4.800 44 3HG2 VAL 5 3HG2 VAL 5 -3.743 2.504 5.881 45 H VAL 6 H VAL 6 -3.675 -1.722 3.095 46 HA VAL 6 HA VAL 6 -4.945 -0.022 0.982 47 HB VAL 6 HB VAL 6 -4.447 -1.905 -0.594 48 1HG1 VAL 6 1HG1 VAL 6 -1.850 -1.537 -0.431 49 2HG1 VAL 6 2HG1 VAL 6 -2.281 -0.393 0.840 50 3HG1 VAL 6 3HG1 VAL 6 -2.902 -0.168 -0.796 51 1HG2 VAL 6 1HG2 VAL 6 -3.855 -3.269 1.822 52 2HG2 VAL 6 2HG2 VAL 6 -2.328 -3.107 0.955 53 3HG2 VAL 6 3HG2 VAL 6 -3.704 -3.887 0.178 54 H ASN 7 H ASN 7 -6.976 -0.685 0.201 55 HA ASN 7 HA ASN 7 -8.335 -2.789 1.841 56 1HB ASN 7 2HB ASN 7 -9.706 -0.572 0.300 57 2HB ASN 7 1HB ASN 7 -10.379 -1.581 1.580 58 1HD2 ASN 7 1HD2 ASN 7 -9.169 -1.333 3.797 59 2HD2 ASN 7 2HD2 ASN 7 -8.655 0.232 4.205 60 H ASP 8 H ASP 8 -8.909 -4.605 0.749 61 HA ASP 8 HA ASP 8 -8.482 -4.824 -2.113 62 1HB ASP 8 2HB ASP 8 -9.495 -6.683 0.025 63 2HB ASP 8 1HB ASP 8 -9.619 -7.133 -1.674 64 H ARG 9 H ARG 9 -11.464 -5.566 -0.254 65 HA ARG 9 HA ARG 9 -13.037 -4.137 -2.343 66 1HB ARG 9 2HB ARG 9 -13.218 -7.040 -1.588 67 2HB ARG 9 1HB ARG 9 -14.688 -6.186 -2.055 68 1HG ARG 9 2HG ARG 9 -14.116 -6.507 -4.208 69 2HG ARG 9 1HG ARG 9 -12.740 -5.434 -3.953 70 1HD ARG 9 2HD ARG 9 -11.698 -7.655 -2.881 71 2HD ARG 9 1HD ARG 9 -12.837 -8.417 -3.990 72 HE ARG 9 HE ARG 9 -11.671 -6.831 -5.742 73 1HH1 ARG 9 2HH1 ARG 9 -10.393 -9.486 -5.447 74 2HH1 ARG 9 1HH1 ARG 9 -8.751 -9.083 -5.071 75 1HH2 ARG 9 1HH2 ARG 9 -9.478 -5.802 -4.200 76 2HH2 ARG 9 2HH2 ARG 9 -8.232 -6.994 -4.362 77 H LEU 10 H LEU 10 -12.633 -2.910 -0.016 78 HA LEU 10 HA LEU 10 -13.674 -1.990 1.867 79 1HB LEU 10 2HB LEU 10 -15.741 -2.570 -0.068 80 2HB LEU 10 1HB LEU 10 -16.374 -2.804 1.561 81 HG LEU 10 HG LEU 10 -14.900 -0.474 1.807 82 1HD1 LEU 10 1HD1 LEU 10 -16.349 -0.465 -0.859 83 2HD1 LEU 10 2HD1 LEU 10 -14.603 -0.360 -0.632 84 3HD1 LEU 10 3HD1 LEU 10 -15.644 0.950 -0.075 85 1HD2 LEU 10 1HD2 LEU 10 -17.136 -0.948 2.747 86 2HD2 LEU 10 2HD2 LEU 10 -17.849 -0.788 1.141 87 3HD2 LEU 10 3HD2 LEU 10 -17.117 0.612 1.925 88 H GLY 11 H GLY 11 -12.457 -3.792 3.002 89 1HA GLY 11 2HA GLY 11 -13.764 -4.900 5.144 90 2HA GLY 11 1HA GLY 11 -14.011 -6.114 3.888 91 H LYS 12 H LYS 12 -11.750 -6.353 2.558 92 HA LYS 12 HA LYS 12 -9.890 -7.466 4.526 93 1HB LYS 12 2HB LYS 12 -10.554 -8.062 1.887 94 2HB LYS 12 1HB LYS 12 -8.929 -7.392 1.768 95 1HG LYS 12 2HG LYS 12 -8.550 -8.977 3.896 96 2HG LYS 12 1HG LYS 12 -9.864 -9.871 3.131 97 1HD LYS 12 2HD LYS 12 -8.443 -10.708 1.609 98 2HD LYS 12 1HD LYS 12 -8.004 -9.077 1.098 99 1HE LYS 12 2HE LYS 12 -6.347 -8.955 2.928 100 2HE LYS 12 1HE LYS 12 -6.776 -10.591 3.424 101 1HZ LYS 12 1HZ LYS 12 -5.424 -11.409 1.893 102 2HZ LYS 12 2HZ LYS 12 -4.921 -9.832 1.504 103 3HZ LYS 12 3HZ LYS 12 -6.212 -10.551 0.664 104 H LYS 13 H LYS 13 -8.525 -6.094 5.548 105 HA LYS 13 HA LYS 13 -7.314 -3.855 3.974 106 1HB LYS 13 2HB LYS 13 -8.740 -3.348 6.058 107 2HB LYS 13 1HB LYS 13 -7.405 -4.031 6.987 108 1HG LYS 13 2HG LYS 13 -5.869 -2.419 5.780 109 2HG LYS 13 1HG LYS 13 -7.313 -1.642 5.130 110 1HD LYS 13 2HD LYS 13 -7.892 -1.833 7.828 111 2HD LYS 13 1HD LYS 13 -6.163 -1.488 7.826 112 1HE LYS 13 2HE LYS 13 -6.660 0.674 7.450 113 2HE LYS 13 1HE LYS 13 -7.262 0.204 5.861 114 1HZ LYS 13 1HZ LYS 13 -8.893 0.103 8.339 115 2HZ LYS 13 2HZ LYS 13 -9.432 -0.104 6.740 116 3HZ LYS 13 3HZ LYS 13 -8.890 1.418 7.267 117 H VAL 14 H VAL 14 -5.180 -4.036 3.541 118 HA VAL 14 HA VAL 14 -3.527 -5.883 5.229 119 HB VAL 14 HB VAL 14 -2.870 -5.105 2.380 120 1HG1 VAL 14 1HG1 VAL 14 -1.688 -7.343 2.517 121 2HG1 VAL 14 2HG1 VAL 14 -2.083 -7.369 4.235 122 3HG1 VAL 14 3HG1 VAL 14 -1.041 -6.101 3.589 123 1HG2 VAL 14 1HG2 VAL 14 -4.459 -7.538 3.268 124 2HG2 VAL 14 2HG2 VAL 14 -3.962 -7.158 1.618 125 3HG2 VAL 14 3HG2 VAL 14 -5.145 -6.140 2.439 126 H ARG 15 H ARG 15 -1.456 -5.113 5.868 127 HA ARG 15 HA ARG 15 -1.067 -2.170 5.511 128 1HB ARG 15 2HB ARG 15 0.217 -2.231 7.601 129 2HB ARG 15 1HB ARG 15 -1.384 -2.923 7.856 130 1HG ARG 15 2HG ARG 15 0.121 -5.117 7.072 131 2HG ARG 15 1HG ARG 15 1.251 -4.194 8.062 132 1HD ARG 15 2HD ARG 15 0.040 -4.502 9.976 133 2HD ARG 15 1HD ARG 15 -1.507 -4.451 9.132 134 HE ARG 15 HE ARG 15 -0.077 -6.837 9.818 135 1HH1 ARG 15 1HH2 ARG 15 -3.005 -6.733 9.133 136 2HH1 ARG 15 2HH2 ARG 15 -3.055 -7.627 7.651 137 1HH2 ARG 15 2HH1 ARG 15 0.361 -7.396 7.082 138 2HH2 ARG 15 1HH1 ARG 15 -1.150 -8.001 6.490 139 H VAL 16 H VAL 16 0.970 -1.398 4.871 140 HA VAL 16 HA VAL 16 3.157 -3.322 4.383 141 HB VAL 16 HB VAL 16 1.806 -3.506 2.348 142 1HG1 VAL 16 1HG1 VAL 16 0.539 -1.603 2.058 143 2HG1 VAL 16 2HG1 VAL 16 1.852 -1.237 0.940 144 3HG1 VAL 16 3HG1 VAL 16 1.844 -0.525 2.552 145 1HG2 VAL 16 1HG2 VAL 16 3.623 -3.460 0.972 146 2HG2 VAL 16 2HG2 VAL 16 4.496 -3.008 2.435 147 3HG2 VAL 16 3HG2 VAL 16 3.960 -1.762 1.309 148 H LYS 17 H LYS 17 5.180 -2.309 4.397 149 HA LYS 17 HA LYS 17 5.123 0.624 4.946 150 1HB LYS 17 2HB LYS 17 7.237 0.299 6.145 151 2HB LYS 17 1HB LYS 17 6.001 -0.782 6.783 152 1HG LYS 17 2HG LYS 17 7.134 -2.292 4.759 153 2HG LYS 17 1HG LYS 17 8.521 -1.423 5.416 154 1HD LYS 17 2HD LYS 17 8.401 -2.480 7.442 155 2HD LYS 17 1HD LYS 17 6.641 -2.571 7.407 156 1HE LYS 17 2HE LYS 17 7.781 -4.177 5.281 157 2HE LYS 17 1HE LYS 17 8.454 -4.650 6.838 158 1HZ LYS 17 1HZ LYS 17 5.779 -4.299 7.313 159 2HZ LYS 17 2HZ LYS 17 6.589 -5.783 7.141 160 3HZ LYS 17 3HZ LYS 17 5.832 -5.066 5.800 161 H CYS 18 H CYS 18 6.323 2.012 3.719 162 HA CYS 18 HA CYS 18 8.483 1.119 1.968 163 1HB CYS 18 2HB CYS 18 7.385 1.847 -0.141 164 2HB CYS 18 1HB CYS 18 6.553 0.472 0.585 165 HG CYS 18 HG CYS 18 4.557 1.902 1.074 166 H LEU 19 H LEU 19 9.577 2.983 0.974 167 HA LEU 19 HA LEU 19 9.290 5.406 2.603 168 1HB LEU 19 2HB LEU 19 11.230 4.489 0.484 169 2HB LEU 19 1HB LEU 19 11.216 6.167 1.023 170 HG LEU 19 HG LEU 19 11.121 4.625 3.378 171 1HD1 LEU 19 1HD1 LEU 19 13.276 3.298 3.053 172 2HD1 LEU 19 2HD1 LEU 19 13.036 3.510 1.318 173 3HD1 LEU 19 3HD1 LEU 19 11.842 2.632 2.274 174 1HD2 LEU 19 1HD2 LEU 19 13.253 6.224 1.953 175 2HD2 LEU 19 2HD2 LEU 19 13.558 5.486 3.527 176 3HD2 LEU 19 3HD2 LEU 19 12.282 6.690 3.351 177 H ALA 20 H ALA 20 8.698 7.464 1.801 178 HA ALA 20 HA ALA 20 6.699 7.541 -0.247 179 1HB ALA 20 1HB ALA 20 6.567 9.853 0.180 180 2HB ALA 20 2HB ALA 20 8.278 9.968 0.595 181 3HB ALA 20 3HB ALA 20 7.149 9.199 1.711 182 H GLU 21 H GLU 21 10.178 7.830 -0.364 183 HA GLU 21 HA GLU 21 10.198 9.015 -3.058 184 1HB GLU 21 2HB GLU 21 12.669 8.695 -2.896 185 2HB GLU 21 1HB GLU 21 12.012 9.611 -1.541 186 1HG GLU 21 2HG GLU 21 11.926 6.791 -0.925 187 2HG GLU 21 1HG GLU 21 13.557 7.237 -1.426 188 H ASP 22 H ASP 22 10.036 5.841 -1.681 189 HA ASP 22 HA ASP 22 11.321 4.333 -3.754 190 1HB ASP 22 2HB ASP 22 9.600 3.786 -1.454 191 2HB ASP 22 1HB ASP 22 9.235 2.730 -2.818 192 H SER 23 H SER 23 10.146 2.955 -5.375 193 HA SER 23 HA SER 23 8.061 4.574 -6.718 194 1HB SER 23 2HB SER 23 10.189 2.821 -7.588 195 2HB SER 23 1HB SER 23 8.655 2.306 -8.281 196 HG SER 23 HG SER 23 9.144 3.866 -9.638 197 H VAL 24 H VAL 24 6.263 3.291 -7.823 198 HA VAL 24 HA VAL 24 4.693 1.918 -5.870 199 HB VAL 24 HB VAL 24 4.436 1.909 -8.895 200 1HG1 VAL 24 1HG1 VAL 24 2.656 0.933 -6.669 201 2HG1 VAL 24 2HG1 VAL 24 3.086 0.123 -8.176 202 3HG1 VAL 24 3HG1 VAL 24 1.964 1.484 -8.195 203 1HG2 VAL 24 1HG2 VAL 24 3.165 3.627 -6.739 204 2HG2 VAL 24 2HG2 VAL 24 2.714 3.660 -8.443 205 3HG2 VAL 24 3HG2 VAL 24 4.329 4.165 -7.950 206 H GLY 25 H GLY 25 6.980 0.761 -8.305 207 1HA GLY 25 2HA GLY 25 6.307 -2.000 -8.333 208 2HA GLY 25 1HA GLY 25 7.932 -1.368 -8.607 209 H ASP 26 H ASP 26 8.459 -0.162 -6.148 210 HA ASP 26 HA ASP 26 9.232 -2.389 -4.503 211 1HB ASP 26 2HB ASP 26 10.453 -0.249 -4.462 212 2HB ASP 26 1HB ASP 26 9.027 0.568 -3.824 213 H PHE 27 H PHE 27 6.535 -0.086 -4.378 214 HA PHE 27 HA PHE 27 5.408 -0.800 -1.869 215 1HB PHE 27 2HB PHE 27 4.749 1.106 -3.478 216 2HB PHE 27 1HB PHE 27 3.791 -0.101 -4.332 217 HD1 PHE 27 HD1 PHE 27 2.243 -1.597 -2.727 218 HD2 PHE 27 HD2 PHE 27 3.711 2.331 -1.796 219 HE1 PHE 27 HE1 PHE 27 0.406 -1.298 -1.095 220 HE2 PHE 27 HE2 PHE 27 1.872 2.628 -0.163 221 HZ PHE 27 HZ PHE 27 0.219 0.814 0.187 222 H LYS 28 H LYS 28 4.810 -2.146 -5.130 223 HA LYS 28 HA LYS 28 2.917 -4.143 -4.253 224 1HB LYS 28 2HB LYS 28 4.615 -3.896 -6.750 225 2HB LYS 28 1HB LYS 28 3.434 -5.184 -6.509 226 1HG LYS 28 2HG LYS 28 1.621 -3.632 -6.395 227 2HG LYS 28 1HG LYS 28 2.717 -2.258 -6.255 228 1HD LYS 28 2HD LYS 28 3.508 -2.598 -8.534 229 2HD LYS 28 1HD LYS 28 2.541 -4.064 -8.684 230 1HE LYS 28 2HE LYS 28 0.526 -2.887 -8.779 231 2HE LYS 28 1HE LYS 28 1.193 -1.479 -7.956 232 1HZ LYS 28 1HZ LYS 28 2.132 -2.318 -10.632 233 2HZ LYS 28 2HZ LYS 28 2.329 -0.813 -9.867 234 3HZ LYS 28 3HZ LYS 28 0.800 -1.288 -10.436 235 H LYS 29 H LYS 29 6.436 -4.068 -4.486 236 HA LYS 29 HA LYS 29 6.837 -6.920 -4.281 237 1HB LYS 29 2HB LYS 29 8.586 -4.508 -3.838 238 2HB LYS 29 1HB LYS 29 9.162 -6.122 -3.417 239 1HG LYS 29 2HG LYS 29 8.421 -6.803 -5.794 240 2HG LYS 29 1HG LYS 29 8.353 -5.073 -6.129 241 1HD LYS 29 2HD LYS 29 10.798 -5.355 -4.862 242 2HD LYS 29 1HD LYS 29 10.688 -6.824 -5.833 243 1HE LYS 29 2HE LYS 29 10.198 -5.475 -7.834 244 2HE LYS 29 1HE LYS 29 10.290 -4.001 -6.871 245 1HZ LYS 29 1HZ LYS 29 12.532 -5.928 -7.049 246 2HZ LYS 29 2HZ LYS 29 12.566 -4.323 -6.485 247 3HZ LYS 29 3HZ LYS 29 12.351 -4.643 -8.140 248 H VAL 30 H VAL 30 6.776 -4.285 -1.862 249 HA VAL 30 HA VAL 30 7.291 -6.087 0.367 250 HB VAL 30 HB VAL 30 6.065 -3.307 0.427 251 1HG1 VAL 30 1HG1 VAL 30 6.678 -3.270 2.730 252 2HG1 VAL 30 2HG1 VAL 30 7.669 -4.720 2.568 253 3HG1 VAL 30 3HG1 VAL 30 5.911 -4.840 2.481 254 1HG2 VAL 30 1HG2 VAL 30 8.456 -2.640 0.999 255 2HG2 VAL 30 2HG2 VAL 30 8.198 -3.126 -0.676 256 3HG2 VAL 30 3HG2 VAL 30 8.948 -4.246 0.459 257 H LEU 31 H LEU 31 4.405 -4.659 -1.134 258 HA LEU 31 HA LEU 31 2.519 -5.635 0.807 259 1HB LEU 31 2HB LEU 31 2.055 -3.811 -0.851 260 2HB LEU 31 1HB LEU 31 2.039 -5.028 -2.128 261 HG LEU 31 HG LEU 31 0.231 -6.232 -0.814 262 1HD1 LEU 31 1HD1 LEU 31 0.410 -3.660 0.773 263 2HD1 LEU 31 2HD1 LEU 31 0.507 -5.315 1.377 264 3HD1 LEU 31 3HD1 LEU 31 -1.028 -4.683 0.782 265 1HD2 LEU 31 1HD2 LEU 31 -1.105 -3.708 -1.288 266 2HD2 LEU 31 2HD2 LEU 31 -1.172 -5.192 -2.239 267 3HD2 LEU 31 3HD2 LEU 31 0.094 -4.004 -2.547 268 H SER 32 H SER 32 3.715 -6.969 -2.288 269 HA SER 32 HA SER 32 2.015 -9.217 -2.485 270 1HB SER 32 2HB SER 32 3.773 -10.236 -3.867 271 2HB SER 32 1HB SER 32 3.575 -8.536 -4.272 272 HG SER 32 HG SER 32 5.760 -9.010 -4.033 273 H LEU 33 H LEU 33 4.666 -8.671 -0.261 274 HA LEU 33 HA LEU 33 5.089 -11.469 0.399 275 1HB LEU 33 2HB LEU 33 6.142 -8.885 1.235 276 2HB LEU 33 1HB LEU 33 5.862 -9.938 2.618 277 HG LEU 33 HG LEU 33 8.136 -10.245 1.710 278 1HD1 LEU 33 1HD1 LEU 33 6.146 -12.496 1.494 279 2HD1 LEU 33 2HD1 LEU 33 7.356 -12.202 2.743 280 3HD1 LEU 33 3HD1 LEU 33 7.854 -12.773 1.152 281 1HD2 LEU 33 1HD2 LEU 33 6.596 -10.487 -0.815 282 2HD2 LEU 33 2HD2 LEU 33 7.927 -11.627 -0.625 283 3HD2 LEU 33 3HD2 LEU 33 8.235 -9.893 -0.547 284 H GLN 34 H GLN 34 2.978 -8.898 1.607 285 HA GLN 34 HA GLN 34 2.064 -10.467 3.909 286 1HB GLN 34 2HB GLN 34 1.250 -7.825 2.694 287 2HB GLN 34 1HB GLN 34 0.318 -8.564 3.995 288 1HG GLN 34 2HG GLN 34 1.778 -7.362 5.297 289 2HG GLN 34 1HG GLN 34 2.781 -8.793 5.061 290 1HE2 GLN 34 1HE2 GLN 34 2.063 -5.706 3.299 291 2HE2 GLN 34 2HE2 GLN 34 3.673 -5.441 2.830 292 H ILE 35 H ILE 35 0.626 -9.421 0.794 293 HA ILE 35 HA ILE 35 -1.768 -11.055 1.257 294 HB ILE 35 HB ILE 35 -2.317 -10.371 -1.139 295 1HG1 ILE 35 2HG1 ILE 35 0.090 -8.567 -0.738 296 2HG1 ILE 35 1HG1 ILE 35 0.059 -9.954 -1.822 297 1HG2 ILE 35 1HG2 ILE 35 -3.469 -8.946 0.180 298 2HG2 ILE 35 2HG2 ILE 35 -2.209 -7.778 -0.221 299 3HG2 ILE 35 3HG2 ILE 35 -2.104 -8.712 1.271 300 1HD1 ILE 35 1HD1 ILE 35 -1.541 -8.945 -3.245 301 2HD1 ILE 35 2HD1 ILE 35 -0.436 -7.632 -2.841 302 3HD1 ILE 35 3HD1 ILE 35 -1.995 -7.754 -2.028 303 H GLY 36 H GLY 36 1.307 -11.479 -0.362 304 1HA GLY 36 2HA GLY 36 2.214 -13.397 -1.381 305 2HA GLY 36 1HA GLY 36 0.821 -14.300 -0.775 306 H THR 37 H THR 37 0.911 -11.462 -2.903 307 HA THR 37 HA THR 37 -0.552 -13.048 -4.975 308 HB THR 37 HB THR 37 -0.661 -10.042 -4.671 309 HG1 THR 37 HG1 THR 37 -2.331 -11.996 -3.465 310 1HG2 THR 37 1HG2 THR 37 -1.961 -10.233 -6.488 311 2HG2 THR 37 2HG2 THR 37 -3.095 -11.196 -5.541 312 3HG2 THR 37 3HG2 THR 37 -1.807 -11.990 -6.448 313 H GLN 38 H GLN 38 2.432 -11.663 -4.329 314 HA GLN 38 HA GLN 38 4.296 -11.257 -5.671 315 1HB GLN 38 2HB GLN 38 2.476 -12.335 -7.848 316 2HB GLN 38 1HB GLN 38 4.181 -11.959 -8.078 317 1HG GLN 38 2HG GLN 38 4.146 -13.533 -5.772 318 2HG GLN 38 1HG GLN 38 2.959 -14.296 -6.831 319 1HE2 GLN 38 1HE2 GLN 38 6.289 -12.893 -7.066 320 2HE2 GLN 38 2HE2 GLN 38 6.856 -14.070 -8.150 321 HA PRO 39 HA PRO 39 3.632 -7.188 -7.179 322 1HB PRO 39 2HB PRO 39 5.987 -6.840 -8.570 323 2HB PRO 39 1HB PRO 39 5.859 -6.782 -6.804 324 1HG PRO 39 2HG PRO 39 6.974 -8.936 -8.536 325 2HG PRO 39 1HG PRO 39 7.356 -8.537 -6.852 326 1HD PRO 39 2HD PRO 39 5.703 -10.664 -7.715 327 2HD PRO 39 1HD PRO 39 5.829 -10.048 -6.054 328 H ASN 40 H ASN 40 3.258 -9.784 -9.173 329 HA ASN 40 HA ASN 40 3.083 -8.164 -11.672 330 1HB ASN 40 2HB ASN 40 3.554 -11.053 -11.083 331 2HB ASN 40 1HB ASN 40 2.650 -10.668 -12.548 332 1HD2 ASN 40 1HD2 ASN 40 5.816 -10.388 -10.985 333 2HD2 ASN 40 2HD2 ASN 40 6.636 -9.813 -12.358 334 H LYS 41 H LYS 41 1.164 -9.770 -9.251 335 HA LYS 41 HA LYS 41 -1.276 -9.498 -10.962 336 1HB LYS 41 2HB LYS 41 -0.335 -11.618 -9.321 337 2HB LYS 41 1HB LYS 41 -1.762 -10.950 -8.529 338 1HG LYS 41 2HG LYS 41 -2.930 -11.075 -10.778 339 2HG LYS 41 1HG LYS 41 -1.556 -12.021 -11.354 340 1HD LYS 41 2HD LYS 41 -2.089 -13.361 -9.076 341 2HD LYS 41 1HD LYS 41 -3.708 -12.762 -9.437 342 1HE LYS 41 2HE LYS 41 -2.089 -14.049 -11.621 343 2HE LYS 41 1HE LYS 41 -2.920 -15.062 -10.448 344 1HZ LYS 41 1HZ LYS 41 -4.289 -12.877 -11.906 345 2HZ LYS 41 2HZ LYS 41 -4.989 -14.170 -11.047 346 3HZ LYS 41 3HZ LYS 41 -4.194 -14.460 -12.520 347 H ILE 42 H ILE 42 0.286 -7.611 -8.843 348 HA ILE 42 HA ILE 42 -2.096 -6.974 -7.175 349 HB ILE 42 HB ILE 42 0.809 -6.138 -6.949 350 1HG1 ILE 42 2HG1 ILE 42 -0.912 -7.676 -4.991 351 2HG1 ILE 42 1HG1 ILE 42 -0.001 -8.489 -6.263 352 1HG2 ILE 42 1HG2 ILE 42 -1.474 -5.469 -5.073 353 2HG2 ILE 42 2HG2 ILE 42 -0.858 -4.343 -6.281 354 3HG2 ILE 42 3HG2 ILE 42 0.190 -4.895 -4.976 355 1HD1 ILE 42 1HD1 ILE 42 1.109 -6.754 -4.041 356 2HD1 ILE 42 2HD1 ILE 42 2.067 -7.319 -5.410 357 3HD1 ILE 42 3HD1 ILE 42 1.373 -8.482 -4.280 358 H VAL 43 H VAL 43 -3.277 -5.195 -7.528 359 HA VAL 43 HA VAL 43 -2.239 -3.088 -9.390 360 HB VAL 43 HB VAL 43 -5.108 -4.049 -9.062 361 1HG1 VAL 43 1HG1 VAL 43 -5.740 -2.419 -10.625 362 2HG1 VAL 43 2HG1 VAL 43 -4.092 -2.206 -11.215 363 3HG1 VAL 43 3HG1 VAL 43 -4.557 -1.559 -9.641 364 1HG2 VAL 43 1HG2 VAL 43 -4.677 -5.547 -10.687 365 2HG2 VAL 43 2HG2 VAL 43 -2.972 -5.101 -10.624 366 3HG2 VAL 43 3HG2 VAL 43 -4.061 -4.268 -11.734 367 H LEU 44 H LEU 44 -1.749 -1.398 -8.028 368 HA LEU 44 HA LEU 44 -3.505 -0.896 -5.681 369 1HB LEU 44 2HB LEU 44 -0.755 0.114 -6.441 370 2HB LEU 44 1HB LEU 44 -1.661 0.744 -5.063 371 HG LEU 44 HG LEU 44 -1.452 -2.215 -5.269 372 1HD1 LEU 44 1HD1 LEU 44 0.813 -1.785 -3.906 373 2HD1 LEU 44 2HD1 LEU 44 0.885 -0.384 -4.975 374 3HD1 LEU 44 3HD1 LEU 44 0.805 -2.010 -5.655 375 1HD2 LEU 44 1HD2 LEU 44 -1.830 -2.097 -3.014 376 2HD2 LEU 44 2HD2 LEU 44 -2.429 -0.488 -3.417 377 3HD2 LEU 44 3HD2 LEU 44 -0.786 -0.690 -2.809 378 H GLN 45 H GLN 45 -4.534 1.100 -5.361 379 HA GLN 45 HA GLN 45 -4.444 3.056 -7.615 380 1HB GLN 45 2HB GLN 45 -7.070 2.485 -6.279 381 2HB GLN 45 1HB GLN 45 -6.755 3.103 -7.898 382 1HG GLN 45 2HG GLN 45 -5.736 0.777 -8.385 383 2HG GLN 45 1HG GLN 45 -6.549 0.258 -6.907 384 1HE2 GLN 45 1HE2 GLN 45 -8.988 0.676 -6.840 385 2HE2 GLN 45 2HE2 GLN 45 -9.848 0.622 -8.303 386 H LYS 46 H LYS 46 -4.518 5.192 -6.944 387 HA LYS 46 HA LYS 46 -4.250 5.701 -4.058 388 1HB LYS 46 2HB LYS 46 -3.499 7.037 -6.525 389 2HB LYS 46 1HB LYS 46 -4.310 8.160 -5.434 390 1HG LYS 46 2HG LYS 46 -2.351 6.392 -4.115 391 2HG LYS 46 1HG LYS 46 -1.649 7.502 -5.291 392 1HD LYS 46 2HD LYS 46 -1.647 8.873 -3.431 393 2HD LYS 46 1HD LYS 46 -3.248 9.248 -4.068 394 1HE LYS 46 2HE LYS 46 -4.303 8.258 -2.320 395 2HE LYS 46 1HE LYS 46 -3.203 6.881 -2.321 396 1HZ LYS 46 1HZ LYS 46 -1.819 7.866 -0.853 397 2HZ LYS 46 2HZ LYS 46 -3.233 8.692 -0.401 398 3HZ LYS 46 3HZ LYS 46 -2.108 9.433 -1.435 399 H GLY 47 H GLY 47 -6.327 7.037 -6.666 400 1HA GLY 47 2HA GLY 47 -8.690 6.954 -4.945 401 2HA GLY 47 1HA GLY 47 -8.098 8.590 -5.238 402 H GLY 48 H GLY 48 -8.924 5.607 -7.032 403 1HA GLY 48 2HA GLY 48 -10.422 5.468 -8.893 404 2HA GLY 48 1HA GLY 48 -10.408 7.227 -9.011 405 H SER 49 H SER 49 -7.270 5.908 -8.662 406 HA SER 49 HA SER 49 -6.837 5.701 -11.594 407 1HB SER 49 2HB SER 49 -6.123 7.987 -10.057 408 2HB SER 49 1HB SER 49 -4.628 7.126 -10.417 409 HG SER 49 HG SER 49 -5.492 8.691 -12.033 410 H VAL 50 H VAL 50 -5.301 4.157 -12.098 411 HA VAL 50 HA VAL 50 -4.334 2.465 -9.917 412 HB VAL 50 HB VAL 50 -3.349 1.084 -11.739 413 1HG1 VAL 50 1HG1 VAL 50 -5.704 0.774 -11.052 414 2HG1 VAL 50 2HG1 VAL 50 -5.487 0.442 -12.771 415 3HG1 VAL 50 3HG1 VAL 50 -6.206 1.966 -12.251 416 1HG2 VAL 50 1HG2 VAL 50 -2.894 3.120 -13.224 417 2HG2 VAL 50 2HG2 VAL 50 -4.604 3.073 -13.651 418 3HG2 VAL 50 3HG2 VAL 50 -3.559 1.708 -14.041 419 H LEU 51 H LEU 51 -2.122 2.039 -9.434 420 HA LEU 51 HA LEU 51 -0.298 4.306 -10.097 421 1HB LEU 51 2HB LEU 51 0.167 2.254 -7.926 422 2HB LEU 51 1HB LEU 51 0.840 3.877 -8.059 423 HG LEU 51 HG LEU 51 -2.099 3.265 -7.613 424 1HD1 LEU 51 1HD1 LEU 51 -1.750 3.947 -5.320 425 2HD1 LEU 51 2HD1 LEU 51 -0.065 4.354 -5.648 426 3HD1 LEU 51 3HD1 LEU 51 -0.589 2.671 -5.688 427 1HD2 LEU 51 1HD2 LEU 51 -1.114 5.494 -8.744 428 2HD2 LEU 51 2HD2 LEU 51 -0.849 5.918 -7.053 429 3HD2 LEU 51 3HD2 LEU 51 -2.475 5.539 -7.623 430 H LYS 52 H LYS 52 1.476 3.920 -11.341 431 HA LYS 52 HA LYS 52 2.017 1.103 -12.150 432 1HB LYS 52 2HB LYS 52 1.580 3.150 -13.773 433 2HB LYS 52 1HB LYS 52 3.287 3.469 -13.476 434 1HG LYS 52 2HG LYS 52 3.683 1.981 -15.129 435 2HG LYS 52 1HG LYS 52 3.265 0.747 -13.940 436 1HD LYS 52 2HD LYS 52 0.870 1.905 -15.096 437 2HD LYS 52 1HD LYS 52 1.927 1.276 -16.357 438 1HE LYS 52 2HE LYS 52 1.496 -0.865 -15.779 439 2HE LYS 52 1HE LYS 52 1.760 -0.533 -14.069 440 1HZ LYS 52 1HZ LYS 52 -0.468 -1.109 -14.192 441 2HZ LYS 52 2HZ LYS 52 -0.721 -0.265 -15.646 442 3HZ LYS 52 3HZ LYS 52 -0.520 0.586 -14.190 443 H ASP 53 H ASP 53 4.092 0.223 -11.987 444 HA ASP 53 HA ASP 53 5.758 1.075 -9.828 445 1HB ASP 53 2HB ASP 53 7.345 -0.624 -10.637 446 2HB ASP 53 1HB ASP 53 5.699 -1.254 -10.662 447 H HIS 54 H HIS 54 5.706 1.980 -13.204 448 HA HIS 54 HA HIS 54 8.403 2.978 -13.394 449 1HB HIS 54 2HB HIS 54 5.881 3.585 -14.956 450 2HB HIS 54 1HB HIS 54 7.456 4.266 -15.365 451 HD1 HIS 54 HD1 HIS 54 5.464 1.128 -15.530 452 HD2 HIS 54 HD2 HIS 54 9.393 2.310 -16.257 453 HE1 HIS 54 HE1 HIS 54 6.556 -0.765 -16.806 454 H ILE 55 H ILE 55 5.630 4.207 -11.750 455 HA ILE 55 HA ILE 55 6.803 6.957 -11.728 456 HB ILE 55 HB ILE 55 4.009 6.005 -11.013 457 1HG1 ILE 55 2HG1 ILE 55 3.726 7.834 -12.999 458 2HG1 ILE 55 1HG1 ILE 55 5.297 7.163 -13.431 459 1HG2 ILE 55 1HG2 ILE 55 4.017 8.784 -11.290 460 2HG2 ILE 55 2HG2 ILE 55 5.472 8.445 -10.354 461 3HG2 ILE 55 3HG2 ILE 55 3.901 7.893 -9.773 462 1HD1 ILE 55 1HD1 ILE 55 4.440 5.044 -13.823 463 2HD1 ILE 55 2HD1 ILE 55 3.069 6.039 -14.314 464 3HD1 ILE 55 3HD1 ILE 55 3.080 5.276 -12.723 465 H SER 56 H SER 56 7.371 7.899 -9.766 466 HA SER 56 HA SER 56 7.920 6.080 -7.564 467 1HB SER 56 2HB SER 56 8.997 8.491 -8.446 468 2HB SER 56 1HB SER 56 8.209 8.911 -6.928 469 HG SER 56 HG SER 56 10.067 8.139 -6.209 470 H LEU 57 H LEU 57 7.085 6.262 -5.410 471 HA LEU 57 HA LEU 57 4.271 6.675 -5.195 472 1HB LEU 57 2HB LEU 57 6.431 6.549 -3.071 473 2HB LEU 57 1HB LEU 57 4.708 6.590 -2.704 474 HG LEU 57 HG LEU 57 5.868 4.532 -4.586 475 1HD1 LEU 57 1HD1 LEU 57 5.530 4.321 -1.577 476 2HD1 LEU 57 2HD1 LEU 57 7.065 4.331 -2.446 477 3HD1 LEU 57 3HD1 LEU 57 5.945 2.985 -2.653 478 1HD2 LEU 57 1HD2 LEU 57 3.815 3.290 -3.656 479 2HD2 LEU 57 2HD2 LEU 57 3.491 4.657 -4.722 480 3HD2 LEU 57 3HD2 LEU 57 3.324 4.843 -2.976 481 H GLU 58 H GLU 58 7.027 8.802 -4.501 482 HA GLU 58 HA GLU 58 5.673 10.905 -3.162 483 1HB GLU 58 2HB GLU 58 8.247 10.478 -3.964 484 2HB GLU 58 1HB GLU 58 7.749 11.721 -5.111 485 1HG GLU 58 2HG GLU 58 7.770 13.324 -3.520 486 2HG GLU 58 1HG GLU 58 6.843 12.323 -2.402 487 H ASP 59 H ASP 59 5.950 10.184 -6.634 488 HA ASP 59 HA ASP 59 4.788 12.629 -7.597 489 1HB ASP 59 2HB ASP 59 4.887 9.843 -8.793 490 2HB ASP 59 1HB ASP 59 4.281 11.254 -9.659 491 H TYR 60 H TYR 60 3.359 9.442 -6.826 492 HA TYR 60 HA TYR 60 0.642 10.255 -7.432 493 1HB TYR 60 2HB TYR 60 1.842 7.934 -5.912 494 2HB TYR 60 1HB TYR 60 0.098 8.166 -6.020 495 HD1 TYR 60 HD1 TYR 60 2.694 6.405 -7.439 496 HD2 TYR 60 HD2 TYR 60 -0.607 8.897 -8.606 497 HE1 TYR 60 HE1 TYR 60 2.689 5.350 -9.683 498 HE2 TYR 60 HE2 TYR 60 -0.609 7.843 -10.850 499 HH TYR 60 HH TYR 60 0.512 6.475 -12.251 500 H GLU 61 H GLU 61 2.738 10.798 -4.748 501 HA GLU 61 HA GLU 61 2.418 12.030 -2.793 502 1HB GLU 61 2HB GLU 61 0.542 13.114 -4.383 503 2HB GLU 61 1HB GLU 61 -0.523 12.338 -3.212 504 1HG GLU 61 2HG GLU 61 1.808 14.049 -2.334 505 2HG GLU 61 1HG GLU 61 0.234 14.754 -2.699 506 H VAL 62 H VAL 62 2.817 9.846 -1.900 507 HA VAL 62 HA VAL 62 0.392 8.555 -0.735 508 HB VAL 62 HB VAL 62 3.251 7.560 -0.996 509 1HG1 VAL 62 1HG1 VAL 62 2.004 5.352 -0.330 510 2HG1 VAL 62 2HG1 VAL 62 0.809 6.446 0.366 511 3HG1 VAL 62 3HG1 VAL 62 2.478 6.484 0.937 512 1HG2 VAL 62 1HG2 VAL 62 2.609 6.690 -2.976 513 2HG2 VAL 62 2HG2 VAL 62 1.121 7.625 -2.843 514 3HG2 VAL 62 3HG2 VAL 62 1.175 5.967 -2.246 515 H HIS 63 H HIS 63 -0.090 9.319 1.255 516 HA HIS 63 HA HIS 63 2.021 10.491 2.958 517 1HB HIS 63 2HB HIS 63 -0.576 11.200 2.539 518 2HB HIS 63 1HB HIS 63 -0.737 10.247 4.013 519 HD1 HIS 63 HD1 HIS 63 1.384 13.119 2.672 520 HD2 HIS 63 HD2 HIS 63 -0.025 11.633 6.301 521 HE1 HIS 63 HE1 HIS 63 2.081 14.785 4.446 522 H ASP 64 H ASP 64 2.113 9.858 5.294 523 HA ASP 64 HA ASP 64 2.386 6.990 5.577 524 1HB ASP 64 2HB ASP 64 3.013 7.471 7.899 525 2HB ASP 64 1HB ASP 64 3.817 8.606 6.817 526 H GLN 65 H GLN 65 1.030 5.531 6.613 527 HA GLN 65 HA GLN 65 -0.973 4.644 7.437 528 1HB GLN 65 2HB GLN 65 -0.707 7.277 8.801 529 2HB GLN 65 1HB GLN 65 -2.306 6.536 8.839 530 1HG GLN 65 2HG GLN 65 -1.567 5.266 10.548 531 2HG GLN 65 1HG GLN 65 -0.547 4.427 9.381 532 1HE2 GLN 65 1HE2 GLN 65 1.667 5.541 8.969 533 2HE2 GLN 65 2HE2 GLN 65 2.416 6.283 10.299 534 H THR 66 H THR 66 -0.911 5.970 4.782 535 HA THR 66 HA THR 66 -3.553 7.251 4.531 536 HB THR 66 HB THR 66 -1.526 7.979 3.194 537 HG1 THR 66 HG1 THR 66 -3.038 8.738 1.992 538 1HG2 THR 66 1HG2 THR 66 -1.514 6.390 0.992 539 2HG2 THR 66 2HG2 THR 66 -1.800 5.184 2.246 540 3HG2 THR 66 3HG2 THR 66 -0.372 6.214 2.323 541 H ASN 67 H ASN 67 -5.220 6.378 3.097 542 HA ASN 67 HA ASN 67 -5.277 3.401 3.177 543 1HB ASN 67 2HB ASN 67 -7.315 5.545 3.341 544 2HB ASN 67 1HB ASN 67 -7.790 4.123 2.410 545 1HD2 ASN 67 1HD2 ASN 67 -6.617 5.148 5.636 546 2HD2 ASN 67 2HD2 ASN 67 -7.175 3.767 6.451 547 H LEU 68 H LEU 68 -4.762 2.383 1.327 548 HA LEU 68 HA LEU 68 -5.235 3.785 -1.274 549 1HB LEU 68 2HB LEU 68 -3.187 1.749 -0.386 550 2HB LEU 68 1HB LEU 68 -3.533 2.009 -2.095 551 HG LEU 68 HG LEU 68 -3.147 4.511 -0.613 552 1HD1 LEU 68 1HD1 LEU 68 -1.560 2.755 0.486 553 2HD1 LEU 68 2HD1 LEU 68 -0.878 4.294 -0.042 554 3HD1 LEU 68 3HD1 LEU 68 -0.668 2.851 -1.034 555 1HD2 LEU 68 1HD2 LEU 68 -1.471 3.539 -2.909 556 2HD2 LEU 68 2HD2 LEU 68 -2.105 5.155 -2.596 557 3HD2 LEU 68 3HD2 LEU 68 -3.178 3.886 -3.185 558 H GLU 69 H GLU 69 -5.565 2.092 -3.121 559 HA GLU 69 HA GLU 69 -7.642 0.149 -2.201 560 1HB GLU 69 2HB GLU 69 -7.190 1.506 -4.874 561 2HB GLU 69 1HB GLU 69 -8.378 0.229 -4.620 562 1HG GLU 69 2HG GLU 69 -9.781 1.954 -4.123 563 2HG GLU 69 1HG GLU 69 -8.981 1.908 -2.552 564 H LEU 70 H LEU 70 -7.406 -2.020 -2.704 565 HA LEU 70 HA LEU 70 -4.965 -2.786 -4.256 566 1HB LEU 70 2HB LEU 70 -4.656 -3.280 -1.871 567 2HB LEU 70 1HB LEU 70 -6.177 -4.169 -1.840 568 HG LEU 70 HG LEU 70 -5.286 -5.802 -3.440 569 1HD1 LEU 70 1HD1 LEU 70 -2.789 -4.083 -3.321 570 2HD1 LEU 70 2HD1 LEU 70 -3.811 -4.356 -4.732 571 3HD1 LEU 70 3HD1 LEU 70 -2.866 -5.684 -4.059 572 1HD2 LEU 70 1HD2 LEU 70 -3.627 -5.202 -0.989 573 2HD2 LEU 70 2HD2 LEU 70 -3.308 -6.616 -1.992 574 3HD2 LEU 70 3HD2 LEU 70 -4.869 -6.436 -1.195 575 H TYR 71 H TYR 71 -5.344 -4.107 -5.962 576 HA TYR 71 HA TYR 71 -7.856 -5.708 -6.037 577 1HB TYR 71 2HB TYR 71 -6.963 -3.594 -7.965 578 2HB TYR 71 1HB TYR 71 -7.812 -5.005 -8.594 579 HD1 TYR 71 HD1 TYR 71 -8.076 -1.996 -6.505 580 HD2 TYR 71 HD2 TYR 71 -10.130 -5.489 -7.930 581 HE1 TYR 71 HE1 TYR 71 -10.232 -1.034 -5.752 582 HE2 TYR 71 HE2 TYR 71 -12.287 -4.527 -7.177 583 HH TYR 71 HH TYR 71 -12.752 -2.471 -5.092 584 H TYR 72 H TYR 72 -7.664 -7.640 -7.279 585 HA TYR 72 HA TYR 72 -4.844 -8.391 -7.883 586 1HB TYR 72 2HB TYR 72 -7.308 -10.104 -7.441 587 2HB TYR 72 1HB TYR 72 -5.709 -10.735 -7.828 588 HD1 TYR 72 HD1 TYR 72 -7.434 -11.210 -5.268 589 HD2 TYR 72 HD2 TYR 72 -4.216 -8.515 -6.183 590 HE1 TYR 72 HE1 TYR 72 -6.826 -11.115 -2.867 591 HE2 TYR 72 HE2 TYR 72 -3.612 -8.421 -3.782 592 HH TYR 72 HH TYR 72 -5.390 -9.040 -1.413 593 H LEU 73 HN LEU 73 -4.258 -8.292 -9.969 594 HA LEU 73 HA LEU 73 -6.035 -9.360 -12.060 595 1HB LEU 73 2HB LEU 73 -6.091 -6.617 -11.554 596 2HB LEU 73 1HB LEU 73 -4.979 -6.768 -12.915 597 HG LEU 73 HG LEU 73 -7.323 -8.483 -13.225 598 1HD1 LEU 73 1HD1 LEU 73 -8.382 -6.650 -11.927 599 2HD1 LEU 73 2HD1 LEU 73 -8.954 -6.688 -13.595 600 3HD1 LEU 73 3HD1 LEU 73 -7.766 -5.483 -13.097 601 1HD2 LEU 73 1HD2 LEU 73 -5.738 -7.916 -15.025 602 2HD2 LEU 73 2HD2 LEU 73 -6.150 -6.209 -14.863 603 3HD2 LEU 73 3HD2 LEU 73 -7.361 -7.359 -15.433 Start of MODEL 17 1 H MET 1 1H MET 1 11.264 6.015 6.028 2 HA MET 1 HA MET 1 9.342 4.926 4.979 3 1HB MET 1 2HB MET 1 10.795 4.157 7.288 4 2HB MET 1 1HB MET 1 9.124 3.672 7.572 5 1HG MET 1 2HG MET 1 9.284 1.995 6.075 6 2HG MET 1 1HG MET 1 9.912 3.086 4.840 7 1HE MET 1 1HE MET 1 10.539 0.128 5.200 8 2HE MET 1 2HE MET 1 12.285 -0.065 5.109 9 3HE MET 1 3HE MET 1 11.464 0.966 3.946 10 H ILE 2 H ILE 2 7.130 4.760 4.859 11 HA ILE 2 HA ILE 2 5.543 6.021 7.062 12 HB ILE 2 HB ILE 2 3.892 6.679 5.292 13 1HG1 ILE 2 2HG1 ILE 2 6.060 6.204 3.260 14 2HG1 ILE 2 1HG1 ILE 2 4.954 4.893 3.672 15 1HG2 ILE 2 1HG2 ILE 2 6.606 7.751 5.661 16 2HG2 ILE 2 2HG2 ILE 2 5.054 8.587 5.683 17 3HG2 ILE 2 3HG2 ILE 2 5.850 8.248 4.147 18 1HD1 ILE 2 1HD1 ILE 2 3.173 5.903 2.664 19 2HD1 ILE 2 2HD1 ILE 2 4.427 6.753 1.760 20 3HD1 ILE 2 3HD1 ILE 2 3.678 7.516 3.161 21 H GLU 3 H GLU 3 3.296 5.177 7.229 22 HA GLU 3 HA GLU 3 3.182 2.282 6.475 23 1HB GLU 3 2HB GLU 3 2.114 3.774 8.882 24 2HB GLU 3 1HB GLU 3 1.582 2.146 8.468 25 1HG GLU 3 2HG GLU 3 3.340 1.647 9.895 26 2HG GLU 3 1HG GLU 3 4.193 1.680 8.354 27 H VAL 4 H VAL 4 1.717 1.923 4.881 28 HA VAL 4 HA VAL 4 -0.704 3.682 4.781 29 HB VAL 4 HB VAL 4 -0.730 3.423 2.375 30 1HG1 VAL 4 1HG1 VAL 4 2.177 3.893 3.033 31 2HG1 VAL 4 2HG1 VAL 4 0.934 5.035 3.542 32 3HG1 VAL 4 3HG1 VAL 4 1.176 4.701 1.827 33 1HG2 VAL 4 1HG2 VAL 4 -0.014 1.357 1.702 34 2HG2 VAL 4 2HG2 VAL 4 1.181 1.239 2.991 35 3HG2 VAL 4 3HG2 VAL 4 1.538 2.177 1.542 36 H VAL 5 H VAL 5 -2.705 2.659 4.155 37 HA VAL 5 HA VAL 5 -2.718 -0.300 4.627 38 HB VAL 5 HB VAL 5 -5.136 0.107 5.371 39 1HG1 VAL 5 1HG1 VAL 5 -3.045 -0.227 6.846 40 2HG1 VAL 5 2HG1 VAL 5 -4.465 0.491 7.607 41 3HG1 VAL 5 3HG1 VAL 5 -3.115 1.514 7.117 42 1HG2 VAL 5 1HG2 VAL 5 -5.159 2.459 4.357 43 2HG2 VAL 5 2HG2 VAL 5 -4.167 2.957 5.729 44 3HG2 VAL 5 3HG2 VAL 5 -5.791 2.324 5.998 45 H VAL 6 H VAL 6 -3.666 -1.562 3.073 46 HA VAL 6 HA VAL 6 -5.026 -0.140 0.820 47 HB VAL 6 HB VAL 6 -4.249 -2.032 -0.623 48 1HG1 VAL 6 1HG1 VAL 6 -2.659 0.069 0.575 49 2HG1 VAL 6 2HG1 VAL 6 -2.641 -0.528 -1.082 50 3HG1 VAL 6 3HG1 VAL 6 -1.638 -1.302 0.144 51 1HG2 VAL 6 1HG2 VAL 6 -2.598 -3.596 0.196 52 2HG2 VAL 6 2HG2 VAL 6 -3.965 -3.652 1.307 53 3HG2 VAL 6 3HG2 VAL 6 -2.505 -2.768 1.750 54 H ASN 7 H ASN 7 -7.071 -0.772 0.328 55 HA ASN 7 HA ASN 7 -8.148 -3.181 1.739 56 1HB ASN 7 2HB ASN 7 -10.388 -2.064 1.490 57 2HB ASN 7 1HB ASN 7 -9.263 -1.167 2.506 58 1HD2 ASN 7 1HD2 ASN 7 -8.421 0.873 1.684 59 2HD2 ASN 7 2HD2 ASN 7 -9.073 1.616 0.304 60 H ASP 8 H ASP 8 -8.964 -4.814 0.490 61 HA ASP 8 HA ASP 8 -8.663 -4.632 -2.407 62 1HB ASP 8 2HB ASP 8 -9.101 -6.757 -0.427 63 2HB ASP 8 1HB ASP 8 -9.977 -7.011 -1.936 64 H ARG 9 H ARG 9 -11.464 -5.365 -0.278 65 HA ARG 9 HA ARG 9 -13.207 -4.119 -2.365 66 1HB ARG 9 2HB ARG 9 -13.525 -6.744 -0.921 67 2HB ARG 9 1HB ARG 9 -14.946 -5.866 -1.485 68 1HG ARG 9 2HG ARG 9 -14.585 -6.933 -3.458 69 2HG ARG 9 1HG ARG 9 -13.297 -5.751 -3.688 70 1HD ARG 9 2HD ARG 9 -11.682 -7.290 -2.645 71 2HD ARG 9 1HD ARG 9 -12.965 -8.470 -2.384 72 HE ARG 9 HE ARG 9 -13.134 -8.689 -4.859 73 1HH1 ARG 9 2HH1 ARG 9 -10.410 -9.665 -4.216 74 2HH1 ARG 9 1HH1 ARG 9 -9.406 -8.747 -5.290 75 1HH2 ARG 9 1HH2 ARG 9 -11.846 -6.362 -5.962 76 2HH2 ARG 9 2HH2 ARG 9 -10.222 -6.873 -6.280 77 H LEU 10 H LEU 10 -13.489 -5.377 0.998 78 HA LEU 10 HA LEU 10 -14.176 -2.706 1.993 79 1HB LEU 10 2HB LEU 10 -16.269 -4.244 0.999 80 2HB LEU 10 1HB LEU 10 -16.317 -4.565 2.731 81 HG LEU 10 HG LEU 10 -15.856 -1.740 2.182 82 1HD1 LEU 10 1HD1 LEU 10 -17.328 -2.673 0.190 83 2HD1 LEU 10 2HD1 LEU 10 -17.765 -1.162 0.986 84 3HD1 LEU 10 3HD1 LEU 10 -18.605 -2.656 1.405 85 1HD2 LEU 10 1HD2 LEU 10 -18.374 -2.401 3.448 86 2HD2 LEU 10 2HD2 LEU 10 -16.941 -1.653 4.156 87 3HD2 LEU 10 3HD2 LEU 10 -17.084 -3.410 4.103 88 H GLY 11 H GLY 11 -14.793 -6.114 2.965 89 1HA GLY 11 2HA GLY 11 -13.954 -5.597 5.703 90 2HA GLY 11 1HA GLY 11 -14.356 -7.174 5.025 91 H LYS 12 H LYS 12 -12.426 -6.994 2.820 92 HA LYS 12 HA LYS 12 -10.088 -7.967 4.247 93 1HB LYS 12 2HB LYS 12 -11.123 -8.134 1.588 94 2HB LYS 12 1HB LYS 12 -9.483 -7.492 1.490 95 1HG LYS 12 2HG LYS 12 -9.511 -9.596 3.435 96 2HG LYS 12 1HG LYS 12 -10.279 -10.188 1.963 97 1HD LYS 12 2HD LYS 12 -7.917 -8.616 1.337 98 2HD LYS 12 1HD LYS 12 -7.520 -9.940 2.430 99 1HE LYS 12 2HE LYS 12 -7.467 -11.238 0.575 100 2HE LYS 12 1HE LYS 12 -9.225 -11.147 0.617 101 1HZ LYS 12 1HZ LYS 12 -8.564 -10.476 -1.528 102 2HZ LYS 12 2HZ LYS 12 -7.358 -9.443 -0.926 103 3HZ LYS 12 3HZ LYS 12 -8.998 -9.052 -0.716 104 H LYS 13 H LYS 13 -8.311 -6.831 4.846 105 HA LYS 13 HA LYS 13 -7.542 -4.361 3.425 106 1HB LYS 13 2HB LYS 13 -9.179 -4.152 5.666 107 2HB LYS 13 1HB LYS 13 -7.559 -3.899 6.318 108 1HG LYS 13 2HG LYS 13 -7.462 -2.403 4.022 109 2HG LYS 13 1HG LYS 13 -9.144 -2.195 4.506 110 1HD LYS 13 2HD LYS 13 -8.009 -1.834 6.903 111 2HD LYS 13 1HD LYS 13 -6.649 -1.331 5.898 112 1HE LYS 13 2HE LYS 13 -9.463 -0.260 5.573 113 2HE LYS 13 1HE LYS 13 -8.214 0.547 6.520 114 1HZ LYS 13 1HZ LYS 13 -7.360 1.389 4.678 115 2HZ LYS 13 2HZ LYS 13 -8.638 0.717 3.785 116 3HZ LYS 13 3HZ LYS 13 -7.188 -0.148 3.981 117 H VAL 14 H VAL 14 -5.356 -4.422 3.227 118 HA VAL 14 HA VAL 14 -3.793 -5.970 5.262 119 HB VAL 14 HB VAL 14 -2.943 -5.397 2.410 120 1HG1 VAL 14 1HG1 VAL 14 -2.001 -7.290 4.582 121 2HG1 VAL 14 2HG1 VAL 14 -1.090 -5.979 3.828 122 3HG1 VAL 14 3HG1 VAL 14 -1.491 -7.424 2.898 123 1HG2 VAL 14 1HG2 VAL 14 -3.552 -8.062 2.453 124 2HG2 VAL 14 2HG2 VAL 14 -4.646 -6.815 1.854 125 3HG2 VAL 14 3HG2 VAL 14 -4.815 -7.417 3.502 126 H ARG 15 H ARG 15 -1.888 -5.018 6.081 127 HA ARG 15 HA ARG 15 -1.614 -2.098 5.521 128 1HB ARG 15 2HB ARG 15 -0.521 -1.941 7.723 129 2HB ARG 15 1HB ARG 15 -2.124 -2.655 7.870 130 1HG ARG 15 2HG ARG 15 -1.288 -4.610 8.651 131 2HG ARG 15 1HG ARG 15 -0.045 -4.666 7.404 132 1HD ARG 15 2HD ARG 15 0.323 -2.608 9.513 133 2HD ARG 15 1HD ARG 15 0.523 -4.285 10.023 134 HE ARG 15 HE ARG 15 2.191 -4.445 8.067 135 1HH1 ARG 15 2HH1 ARG 15 1.876 -1.668 7.046 136 2HH1 ARG 15 1HH1 ARG 15 3.166 -0.824 7.831 137 1HH2 ARG 15 1HH2 ARG 15 3.661 -3.283 10.242 138 2HH2 ARG 15 2HH2 ARG 15 4.180 -1.741 9.650 139 H VAL 16 H VAL 16 0.349 -1.283 4.842 140 HA VAL 16 HA VAL 16 2.720 -3.061 4.796 141 HB VAL 16 HB VAL 16 1.509 -3.498 2.681 142 1HG1 VAL 16 1HG1 VAL 16 2.066 -0.675 1.817 143 2HG1 VAL 16 2HG1 VAL 16 0.588 -1.038 2.706 144 3HG1 VAL 16 3HG1 VAL 16 0.905 -1.829 1.164 145 1HG2 VAL 16 1HG2 VAL 16 3.855 -1.822 1.862 146 2HG2 VAL 16 2HG2 VAL 16 3.418 -3.456 1.363 147 3HG2 VAL 16 3HG2 VAL 16 4.137 -3.183 2.949 148 H LYS 17 H LYS 17 4.695 -1.898 4.721 149 HA LYS 17 HA LYS 17 4.405 1.075 4.904 150 1HB LYS 17 2HB LYS 17 6.353 1.067 6.418 151 2HB LYS 17 1HB LYS 17 5.046 0.078 7.063 152 1HG LYS 17 2HG LYS 17 6.169 -1.951 6.149 153 2HG LYS 17 1HG LYS 17 7.505 -0.936 5.602 154 1HD LYS 17 2HD LYS 17 8.289 -0.564 7.737 155 2HD LYS 17 1HD LYS 17 6.684 -0.686 8.460 156 1HE LYS 17 2HE LYS 17 7.463 -2.717 9.164 157 2HE LYS 17 1HE LYS 17 6.967 -3.223 7.550 158 1HZ LYS 17 1HZ LYS 17 9.452 -2.210 7.151 159 2HZ LYS 17 2HZ LYS 17 9.076 -3.857 7.315 160 3HZ LYS 17 3HZ LYS 17 9.604 -2.966 8.661 161 H CYS 18 H CYS 18 6.042 2.360 3.920 162 HA CYS 18 HA CYS 18 8.298 1.205 2.503 163 1HB CYS 18 2HB CYS 18 5.784 1.220 1.136 164 2HB CYS 18 1HB CYS 18 6.811 2.444 0.390 165 HG CYS 18 HG CYS 18 7.122 -0.300 -0.331 166 H LEU 19 H LEU 19 9.505 2.939 1.290 167 HA LEU 19 HA LEU 19 9.270 5.508 2.707 168 1HB LEU 19 2HB LEU 19 11.336 4.076 1.239 169 2HB LEU 19 1HB LEU 19 11.226 5.752 0.707 170 HG LEU 19 HG LEU 19 11.173 5.209 3.648 171 1HD1 LEU 19 1HD1 LEU 19 13.821 5.509 2.269 172 2HD1 LEU 19 2HD1 LEU 19 13.093 3.907 2.375 173 3HD1 LEU 19 3HD1 LEU 19 13.458 4.809 3.845 174 1HD2 LEU 19 1HD2 LEU 19 11.089 7.479 3.386 175 2HD2 LEU 19 2HD2 LEU 19 11.779 7.417 1.766 176 3HD2 LEU 19 3HD2 LEU 19 12.833 7.325 3.177 177 H ALA 20 H ALA 20 8.740 7.490 1.722 178 HA ALA 20 HA ALA 20 6.890 7.419 -0.468 179 1HB ALA 20 1HB ALA 20 6.474 9.328 0.712 180 2HB ALA 20 2HB ALA 20 7.645 10.035 -0.399 181 3HB ALA 20 3HB ALA 20 8.158 9.510 1.203 182 H GLU 21 H GLU 21 10.362 7.620 -0.374 183 HA GLU 21 HA GLU 21 10.639 8.771 -3.051 184 1HB GLU 21 2HB GLU 21 13.044 8.279 -2.756 185 2HB GLU 21 1HB GLU 21 12.393 9.135 -1.359 186 1HG GLU 21 2HG GLU 21 13.251 7.471 -0.092 187 2HG GLU 21 1HG GLU 21 11.975 6.446 -0.745 188 H ASP 22 H ASP 22 10.240 5.588 -1.685 189 HA ASP 22 HA ASP 22 11.426 4.057 -3.797 190 1HB ASP 22 2HB ASP 22 9.526 3.521 -1.567 191 2HB ASP 22 1HB ASP 22 9.529 2.368 -2.901 192 H SER 23 H SER 23 10.308 2.886 -5.513 193 HA SER 23 HA SER 23 8.144 4.505 -6.708 194 1HB SER 23 2HB SER 23 10.314 2.938 -7.719 195 2HB SER 23 1HB SER 23 8.813 2.262 -8.342 196 HG SER 23 HG SER 23 9.076 3.863 -9.717 197 H VAL 24 H VAL 24 6.381 3.195 -7.890 198 HA VAL 24 HA VAL 24 4.849 1.721 -5.974 199 HB VAL 24 HB VAL 24 4.572 1.809 -8.995 200 1HG1 VAL 24 1HG1 VAL 24 2.245 1.133 -8.588 201 2HG1 VAL 24 2HG1 VAL 24 2.558 1.051 -6.856 202 3HG1 VAL 24 3HG1 VAL 24 3.351 -0.081 -7.950 203 1HG2 VAL 24 1HG2 VAL 24 3.455 3.507 -6.751 204 2HG2 VAL 24 2HG2 VAL 24 2.744 3.481 -8.365 205 3HG2 VAL 24 3HG2 VAL 24 4.400 4.038 -8.142 206 H GLY 25 H GLY 25 7.198 0.715 -8.403 207 1HA GLY 25 2HA GLY 25 6.557 -2.056 -8.571 208 2HA GLY 25 1HA GLY 25 8.170 -1.382 -8.819 209 H ASP 26 H ASP 26 8.782 -0.324 -6.365 210 HA ASP 26 HA ASP 26 9.475 -2.644 -4.797 211 1HB ASP 26 2HB ASP 26 10.742 -0.439 -4.880 212 2HB ASP 26 1HB ASP 26 9.470 0.245 -3.869 213 H PHE 27 H PHE 27 6.959 -0.157 -4.552 214 HA PHE 27 HA PHE 27 5.890 -0.851 -2.005 215 1HB PHE 27 2HB PHE 27 5.322 1.193 -3.368 216 2HB PHE 27 1HB PHE 27 4.356 0.163 -4.420 217 HD1 PHE 27 HD1 PHE 27 2.081 0.306 -4.006 218 HD2 PHE 27 HD2 PHE 27 4.817 0.527 -0.704 219 HE1 PHE 27 HE1 PHE 27 0.169 0.496 -2.437 220 HE2 PHE 27 HE2 PHE 27 2.909 0.716 0.863 221 HZ PHE 27 HZ PHE 27 0.585 0.699 -0.002 222 H LYS 28 H LYS 28 5.168 -2.098 -5.269 223 HA LYS 28 HA LYS 28 3.079 -3.910 -4.436 224 1HB LYS 28 2HB LYS 28 4.799 -3.612 -6.884 225 2HB LYS 28 1HB LYS 28 3.803 -5.056 -6.685 226 1HG LYS 28 2HG LYS 28 1.924 -3.289 -6.101 227 2HG LYS 28 1HG LYS 28 2.955 -2.204 -7.035 228 1HD LYS 28 2HD LYS 28 2.826 -4.615 -8.504 229 2HD LYS 28 1HD LYS 28 1.177 -4.273 -7.984 230 1HE LYS 28 2HE LYS 28 2.938 -2.163 -9.239 231 2HE LYS 28 1HE LYS 28 1.905 -3.219 -10.201 232 1HZ LYS 28 1HZ LYS 28 0.091 -2.454 -8.550 233 2HZ LYS 28 2HZ LYS 28 0.552 -1.420 -9.816 234 3HZ LYS 28 3HZ LYS 28 1.142 -1.159 -8.245 235 H LYS 29 H LYS 29 6.604 -4.201 -4.728 236 HA LYS 29 HA LYS 29 6.736 -7.051 -4.423 237 1HB LYS 29 2HB LYS 29 8.726 -4.830 -3.956 238 2HB LYS 29 1HB LYS 29 9.132 -6.518 -3.631 239 1HG LYS 29 2HG LYS 29 8.266 -6.980 -6.023 240 2HG LYS 29 1HG LYS 29 8.385 -5.238 -6.258 241 1HD LYS 29 2HD LYS 29 10.806 -5.541 -5.283 242 2HD LYS 29 1HD LYS 29 10.579 -7.225 -5.754 243 1HE LYS 29 2HE LYS 29 11.125 -6.664 -7.867 244 2HE LYS 29 1HE LYS 29 9.673 -5.661 -7.940 245 1HZ LYS 29 1HZ LYS 29 11.746 -4.434 -8.409 246 2HZ LYS 29 2HZ LYS 29 12.277 -4.761 -6.830 247 3HZ LYS 29 3HZ LYS 29 10.896 -3.808 -7.083 248 H VAL 30 H VAL 30 6.872 -4.384 -2.033 249 HA VAL 30 HA VAL 30 7.339 -6.105 0.239 250 HB VAL 30 HB VAL 30 5.988 -3.383 0.212 251 1HG1 VAL 30 1HG1 VAL 30 7.597 -3.858 2.517 252 2HG1 VAL 30 2HG1 VAL 30 6.563 -5.270 2.299 253 3HG1 VAL 30 3HG1 VAL 30 5.847 -3.666 2.442 254 1HG2 VAL 30 1HG2 VAL 30 8.499 -2.855 0.999 255 2HG2 VAL 30 2HG2 VAL 30 8.041 -2.840 -0.703 256 3HG2 VAL 30 3HG2 VAL 30 8.838 -4.256 -0.016 257 H LEU 31 H LEU 31 4.402 -4.956 -1.391 258 HA LEU 31 HA LEU 31 2.563 -6.004 0.597 259 1HB LEU 31 2HB LEU 31 2.372 -4.844 -2.142 260 2HB LEU 31 1HB LEU 31 1.036 -5.871 -1.621 261 HG LEU 31 HG LEU 31 2.007 -3.839 0.329 262 1HD1 LEU 31 1HD1 LEU 31 0.736 -2.045 -0.729 263 2HD1 LEU 31 2HD1 LEU 31 0.278 -3.112 -2.054 264 3HD1 LEU 31 3HD1 LEU 31 1.960 -2.627 -1.855 265 1HD2 LEU 31 1HD2 LEU 31 -0.824 -4.451 -0.514 266 2HD2 LEU 31 2HD2 LEU 31 -0.237 -3.894 1.054 267 3HD2 LEU 31 3HD2 LEU 31 0.057 -5.557 0.540 268 H SER 32 H SER 32 3.685 -7.173 -2.596 269 HA SER 32 HA SER 32 2.192 -9.554 -2.750 270 1HB SER 32 2HB SER 32 3.986 -10.394 -4.235 271 2HB SER 32 1HB SER 32 3.544 -8.736 -4.620 272 HG SER 32 HG SER 32 5.808 -9.018 -4.515 273 H LEU 33 H LEU 33 4.965 -8.855 -0.709 274 HA LEU 33 HA LEU 33 5.632 -11.621 -0.142 275 1HB LEU 33 2HB LEU 33 6.291 -8.974 1.139 276 2HB LEU 33 1HB LEU 33 6.725 -10.484 1.938 277 HG LEU 33 HG LEU 33 7.421 -10.092 -0.959 278 1HD1 LEU 33 1HD1 LEU 33 8.329 -8.094 0.012 279 2HD1 LEU 33 2HD1 LEU 33 9.665 -9.236 -0.118 280 3HD1 LEU 33 3HD1 LEU 33 8.885 -8.965 1.440 281 1HD2 LEU 33 1HD2 LEU 33 9.256 -11.616 -0.344 282 2HD2 LEU 33 2HD2 LEU 33 7.703 -12.304 0.133 283 3HD2 LEU 33 3HD2 LEU 33 8.748 -11.562 1.344 284 H GLN 34 H GLN 34 3.451 -9.232 1.310 285 HA GLN 34 HA GLN 34 2.794 -10.960 3.586 286 1HB GLN 34 2HB GLN 34 1.640 -8.345 2.582 287 2HB GLN 34 1HB GLN 34 1.051 -9.177 4.022 288 1HG GLN 34 2HG GLN 34 3.215 -9.001 5.090 289 2HG GLN 34 1HG GLN 34 3.944 -8.369 3.613 290 1HE2 GLN 34 1HE2 GLN 34 3.006 -6.201 2.828 291 2HE2 GLN 34 2HE2 GLN 34 2.481 -5.098 4.006 292 H ILE 35 H ILE 35 0.961 -9.753 0.731 293 HA ILE 35 HA ILE 35 -1.255 -11.583 1.281 294 HB ILE 35 HB ILE 35 -2.044 -10.799 -1.038 295 1HG1 ILE 35 2HG1 ILE 35 0.198 -8.795 -0.636 296 2HG1 ILE 35 1HG1 ILE 35 0.252 -10.109 -1.808 297 1HG2 ILE 35 1HG2 ILE 35 -1.905 -8.273 0.250 298 2HG2 ILE 35 2HG2 ILE 35 -1.983 -9.498 1.516 299 3HG2 ILE 35 3HG2 ILE 35 -3.234 -9.432 0.276 300 1HD1 ILE 35 1HD1 ILE 35 -1.239 -9.086 -3.211 301 2HD1 ILE 35 2HD1 ILE 35 -0.679 -7.630 -2.392 302 3HD1 ILE 35 3HD1 ILE 35 -2.178 -8.406 -1.884 303 H GLY 36 H GLY 36 1.686 -11.770 -0.593 304 1HA GLY 36 2HA GLY 36 2.583 -13.580 -1.804 305 2HA GLY 36 1HA GLY 36 1.273 -14.574 -1.160 306 H THR 37 H THR 37 0.987 -11.598 -3.069 307 HA THR 37 HA THR 37 -0.528 -13.150 -5.128 308 HB THR 37 HB THR 37 -0.704 -10.162 -4.739 309 HG1 THR 37 HG1 THR 37 -2.180 -12.170 -3.375 310 1HG2 THR 37 1HG2 THR 37 -1.849 -11.976 -6.530 311 2HG2 THR 37 2HG2 THR 37 -2.360 -10.312 -6.248 312 3HG2 THR 37 3HG2 THR 37 -3.128 -11.631 -5.366 313 H GLN 38 H GLN 38 2.445 -11.653 -4.653 314 HA GLN 38 HA GLN 38 4.172 -11.075 -6.112 315 1HB GLN 38 2HB GLN 38 2.263 -12.361 -8.074 316 2HB GLN 38 1HB GLN 38 3.793 -11.658 -8.589 317 1HG GLN 38 2HG GLN 38 4.602 -13.745 -8.142 318 2HG GLN 38 1HG GLN 38 4.640 -13.150 -6.482 319 1HE2 GLN 38 1HE2 GLN 38 2.585 -14.993 -8.782 320 2HE2 GLN 38 2HE2 GLN 38 1.737 -15.841 -7.581 321 HA PRO 39 HA PRO 39 3.148 -7.039 -7.494 322 1HB PRO 39 2HB PRO 39 5.267 -6.562 -9.185 323 2HB PRO 39 1HB PRO 39 5.391 -6.540 -7.418 324 1HG PRO 39 2HG PRO 39 6.303 -8.638 -9.340 325 2HG PRO 39 1HG PRO 39 6.962 -8.208 -7.753 326 1HD PRO 39 2HD PRO 39 5.315 -10.424 -8.274 327 2HD PRO 39 1HD PRO 39 5.620 -9.727 -6.669 328 H ASN 40 H ASN 40 3.361 -9.665 -9.748 329 HA ASN 40 HA ASN 40 2.530 -8.120 -12.095 330 1HB ASN 40 2HB ASN 40 3.048 -11.018 -11.497 331 2HB ASN 40 1HB ASN 40 2.128 -10.590 -12.939 332 1HD2 ASN 40 1HD2 ASN 40 3.244 -9.338 -14.629 333 2HD2 ASN 40 2HD2 ASN 40 4.937 -9.223 -14.653 334 H LYS 41 H LYS 41 0.948 -9.832 -9.470 335 HA LYS 41 HA LYS 41 -1.663 -9.574 -10.905 336 1HB LYS 41 2HB LYS 41 -0.697 -11.846 -9.907 337 2HB LYS 41 1HB LYS 41 -1.402 -11.211 -8.419 338 1HG LYS 41 2HG LYS 41 -3.440 -11.854 -9.118 339 2HG LYS 41 1HG LYS 41 -3.291 -10.787 -10.516 340 1HD LYS 41 2HD LYS 41 -2.149 -12.539 -11.779 341 2HD LYS 41 1HD LYS 41 -2.185 -13.606 -10.375 342 1HE LYS 41 2HE LYS 41 -4.798 -12.477 -11.234 343 2HE LYS 41 1HE LYS 41 -4.074 -13.669 -12.308 344 1HZ LYS 41 1HZ LYS 41 -3.788 -15.108 -10.304 345 2HZ LYS 41 2HZ LYS 41 -5.402 -14.832 -10.755 346 3HZ LYS 41 3HZ LYS 41 -4.734 -13.997 -9.436 347 H ILE 42 H ILE 42 0.016 -7.663 -8.965 348 HA ILE 42 HA ILE 42 -2.236 -7.114 -7.082 349 HB ILE 42 HB ILE 42 0.708 -6.419 -6.979 350 1HG1 ILE 42 2HG1 ILE 42 -1.070 -7.691 -4.884 351 2HG1 ILE 42 1HG1 ILE 42 -0.255 -8.646 -6.122 352 1HG2 ILE 42 1HG2 ILE 42 -1.611 -5.260 -5.422 353 2HG2 ILE 42 2HG2 ILE 42 -0.343 -4.392 -6.286 354 3HG2 ILE 42 3HG2 ILE 42 0.036 -5.251 -4.792 355 1HD1 ILE 42 1HD1 ILE 42 0.833 -7.489 -3.689 356 2HD1 ILE 42 2HD1 ILE 42 1.732 -6.942 -5.105 357 3HD1 ILE 42 3HD1 ILE 42 1.559 -8.667 -4.781 358 H VAL 43 H VAL 43 -3.476 -5.378 -7.474 359 HA VAL 43 HA VAL 43 -2.446 -3.237 -9.299 360 HB VAL 43 HB VAL 43 -5.313 -4.188 -8.943 361 1HG1 VAL 43 1HG1 VAL 43 -4.048 -2.064 -10.696 362 2HG1 VAL 43 2HG1 VAL 43 -5.283 -1.834 -9.457 363 3HG1 VAL 43 3HG1 VAL 43 -5.679 -2.688 -10.949 364 1HG2 VAL 43 1HG2 VAL 43 -3.482 -4.456 -11.349 365 2HG2 VAL 43 2HG2 VAL 43 -5.116 -5.099 -11.185 366 3HG2 VAL 43 3HG2 VAL 43 -3.807 -5.761 -10.208 367 H LEU 44 H LEU 44 -1.835 -1.672 -7.821 368 HA LEU 44 HA LEU 44 -3.649 -1.073 -5.540 369 1HB LEU 44 2HB LEU 44 -0.807 -0.248 -6.176 370 2HB LEU 44 1HB LEU 44 -1.718 0.410 -4.815 371 HG LEU 44 HG LEU 44 -1.723 -2.549 -5.064 372 1HD1 LEU 44 1HD1 LEU 44 0.534 -2.609 -3.887 373 2HD1 LEU 44 2HD1 LEU 44 0.750 -0.937 -4.405 374 3HD1 LEU 44 3HD1 LEU 44 0.586 -2.217 -5.604 375 1HD2 LEU 44 1HD2 LEU 44 -2.538 -2.184 -2.992 376 2HD2 LEU 44 2HD2 LEU 44 -2.114 -0.475 -3.077 377 3HD2 LEU 44 3HD2 LEU 44 -0.929 -1.650 -2.510 378 H GLN 45 H GLN 45 -4.600 0.966 -5.267 379 HA GLN 45 HA GLN 45 -4.241 2.926 -7.496 380 1HB GLN 45 2HB GLN 45 -6.918 2.353 -6.208 381 2HB GLN 45 1HB GLN 45 -6.596 3.283 -7.669 382 1HG GLN 45 2HG GLN 45 -5.500 0.934 -8.412 383 2HG GLN 45 1HG GLN 45 -6.720 0.332 -7.288 384 1HE2 GLN 45 1HE2 GLN 45 -9.019 1.366 -7.672 385 2HE2 GLN 45 2HE2 GLN 45 -9.478 1.582 -9.292 386 H LYS 46 H LYS 46 -4.102 5.048 -6.836 387 HA LYS 46 HA LYS 46 -3.752 5.613 -4.006 388 1HB LYS 46 2HB LYS 46 -3.106 6.880 -6.480 389 2HB LYS 46 1HB LYS 46 -4.062 8.023 -5.540 390 1HG LYS 46 2HG LYS 46 -1.954 6.542 -4.055 391 2HG LYS 46 1HG LYS 46 -1.395 7.740 -5.221 392 1HD LYS 46 2HD LYS 46 -2.091 9.475 -3.940 393 2HD LYS 46 1HD LYS 46 -3.633 8.697 -3.580 394 1HE LYS 46 2HE LYS 46 -1.642 7.191 -2.234 395 2HE LYS 46 1HE LYS 46 -1.285 8.886 -1.919 396 1HZ LYS 46 1HZ LYS 46 -3.533 9.218 -1.174 397 2HZ LYS 46 2HZ LYS 46 -2.841 7.932 -0.307 398 3HZ LYS 46 3HZ LYS 46 -3.946 7.618 -1.559 399 H GLY 47 H GLY 47 -6.078 6.857 -6.435 400 1HA GLY 47 2HA GLY 47 -8.308 6.695 -4.569 401 2HA GLY 47 1HA GLY 47 -7.775 8.357 -4.841 402 H GLY 48 H GLY 48 -8.499 5.416 -6.755 403 1HA GLY 48 2HA GLY 48 -10.220 5.349 -8.469 404 2HA GLY 48 1HA GLY 48 -10.100 7.102 -8.616 405 H SER 49 H SER 49 -6.959 6.206 -8.425 406 HA SER 49 HA SER 49 -6.710 5.693 -11.363 407 1HB SER 49 2HB SER 49 -4.614 7.080 -11.261 408 2HB SER 49 1HB SER 49 -6.081 8.000 -10.953 409 HG SER 49 HG SER 49 -4.123 8.149 -9.459 410 H VAL 50 H VAL 50 -5.168 4.153 -11.952 411 HA VAL 50 HA VAL 50 -4.233 2.372 -9.828 412 HB VAL 50 HB VAL 50 -5.081 1.586 -12.076 413 1HG1 VAL 50 1HG1 VAL 50 -3.851 1.881 -14.035 414 2HG1 VAL 50 2HG1 VAL 50 -2.350 2.202 -13.166 415 3HG1 VAL 50 3HG1 VAL 50 -3.610 3.434 -13.238 416 1HG2 VAL 50 1HG2 VAL 50 -3.737 -0.314 -12.019 417 2HG2 VAL 50 2HG2 VAL 50 -3.403 0.371 -10.429 418 3HG2 VAL 50 3HG2 VAL 50 -2.260 0.613 -11.749 419 H LEU 51 H LEU 51 -2.113 2.051 -9.154 420 HA LEU 51 HA LEU 51 -0.192 4.202 -9.850 421 1HB LEU 51 2HB LEU 51 0.245 2.014 -7.806 422 2HB LEU 51 1HB LEU 51 1.005 3.602 -7.882 423 HG LEU 51 HG LEU 51 -1.949 3.133 -7.368 424 1HD1 LEU 51 1HD1 LEU 51 -0.315 2.395 -5.541 425 2HD1 LEU 51 2HD1 LEU 51 -1.522 3.591 -5.070 426 3HD1 LEU 51 3HD1 LEU 51 0.135 4.095 -5.401 427 1HD2 LEU 51 1HD2 LEU 51 -1.032 5.332 -8.463 428 2HD2 LEU 51 2HD2 LEU 51 -0.419 5.670 -6.845 429 3HD2 LEU 51 3HD2 LEU 51 -2.148 5.452 -7.105 430 H LYS 52 H LYS 52 1.729 3.804 -10.934 431 HA LYS 52 HA LYS 52 2.148 1.002 -11.904 432 1HB LYS 52 2HB LYS 52 1.947 3.536 -13.313 433 2HB LYS 52 1HB LYS 52 3.487 2.745 -13.650 434 1HG LYS 52 2HG LYS 52 1.885 0.604 -13.868 435 2HG LYS 52 1HG LYS 52 0.717 1.855 -14.299 436 1HD LYS 52 2HD LYS 52 1.871 2.473 -16.210 437 2HD LYS 52 1HD LYS 52 3.429 1.965 -15.558 438 1HE LYS 52 2HE LYS 52 2.518 -0.435 -15.684 439 2HE LYS 52 1HE LYS 52 1.228 0.230 -16.687 440 1HZ LYS 52 1HZ LYS 52 4.007 -0.216 -17.316 441 2HZ LYS 52 2HZ LYS 52 3.433 1.310 -17.797 442 3HZ LYS 52 3HZ LYS 52 2.666 -0.102 -18.348 443 H ASP 53 H ASP 53 4.259 0.197 -11.916 444 HA ASP 53 HA ASP 53 6.047 1.066 -9.891 445 1HB ASP 53 2HB ASP 53 7.655 -0.521 -10.868 446 2HB ASP 53 1HB ASP 53 6.042 -1.228 -10.796 447 H HIS 54 H HIS 54 5.833 2.024 -13.269 448 HA HIS 54 HA HIS 54 8.465 3.151 -13.510 449 1HB HIS 54 2HB HIS 54 5.872 3.650 -14.978 450 2HB HIS 54 1HB HIS 54 7.372 4.473 -15.402 451 HD1 HIS 54 HD1 HIS 54 5.641 1.186 -15.623 452 HD2 HIS 54 HD2 HIS 54 9.445 2.710 -16.399 453 HE1 HIS 54 HE1 HIS 54 6.859 -0.578 -16.972 454 H ILE 55 H ILE 55 5.752 4.243 -11.694 455 HA ILE 55 HA ILE 55 6.868 7.019 -11.648 456 HB ILE 55 HB ILE 55 4.082 6.014 -10.978 457 1HG1 ILE 55 2HG1 ILE 55 3.781 7.911 -12.885 458 2HG1 ILE 55 1HG1 ILE 55 5.377 7.308 -13.326 459 1HG2 ILE 55 1HG2 ILE 55 4.987 7.943 -9.545 460 2HG2 ILE 55 2HG2 ILE 55 3.495 8.262 -10.427 461 3HG2 ILE 55 3HG2 ILE 55 5.027 8.889 -11.033 462 1HD1 ILE 55 1HD1 ILE 55 3.981 5.882 -14.538 463 2HD1 ILE 55 2HD1 ILE 55 2.754 5.846 -13.272 464 3HD1 ILE 55 3HD1 ILE 55 4.256 4.947 -13.069 465 H SER 56 H SER 56 7.408 7.933 -9.657 466 HA SER 56 HA SER 56 7.997 6.068 -7.499 467 1HB SER 56 2HB SER 56 8.946 8.051 -6.359 468 2HB SER 56 1HB SER 56 9.546 7.898 -8.007 469 HG SER 56 HG SER 56 8.777 10.043 -7.314 470 H LEU 57 H LEU 57 7.187 6.219 -5.321 471 HA LEU 57 HA LEU 57 4.357 6.572 -5.095 472 1HB LEU 57 2HB LEU 57 6.535 6.395 -2.994 473 2HB LEU 57 1HB LEU 57 4.817 6.442 -2.600 474 HG LEU 57 HG LEU 57 5.915 4.419 -4.554 475 1HD1 LEU 57 1HD1 LEU 57 5.779 4.252 -1.532 476 2HD1 LEU 57 2HD1 LEU 57 7.200 4.039 -2.554 477 3HD1 LEU 57 3HD1 LEU 57 5.912 2.836 -2.573 478 1HD2 LEU 57 1HD2 LEU 57 3.764 3.498 -2.913 479 2HD2 LEU 57 2HD2 LEU 57 3.741 3.828 -4.644 480 3HD2 LEU 57 3HD2 LEU 57 3.338 5.105 -3.498 481 H GLU 58 H GLU 58 7.082 8.734 -4.455 482 HA GLU 58 HA GLU 58 5.679 10.781 -3.033 483 1HB GLU 58 2HB GLU 58 8.291 10.397 -4.111 484 2HB GLU 58 1HB GLU 58 7.692 11.935 -4.728 485 1HG GLU 58 2HG GLU 58 7.444 12.851 -2.590 486 2HG GLU 58 1HG GLU 58 7.351 11.269 -1.816 487 H ASP 59 H ASP 59 6.019 10.087 -6.492 488 HA ASP 59 HA ASP 59 4.899 12.545 -7.474 489 1HB ASP 59 2HB ASP 59 5.948 10.206 -8.604 490 2HB ASP 59 1HB ASP 59 4.262 10.218 -9.117 491 H TYR 60 H TYR 60 3.460 9.417 -6.568 492 HA TYR 60 HA TYR 60 0.757 10.173 -7.307 493 1HB TYR 60 2HB TYR 60 1.949 7.925 -5.685 494 2HB TYR 60 1HB TYR 60 0.205 8.142 -5.801 495 HD1 TYR 60 HD1 TYR 60 -0.613 8.672 -8.336 496 HD2 TYR 60 HD2 TYR 60 2.921 6.487 -7.239 497 HE1 TYR 60 HE1 TYR 60 -0.605 7.569 -10.557 498 HE2 TYR 60 HE2 TYR 60 2.928 5.385 -9.461 499 HH TYR 60 HH TYR 60 1.284 6.477 -12.057 500 H GLU 61 H GLU 61 2.765 10.889 -4.598 501 HA GLU 61 HA GLU 61 2.347 12.286 -2.766 502 1HB GLU 61 2HB GLU 61 0.448 13.166 -4.386 503 2HB GLU 61 1HB GLU 61 -0.610 12.292 -3.279 504 1HG GLU 61 2HG GLU 61 1.151 13.668 -1.599 505 2HG GLU 61 1HG GLU 61 0.787 14.820 -2.882 506 H VAL 62 H VAL 62 2.850 9.929 -2.009 507 HA VAL 62 HA VAL 62 0.553 8.803 -0.476 508 HB VAL 62 HB VAL 62 3.285 7.596 -1.040 509 1HG1 VAL 62 1HG1 VAL 62 2.248 5.514 -0.229 510 2HG1 VAL 62 2HG1 VAL 62 0.748 6.379 0.098 511 3HG1 VAL 62 3HG1 VAL 62 2.201 6.754 1.023 512 1HG2 VAL 62 1HG2 VAL 62 1.654 7.973 -3.010 513 2HG2 VAL 62 2HG2 VAL 62 0.633 6.765 -2.232 514 3HG2 VAL 62 3HG2 VAL 62 2.255 6.333 -2.771 515 H HIS 63 H HIS 63 0.430 9.468 1.607 516 HA HIS 63 HA HIS 63 2.951 10.295 2.993 517 1HB HIS 63 2HB HIS 63 0.066 11.119 3.402 518 2HB HIS 63 1HB HIS 63 1.356 11.538 4.528 519 HD1 HIS 63 HD1 HIS 63 3.390 12.969 3.474 520 HD2 HIS 63 HD2 HIS 63 -0.069 12.761 1.155 521 HE1 HIS 63 HE1 HIS 63 3.567 14.817 1.752 522 H ASP 64 H ASP 64 2.462 10.123 5.565 523 HA ASP 64 HA ASP 64 2.334 7.281 6.127 524 1HB ASP 64 2HB ASP 64 3.524 9.353 7.391 525 2HB ASP 64 1HB ASP 64 2.057 9.234 8.360 526 H GLN 65 H GLN 65 0.673 6.108 7.050 527 HA GLN 65 HA GLN 65 -1.514 5.528 7.626 528 1HB GLN 65 2HB GLN 65 -1.626 8.410 8.580 529 2HB GLN 65 1HB GLN 65 -2.774 7.143 9.007 530 1HG GLN 65 2HG GLN 65 0.199 7.000 9.582 531 2HG GLN 65 1HG GLN 65 -1.009 7.523 10.753 532 1HE2 GLN 65 1HE2 GLN 65 0.422 4.733 9.211 533 2HE2 GLN 65 2HE2 GLN 65 -0.517 3.563 10.005 534 H THR 66 H THR 66 -1.090 6.270 4.931 535 HA THR 66 HA THR 66 -3.432 7.948 4.205 536 HB THR 66 HB THR 66 -1.147 8.244 3.099 537 HG1 THR 66 HG1 THR 66 -2.319 9.087 1.604 538 1HG2 THR 66 1HG2 THR 66 -1.958 5.599 1.863 539 2HG2 THR 66 2HG2 THR 66 -0.502 5.935 2.798 540 3HG2 THR 66 3HG2 THR 66 -0.709 6.652 1.202 541 H ASN 67 H ASN 67 -4.993 7.110 2.606 542 HA ASN 67 HA ASN 67 -5.499 4.210 3.040 543 1HB ASN 67 2HB ASN 67 -7.212 6.242 3.347 544 2HB ASN 67 1HB ASN 67 -7.462 5.965 1.624 545 1HD2 ASN 67 1HD2 ASN 67 -7.644 4.372 4.823 546 2HD2 ASN 67 2HD2 ASN 67 -8.688 3.130 4.322 547 H LEU 68 H LEU 68 -5.186 2.776 1.426 548 HA LEU 68 HA LEU 68 -4.981 3.794 -1.383 549 1HB LEU 68 2HB LEU 68 -3.081 2.221 0.239 550 2HB LEU 68 1HB LEU 68 -3.395 1.549 -1.360 551 HG LEU 68 HG LEU 68 -2.968 4.484 -1.263 552 1HD1 LEU 68 1HD1 LEU 68 -0.528 4.262 -1.115 553 2HD1 LEU 68 2HD1 LEU 68 -0.687 2.524 -0.857 554 3HD1 LEU 68 3HD1 LEU 68 -1.281 3.653 0.360 555 1HD2 LEU 68 1HD2 LEU 68 -1.292 3.240 -3.129 556 2HD2 LEU 68 2HD2 LEU 68 -2.870 3.955 -3.458 557 3HD2 LEU 68 3HD2 LEU 68 -2.739 2.233 -3.101 558 H GLU 69 H GLU 69 -5.523 2.153 -3.025 559 HA GLU 69 HA GLU 69 -7.551 0.208 -2.002 560 1HB GLU 69 2HB GLU 69 -7.203 1.480 -4.734 561 2HB GLU 69 1HB GLU 69 -8.414 0.256 -4.359 562 1HG GLU 69 2HG GLU 69 -9.724 2.067 -3.889 563 2HG GLU 69 1HG GLU 69 -8.875 2.026 -2.344 564 H LEU 70 H LEU 70 -7.555 -1.948 -2.895 565 HA LEU 70 HA LEU 70 -5.082 -2.735 -4.365 566 1HB LEU 70 2HB LEU 70 -4.729 -3.216 -1.972 567 2HB LEU 70 1HB LEU 70 -6.225 -4.145 -1.931 568 HG LEU 70 HG LEU 70 -5.306 -5.750 -3.544 569 1HD1 LEU 70 1HD1 LEU 70 -3.825 -3.946 -4.648 570 2HD1 LEU 70 2HD1 LEU 70 -3.137 -5.560 -4.486 571 3HD1 LEU 70 3HD1 LEU 70 -2.667 -4.287 -3.362 572 1HD2 LEU 70 1HD2 LEU 70 -3.866 -6.854 -2.050 573 2HD2 LEU 70 2HD2 LEU 70 -4.767 -5.778 -0.984 574 3HD2 LEU 70 3HD2 LEU 70 -3.134 -5.348 -1.494 575 H TYR 71 H TYR 71 -5.410 -4.318 -5.907 576 HA TYR 71 HA TYR 71 -7.993 -5.780 -5.980 577 1HB TYR 71 2HB TYR 71 -6.976 -3.903 -8.130 578 2HB TYR 71 1HB TYR 71 -8.148 -5.176 -8.469 579 HD1 TYR 71 HD1 TYR 71 -10.381 -5.156 -7.364 580 HD2 TYR 71 HD2 TYR 71 -7.594 -1.917 -6.914 581 HE1 TYR 71 HE1 TYR 71 -12.203 -3.706 -6.515 582 HE2 TYR 71 HE2 TYR 71 -9.418 -0.467 -6.066 583 HH TYR 71 HH TYR 71 -12.304 -0.697 -6.509 584 H TYR 72 H TYR 72 -7.778 -7.813 -6.988 585 HA TYR 72 HA TYR 72 -4.981 -8.562 -7.686 586 1HB TYR 72 2HB TYR 72 -7.415 -10.266 -7.067 587 2HB TYR 72 1HB TYR 72 -5.831 -10.910 -7.490 588 HD1 TYR 72 HD1 TYR 72 -4.196 -8.725 -6.034 589 HD2 TYR 72 HD2 TYR 72 -7.532 -11.151 -4.828 590 HE1 TYR 72 HE1 TYR 72 -3.486 -8.525 -3.668 591 HE2 TYR 72 HE2 TYR 72 -6.819 -10.950 -2.464 592 HH TYR 72 HH TYR 72 -5.050 -8.779 -1.254 593 H LEU 73 HN LEU 73 -4.561 -8.286 -9.820 594 HA LEU 73 HA LEU 73 -6.371 -9.573 -11.788 595 1HB LEU 73 2HB LEU 73 -6.443 -6.818 -11.399 596 2HB LEU 73 1HB LEU 73 -5.356 -7.004 -12.773 597 HG LEU 73 HG LEU 73 -7.678 -6.782 -13.547 598 1HD1 LEU 73 1HD1 LEU 73 -6.875 -9.678 -13.881 599 2HD1 LEU 73 2HD1 LEU 73 -6.001 -8.365 -14.669 600 3HD1 LEU 73 3HD1 LEU 73 -7.704 -8.638 -15.038 601 1HD2 LEU 73 1HD2 LEU 73 -9.419 -8.259 -12.877 602 2HD2 LEU 73 2HD2 LEU 73 -8.600 -7.823 -11.378 603 3HD2 LEU 73 3HD2 LEU 73 -8.285 -9.387 -12.132 Start of MODEL 18 1 H MET 1 1H MET 1 11.401 6.389 5.105 2 HA MET 1 HA MET 1 9.421 5.139 4.443 3 1HB MET 1 2HB MET 1 11.287 4.442 6.269 4 2HB MET 1 1HB MET 1 9.844 4.332 7.277 5 1HG MET 1 2HG MET 1 8.818 2.969 5.335 6 2HG MET 1 1HG MET 1 10.471 2.827 4.734 7 1HE MET 1 1HE MET 1 11.790 0.082 5.932 8 2HE MET 1 2HE MET 1 10.908 0.886 4.637 9 3HE MET 1 3HE MET 1 10.138 -0.411 5.542 10 H ILE 2 H ILE 2 7.231 4.893 4.627 11 HA ILE 2 HA ILE 2 5.875 6.154 6.977 12 HB ILE 2 HB ILE 2 4.068 6.896 5.453 13 1HG1 ILE 2 2HG1 ILE 2 5.885 6.253 3.131 14 2HG1 ILE 2 1HG1 ILE 2 4.726 5.060 3.716 15 1HG2 ILE 2 1HG2 ILE 2 5.232 8.775 4.535 16 2HG2 ILE 2 2HG2 ILE 2 6.742 7.873 4.427 17 3HG2 ILE 2 3HG2 ILE 2 6.099 8.330 6.004 18 1HD1 ILE 2 1HD1 ILE 2 3.144 6.089 2.491 19 2HD1 ILE 2 2HD1 ILE 2 4.254 7.394 2.074 20 3HD1 ILE 2 3HD1 ILE 2 3.299 7.486 3.554 21 H GLU 3 H GLU 3 3.658 5.273 7.338 22 HA GLU 3 HA GLU 3 3.507 2.392 6.535 23 1HB GLU 3 2HB GLU 3 3.650 3.416 9.079 24 2HB GLU 3 1HB GLU 3 1.906 3.288 8.854 25 1HG GLU 3 2HG GLU 3 3.786 1.010 8.199 26 2HG GLU 3 1HG GLU 3 3.082 1.217 9.801 27 H VAL 4 H VAL 4 2.012 2.199 4.923 28 HA VAL 4 HA VAL 4 -0.410 3.950 5.017 29 HB VAL 4 HB VAL 4 -0.646 3.456 2.609 30 1HG1 VAL 4 1HG1 VAL 4 0.699 5.224 2.266 31 2HG1 VAL 4 2HG1 VAL 4 2.121 4.194 2.410 32 3HG1 VAL 4 3HG1 VAL 4 1.435 4.955 3.846 33 1HG2 VAL 4 1HG2 VAL 4 0.448 1.162 2.817 34 2HG2 VAL 4 2HG2 VAL 4 1.999 2.001 2.827 35 3HG2 VAL 4 3HG2 VAL 4 0.942 2.118 1.421 36 H VAL 5 H VAL 5 -2.481 2.957 4.399 37 HA VAL 5 HA VAL 5 -2.615 0.068 5.181 38 HB VAL 5 HB VAL 5 -4.865 2.091 5.374 39 1HG1 VAL 5 1HG1 VAL 5 -4.709 -0.732 5.648 40 2HG1 VAL 5 2HG1 VAL 5 -6.088 0.308 5.999 41 3HG1 VAL 5 3HG1 VAL 5 -4.927 -0.074 7.269 42 1HG2 VAL 5 1HG2 VAL 5 -4.112 2.830 7.385 43 2HG2 VAL 5 2HG2 VAL 5 -2.543 2.201 6.880 44 3HG2 VAL 5 3HG2 VAL 5 -3.606 1.217 7.884 45 H VAL 6 H VAL 6 -3.484 -1.325 3.688 46 HA VAL 6 HA VAL 6 -4.732 -0.109 1.253 47 HB VAL 6 HB VAL 6 -3.967 -2.131 0.030 48 1HG1 VAL 6 1HG1 VAL 6 -1.578 -0.988 1.461 49 2HG1 VAL 6 2HG1 VAL 6 -2.565 0.032 0.414 50 3HG1 VAL 6 3HG1 VAL 6 -1.759 -1.390 -0.247 51 1HG2 VAL 6 1HG2 VAL 6 -2.214 -3.548 1.208 52 2HG2 VAL 6 2HG2 VAL 6 -3.866 -3.782 1.780 53 3HG2 VAL 6 3HG2 VAL 6 -2.737 -2.805 2.718 54 H ASN 7 H ASN 7 -6.724 -0.853 0.611 55 HA ASN 7 HA ASN 7 -7.925 -3.093 2.192 56 1HB ASN 7 2HB ASN 7 -10.138 -1.756 1.756 57 2HB ASN 7 1HB ASN 7 -9.079 -1.255 3.070 58 1HD2 ASN 7 1HD2 ASN 7 -7.968 0.788 2.865 59 2HD2 ASN 7 2HD2 ASN 7 -8.273 1.863 1.587 60 H ASP 8 H ASP 8 -8.558 -4.735 0.901 61 HA ASP 8 HA ASP 8 -8.713 -4.316 -2.015 62 1HB ASP 8 2HB ASP 8 -7.620 -6.338 -0.775 63 2HB ASP 8 1HB ASP 8 -9.274 -6.930 -0.623 64 H ARG 9 H ARG 9 -10.591 -4.712 -3.257 65 HA ARG 9 HA ARG 9 -13.093 -3.970 -2.052 66 1HB ARG 9 2HB ARG 9 -12.506 -5.225 -4.750 67 2HB ARG 9 1HB ARG 9 -14.067 -4.557 -4.275 68 1HG ARG 9 2HG ARG 9 -11.500 -2.950 -4.208 69 2HG ARG 9 1HG ARG 9 -12.580 -2.983 -5.600 70 1HD ARG 9 2HD ARG 9 -14.194 -1.738 -4.557 71 2HD ARG 9 1HD ARG 9 -13.859 -2.438 -2.974 72 HE ARG 9 HE ARG 9 -12.643 -0.028 -4.071 73 1HH1 ARG 9 2HH1 ARG 9 -13.300 -0.608 -1.155 74 2HH1 ARG 9 1HH1 ARG 9 -11.715 -0.748 -0.472 75 1HH2 ARG 9 1HH2 ARG 9 -10.135 -1.117 -3.544 76 2HH2 ARG 9 2HH2 ARG 9 -9.920 -1.036 -1.828 77 H LEU 10 H LEU 10 -11.712 -7.117 -2.981 78 HA LEU 10 HA LEU 10 -14.059 -8.697 -2.583 79 1HB LEU 10 2HB LEU 10 -11.139 -9.193 -2.740 80 2HB LEU 10 1HB LEU 10 -12.067 -10.411 -1.867 81 HG LEU 10 HG LEU 10 -13.506 -9.686 -4.246 82 1HD1 LEU 10 1HD1 LEU 10 -11.993 -9.828 -5.953 83 2HD1 LEU 10 2HD1 LEU 10 -10.963 -10.962 -5.080 84 3HD1 LEU 10 3HD1 LEU 10 -10.870 -9.236 -4.728 85 1HD2 LEU 10 1HD2 LEU 10 -13.337 -12.087 -4.670 86 2HD2 LEU 10 2HD2 LEU 10 -13.639 -11.818 -2.954 87 3HD2 LEU 10 3HD2 LEU 10 -12.016 -12.225 -3.510 88 H GLY 11 H GLY 11 -11.401 -7.879 -0.313 89 1HA GLY 11 2HA GLY 11 -12.610 -7.279 1.988 90 2HA GLY 11 1HA GLY 11 -12.986 -9.000 1.933 91 H LYS 12 H LYS 12 -10.095 -6.931 1.400 92 HA LYS 12 HA LYS 12 -8.616 -8.626 3.345 93 1HB LYS 12 2HB LYS 12 -8.238 -8.669 0.478 94 2HB LYS 12 1HB LYS 12 -6.783 -8.056 1.263 95 1HG LYS 12 2HG LYS 12 -7.435 -10.155 2.906 96 2HG LYS 12 1HG LYS 12 -7.964 -10.760 1.335 97 1HD LYS 12 2HD LYS 12 -5.568 -9.696 0.640 98 2HD LYS 12 1HD LYS 12 -5.218 -10.162 2.301 99 1HE LYS 12 2HE LYS 12 -5.268 -12.384 1.813 100 2HE LYS 12 1HE LYS 12 -6.678 -12.212 0.770 101 1HZ LYS 12 1HZ LYS 12 -5.022 -11.074 -0.819 102 2HZ LYS 12 2HZ LYS 12 -5.015 -12.768 -0.708 103 3HZ LYS 12 3HZ LYS 12 -3.829 -11.855 0.099 104 H LYS 13 H LYS 13 -8.339 -6.979 4.829 105 HA LYS 13 HA LYS 13 -7.189 -4.394 3.869 106 1HB LYS 13 2HB LYS 13 -8.890 -5.205 6.183 107 2HB LYS 13 1HB LYS 13 -7.719 -3.920 6.474 108 1HG LYS 13 2HG LYS 13 -9.155 -2.473 5.513 109 2HG LYS 13 1HG LYS 13 -8.903 -3.313 3.985 110 1HD LYS 13 2HD LYS 13 -10.672 -4.993 5.255 111 2HD LYS 13 1HD LYS 13 -11.208 -3.413 5.824 112 1HE LYS 13 2HE LYS 13 -12.300 -3.204 3.856 113 2HE LYS 13 1HE LYS 13 -10.715 -3.014 3.107 114 1HZ LYS 13 1HZ LYS 13 -10.609 -5.292 2.614 115 2HZ LYS 13 2HZ LYS 13 -12.176 -4.812 2.166 116 3HZ LYS 13 3HZ LYS 13 -11.927 -5.670 3.612 117 H VAL 14 H VAL 14 -5.002 -4.241 4.056 118 HA VAL 14 HA VAL 14 -3.673 -5.468 6.426 119 HB VAL 14 HB VAL 14 -1.787 -5.744 4.373 120 1HG1 VAL 14 1HG1 VAL 14 -3.528 -8.033 5.225 121 2HG1 VAL 14 2HG1 VAL 14 -2.550 -7.197 6.429 122 3HG1 VAL 14 3HG1 VAL 14 -1.775 -7.969 5.046 123 1HG2 VAL 14 1HG2 VAL 14 -4.393 -5.851 3.170 124 2HG2 VAL 14 2HG2 VAL 14 -3.741 -7.485 3.209 125 3HG2 VAL 14 3HG2 VAL 14 -2.834 -6.193 2.426 126 H ARG 15 H ARG 15 -1.276 -4.654 6.497 127 HA ARG 15 HA ARG 15 -1.196 -1.774 5.668 128 1HB ARG 15 2HB ARG 15 -0.808 -3.043 8.338 129 2HB ARG 15 1HB ARG 15 0.269 -1.710 7.924 130 1HG ARG 15 2HG ARG 15 -1.599 -0.229 7.530 131 2HG ARG 15 1HG ARG 15 -2.748 -1.560 7.686 132 1HD ARG 15 2HD ARG 15 -1.423 -1.768 10.061 133 2HD ARG 15 1HD ARG 15 -1.342 -0.028 9.796 134 HE ARG 15 HE ARG 15 -3.961 -0.417 9.357 135 1HH1 ARG 15 1HH2 ARG 15 -2.691 0.270 12.129 136 2HH1 ARG 15 2HH2 ARG 15 -3.564 -0.836 13.138 137 1HH2 ARG 15 2HH1 ARG 15 -4.750 -2.739 10.476 138 2HH2 ARG 15 1HH1 ARG 15 -4.735 -2.545 12.198 139 H VAL 16 H VAL 16 0.705 -1.121 4.727 140 HA VAL 16 HA VAL 16 3.111 -2.858 4.978 141 HB VAL 16 HB VAL 16 1.941 -3.490 2.890 142 1HG1 VAL 16 1HG1 VAL 16 1.536 -0.659 2.713 143 2HG1 VAL 16 2HG1 VAL 16 0.884 -1.924 1.676 144 3HG1 VAL 16 3HG1 VAL 16 2.438 -1.184 1.292 145 1HG2 VAL 16 1HG2 VAL 16 4.504 -1.911 2.502 146 2HG2 VAL 16 2HG2 VAL 16 3.840 -3.042 1.323 147 3HG2 VAL 16 3HG2 VAL 16 4.373 -3.624 2.900 148 H LYS 17 H LYS 17 4.976 -1.669 5.228 149 HA LYS 17 HA LYS 17 4.704 1.292 5.038 150 1HB LYS 17 2HB LYS 17 6.621 1.404 6.565 151 2HB LYS 17 1HB LYS 17 5.361 0.375 7.244 152 1HG LYS 17 2HG LYS 17 6.883 -1.409 5.765 153 2HG LYS 17 1HG LYS 17 8.096 -0.318 6.429 154 1HD LYS 17 2HD LYS 17 7.927 -1.381 8.406 155 2HD LYS 17 1HD LYS 17 6.251 -0.845 8.522 156 1HE LYS 17 2HE LYS 17 6.749 -3.159 6.730 157 2HE LYS 17 1HE LYS 17 6.960 -3.463 8.453 158 1HZ LYS 17 1HZ LYS 17 4.771 -3.003 8.896 159 2HZ LYS 17 2HZ LYS 17 4.631 -3.699 7.354 160 3HZ LYS 17 3HZ LYS 17 4.574 -2.013 7.532 161 H CYS 18 H CYS 18 5.953 2.464 3.628 162 HA CYS 18 HA CYS 18 8.358 1.274 2.395 163 1HB CYS 18 2HB CYS 18 5.820 1.226 1.064 164 2HB CYS 18 1HB CYS 18 6.858 2.381 0.229 165 HG CYS 18 HG CYS 18 7.451 -0.658 0.537 166 H LEU 19 H LEU 19 9.617 2.924 1.192 167 HA LEU 19 HA LEU 19 9.380 5.560 2.445 168 1HB LEU 19 2HB LEU 19 11.335 4.260 0.563 169 2HB LEU 19 1HB LEU 19 11.360 6.009 0.774 170 HG LEU 19 HG LEU 19 11.162 4.858 3.370 171 1HD1 LEU 19 1HD1 LEU 19 13.335 3.635 1.641 172 2HD1 LEU 19 2HD1 LEU 19 12.013 2.766 2.422 173 3HD1 LEU 19 3HD1 LEU 19 13.266 3.529 3.401 174 1HD2 LEU 19 1HD2 LEU 19 12.222 6.998 2.860 175 2HD2 LEU 19 2HD2 LEU 19 13.440 6.192 1.872 176 3HD2 LEU 19 3HD2 LEU 19 13.409 5.936 3.616 177 H ALA 20 H ALA 20 8.970 7.535 1.335 178 HA ALA 20 HA ALA 20 7.016 7.426 -0.771 179 1HB ALA 20 1HB ALA 20 6.974 9.774 -0.651 180 2HB ALA 20 2HB ALA 20 8.678 9.876 -0.208 181 3HB ALA 20 3HB ALA 20 7.492 9.314 0.971 182 H GLU 21 H GLU 21 10.498 7.479 -0.783 183 HA GLU 21 HA GLU 21 10.745 8.393 -3.554 184 1HB GLU 21 2HB GLU 21 13.140 7.826 -3.272 185 2HB GLU 21 1HB GLU 21 12.556 8.840 -1.954 186 1HG GLU 21 2HG GLU 21 13.426 7.272 -0.568 187 2HG GLU 21 1HG GLU 21 12.049 6.273 -1.029 188 H ASP 22 H ASP 22 10.236 5.356 -1.928 189 HA ASP 22 HA ASP 22 11.348 3.598 -3.893 190 1HB ASP 22 2HB ASP 22 9.480 3.355 -1.608 191 2HB ASP 22 1HB ASP 22 9.286 2.137 -2.868 192 H SER 23 H SER 23 10.336 2.514 -5.641 193 HA SER 23 HA SER 23 8.257 4.074 -6.981 194 1HB SER 23 2HB SER 23 8.597 2.492 -8.845 195 2HB SER 23 1HB SER 23 10.132 3.134 -8.268 196 HG SER 23 HG SER 23 10.152 0.844 -8.551 197 H VAL 24 H VAL 24 6.305 2.992 -7.919 198 HA VAL 24 HA VAL 24 4.727 1.702 -5.912 199 HB VAL 24 HB VAL 24 4.332 1.795 -8.922 200 1HG1 VAL 24 1HG1 VAL 24 2.488 1.001 -6.655 201 2HG1 VAL 24 2HG1 VAL 24 2.952 0.032 -8.054 202 3HG1 VAL 24 3HG1 VAL 24 1.904 1.435 -8.261 203 1HG2 VAL 24 1HG2 VAL 24 2.604 3.568 -8.123 204 2HG2 VAL 24 2HG2 VAL 24 4.304 4.028 -8.156 205 3HG2 VAL 24 3HG2 VAL 24 3.540 3.589 -6.629 206 H GLY 25 H GLY 25 6.741 0.438 -8.535 207 1HA GLY 25 2HA GLY 25 5.868 -2.277 -8.510 208 2HA GLY 25 1HA GLY 25 7.486 -1.745 -8.977 209 H ASP 26 H ASP 26 8.430 -0.629 -6.630 210 HA ASP 26 HA ASP 26 9.199 -2.930 -5.084 211 1HB ASP 26 2HB ASP 26 10.465 -0.706 -5.334 212 2HB ASP 26 1HB ASP 26 9.347 -0.058 -4.135 213 H PHE 27 H PHE 27 6.762 -0.391 -4.637 214 HA PHE 27 HA PHE 27 5.950 -1.021 -1.976 215 1HB PHE 27 2HB PHE 27 5.269 1.019 -3.279 216 2HB PHE 27 1HB PHE 27 4.214 -0.003 -4.252 217 HD1 PHE 27 HD1 PHE 27 4.683 1.647 -1.024 218 HD2 PHE 27 HD2 PHE 27 2.262 -1.142 -3.217 219 HE1 PHE 27 HE1 PHE 27 2.900 1.848 0.684 220 HE2 PHE 27 HE2 PHE 27 0.482 -0.942 -1.508 221 HZ PHE 27 HZ PHE 27 0.799 0.553 0.442 222 H LYS 28 H LYS 28 4.876 -2.283 -5.134 223 HA LYS 28 HA LYS 28 2.843 -4.037 -4.067 224 1HB LYS 28 2HB LYS 28 4.342 -3.950 -6.695 225 2HB LYS 28 1HB LYS 28 3.135 -5.187 -6.345 226 1HG LYS 28 2HG LYS 28 1.383 -3.620 -6.209 227 2HG LYS 28 1HG LYS 28 2.490 -2.268 -5.971 228 1HD LYS 28 2HD LYS 28 3.277 -2.452 -8.274 229 2HD LYS 28 1HD LYS 28 2.281 -3.887 -8.528 230 1HE LYS 28 2HE LYS 28 0.251 -2.618 -8.274 231 2HE LYS 28 1HE LYS 28 1.140 -1.197 -7.732 232 1HZ LYS 28 1HZ LYS 28 2.280 -1.276 -9.962 233 2HZ LYS 28 2HZ LYS 28 0.641 -0.831 -9.981 234 3HZ LYS 28 3HZ LYS 28 1.101 -2.401 -10.436 235 H LYS 29 H LYS 29 6.322 -4.344 -4.564 236 HA LYS 29 HA LYS 29 6.463 -7.219 -4.311 237 1HB LYS 29 2HB LYS 29 8.481 -4.997 -3.944 238 2HB LYS 29 1HB LYS 29 8.902 -6.687 -3.666 239 1HG LYS 29 2HG LYS 29 8.134 -7.225 -5.977 240 2HG LYS 29 1HG LYS 29 7.825 -5.510 -6.246 241 1HD LYS 29 2HD LYS 29 10.305 -5.198 -5.482 242 2HD LYS 29 1HD LYS 29 10.459 -6.911 -5.867 243 1HE LYS 29 2HE LYS 29 9.829 -6.553 -8.147 244 2HE LYS 29 1HE LYS 29 9.296 -4.907 -7.809 245 1HZ LYS 29 1HZ LYS 29 11.406 -4.739 -8.801 246 2HZ LYS 29 2HZ LYS 29 12.070 -5.950 -7.810 247 3HZ LYS 29 3HZ LYS 29 11.652 -4.439 -7.152 248 H VAL 30 H VAL 30 6.772 -4.528 -1.980 249 HA VAL 30 HA VAL 30 7.279 -6.267 0.294 250 HB VAL 30 HB VAL 30 6.230 -3.414 0.278 251 1HG1 VAL 30 1HG1 VAL 30 7.282 -3.368 2.546 252 2HG1 VAL 30 2HG1 VAL 30 7.622 -5.091 2.391 253 3HG1 VAL 30 3HG1 VAL 30 5.953 -4.522 2.438 254 1HG2 VAL 30 1HG2 VAL 30 8.339 -3.532 -0.947 255 2HG2 VAL 30 2HG2 VAL 30 9.062 -4.510 0.328 256 3HG2 VAL 30 3HG2 VAL 30 8.642 -2.826 0.640 257 H LEU 31 H LEU 31 4.405 -4.865 -1.214 258 HA LEU 31 HA LEU 31 2.575 -5.602 0.908 259 1HB LEU 31 2HB LEU 31 2.126 -3.814 -0.799 260 2HB LEU 31 1HB LEU 31 1.957 -5.079 -2.016 261 HG LEU 31 HG LEU 31 0.178 -6.114 -0.510 262 1HD1 LEU 31 1HD1 LEU 31 0.042 -3.369 0.733 263 2HD1 LEU 31 2HD1 LEU 31 0.999 -4.652 1.472 264 3HD1 LEU 31 3HD1 LEU 31 -0.740 -4.856 1.266 265 1HD2 LEU 31 1HD2 LEU 31 -1.524 -4.293 -1.151 266 2HD2 LEU 31 2HD2 LEU 31 -0.575 -4.985 -2.465 267 3HD2 LEU 31 3HD2 LEU 31 -0.152 -3.404 -1.811 268 H SER 32 H SER 32 3.466 -7.083 -2.224 269 HA SER 32 HA SER 32 1.665 -9.253 -2.220 270 1HB SER 32 2HB SER 32 3.297 -10.396 -3.682 271 2HB SER 32 1HB SER 32 3.085 -8.712 -4.147 272 HG SER 32 HG SER 32 5.309 -9.480 -3.989 273 H LEU 33 H LEU 33 4.398 -8.745 -0.125 274 HA LEU 33 HA LEU 33 4.898 -11.522 0.512 275 1HB LEU 33 2HB LEU 33 5.614 -8.885 1.758 276 2HB LEU 33 1HB LEU 33 5.884 -10.375 2.662 277 HG LEU 33 HG LEU 33 6.811 -10.278 -0.180 278 1HD1 LEU 33 1HD1 LEU 33 8.786 -9.357 1.814 279 2HD1 LEU 33 2HD1 LEU 33 7.509 -8.194 1.459 280 3HD1 LEU 33 3HD1 LEU 33 8.522 -8.813 0.156 281 1HD2 LEU 33 1HD2 LEU 33 7.352 -11.756 2.333 282 2HD2 LEU 33 2HD2 LEU 33 8.769 -11.419 1.340 283 3HD2 LEU 33 3HD2 LEU 33 7.412 -12.318 0.663 284 H GLN 34 H GLN 34 2.876 -8.981 2.025 285 HA GLN 34 HA GLN 34 1.991 -10.814 4.134 286 1HB GLN 34 2HB GLN 34 0.636 -8.960 4.936 287 2HB GLN 34 1HB GLN 34 2.249 -8.371 4.545 288 1HG GLN 34 2HG GLN 34 1.052 -7.972 2.160 289 2HG GLN 34 1HG GLN 34 -0.351 -7.806 3.212 290 1HE2 GLN 34 1HE2 GLN 34 3.118 -6.763 3.420 291 2HE2 GLN 34 2HE2 GLN 34 2.752 -5.166 3.861 292 H ILE 35 H ILE 35 0.617 -9.575 1.083 293 HA ILE 35 HA ILE 35 -1.939 -10.961 1.633 294 HB ILE 35 HB ILE 35 -2.495 -10.157 -0.747 295 1HG1 ILE 35 2HG1 ILE 35 -0.046 -8.442 -0.269 296 2HG1 ILE 35 1HG1 ILE 35 -0.081 -9.803 -1.386 297 1HG2 ILE 35 1HG2 ILE 35 -2.762 -7.776 0.064 298 2HG2 ILE 35 2HG2 ILE 35 -1.869 -8.247 1.509 299 3HG2 ILE 35 3HG2 ILE 35 -3.415 -9.010 1.139 300 1HD1 ILE 35 1HD1 ILE 35 -1.760 -8.738 -2.744 301 2HD1 ILE 35 2HD1 ILE 35 -0.501 -7.542 -2.449 302 3HD1 ILE 35 3HD1 ILE 35 -2.010 -7.474 -1.542 303 H GLY 36 H GLY 36 1.035 -11.583 -0.088 304 1HA GLY 36 2HA GLY 36 1.744 -13.508 -1.239 305 2HA GLY 36 1HA GLY 36 0.325 -14.331 -0.582 306 H THR 37 H THR 37 0.527 -11.456 -2.670 307 HA THR 37 HA THR 37 -1.140 -12.904 -4.692 308 HB THR 37 HB THR 37 -1.100 -9.905 -4.328 309 HG1 THR 37 HG1 THR 37 -2.993 -10.262 -3.026 310 1HG2 THR 37 1HG2 THR 37 -2.227 -10.396 -6.295 311 2HG2 THR 37 2HG2 THR 37 -3.550 -10.424 -5.131 312 3HG2 THR 37 3HG2 THR 37 -2.833 -11.936 -5.685 313 H GLN 38 H GLN 38 1.950 -11.801 -4.208 314 HA GLN 38 HA GLN 38 3.743 -11.405 -5.647 315 1HB GLN 38 2HB GLN 38 1.685 -12.311 -7.675 316 2HB GLN 38 1HB GLN 38 3.328 -11.861 -8.129 317 1HG GLN 38 2HG GLN 38 3.935 -13.976 -7.639 318 2HG GLN 38 1HG GLN 38 3.658 -13.577 -5.943 319 1HE2 GLN 38 1HE2 GLN 38 1.714 -14.378 -4.930 320 2HE2 GLN 38 2HE2 GLN 38 0.662 -15.456 -5.712 321 HA PRO 39 HA PRO 39 3.257 -7.204 -6.836 322 1HB PRO 39 2HB PRO 39 5.525 -6.915 -8.371 323 2HB PRO 39 1HB PRO 39 5.532 -6.984 -6.600 324 1HG PRO 39 2HG PRO 39 6.331 -9.085 -8.567 325 2HG PRO 39 1HG PRO 39 6.905 -8.820 -6.912 326 1HD PRO 39 2HD PRO 39 5.043 -10.782 -7.703 327 2HD PRO 39 1HD PRO 39 5.331 -10.241 -6.034 328 H ASN 40 H ASN 40 3.020 -9.732 -9.113 329 HA ASN 40 HA ASN 40 2.586 -7.924 -11.424 330 1HB ASN 40 2HB ASN 40 2.864 -10.904 -11.085 331 2HB ASN 40 1HB ASN 40 2.148 -10.239 -12.553 332 1HD2 ASN 40 1HD2 ASN 40 5.155 -10.478 -10.693 333 2HD2 ASN 40 2HD2 ASN 40 6.161 -9.848 -11.906 334 H LYS 41 H LYS 41 0.761 -9.660 -9.006 335 HA LYS 41 HA LYS 41 -1.740 -9.299 -10.606 336 1HB LYS 41 2HB LYS 41 -0.776 -11.385 -8.820 337 2HB LYS 41 1HB LYS 41 -2.351 -10.783 -8.304 338 1HG LYS 41 2HG LYS 41 -3.370 -11.857 -9.996 339 2HG LYS 41 1HG LYS 41 -2.316 -11.078 -11.176 340 1HD LYS 41 2HD LYS 41 -1.094 -13.259 -9.569 341 2HD LYS 41 1HD LYS 41 -2.314 -13.748 -10.743 342 1HE LYS 41 2HE LYS 41 -0.560 -11.796 -11.938 343 2HE LYS 41 1HE LYS 41 0.397 -13.110 -11.257 344 1HZ LYS 41 1HZ LYS 41 -0.909 -14.695 -12.470 345 2HZ LYS 41 2HZ LYS 41 -0.321 -13.527 -13.555 346 3HZ LYS 41 3HZ LYS 41 -1.941 -13.481 -13.049 347 H ILE 42 H ILE 42 -0.104 -7.390 -8.637 348 HA ILE 42 HA ILE 42 -2.418 -6.698 -6.879 349 HB ILE 42 HB ILE 42 0.525 -5.988 -6.676 350 1HG1 ILE 42 2HG1 ILE 42 -1.217 -7.407 -4.655 351 2HG1 ILE 42 1HG1 ILE 42 -0.411 -8.293 -5.950 352 1HG2 ILE 42 1HG2 ILE 42 -0.711 -4.051 -5.947 353 2HG2 ILE 42 2HG2 ILE 42 -0.206 -4.914 -4.494 354 3HG2 ILE 42 3HG2 ILE 42 -1.867 -5.051 -5.068 355 1HD1 ILE 42 1HD1 ILE 42 0.786 -6.832 -3.623 356 2HD1 ILE 42 2HD1 ILE 42 1.709 -6.937 -5.123 357 3HD1 ILE 42 3HD1 ILE 42 1.208 -8.409 -4.291 358 H VAL 43 H VAL 43 -3.510 -4.857 -7.243 359 HA VAL 43 HA VAL 43 -2.317 -2.787 -9.045 360 HB VAL 43 HB VAL 43 -5.217 -3.702 -8.955 361 1HG1 VAL 43 1HG1 VAL 43 -5.178 -2.182 -11.103 362 2HG1 VAL 43 2HG1 VAL 43 -3.783 -1.442 -10.320 363 3HG1 VAL 43 3HG1 VAL 43 -5.350 -1.439 -9.513 364 1HG2 VAL 43 1HG2 VAL 43 -4.625 -5.209 -10.520 365 2HG2 VAL 43 2HG2 VAL 43 -2.946 -4.684 -10.414 366 3HG2 VAL 43 3HG2 VAL 43 -4.043 -3.899 -11.547 367 H LEU 44 H LEU 44 -1.851 -1.173 -7.589 368 HA LEU 44 HA LEU 44 -3.768 -0.642 -5.380 369 1HB LEU 44 2HB LEU 44 -0.894 0.086 -5.890 370 2HB LEU 44 1HB LEU 44 -1.843 0.983 -4.704 371 HG LEU 44 HG LEU 44 -2.232 -1.887 -4.419 372 1HD1 LEU 44 1HD1 LEU 44 0.292 -1.726 -3.296 373 2HD1 LEU 44 2HD1 LEU 44 0.499 -0.908 -4.844 374 3HD1 LEU 44 3HD1 LEU 44 -0.107 -2.562 -4.797 375 1HD2 LEU 44 1HD2 LEU 44 -1.553 -1.303 -2.071 376 2HD2 LEU 44 2HD2 LEU 44 -2.851 -0.288 -2.698 377 3HD2 LEU 44 3HD2 LEU 44 -1.202 0.332 -2.626 378 H GLN 45 H GLN 45 -4.620 1.460 -5.007 379 HA GLN 45 HA GLN 45 -4.347 3.417 -7.244 380 1HB GLN 45 2HB GLN 45 -7.047 3.145 -6.014 381 2HB GLN 45 1HB GLN 45 -6.603 3.535 -7.674 382 1HG GLN 45 2HG GLN 45 -5.861 1.098 -7.907 383 2HG GLN 45 1HG GLN 45 -6.665 0.806 -6.364 384 1HE2 GLN 45 1HE2 GLN 45 -7.187 1.139 -9.768 385 2HE2 GLN 45 2HE2 GLN 45 -8.883 1.118 -9.728 386 H LYS 46 H LYS 46 -4.069 5.484 -6.509 387 HA LYS 46 HA LYS 46 -4.265 5.948 -3.581 388 1HB LYS 46 2HB LYS 46 -2.479 6.827 -5.640 389 2HB LYS 46 1HB LYS 46 -3.286 8.249 -4.983 390 1HG LYS 46 2HG LYS 46 -2.614 6.544 -2.793 391 2HG LYS 46 1HG LYS 46 -1.179 6.709 -3.804 392 1HD LYS 46 2HD LYS 46 -0.937 8.598 -2.499 393 2HD LYS 46 1HD LYS 46 -1.913 9.274 -3.803 394 1HE LYS 46 2HE LYS 46 -3.844 9.331 -2.518 395 2HE LYS 46 1HE LYS 46 -3.316 8.008 -1.479 396 1HZ LYS 46 1HZ LYS 46 -2.216 10.767 -1.483 397 2HZ LYS 46 2HZ LYS 46 -1.664 9.493 -0.505 398 3HZ LYS 46 3HZ LYS 46 -3.237 10.102 -0.302 399 H GLY 47 H GLY 47 -6.558 6.162 -3.403 400 1HA GLY 47 2HA GLY 47 -8.487 7.498 -3.209 401 2HA GLY 47 1HA GLY 47 -7.579 8.831 -3.925 402 H GLY 48 H GLY 48 -7.491 8.997 -6.242 403 1HA GLY 48 2HA GLY 48 -9.412 7.249 -7.726 404 2HA GLY 48 1HA GLY 48 -9.490 9.003 -7.892 405 H SER 49 H SER 49 -6.686 6.784 -7.762 406 HA SER 49 HA SER 49 -6.036 7.365 -10.583 407 1HB SER 49 2HB SER 49 -4.928 8.939 -8.523 408 2HB SER 49 1HB SER 49 -3.659 7.808 -8.982 409 HG SER 49 HG SER 49 -3.723 9.750 -10.260 410 H VAL 50 H VAL 50 -4.913 5.663 -11.495 411 HA VAL 50 HA VAL 50 -4.475 3.286 -9.826 412 HB VAL 50 HB VAL 50 -3.879 3.683 -12.777 413 1HG1 VAL 50 1HG1 VAL 50 -3.549 1.396 -12.905 414 2HG1 VAL 50 2HG1 VAL 50 -4.591 1.061 -11.524 415 3HG1 VAL 50 3HG1 VAL 50 -2.960 1.680 -11.268 416 1HG2 VAL 50 1HG2 VAL 50 -6.091 2.472 -13.052 417 2HG2 VAL 50 2HG2 VAL 50 -6.228 4.114 -12.427 418 3HG2 VAL 50 3HG2 VAL 50 -6.374 2.740 -11.332 419 H LEU 51 H LEU 51 -2.543 2.689 -8.977 420 HA LEU 51 HA LEU 51 -0.181 4.377 -9.501 421 1HB LEU 51 2HB LEU 51 -0.379 2.002 -7.627 422 2HB LEU 51 1HB LEU 51 0.805 3.308 -7.585 423 HG LEU 51 HG LEU 51 -2.177 3.614 -7.105 424 1HD1 LEU 51 1HD1 LEU 51 0.190 3.251 -5.335 425 2HD1 LEU 51 2HD1 LEU 51 -1.486 2.759 -5.090 426 3HD1 LEU 51 3HD1 LEU 51 -1.013 4.437 -4.828 427 1HD2 LEU 51 1HD2 LEU 51 -0.255 5.765 -6.402 428 2HD2 LEU 51 2HD2 LEU 51 -1.885 5.884 -7.062 429 3HD2 LEU 51 3HD2 LEU 51 -0.530 5.521 -8.126 430 H LYS 52 H LYS 52 1.526 3.755 -10.743 431 HA LYS 52 HA LYS 52 1.553 0.939 -11.764 432 1HB LYS 52 2HB LYS 52 1.318 3.375 -13.206 433 2HB LYS 52 1HB LYS 52 2.941 2.761 -13.516 434 1HG LYS 52 2HG LYS 52 2.166 1.038 -14.763 435 2HG LYS 52 1HG LYS 52 0.909 0.651 -13.587 436 1HD LYS 52 2HD LYS 52 0.489 3.162 -15.105 437 2HD LYS 52 1HD LYS 52 0.388 1.679 -16.054 438 1HE LYS 52 2HE LYS 52 -1.387 0.824 -14.760 439 2HE LYS 52 1HE LYS 52 -1.057 1.923 -13.420 440 1HZ LYS 52 1HZ LYS 52 -2.182 2.615 -16.077 441 2HZ LYS 52 2HZ LYS 52 -1.668 3.771 -14.941 442 3HZ LYS 52 3HZ LYS 52 -2.956 2.726 -14.569 443 H ASP 53 H ASP 53 3.561 -0.084 -11.873 444 HA ASP 53 HA ASP 53 5.580 0.661 -10.012 445 1HB ASP 53 2HB ASP 53 6.932 -1.122 -11.039 446 2HB ASP 53 1HB ASP 53 5.264 -1.654 -10.831 447 H HIS 54 H HIS 54 5.128 1.547 -13.374 448 HA HIS 54 HA HIS 54 7.817 2.415 -13.922 449 1HB HIS 54 2HB HIS 54 5.163 3.236 -15.135 450 2HB HIS 54 1HB HIS 54 6.734 3.712 -15.778 451 HD1 HIS 54 HD1 HIS 54 8.374 1.600 -16.386 452 HD2 HIS 54 HD2 HIS 54 4.306 0.763 -16.040 453 HE1 HIS 54 HE1 HIS 54 8.004 -0.638 -17.514 454 H ILE 55 H ILE 55 5.283 3.812 -12.009 455 HA ILE 55 HA ILE 55 6.687 6.453 -12.039 456 HB ILE 55 HB ILE 55 3.850 5.747 -11.215 457 1HG1 ILE 55 2HG1 ILE 55 3.754 7.673 -13.185 458 2HG1 ILE 55 1HG1 ILE 55 5.130 6.697 -13.696 459 1HG2 ILE 55 1HG2 ILE 55 4.519 7.541 -9.799 460 2HG2 ILE 55 2HG2 ILE 55 3.674 8.313 -11.140 461 3HG2 ILE 55 3HG2 ILE 55 5.437 8.318 -11.089 462 1HD1 ILE 55 1HD1 ILE 55 3.518 5.396 -14.651 463 2HD1 ILE 55 2HD1 ILE 55 2.258 5.991 -13.573 464 3HD1 ILE 55 3HD1 ILE 55 3.369 4.738 -13.022 465 H SER 56 H SER 56 7.220 7.417 -10.014 466 HA SER 56 HA SER 56 7.704 5.463 -7.869 467 1HB SER 56 2HB SER 56 9.167 7.577 -8.803 468 2HB SER 56 1HB SER 56 8.402 8.290 -7.386 469 HG SER 56 HG SER 56 10.011 7.299 -6.422 470 H LEU 57 H LEU 57 7.060 5.843 -5.651 471 HA LEU 57 HA LEU 57 4.326 6.565 -5.298 472 1HB LEU 57 2HB LEU 57 6.627 6.186 -3.377 473 2HB LEU 57 1HB LEU 57 5.028 6.663 -2.804 474 HG LEU 57 HG LEU 57 5.336 4.298 -4.644 475 1HD1 LEU 57 1HD1 LEU 57 5.207 3.815 -1.712 476 2HD1 LEU 57 2HD1 LEU 57 6.762 4.352 -2.347 477 3HD1 LEU 57 3HD1 LEU 57 6.014 2.882 -2.972 478 1HD2 LEU 57 1HD2 LEU 57 3.370 3.834 -2.734 479 2HD2 LEU 57 2HD2 LEU 57 3.089 4.437 -4.367 480 3HD2 LEU 57 3HD2 LEU 57 3.246 5.569 -3.025 481 H GLU 58 H GLU 58 7.304 8.449 -4.961 482 HA GLU 58 HA GLU 58 6.254 10.728 -3.622 483 1HB GLU 58 2HB GLU 58 8.717 10.022 -4.547 484 2HB GLU 58 1HB GLU 58 8.264 11.238 -5.742 485 1HG GLU 58 2HG GLU 58 7.692 11.952 -2.920 486 2HG GLU 58 1HG GLU 58 9.400 11.841 -3.342 487 H ASP 59 H ASP 59 6.266 9.856 -7.074 488 HA ASP 59 HA ASP 59 5.264 12.347 -8.080 489 1HB ASP 59 2HB ASP 59 4.962 9.524 -9.149 490 2HB ASP 59 1HB ASP 59 4.527 10.976 -10.046 491 H TYR 60 H TYR 60 3.604 9.380 -6.986 492 HA TYR 60 HA TYR 60 0.941 10.402 -7.518 493 1HB TYR 60 2HB TYR 60 1.986 8.088 -5.873 494 2HB TYR 60 1HB TYR 60 0.267 8.462 -5.988 495 HD1 TYR 60 HD1 TYR 60 -0.559 8.927 -8.511 496 HD2 TYR 60 HD2 TYR 60 2.851 6.559 -7.402 497 HE1 TYR 60 HE1 TYR 60 -0.669 7.748 -10.689 498 HE2 TYR 60 HE2 TYR 60 2.740 5.380 -9.580 499 HH TYR 60 HH TYR 60 0.132 5.361 -11.531 500 H GLU 61 H GLU 61 3.221 10.918 -4.977 501 HA GLU 61 HA GLU 61 3.115 12.263 -3.077 502 1HB GLU 61 2HB GLU 61 1.122 13.304 -4.759 503 2HB GLU 61 1HB GLU 61 0.322 13.084 -3.204 504 1HG GLU 61 2HG GLU 61 1.265 15.240 -3.040 505 2HG GLU 61 1HG GLU 61 2.425 14.217 -2.192 506 H VAL 62 H VAL 62 3.104 9.893 -2.259 507 HA VAL 62 HA VAL 62 0.584 9.021 -1.021 508 HB VAL 62 HB VAL 62 2.234 7.383 -1.946 509 1HG1 VAL 62 1HG1 VAL 62 4.395 7.997 -1.497 510 2HG1 VAL 62 2HG1 VAL 62 4.140 6.981 -0.079 511 3HG1 VAL 62 3HG1 VAL 62 3.980 8.729 0.052 512 1HG2 VAL 62 1HG2 VAL 62 0.652 7.142 0.249 513 2HG2 VAL 62 2HG2 VAL 62 2.220 6.742 0.948 514 3HG2 VAL 62 3HG2 VAL 62 1.600 5.813 -0.415 515 H HIS 63 H HIS 63 0.105 9.144 1.189 516 HA HIS 63 HA HIS 63 1.952 10.864 2.801 517 1HB HIS 63 2HB HIS 63 -1.058 10.539 3.003 518 2HB HIS 63 1HB HIS 63 -0.073 11.558 4.053 519 HD1 HIS 63 HD1 HIS 63 1.375 13.464 2.712 520 HD2 HIS 63 HD2 HIS 63 -1.870 11.815 0.682 521 HE1 HIS 63 HE1 HIS 63 0.845 15.043 0.804 522 H ASP 64 H ASP 64 1.935 10.441 5.163 523 HA ASP 64 HA ASP 64 2.263 7.620 5.731 524 1HB ASP 64 2HB ASP 64 3.555 9.498 6.836 525 2HB ASP 64 1HB ASP 64 2.091 9.890 7.735 526 H GLN 65 H GLN 65 0.822 6.216 6.631 527 HA GLN 65 HA GLN 65 -1.183 5.358 7.467 528 1HB GLN 65 2HB GLN 65 -0.591 7.622 9.036 529 2HB GLN 65 1HB GLN 65 -2.298 7.777 8.621 530 1HG GLN 65 2HG GLN 65 -2.084 6.479 10.679 531 2HG GLN 65 1HG GLN 65 -2.662 5.430 9.385 532 1HE2 GLN 65 1HE2 GLN 65 0.486 6.476 10.836 533 2HE2 GLN 65 2HE2 GLN 65 1.226 4.957 10.675 534 H THR 66 H THR 66 -1.101 6.471 4.787 535 HA THR 66 HA THR 66 -3.696 7.832 4.423 536 HB THR 66 HB THR 66 -1.652 8.443 3.071 537 HG1 THR 66 HG1 THR 66 -3.237 9.129 1.901 538 1HG2 THR 66 1HG2 THR 66 -1.431 6.790 1.020 539 2HG2 THR 66 2HG2 THR 66 -2.022 5.605 2.183 540 3HG2 THR 66 3HG2 THR 66 -0.534 6.492 2.508 541 H ASN 67 H ASN 67 -5.323 6.907 2.918 542 HA ASN 67 HA ASN 67 -5.511 3.958 3.279 543 1HB ASN 67 2HB ASN 67 -7.484 6.175 2.949 544 2HB ASN 67 1HB ASN 67 -7.936 4.580 2.347 545 1HD2 ASN 67 1HD2 ASN 67 -8.215 2.848 3.914 546 2HD2 ASN 67 2HD2 ASN 67 -8.271 3.154 5.583 547 H LEU 68 H LEU 68 -4.794 2.791 1.586 548 HA LEU 68 HA LEU 68 -5.066 3.905 -1.174 549 1HB LEU 68 2HB LEU 68 -3.196 1.904 0.086 550 2HB LEU 68 1HB LEU 68 -3.437 1.926 -1.661 551 HG LEU 68 HG LEU 68 -2.937 4.567 -0.406 552 1HD1 LEU 68 1HD1 LEU 68 -0.792 2.430 -0.617 553 2HD1 LEU 68 2HD1 LEU 68 -1.362 3.195 0.866 554 3HD1 LEU 68 3HD1 LEU 68 -0.480 4.142 -0.331 555 1HD2 LEU 68 1HD2 LEU 68 -3.182 4.141 -2.868 556 2HD2 LEU 68 2HD2 LEU 68 -1.724 3.152 -2.802 557 3HD2 LEU 68 3HD2 LEU 68 -1.635 4.875 -2.445 558 H GLU 69 H GLU 69 -5.793 2.428 -2.868 559 HA GLU 69 HA GLU 69 -7.768 0.450 -1.841 560 1HB GLU 69 2HB GLU 69 -7.434 1.865 -4.496 561 2HB GLU 69 1HB GLU 69 -8.538 0.506 -4.292 562 1HG GLU 69 2HG GLU 69 -10.004 2.199 -3.769 563 2HG GLU 69 1HG GLU 69 -9.299 1.969 -2.169 564 H LEU 70 H LEU 70 -7.646 -1.723 -2.423 565 HA LEU 70 HA LEU 70 -5.181 -2.540 -3.900 566 1HB LEU 70 2HB LEU 70 -5.242 -3.174 -1.468 567 2HB LEU 70 1HB LEU 70 -6.683 -4.132 -1.798 568 HG LEU 70 HG LEU 70 -5.427 -5.514 -3.395 569 1HD1 LEU 70 1HD1 LEU 70 -3.850 -3.830 -4.215 570 2HD1 LEU 70 2HD1 LEU 70 -2.963 -5.218 -3.585 571 3HD1 LEU 70 3HD1 LEU 70 -3.086 -3.742 -2.627 572 1HD2 LEU 70 1HD2 LEU 70 -5.263 -5.648 -0.692 573 2HD2 LEU 70 2HD2 LEU 70 -3.553 -5.483 -1.090 574 3HD2 LEU 70 3HD2 LEU 70 -4.490 -6.817 -1.761 575 H TYR 71 H TYR 71 -5.469 -3.790 -5.673 576 HA TYR 71 HA TYR 71 -8.143 -5.033 -6.147 577 1HB TYR 71 2HB TYR 71 -6.750 -2.936 -7.698 578 2HB TYR 71 1HB TYR 71 -7.362 -4.278 -8.661 579 HD1 TYR 71 HD1 TYR 71 -8.233 -1.397 -6.590 580 HD2 TYR 71 HD2 TYR 71 -9.782 -4.833 -8.653 581 HE1 TYR 71 HE1 TYR 71 -10.520 -0.453 -6.444 582 HE2 TYR 71 HE2 TYR 71 -12.070 -3.889 -8.506 583 HH TYR 71 HH TYR 71 -12.858 -1.036 -8.164 584 H TYR 72 H TYR 72 -8.019 -7.057 -7.138 585 HA TYR 72 HA TYR 72 -5.261 -8.101 -7.588 586 1HB TYR 72 2HB TYR 72 -7.891 -9.548 -7.132 587 2HB TYR 72 1HB TYR 72 -6.349 -10.349 -7.430 588 HD1 TYR 72 HD1 TYR 72 -8.249 -10.375 -4.889 589 HD2 TYR 72 HD2 TYR 72 -4.619 -8.303 -5.888 590 HE1 TYR 72 HE1 TYR 72 -7.688 -10.190 -2.481 591 HE2 TYR 72 HE2 TYR 72 -4.061 -8.119 -3.482 592 HH TYR 72 HH TYR 72 -5.977 -8.270 -1.133 593 H LEU 73 HN LEU 73 -4.595 -8.437 -9.626 594 HA LEU 73 HA LEU 73 -4.607 -8.885 -11.919 595 1HB LEU 73 2HB LEU 73 -7.135 -10.042 -11.012 596 2HB LEU 73 1HB LEU 73 -7.238 -9.429 -12.661 597 HG LEU 73 HG LEU 73 -4.722 -10.785 -12.312 598 1HD1 LEU 73 1HD1 LEU 73 -7.109 -12.066 -11.095 599 2HD1 LEU 73 2HD1 LEU 73 -5.396 -12.334 -10.770 600 3HD1 LEU 73 3HD1 LEU 73 -6.154 -13.084 -12.174 601 1HD2 LEU 73 1HD2 LEU 73 -5.799 -12.240 -14.128 602 2HD2 LEU 73 2HD2 LEU 73 -5.679 -10.517 -14.483 603 3HD2 LEU 73 3HD2 LEU 73 -7.219 -11.205 -13.971 Start of MODEL 19 1 H MET 1 1H MET 1 11.418 5.484 5.995 2 HA MET 1 HA MET 1 9.381 4.654 4.929 3 1HB MET 1 2HB MET 1 10.996 3.432 6.854 4 2HB MET 1 1HB MET 1 9.353 3.043 7.362 5 1HG MET 1 2HG MET 1 8.852 1.943 5.348 6 2HG MET 1 1HG MET 1 10.157 2.748 4.477 7 1HE MET 1 1HE MET 1 12.411 0.315 3.965 8 2HE MET 1 2HE MET 1 11.013 1.234 3.411 9 3HE MET 1 3HE MET 1 10.830 -0.468 3.833 10 H ILE 2 H ILE 2 7.161 4.624 4.944 11 HA ILE 2 HA ILE 2 5.803 5.613 7.424 12 HB ILE 2 HB ILE 2 4.053 6.536 5.936 13 1HG1 ILE 2 2HG1 ILE 2 5.885 6.021 3.595 14 2HG1 ILE 2 1HG1 ILE 2 4.691 4.814 4.070 15 1HG2 ILE 2 1HG2 ILE 2 5.613 8.182 6.489 16 2HG2 ILE 2 2HG2 ILE 2 5.678 8.216 4.728 17 3HG2 ILE 2 3HG2 ILE 2 6.927 7.367 5.640 18 1HD1 ILE 2 1HD1 ILE 2 3.006 6.010 3.169 19 2HD1 ILE 2 2HD1 ILE 2 4.236 7.044 2.443 20 3HD1 ILE 2 3HD1 ILE 2 3.525 7.478 3.997 21 H GLU 3 H GLU 3 3.586 4.801 7.736 22 HA GLU 3 HA GLU 3 3.312 1.989 6.755 23 1HB GLU 3 2HB GLU 3 3.515 2.281 9.217 24 2HB GLU 3 1HB GLU 3 2.086 3.312 9.198 25 1HG GLU 3 2HG GLU 3 1.319 1.131 9.810 26 2HG GLU 3 1HG GLU 3 0.842 1.359 8.130 27 H VAL 4 H VAL 4 1.585 1.534 5.443 28 HA VAL 4 HA VAL 4 -0.706 3.449 5.420 29 HB VAL 4 HB VAL 4 -0.755 3.258 2.917 30 1HG1 VAL 4 1HG1 VAL 4 1.850 4.332 4.044 31 2HG1 VAL 4 2HG1 VAL 4 0.309 5.186 4.091 32 3HG1 VAL 4 3HG1 VAL 4 1.075 4.834 2.542 33 1HG2 VAL 4 1HG2 VAL 4 0.867 2.132 1.717 34 2HG2 VAL 4 2HG2 VAL 4 0.806 1.109 3.151 35 3HG2 VAL 4 3HG2 VAL 4 2.083 2.313 2.980 36 H VAL 5 H VAL 5 -2.669 2.518 4.413 37 HA VAL 5 HA VAL 5 -2.754 -0.461 4.711 38 HB VAL 5 HB VAL 5 -5.194 -0.117 5.286 39 1HG1 VAL 5 1HG1 VAL 5 -2.883 0.158 6.876 40 2HG1 VAL 5 2HG1 VAL 5 -4.507 -0.272 7.421 41 3HG1 VAL 5 3HG1 VAL 5 -3.990 1.417 7.425 42 1HG2 VAL 5 1HG2 VAL 5 -4.767 2.448 4.363 43 2HG2 VAL 5 2HG2 VAL 5 -4.718 2.672 6.112 44 3HG2 VAL 5 3HG2 VAL 5 -6.136 1.949 5.352 45 H VAL 6 H VAL 6 -3.893 -1.630 3.135 46 HA VAL 6 HA VAL 6 -4.876 -0.054 0.787 47 HB VAL 6 HB VAL 6 -3.681 -2.783 0.409 48 1HG1 VAL 6 1HG1 VAL 6 -3.250 -1.954 -1.803 49 2HG1 VAL 6 2HG1 VAL 6 -3.572 -0.292 -1.309 50 3HG1 VAL 6 3HG1 VAL 6 -4.890 -1.459 -1.388 51 1HG2 VAL 6 1HG2 VAL 6 -1.909 -1.731 1.642 52 2HG2 VAL 6 2HG2 VAL 6 -2.145 -0.199 0.801 53 3HG2 VAL 6 3HG2 VAL 6 -1.475 -1.585 -0.061 54 H ASN 7 H ASN 7 -7.041 -0.363 0.677 55 HA ASN 7 HA ASN 7 -8.203 -2.911 1.681 56 1HB ASN 7 2HB ASN 7 -9.264 -0.149 1.174 57 2HB ASN 7 1HB ASN 7 -10.385 -1.510 1.161 58 1HD2 ASN 7 1HD2 ASN 7 -7.797 -0.064 3.226 59 2HD2 ASN 7 2HD2 ASN 7 -8.504 -0.540 4.693 60 H ASP 8 H ASP 8 -8.950 -4.433 0.281 61 HA ASP 8 HA ASP 8 -8.601 -4.118 -2.568 62 1HB ASP 8 2HB ASP 8 -8.976 -6.274 -0.813 63 2HB ASP 8 1HB ASP 8 -10.395 -6.292 -1.859 64 H ARG 9 H ARG 9 -11.466 -4.157 -0.440 65 HA ARG 9 HA ARG 9 -12.940 -2.558 -2.424 66 1HB ARG 9 2HB ARG 9 -13.398 -5.432 -2.051 67 2HB ARG 9 1HB ARG 9 -14.856 -4.469 -1.813 68 1HG ARG 9 2HG ARG 9 -13.170 -3.735 -4.148 69 2HG ARG 9 1HG ARG 9 -14.014 -5.277 -4.255 70 1HD ARG 9 2HD ARG 9 -15.475 -3.590 -5.173 71 2HD ARG 9 1HD ARG 9 -16.135 -4.068 -3.610 72 HE ARG 9 HE ARG 9 -15.259 -1.958 -2.677 73 1HH1 ARG 9 2HH1 ARG 9 -17.089 -1.070 -4.849 74 2HH1 ARG 9 1HH1 ARG 9 -16.107 0.049 -5.733 75 1HH2 ARG 9 1HH2 ARG 9 -13.121 -1.062 -4.339 76 2HH2 ARG 9 2HH2 ARG 9 -13.852 0.055 -5.442 77 H LEU 10 H LEU 10 -13.679 -4.568 0.464 78 HA LEU 10 HA LEU 10 -14.067 -2.249 2.161 79 1HB LEU 10 2HB LEU 10 -16.228 -2.747 0.533 80 2HB LEU 10 1HB LEU 10 -16.642 -3.681 1.970 81 HG LEU 10 HG LEU 10 -15.555 -1.089 2.705 82 1HD1 LEU 10 1HD1 LEU 10 -16.804 -0.820 0.342 83 2HD1 LEU 10 2HD1 LEU 10 -16.932 0.396 1.613 84 3HD1 LEU 10 3HD1 LEU 10 -18.218 -0.792 1.395 85 1HD2 LEU 10 1HD2 LEU 10 -16.825 -2.389 4.271 86 2HD2 LEU 10 2HD2 LEU 10 -18.162 -2.571 3.134 87 3HD2 LEU 10 3HD2 LEU 10 -17.829 -0.997 3.859 88 H GLY 11 H GLY 11 -13.215 -3.076 3.999 89 1HA GLY 11 2HA GLY 11 -13.588 -4.464 5.995 90 2HA GLY 11 1HA GLY 11 -14.167 -5.749 4.936 91 H LYS 12 H LYS 12 -12.344 -6.240 3.124 92 HA LYS 12 HA LYS 12 -10.062 -7.261 4.619 93 1HB LYS 12 2HB LYS 12 -11.229 -8.356 2.594 94 2HB LYS 12 1HB LYS 12 -10.312 -7.220 1.605 95 1HG LYS 12 2HG LYS 12 -8.502 -8.370 3.488 96 2HG LYS 12 1HG LYS 12 -9.424 -9.688 2.766 97 1HD LYS 12 2HD LYS 12 -8.044 -9.538 0.988 98 2HD LYS 12 1HD LYS 12 -8.834 -8.007 0.612 99 1HE LYS 12 2HE LYS 12 -6.854 -7.690 2.724 100 2HE LYS 12 1HE LYS 12 -6.135 -8.361 1.261 101 1HZ LYS 12 1HZ LYS 12 -6.451 -5.784 1.591 102 2HZ LYS 12 2HZ LYS 12 -7.990 -6.122 0.960 103 3HZ LYS 12 3HZ LYS 12 -6.599 -6.506 0.064 104 H LYS 13 H LYS 13 -8.168 -6.209 4.966 105 HA LYS 13 HA LYS 13 -7.220 -4.183 3.011 106 1HB LYS 13 2HB LYS 13 -6.712 -2.588 4.871 107 2HB LYS 13 1HB LYS 13 -8.439 -2.848 4.640 108 1HG LYS 13 2HG LYS 13 -8.679 -3.970 6.631 109 2HG LYS 13 1HG LYS 13 -7.060 -4.665 6.555 110 1HD LYS 13 2HD LYS 13 -7.169 -1.715 6.830 111 2HD LYS 13 1HD LYS 13 -7.735 -2.632 8.226 112 1HE LYS 13 2HE LYS 13 -5.177 -3.473 6.913 113 2HE LYS 13 1HE LYS 13 -5.159 -2.049 7.951 114 1HZ LYS 13 1HZ LYS 13 -6.614 -4.193 9.140 115 2HZ LYS 13 2HZ LYS 13 -5.293 -3.316 9.751 116 3HZ LYS 13 3HZ LYS 13 -5.033 -4.669 8.758 117 H VAL 14 H VAL 14 -4.907 -3.754 3.193 118 HA VAL 14 HA VAL 14 -3.433 -5.767 4.854 119 HB VAL 14 HB VAL 14 -2.466 -4.790 2.162 120 1HG1 VAL 14 1HG1 VAL 14 -0.928 -6.575 2.315 121 2HG1 VAL 14 2HG1 VAL 14 -1.870 -7.399 3.557 122 3HG1 VAL 14 3HG1 VAL 14 -0.979 -5.929 3.954 123 1HG2 VAL 14 1HG2 VAL 14 -3.279 -7.183 1.465 124 2HG2 VAL 14 2HG2 VAL 14 -4.445 -5.861 1.500 125 3HG2 VAL 14 3HG2 VAL 14 -4.382 -7.016 2.831 126 H ARG 15 H ARG 15 -1.716 -4.985 6.018 127 HA ARG 15 HA ARG 15 -1.166 -2.063 5.848 128 1HB ARG 15 2HB ARG 15 -1.056 -4.116 7.998 129 2HB ARG 15 1HB ARG 15 0.204 -2.883 8.046 130 1HG ARG 15 2HG ARG 15 -2.428 -1.740 7.488 131 2HG ARG 15 1HG ARG 15 -2.390 -2.605 9.023 132 1HD ARG 15 2HD ARG 15 -0.081 -1.297 9.288 133 2HD ARG 15 1HD ARG 15 -0.866 -0.176 8.177 134 HE ARG 15 HE ARG 15 -2.349 -0.991 10.624 135 1HH1 ARG 15 2HH1 ARG 15 -0.050 0.903 11.176 136 2HH1 ARG 15 1HH1 ARG 15 -0.830 2.444 11.049 137 1HH2 ARG 15 1HH2 ARG 15 -3.637 1.186 9.423 138 2HH2 ARG 15 2HH2 ARG 15 -2.871 2.606 10.052 139 H VAL 16 H VAL 16 0.660 -1.436 4.799 140 HA VAL 16 HA VAL 16 3.057 -3.201 4.880 141 HB VAL 16 HB VAL 16 1.867 -3.680 2.759 142 1HG1 VAL 16 1HG1 VAL 16 1.255 -0.972 2.795 143 2HG1 VAL 16 2HG1 VAL 16 0.987 -2.070 1.442 144 3HG1 VAL 16 3HG1 VAL 16 2.457 -1.100 1.511 145 1HG2 VAL 16 1HG2 VAL 16 3.816 -2.832 1.218 146 2HG2 VAL 16 2HG2 VAL 16 4.176 -3.980 2.506 147 3HG2 VAL 16 3HG2 VAL 16 4.524 -2.266 2.730 148 H LYS 17 H LYS 17 4.963 -2.050 5.098 149 HA LYS 17 HA LYS 17 4.682 0.915 5.196 150 1HB LYS 17 2HB LYS 17 6.524 0.945 6.734 151 2HB LYS 17 1HB LYS 17 5.436 -0.336 7.259 152 1HG LYS 17 2HG LYS 17 6.930 -1.909 5.834 153 2HG LYS 17 1HG LYS 17 8.101 -0.591 5.868 154 1HD LYS 17 2HD LYS 17 8.768 -1.322 7.893 155 2HD LYS 17 1HD LYS 17 7.190 -0.850 8.521 156 1HE LYS 17 2HE LYS 17 7.459 -3.478 7.098 157 2HE LYS 17 1HE LYS 17 8.013 -3.348 8.768 158 1HZ LYS 17 1HZ LYS 17 5.297 -2.694 7.758 159 2HZ LYS 17 2HZ LYS 17 5.820 -2.467 9.360 160 3HZ LYS 17 3HZ LYS 17 5.720 -4.031 8.711 161 H CYS 18 H CYS 18 5.986 2.248 3.976 162 HA CYS 18 HA CYS 18 8.308 1.218 2.501 163 1HB CYS 18 2HB CYS 18 5.661 1.485 1.240 164 2HB CYS 18 1HB CYS 18 6.934 2.365 0.395 165 HG CYS 18 HG CYS 18 8.266 0.127 0.160 166 H LEU 19 H LEU 19 9.572 2.953 1.580 167 HA LEU 19 HA LEU 19 9.196 5.526 2.929 168 1HB LEU 19 2HB LEU 19 11.361 4.122 1.651 169 2HB LEU 19 1HB LEU 19 11.217 5.724 0.931 170 HG LEU 19 HG LEU 19 11.001 5.606 3.891 171 1HD1 LEU 19 1HD1 LEU 19 13.452 5.485 4.167 172 2HD1 LEU 19 2HD1 LEU 19 13.632 5.183 2.438 173 3HD1 LEU 19 3HD1 LEU 19 12.823 3.996 3.461 174 1HD2 LEU 19 1HD2 LEU 19 12.497 7.631 3.597 175 2HD2 LEU 19 2HD2 LEU 19 10.937 7.753 2.785 176 3HD2 LEU 19 3HD2 LEU 19 12.387 7.377 1.856 177 H ALA 20 H ALA 20 8.789 7.538 1.868 178 HA ALA 20 HA ALA 20 6.930 7.451 -0.316 179 1HB ALA 20 1HB ALA 20 7.605 9.330 1.551 180 2HB ALA 20 2HB ALA 20 6.623 9.663 0.124 181 3HB ALA 20 3HB ALA 20 8.353 10.007 0.104 182 H GLU 21 H GLU 21 10.407 7.564 -0.247 183 HA GLU 21 HA GLU 21 10.710 8.650 -2.943 184 1HB GLU 21 2HB GLU 21 13.094 8.042 -2.664 185 2HB GLU 21 1HB GLU 21 12.498 8.955 -1.280 186 1HG GLU 21 2HG GLU 21 13.308 7.278 0.003 187 2HG GLU 21 1HG GLU 21 11.957 6.315 -0.587 188 H ASP 22 H ASP 22 10.217 5.495 -1.525 189 HA ASP 22 HA ASP 22 11.300 3.889 -3.624 190 1HB ASP 22 2HB ASP 22 9.249 3.446 -1.476 191 2HB ASP 22 1HB ASP 22 9.438 2.238 -2.747 192 H SER 23 H SER 23 10.128 2.766 -5.341 193 HA SER 23 HA SER 23 8.049 4.494 -6.534 194 1HB SER 23 2HB SER 23 10.069 2.628 -7.537 195 2HB SER 23 1HB SER 23 8.502 2.420 -8.315 196 HG SER 23 HG SER 23 10.090 4.095 -9.131 197 H VAL 24 H VAL 24 6.217 3.321 -7.713 198 HA VAL 24 HA VAL 24 4.593 1.894 -5.861 199 HB VAL 24 HB VAL 24 4.409 1.930 -8.891 200 1HG1 VAL 24 1HG1 VAL 24 2.948 0.225 -8.295 201 2HG1 VAL 24 2HG1 VAL 24 1.887 1.626 -8.154 202 3HG1 VAL 24 3HG1 VAL 24 2.618 0.924 -6.710 203 1HG2 VAL 24 1HG2 VAL 24 4.351 4.141 -7.460 204 2HG2 VAL 24 2HG2 VAL 24 2.732 3.588 -7.031 205 3HG2 VAL 24 3HG2 VAL 24 3.145 3.883 -8.719 206 H GLY 25 H GLY 25 6.819 0.773 -8.388 207 1HA GLY 25 2HA GLY 25 6.148 -1.990 -8.394 208 2HA GLY 25 1HA GLY 25 7.749 -1.350 -8.768 209 H ASP 26 H ASP 26 8.568 -0.229 -6.418 210 HA ASP 26 HA ASP 26 9.349 -2.476 -4.816 211 1HB ASP 26 2HB ASP 26 10.570 -0.260 -4.977 212 2HB ASP 26 1HB ASP 26 9.317 0.431 -3.948 213 H PHE 27 H PHE 27 6.754 -0.079 -4.497 214 HA PHE 27 HA PHE 27 5.860 -0.745 -1.874 215 1HB PHE 27 2HB PHE 27 5.116 1.226 -3.302 216 2HB PHE 27 1HB PHE 27 4.096 0.097 -4.193 217 HD1 PHE 27 HD1 PHE 27 4.796 1.392 -0.754 218 HD2 PHE 27 HD2 PHE 27 1.983 -0.540 -3.362 219 HE1 PHE 27 HE1 PHE 27 3.049 1.573 0.993 220 HE2 PHE 27 HE2 PHE 27 0.239 -0.359 -1.613 221 HZ PHE 27 HZ PHE 27 0.770 0.698 0.562 222 H LYS 28 H LYS 28 4.875 -2.023 -5.068 223 HA LYS 28 HA LYS 28 3.013 -3.959 -3.997 224 1HB LYS 28 2HB LYS 28 4.393 -3.658 -6.671 225 2HB LYS 28 1HB LYS 28 3.321 -5.016 -6.325 226 1HG LYS 28 2HG LYS 28 1.496 -3.462 -5.791 227 2HG LYS 28 1HG LYS 28 2.562 -2.090 -6.089 228 1HD LYS 28 2HD LYS 28 2.818 -2.753 -8.427 229 2HD LYS 28 1HD LYS 28 1.845 -4.196 -8.149 230 1HE LYS 28 2HE LYS 28 -0.137 -2.995 -7.966 231 2HE LYS 28 1HE LYS 28 0.682 -1.521 -7.453 232 1HZ LYS 28 1HZ LYS 28 1.542 -1.241 -9.678 233 2HZ LYS 28 2HZ LYS 28 -0.153 -1.364 -9.728 234 3HZ LYS 28 3HZ LYS 28 0.809 -2.686 -10.182 235 H LYS 29 H LYS 29 6.478 -4.001 -4.703 236 HA LYS 29 HA LYS 29 6.882 -6.834 -4.577 237 1HB LYS 29 2HB LYS 29 8.699 -4.484 -4.002 238 2HB LYS 29 1HB LYS 29 9.253 -6.151 -3.884 239 1HG LYS 29 2HG LYS 29 7.971 -6.124 -6.332 240 2HG LYS 29 1HG LYS 29 8.721 -4.530 -6.273 241 1HD LYS 29 2HD LYS 29 10.624 -5.561 -6.933 242 2HD LYS 29 1HD LYS 29 10.711 -6.186 -5.287 243 1HE LYS 29 2HE LYS 29 8.951 -7.946 -6.428 244 2HE LYS 29 1HE LYS 29 10.003 -7.579 -7.793 245 1HZ LYS 29 1HZ LYS 29 11.063 -9.327 -6.728 246 2HZ LYS 29 2HZ LYS 29 10.713 -8.738 -5.174 247 3HZ LYS 29 3HZ LYS 29 11.887 -7.969 -6.131 248 H VAL 30 H VAL 30 6.907 -4.309 -2.045 249 HA VAL 30 HA VAL 30 7.632 -6.104 0.101 250 HB VAL 30 HB VAL 30 6.142 -3.458 0.251 251 1HG1 VAL 30 1HG1 VAL 30 7.886 -4.695 2.382 252 2HG1 VAL 30 2HG1 VAL 30 6.170 -5.087 2.276 253 3HG1 VAL 30 3HG1 VAL 30 6.679 -3.421 2.551 254 1HG2 VAL 30 1HG2 VAL 30 8.573 -3.708 -0.835 255 2HG2 VAL 30 2HG2 VAL 30 9.057 -3.761 0.860 256 3HG2 VAL 30 3HG2 VAL 30 8.183 -2.363 0.236 257 H LEU 31 H LEU 31 4.536 -5.045 -1.290 258 HA LEU 31 HA LEU 31 2.873 -6.270 0.735 259 1HB LEU 31 2HB LEU 31 2.443 -5.159 -2.012 260 2HB LEU 31 1HB LEU 31 1.197 -6.207 -1.336 261 HG LEU 31 HG LEU 31 2.289 -4.030 0.400 262 1HD1 LEU 31 1HD1 LEU 31 -0.039 -3.212 -1.183 263 2HD1 LEU 31 2HD1 LEU 31 1.418 -3.410 -2.158 264 3HD1 LEU 31 3HD1 LEU 31 1.420 -2.308 -0.782 265 1HD2 LEU 31 1HD2 LEU 31 -0.148 -4.009 1.083 266 2HD2 LEU 31 2HD2 LEU 31 0.669 -5.547 1.359 267 3HD2 LEU 31 3HD2 LEU 31 -0.405 -5.356 -0.026 268 H SER 32 H SER 32 3.794 -7.310 -2.570 269 HA SER 32 HA SER 32 2.495 -9.790 -2.652 270 1HB SER 32 2HB SER 32 4.290 -10.487 -4.243 271 2HB SER 32 1HB SER 32 3.626 -8.897 -4.601 272 HG SER 32 HG SER 32 5.874 -8.816 -4.663 273 H LEU 33 H LEU 33 5.254 -8.936 -0.678 274 HA LEU 33 HA LEU 33 6.193 -11.659 -0.278 275 1HB LEU 33 2HB LEU 33 6.694 -9.025 1.100 276 2HB LEU 33 1HB LEU 33 7.308 -10.530 1.781 277 HG LEU 33 HG LEU 33 7.786 -9.948 -1.123 278 1HD1 LEU 33 1HD1 LEU 33 8.429 -7.920 0.303 279 2HD1 LEU 33 2HD1 LEU 33 9.722 -8.633 -0.662 280 3HD1 LEU 33 3HD1 LEU 33 9.625 -8.965 1.068 281 1HD2 LEU 33 1HD2 LEU 33 10.049 -11.038 0.054 282 2HD2 LEU 33 2HD2 LEU 33 8.798 -11.951 -0.789 283 3HD2 LEU 33 3HD2 LEU 33 8.734 -11.781 0.966 284 H GLN 34 H GLN 34 4.078 -9.444 1.579 285 HA GLN 34 HA GLN 34 3.620 -11.470 3.646 286 1HB GLN 34 2HB GLN 34 2.136 -9.810 4.671 287 2HB GLN 34 1HB GLN 34 3.679 -9.079 4.238 288 1HG GLN 34 2HG GLN 34 2.645 -8.218 2.138 289 2HG GLN 34 1HG GLN 34 1.095 -8.878 2.660 290 1HE2 GLN 34 1HE2 GLN 34 3.109 -6.112 2.845 291 2HE2 GLN 34 2HE2 GLN 34 2.293 -5.316 4.101 292 H ILE 35 H ILE 35 1.802 -10.243 0.834 293 HA ILE 35 HA ILE 35 -0.501 -11.963 1.572 294 HB ILE 35 HB ILE 35 -1.338 -11.023 -0.766 295 1HG1 ILE 35 2HG1 ILE 35 0.580 -8.844 0.098 296 2HG1 ILE 35 1HG1 ILE 35 0.933 -9.968 -1.215 297 1HG2 ILE 35 1HG2 ILE 35 -1.919 -8.828 0.614 298 2HG2 ILE 35 2HG2 ILE 35 -1.249 -9.773 1.945 299 3HG2 ILE 35 3HG2 ILE 35 -2.628 -10.387 1.033 300 1HD1 ILE 35 1HD1 ILE 35 -1.604 -8.326 -1.152 301 2HD1 ILE 35 2HD1 ILE 35 -0.884 -9.165 -2.526 302 3HD1 ILE 35 3HD1 ILE 35 -0.116 -7.719 -1.876 303 H GLY 36 H GLY 36 2.207 -11.961 -0.662 304 1HA GLY 36 2HA GLY 36 3.011 -13.723 -2.007 305 2HA GLY 36 1HA GLY 36 1.758 -14.755 -1.315 306 H THR 37 H THR 37 1.375 -11.681 -3.051 307 HA THR 37 HA THR 37 -0.343 -13.104 -5.043 308 HB THR 37 HB THR 37 -0.404 -10.128 -4.578 309 HG1 THR 37 HG1 THR 37 -2.146 -10.669 -3.060 310 1HG2 THR 37 1HG2 THR 37 -2.637 -10.306 -5.399 311 2HG2 THR 37 2HG2 THR 37 -2.634 -12.060 -5.224 312 3HG2 THR 37 3HG2 THR 37 -1.642 -11.296 -6.465 313 H GLN 38 H GLN 38 2.673 -11.594 -4.704 314 HA GLN 38 HA GLN 38 4.304 -10.978 -6.255 315 1HB GLN 38 2HB GLN 38 2.366 -12.526 -7.921 316 2HB GLN 38 1HB GLN 38 3.524 -11.506 -8.771 317 1HG GLN 38 2HG GLN 38 4.843 -13.369 -8.575 318 2HG GLN 38 1HG GLN 38 5.191 -12.665 -6.996 319 1HE2 GLN 38 1HE2 GLN 38 4.475 -13.814 -5.134 320 2HE2 GLN 38 2HE2 GLN 38 3.596 -15.263 -5.211 321 HA PRO 39 HA PRO 39 3.092 -6.971 -7.577 322 1HB PRO 39 2HB PRO 39 5.099 -6.442 -9.388 323 2HB PRO 39 1HB PRO 39 5.322 -6.405 -7.630 324 1HG PRO 39 2HG PRO 39 6.189 -8.485 -9.594 325 2HG PRO 39 1HG PRO 39 6.917 -8.033 -8.042 326 1HD PRO 39 2HD PRO 39 5.307 -10.296 -8.479 327 2HD PRO 39 1HD PRO 39 5.681 -9.591 -6.891 328 H ASN 40 H ASN 40 3.315 -9.585 -9.854 329 HA ASN 40 HA ASN 40 2.256 -8.063 -12.125 330 1HB ASN 40 2HB ASN 40 2.806 -11.005 -11.666 331 2HB ASN 40 1HB ASN 40 2.109 -10.382 -13.162 332 1HD2 ASN 40 1HD2 ASN 40 5.060 -10.437 -11.184 333 2HD2 ASN 40 2HD2 ASN 40 6.074 -9.771 -12.371 334 H LYS 41 H LYS 41 0.940 -9.902 -9.441 335 HA LYS 41 HA LYS 41 -1.740 -9.896 -10.762 336 1HB LYS 41 2HB LYS 41 -0.388 -11.860 -9.233 337 2HB LYS 41 1HB LYS 41 -1.725 -11.284 -8.240 338 1HG LYS 41 2HG LYS 41 -2.310 -11.800 -11.117 339 2HG LYS 41 1HG LYS 41 -2.044 -13.209 -10.089 340 1HD LYS 41 2HD LYS 41 -3.690 -11.701 -8.503 341 2HD LYS 41 1HD LYS 41 -4.296 -11.296 -10.109 342 1HE LYS 41 2HE LYS 41 -4.003 -13.990 -10.360 343 2HE LYS 41 1HE LYS 41 -4.394 -13.870 -8.647 344 1HZ LYS 41 1HZ LYS 41 -6.308 -12.447 -9.315 345 2HZ LYS 41 2HZ LYS 41 -6.418 -14.062 -9.835 346 3HZ LYS 41 3HZ LYS 41 -5.977 -12.844 -10.934 347 H ILE 42 H ILE 42 -0.006 -7.889 -8.815 348 HA ILE 42 HA ILE 42 -2.318 -7.234 -7.049 349 HB ILE 42 HB ILE 42 0.623 -6.514 -6.883 350 1HG1 ILE 42 2HG1 ILE 42 -1.151 -7.885 -4.849 351 2HG1 ILE 42 1HG1 ILE 42 -0.291 -8.788 -6.095 352 1HG2 ILE 42 1HG2 ILE 42 -0.069 -4.606 -5.870 353 2HG2 ILE 42 2HG2 ILE 42 -0.590 -5.645 -4.545 354 3HG2 ILE 42 3HG2 ILE 42 -1.741 -5.159 -5.789 355 1HD1 ILE 42 1HD1 ILE 42 0.734 -7.599 -3.632 356 2HD1 ILE 42 2HD1 ILE 42 1.657 -7.093 -5.046 357 3HD1 ILE 42 3HD1 ILE 42 1.472 -8.808 -4.682 358 H VAL 43 H VAL 43 -3.448 -5.398 -7.388 359 HA VAL 43 HA VAL 43 -2.349 -3.359 -9.286 360 HB VAL 43 HB VAL 43 -5.240 -4.252 -8.982 361 1HG1 VAL 43 1HG1 VAL 43 -4.705 -1.791 -9.573 362 2HG1 VAL 43 2HG1 VAL 43 -5.794 -2.667 -10.650 363 3HG1 VAL 43 3HG1 VAL 43 -4.106 -2.429 -11.105 364 1HG2 VAL 43 1HG2 VAL 43 -5.015 -5.419 -11.004 365 2HG2 VAL 43 2HG2 VAL 43 -3.472 -5.749 -10.219 366 3HG2 VAL 43 3HG2 VAL 43 -3.574 -4.518 -11.477 367 H LEU 44 H LEU 44 -1.856 -1.620 -8.005 368 HA LEU 44 HA LEU 44 -3.579 -1.025 -5.655 369 1HB LEU 44 2HB LEU 44 -0.762 -0.712 -6.262 370 2HB LEU 44 1HB LEU 44 -1.462 0.824 -5.751 371 HG LEU 44 HG LEU 44 -2.541 -1.179 -4.047 372 1HD1 LEU 44 1HD1 LEU 44 0.461 -1.261 -3.905 373 2HD1 LEU 44 2HD1 LEU 44 -0.397 -2.381 -4.960 374 3HD1 LEU 44 3HD1 LEU 44 -0.714 -2.386 -3.225 375 1HD2 LEU 44 1HD2 LEU 44 -2.018 1.267 -3.610 376 2HD2 LEU 44 2HD2 LEU 44 -0.325 0.801 -3.447 377 3HD2 LEU 44 3HD2 LEU 44 -1.527 0.165 -2.323 378 H GLN 45 H GLN 45 -4.500 1.058 -5.350 379 HA GLN 45 HA GLN 45 -4.462 2.902 -7.694 380 1HB GLN 45 2HB GLN 45 -7.028 2.202 -6.245 381 2HB GLN 45 1HB GLN 45 -6.844 3.089 -7.756 382 1HG GLN 45 2HG GLN 45 -5.687 0.854 -8.570 383 2HG GLN 45 1HG GLN 45 -6.617 0.142 -7.251 384 1HE2 GLN 45 1HE2 GLN 45 -6.874 1.717 -10.409 385 2HE2 GLN 45 2HE2 GLN 45 -8.536 1.437 -10.612 386 H LYS 46 H LYS 46 -4.697 5.101 -7.118 387 HA LYS 46 HA LYS 46 -4.285 5.693 -4.250 388 1HB LYS 46 2HB LYS 46 -3.658 6.995 -6.798 389 2HB LYS 46 1HB LYS 46 -4.338 8.117 -5.621 390 1HG LYS 46 2HG LYS 46 -2.250 6.219 -4.645 391 2HG LYS 46 1HG LYS 46 -1.718 7.551 -5.672 392 1HD LYS 46 2HD LYS 46 -2.205 9.138 -4.103 393 2HD LYS 46 1HD LYS 46 -3.636 8.281 -3.534 394 1HE LYS 46 2HE LYS 46 -1.786 6.553 -2.669 395 2HE LYS 46 1HE LYS 46 -0.794 8.008 -2.665 396 1HZ LYS 46 1HZ LYS 46 -1.915 7.680 -0.547 397 2HZ LYS 46 2HZ LYS 46 -3.426 7.713 -1.321 398 3HZ LYS 46 3HZ LYS 46 -2.448 9.103 -1.301 399 H GLY 47 H GLY 47 -6.351 7.110 -6.826 400 1HA GLY 47 2HA GLY 47 -8.697 7.036 -5.039 401 2HA GLY 47 1HA GLY 47 -8.129 8.649 -5.476 402 H GLY 48 H GLY 48 -8.887 5.528 -7.055 403 1HA GLY 48 2HA GLY 48 -10.467 5.228 -8.837 404 2HA GLY 48 1HA GLY 48 -10.497 6.975 -9.077 405 H SER 49 H SER 49 -7.294 5.928 -8.746 406 HA SER 49 HA SER 49 -6.974 5.516 -11.683 407 1HB SER 49 2HB SER 49 -4.952 6.973 -11.609 408 2HB SER 49 1HB SER 49 -6.427 7.857 -11.234 409 HG SER 49 HG SER 49 -4.872 8.371 -9.710 410 H VAL 50 H VAL 50 -5.374 4.022 -12.227 411 HA VAL 50 HA VAL 50 -4.458 2.270 -10.074 412 HB VAL 50 HB VAL 50 -5.206 1.425 -12.314 413 1HG1 VAL 50 1HG1 VAL 50 -4.265 2.128 -14.242 414 2HG1 VAL 50 2HG1 VAL 50 -2.633 1.892 -13.617 415 3HG1 VAL 50 3HG1 VAL 50 -3.494 3.397 -13.291 416 1HG2 VAL 50 1HG2 VAL 50 -3.775 0.054 -10.836 417 2HG2 VAL 50 2HG2 VAL 50 -2.336 0.774 -11.560 418 3HG2 VAL 50 3HG2 VAL 50 -3.399 -0.243 -12.533 419 H LEU 51 H LEU 51 -2.341 2.001 -9.348 420 HA LEU 51 HA LEU 51 -0.498 4.243 -9.946 421 1HB LEU 51 2HB LEU 51 -0.126 2.030 -7.910 422 2HB LEU 51 1HB LEU 51 0.703 3.584 -7.966 423 HG LEU 51 HG LEU 51 -2.272 3.194 -7.499 424 1HD1 LEU 51 1HD1 LEU 51 -1.842 3.810 -5.218 425 2HD1 LEU 51 2HD1 LEU 51 -0.161 4.202 -5.578 426 3HD1 LEU 51 3HD1 LEU 51 -0.704 2.525 -5.620 427 1HD2 LEU 51 1HD2 LEU 51 -2.528 5.462 -7.613 428 2HD2 LEU 51 2HD2 LEU 51 -1.081 5.383 -8.617 429 3HD2 LEU 51 3HD2 LEU 51 -0.944 5.776 -6.905 430 H LYS 52 H LYS 52 1.083 3.985 -11.415 431 HA LYS 52 HA LYS 52 1.716 1.302 -12.458 432 1HB LYS 52 2HB LYS 52 1.752 3.962 -13.483 433 2HB LYS 52 1HB LYS 52 3.400 3.341 -13.571 434 1HG LYS 52 2HG LYS 52 2.507 1.273 -14.669 435 2HG LYS 52 1HG LYS 52 0.910 2.018 -14.681 436 1HD LYS 52 2HD LYS 52 3.244 3.500 -15.854 437 2HD LYS 52 1HD LYS 52 2.444 2.246 -16.799 438 1HE LYS 52 2HE LYS 52 0.911 3.794 -17.376 439 2HE LYS 52 1HE LYS 52 0.342 3.737 -15.710 440 1HZ LYS 52 1HZ LYS 52 2.555 5.486 -16.634 441 2HZ LYS 52 2HZ LYS 52 1.785 5.513 -15.120 442 3HZ LYS 52 3HZ LYS 52 0.941 5.994 -16.511 443 H ASP 53 H ASP 53 3.669 0.251 -12.202 444 HA ASP 53 HA ASP 53 5.257 0.747 -9.887 445 1HB ASP 53 2HB ASP 53 6.173 -0.783 -12.333 446 2HB ASP 53 1HB ASP 53 6.699 -1.009 -10.667 447 H HIS 54 H HIS 54 5.554 1.929 -13.182 448 HA HIS 54 HA HIS 54 8.299 2.806 -13.015 449 1HB HIS 54 2HB HIS 54 6.032 3.116 -14.877 450 2HB HIS 54 1HB HIS 54 7.132 4.492 -14.849 451 HD1 HIS 54 HD1 HIS 54 9.494 4.149 -15.778 452 HD2 HIS 54 HD2 HIS 54 7.250 0.642 -15.714 453 HE1 HIS 54 HE1 HIS 54 10.798 2.439 -17.116 454 H ILE 55 H ILE 55 5.299 4.142 -11.822 455 HA ILE 55 HA ILE 55 6.409 6.858 -11.528 456 HB ILE 55 HB ILE 55 3.825 5.745 -10.401 457 1HG1 ILE 55 2HG1 ILE 55 3.799 5.406 -12.811 458 2HG1 ILE 55 1HG1 ILE 55 2.773 6.787 -12.430 459 1HG2 ILE 55 1HG2 ILE 55 4.261 7.816 -9.358 460 2HG2 ILE 55 2HG2 ILE 55 3.231 8.257 -10.720 461 3HG2 ILE 55 3HG2 ILE 55 4.975 8.503 -10.817 462 1HD1 ILE 55 1HD1 ILE 55 5.225 6.682 -14.019 463 2HD1 ILE 55 2HD1 ILE 55 5.285 7.928 -12.772 464 3HD1 ILE 55 3HD1 ILE 55 3.981 7.930 -13.958 465 H SER 56 H SER 56 6.938 7.823 -9.535 466 HA SER 56 HA SER 56 7.788 5.947 -7.436 467 1HB SER 56 2HB SER 56 8.969 8.173 -8.375 468 2HB SER 56 1HB SER 56 8.051 8.886 -7.053 469 HG SER 56 HG SER 56 10.002 8.208 -6.231 470 H LEU 57 H LEU 57 7.088 6.116 -5.220 471 HA LEU 57 HA LEU 57 4.295 6.552 -4.833 472 1HB LEU 57 2HB LEU 57 6.576 6.402 -2.841 473 2HB LEU 57 1HB LEU 57 4.878 6.470 -2.368 474 HG LEU 57 HG LEU 57 5.962 4.378 -4.271 475 1HD1 LEU 57 1HD1 LEU 57 5.943 2.846 -2.318 476 2HD1 LEU 57 2HD1 LEU 57 5.568 4.210 -1.266 477 3HD1 LEU 57 3HD1 LEU 57 7.113 4.148 -2.114 478 1HD2 LEU 57 1HD2 LEU 57 3.868 3.404 -4.128 479 2HD2 LEU 57 2HD2 LEU 57 3.409 5.092 -3.909 480 3HD2 LEU 57 3HD2 LEU 57 3.569 4.034 -2.508 481 H GLU 58 H GLU 58 7.097 8.667 -4.336 482 HA GLU 58 HA GLU 58 5.740 10.784 -2.960 483 1HB GLU 58 2HB GLU 58 8.349 10.317 -4.052 484 2HB GLU 58 1HB GLU 58 7.779 11.879 -4.638 485 1HG GLU 58 2HG GLU 58 7.530 12.749 -2.470 486 2HG GLU 58 1HG GLU 58 7.482 11.147 -1.732 487 H ASP 59 H ASP 59 6.098 10.010 -6.408 488 HA ASP 59 HA ASP 59 5.041 12.480 -7.436 489 1HB ASP 59 2HB ASP 59 5.223 9.676 -8.557 490 2HB ASP 59 1HB ASP 59 4.476 10.989 -9.465 491 H TYR 60 H TYR 60 3.506 9.349 -6.652 492 HA TYR 60 HA TYR 60 0.835 10.214 -7.363 493 1HB TYR 60 2HB TYR 60 1.992 7.874 -5.872 494 2HB TYR 60 1HB TYR 60 0.254 8.166 -5.817 495 HD1 TYR 60 HD1 TYR 60 2.392 6.102 -7.351 496 HD2 TYR 60 HD2 TYR 60 -0.412 9.166 -8.454 497 HE1 TYR 60 HE1 TYR 60 2.144 5.073 -9.593 498 HE2 TYR 60 HE2 TYR 60 -0.656 8.137 -10.694 499 HH TYR 60 HH TYR 60 -0.308 5.635 -11.616 500 H GLU 61 H GLU 61 2.847 10.798 -4.632 501 HA GLU 61 HA GLU 61 2.476 12.133 -2.753 502 1HB GLU 61 2HB GLU 61 0.345 12.852 -4.460 503 2HB GLU 61 1HB GLU 61 -0.393 12.522 -2.894 504 1HG GLU 61 2HG GLU 61 0.215 14.791 -2.733 505 2HG GLU 61 1HG GLU 61 1.544 13.960 -1.924 506 H VAL 62 H VAL 62 2.867 9.870 -1.899 507 HA VAL 62 HA VAL 62 0.461 8.659 -0.632 508 HB VAL 62 HB VAL 62 3.325 7.661 -0.828 509 1HG1 VAL 62 1HG1 VAL 62 2.483 6.632 1.106 510 2HG1 VAL 62 2HG1 VAL 62 2.065 5.470 -0.154 511 3HG1 VAL 62 3HG1 VAL 62 0.839 6.571 0.473 512 1HG2 VAL 62 1HG2 VAL 62 1.812 7.775 -2.932 513 2HG2 VAL 62 2HG2 VAL 62 0.879 6.494 -2.159 514 3HG2 VAL 62 3HG2 VAL 62 2.576 6.231 -2.558 515 H HIS 63 H HIS 63 -0.016 9.535 1.324 516 HA HIS 63 HA HIS 63 2.151 10.691 2.986 517 1HB HIS 63 2HB HIS 63 -0.869 10.760 3.258 518 2HB HIS 63 1HB HIS 63 0.247 11.544 4.376 519 HD1 HIS 63 HD1 HIS 63 -1.035 11.745 0.843 520 HD2 HIS 63 HD2 HIS 63 1.483 13.894 3.375 521 HE1 HIS 63 HE1 HIS 63 -0.556 13.943 -0.321 522 H ASP 64 H ASP 64 1.975 10.267 5.411 523 HA ASP 64 HA ASP 64 2.179 7.425 5.906 524 1HB ASP 64 2HB ASP 64 3.469 9.222 7.130 525 2HB ASP 64 1HB ASP 64 1.974 9.645 7.963 526 H GLN 65 H GLN 65 0.694 6.039 6.802 527 HA GLN 65 HA GLN 65 -1.368 5.209 7.517 528 1HB GLN 65 2HB GLN 65 -0.924 7.644 8.998 529 2HB GLN 65 1HB GLN 65 -2.643 7.486 8.636 530 1HG GLN 65 2HG GLN 65 -2.570 6.204 10.547 531 2HG GLN 65 1HG GLN 65 -2.169 4.953 9.371 532 1HE2 GLN 65 1HE2 GLN 65 0.135 4.327 9.173 533 2HE2 GLN 65 2HE2 GLN 65 1.231 4.681 10.420 534 H THR 66 H THR 66 -1.105 6.333 4.842 535 HA THR 66 HA THR 66 -3.663 7.705 4.307 536 HB THR 66 HB THR 66 -1.491 8.257 3.101 537 HG1 THR 66 HG1 THR 66 -2.953 9.035 1.838 538 1HG2 THR 66 1HG2 THR 66 -1.259 5.562 2.770 539 2HG2 THR 66 2HG2 THR 66 -0.434 6.751 1.763 540 3HG2 THR 66 3HG2 THR 66 -1.943 6.027 1.213 541 H ASN 67 H ASN 67 -5.253 6.790 2.815 542 HA ASN 67 HA ASN 67 -5.431 3.833 3.083 543 1HB ASN 67 2HB ASN 67 -7.308 5.882 3.423 544 2HB ASN 67 1HB ASN 67 -7.748 5.133 1.887 545 1HD2 ASN 67 1HD2 ASN 67 -8.344 2.830 1.915 546 2HD2 ASN 67 2HD2 ASN 67 -8.742 2.050 3.368 547 H LEU 68 H LEU 68 -4.988 2.580 1.356 548 HA LEU 68 HA LEU 68 -5.058 3.819 -1.370 549 1HB LEU 68 2HB LEU 68 -3.261 1.696 -0.179 550 2HB LEU 68 1HB LEU 68 -3.396 1.941 -1.919 551 HG LEU 68 HG LEU 68 -2.958 4.409 -0.348 552 1HD1 LEU 68 1HD1 LEU 68 -0.993 2.126 -0.383 553 2HD1 LEU 68 2HD1 LEU 68 -1.434 3.185 0.956 554 3HD1 LEU 68 3HD1 LEU 68 -0.420 3.793 -0.353 555 1HD2 LEU 68 1HD2 LEU 68 -1.230 4.660 -2.229 556 2HD2 LEU 68 2HD2 LEU 68 -2.918 4.568 -2.729 557 3HD2 LEU 68 3HD2 LEU 68 -1.876 3.154 -2.880 558 H GLU 69 H GLU 69 -5.516 2.176 -3.137 559 HA GLU 69 HA GLU 69 -7.632 0.279 -2.209 560 1HB GLU 69 2HB GLU 69 -7.617 2.252 -4.241 561 2HB GLU 69 1HB GLU 69 -7.629 0.693 -5.064 562 1HG GLU 69 2HG GLU 69 -9.425 0.707 -2.768 563 2HG GLU 69 1HG GLU 69 -9.836 1.974 -3.923 564 H LEU 70 H LEU 70 -7.577 -1.877 -2.904 565 HA LEU 70 HA LEU 70 -5.122 -2.727 -4.394 566 1HB LEU 70 2HB LEU 70 -5.051 -3.271 -1.944 567 2HB LEU 70 1HB LEU 70 -6.503 -4.244 -2.158 568 HG LEU 70 HG LEU 70 -5.318 -5.690 -3.761 569 1HD1 LEU 70 1HD1 LEU 70 -3.612 -4.667 -4.867 570 2HD1 LEU 70 2HD1 LEU 70 -2.637 -5.159 -3.482 571 3HD1 LEU 70 3HD1 LEU 70 -3.316 -3.532 -3.550 572 1HD2 LEU 70 1HD2 LEU 70 -5.128 -6.584 -1.616 573 2HD2 LEU 70 2HD2 LEU 70 -4.188 -5.218 -1.019 574 3HD2 LEU 70 3HD2 LEU 70 -3.431 -6.421 -2.064 575 H TYR 71 H TYR 71 -5.388 -4.505 -5.818 576 HA TYR 71 HA TYR 71 -8.054 -5.715 -6.157 577 1HB TYR 71 2HB TYR 71 -6.986 -3.603 -7.925 578 2HB TYR 71 1HB TYR 71 -7.534 -5.049 -8.772 579 HD1 TYR 71 HD1 TYR 71 -8.584 -1.940 -7.674 580 HD2 TYR 71 HD2 TYR 71 -9.831 -6.053 -7.636 581 HE1 TYR 71 HE1 TYR 71 -10.938 -1.225 -7.368 582 HE2 TYR 71 HE2 TYR 71 -12.184 -5.336 -7.327 583 HH TYR 71 HH TYR 71 -13.484 -2.967 -7.988 584 H TYR 72 H TYR 72 -7.909 -7.738 -7.186 585 HA TYR 72 HA TYR 72 -5.126 -8.684 -7.668 586 1HB TYR 72 2HB TYR 72 -7.689 -10.240 -7.185 587 2HB TYR 72 1HB TYR 72 -6.100 -10.964 -7.438 588 HD1 TYR 72 HD1 TYR 72 -8.297 -10.411 -4.935 589 HD2 TYR 72 HD2 TYR 72 -4.248 -9.385 -5.941 590 HE1 TYR 72 HE1 TYR 72 -7.775 -10.108 -2.530 591 HE2 TYR 72 HE2 TYR 72 -3.725 -9.083 -3.537 592 HH TYR 72 HH TYR 72 -5.625 -8.494 -1.309 593 H LEU 73 HN LEU 73 -4.609 -8.353 -9.778 594 HA LEU 73 HA LEU 73 -6.330 -9.641 -11.828 595 1HB LEU 73 2HB LEU 73 -6.330 -6.875 -11.480 596 2HB LEU 73 1HB LEU 73 -5.177 -7.122 -12.789 597 HG LEU 73 HG LEU 73 -7.464 -6.829 -13.667 598 1HD1 LEU 73 1HD1 LEU 73 -7.507 -8.775 -15.111 599 2HD1 LEU 73 2HD1 LEU 73 -6.553 -9.705 -13.955 600 3HD1 LEU 73 3HD1 LEU 73 -5.823 -8.346 -14.809 601 1HD2 LEU 73 1HD2 LEU 73 -8.478 -7.904 -11.535 602 2HD2 LEU 73 2HD2 LEU 73 -8.200 -9.444 -12.350 603 3HD2 LEU 73 3HD2 LEU 73 -9.265 -8.240 -13.077 Start of MODEL 20 1 H MET 1 1H MET 1 10.917 5.958 7.072 2 HA MET 1 HA MET 1 9.682 4.686 4.688 3 1HB MET 1 2HB MET 1 11.313 3.578 6.714 4 2HB MET 1 1HB MET 1 9.658 3.127 7.126 5 1HG MET 1 2HG MET 1 9.350 1.924 5.161 6 2HG MET 1 1HG MET 1 10.561 2.855 4.281 7 1HE MET 1 1HE MET 1 11.662 -0.340 3.712 8 2HE MET 1 2HE MET 1 13.032 0.763 3.741 9 3HE MET 1 3HE MET 1 11.452 1.346 3.220 10 H ILE 2 H ILE 2 7.465 4.607 4.762 11 HA ILE 2 HA ILE 2 6.138 5.687 7.221 12 HB ILE 2 HB ILE 2 4.354 6.532 5.723 13 1HG1 ILE 2 2HG1 ILE 2 6.175 5.894 3.398 14 2HG1 ILE 2 1HG1 ILE 2 4.929 4.760 3.917 15 1HG2 ILE 2 1HG2 ILE 2 5.752 8.311 6.051 16 2HG2 ILE 2 2HG2 ILE 2 6.120 8.071 4.343 17 3HG2 ILE 2 3HG2 ILE 2 7.186 7.403 5.578 18 1HD1 ILE 2 1HD1 ILE 2 3.643 7.252 3.819 19 2HD1 ILE 2 2HD1 ILE 2 3.466 5.930 2.667 20 3HD1 ILE 2 3HD1 ILE 2 4.651 7.202 2.374 21 H GLU 3 H GLU 3 3.902 4.854 7.562 22 HA GLU 3 HA GLU 3 3.669 2.016 6.634 23 1HB GLU 3 2HB GLU 3 3.907 2.871 9.214 24 2HB GLU 3 1HB GLU 3 2.153 2.863 9.036 25 1HG GLU 3 2HG GLU 3 3.886 0.517 8.226 26 2HG GLU 3 1HG GLU 3 3.191 0.674 9.839 27 H VAL 4 H VAL 4 2.227 2.055 4.971 28 HA VAL 4 HA VAL 4 -0.257 3.690 5.290 29 HB VAL 4 HB VAL 4 -0.474 3.564 2.844 30 1HG1 VAL 4 1HG1 VAL 4 0.761 5.458 3.554 31 2HG1 VAL 4 2HG1 VAL 4 1.746 4.743 2.278 32 3HG1 VAL 4 3HG1 VAL 4 2.173 4.486 3.970 33 1HG2 VAL 4 1HG2 VAL 4 2.017 1.858 3.087 34 2HG2 VAL 4 2HG2 VAL 4 1.525 2.614 1.574 35 3HG2 VAL 4 3HG2 VAL 4 0.479 1.421 2.344 36 H VAL 5 H VAL 5 -2.255 2.650 4.302 37 HA VAL 5 HA VAL 5 -2.180 -0.323 4.648 38 HB VAL 5 HB VAL 5 -4.535 -0.100 5.566 39 1HG1 VAL 5 1HG1 VAL 5 -2.298 1.226 7.129 40 2HG1 VAL 5 2HG1 VAL 5 -2.572 -0.512 7.006 41 3HG1 VAL 5 3HG1 VAL 5 -3.753 0.511 7.823 42 1HG2 VAL 5 1HG2 VAL 5 -4.630 2.363 4.662 43 2HG2 VAL 5 2HG2 VAL 5 -3.809 2.762 6.171 44 3HG2 VAL 5 3HG2 VAL 5 -5.394 1.991 6.207 45 H VAL 6 H VAL 6 -3.529 -1.521 3.263 46 HA VAL 6 HA VAL 6 -4.812 0.037 1.053 47 HB VAL 6 HB VAL 6 -4.238 -2.151 -0.298 48 1HG1 VAL 6 1HG1 VAL 6 -3.355 0.249 -0.545 49 2HG1 VAL 6 2HG1 VAL 6 -2.346 -1.044 -1.190 50 3HG1 VAL 6 3HG1 VAL 6 -1.945 -0.302 0.359 51 1HG2 VAL 6 1HG2 VAL 6 -3.292 -3.181 1.895 52 2HG2 VAL 6 2HG2 VAL 6 -1.892 -2.149 1.602 53 3HG2 VAL 6 3HG2 VAL 6 -2.347 -3.374 0.418 54 H ASN 7 H ASN 7 -6.854 -0.611 0.448 55 HA ASN 7 HA ASN 7 -7.971 -3.047 1.776 56 1HB ASN 7 2HB ASN 7 -10.162 -1.783 1.883 57 2HB ASN 7 1HB ASN 7 -8.903 -1.162 2.947 58 1HD2 ASN 7 1HD2 ASN 7 -7.944 0.928 2.421 59 2HD2 ASN 7 2HD2 ASN 7 -8.630 1.952 1.252 60 H ASP 8 H ASP 8 -9.195 -4.382 0.455 61 HA ASP 8 HA ASP 8 -9.029 -3.913 -2.419 62 1HB ASP 8 2HB ASP 8 -9.983 -6.147 -0.664 63 2HB ASP 8 1HB ASP 8 -10.522 -6.108 -2.343 64 H ARG 9 H ARG 9 -11.978 -5.049 -0.749 65 HA ARG 9 HA ARG 9 -13.552 -2.704 -1.231 66 1HB ARG 9 2HB ARG 9 -12.996 -4.014 -3.594 67 2HB ARG 9 1HB ARG 9 -14.553 -4.706 -3.140 68 1HG ARG 9 2HG ARG 9 -15.662 -2.756 -3.483 69 2HG ARG 9 1HG ARG 9 -14.378 -1.788 -2.760 70 1HD ARG 9 2HD ARG 9 -13.031 -2.255 -4.887 71 2HD ARG 9 1HD ARG 9 -14.537 -2.853 -5.584 72 HE ARG 9 HE ARG 9 -15.480 -0.545 -5.091 73 1HH1 ARG 9 2HH1 ARG 9 -13.105 0.452 -3.547 74 2HH1 ARG 9 1HH1 ARG 9 -12.272 1.395 -4.739 75 1HH2 ARG 9 1HH2 ARG 9 -13.985 -0.009 -7.421 76 2HH2 ARG 9 2HH2 ARG 9 -12.774 1.132 -6.942 77 H LEU 10 H LEU 10 -13.926 -6.277 -1.476 78 HA LEU 10 HA LEU 10 -16.490 -6.312 -0.175 79 1HB LEU 10 2HB LEU 10 -14.572 -8.263 -1.194 80 2HB LEU 10 1HB LEU 10 -15.331 -8.809 0.301 81 HG LEU 10 HG LEU 10 -17.272 -7.572 -1.484 82 1HD1 LEU 10 1HD1 LEU 10 -16.918 -10.026 -2.790 83 2HD1 LEU 10 2HD1 LEU 10 -15.295 -9.342 -2.683 84 3HD1 LEU 10 3HD1 LEU 10 -16.589 -8.427 -3.456 85 1HD2 LEU 10 1HD2 LEU 10 -17.416 -9.260 0.559 86 2HD2 LEU 10 2HD2 LEU 10 -17.246 -10.469 -0.713 87 3HD2 LEU 10 3HD2 LEU 10 -18.595 -9.334 -0.751 88 H GLY 11 H GLY 11 -13.331 -7.455 1.114 89 1HA GLY 11 2HA GLY 11 -13.609 -6.053 3.610 90 2HA GLY 11 1HA GLY 11 -14.133 -7.725 3.802 91 H LYS 12 H LYS 12 -11.450 -6.124 2.041 92 HA LYS 12 HA LYS 12 -9.573 -8.003 3.427 93 1HB LYS 12 2HB LYS 12 -10.128 -7.819 0.651 94 2HB LYS 12 1HB LYS 12 -8.538 -7.099 0.890 95 1HG LYS 12 2HG LYS 12 -7.678 -9.069 1.909 96 2HG LYS 12 1HG LYS 12 -9.291 -9.754 2.115 97 1HD LYS 12 2HD LYS 12 -8.546 -9.073 -0.672 98 2HD LYS 12 1HD LYS 12 -7.643 -10.403 0.051 99 1HE LYS 12 2HE LYS 12 -9.418 -11.675 -0.585 100 2HE LYS 12 1HE LYS 12 -10.198 -10.998 0.844 101 1HZ LYS 12 1HZ LYS 12 -10.288 -9.474 -1.663 102 2HZ LYS 12 2HZ LYS 12 -11.414 -9.534 -0.390 103 3HZ LYS 12 3HZ LYS 12 -11.308 -10.819 -1.497 104 H LYS 13 H LYS 13 -8.529 -6.691 4.879 105 HA LYS 13 HA LYS 13 -7.482 -4.067 3.872 106 1HB LYS 13 2HB LYS 13 -9.135 -4.621 6.131 107 2HB LYS 13 1HB LYS 13 -7.549 -4.153 6.745 108 1HG LYS 13 2HG LYS 13 -7.889 -2.321 4.746 109 2HG LYS 13 1HG LYS 13 -9.553 -2.544 5.281 110 1HD LYS 13 2HD LYS 13 -8.962 -1.999 7.564 111 2HD LYS 13 1HD LYS 13 -7.246 -1.968 7.157 112 1HE LYS 13 2HE LYS 13 -9.288 -0.129 5.885 113 2HE LYS 13 1HE LYS 13 -8.335 0.316 7.298 114 1HZ LYS 13 1HZ LYS 13 -7.111 1.118 5.513 115 2HZ LYS 13 2HZ LYS 13 -7.397 -0.257 4.558 116 3HZ LYS 13 3HZ LYS 13 -6.342 -0.345 5.886 117 H VAL 14 H VAL 14 -5.305 -4.161 3.610 118 HA VAL 14 HA VAL 14 -3.714 -5.799 5.551 119 HB VAL 14 HB VAL 14 -2.166 -5.586 3.214 120 1HG1 VAL 14 1HG1 VAL 14 -2.157 -7.923 3.321 121 2HG1 VAL 14 2HG1 VAL 14 -3.833 -8.005 3.864 122 3HG1 VAL 14 3HG1 VAL 14 -2.571 -7.465 4.973 123 1HG2 VAL 14 1HG2 VAL 14 -4.169 -4.983 1.919 124 2HG2 VAL 14 2HG2 VAL 14 -5.026 -6.387 2.556 125 3HG2 VAL 14 3HG2 VAL 14 -3.639 -6.610 1.489 126 H ARG 15 H ARG 15 -1.606 -4.956 6.068 127 HA ARG 15 HA ARG 15 -1.335 -2.025 5.529 128 1HB ARG 15 2HB ARG 15 -0.036 -1.933 7.645 129 2HB ARG 15 1HB ARG 15 -1.676 -2.520 7.905 130 1HG ARG 15 2HG ARG 15 -0.877 -4.425 8.796 131 2HG ARG 15 1HG ARG 15 0.014 -4.768 7.313 132 1HD ARG 15 2HD ARG 15 1.127 -2.720 9.192 133 2HD ARG 15 1HD ARG 15 1.289 -4.421 9.621 134 HE ARG 15 HE ARG 15 2.142 -4.206 6.946 135 1HH1 ARG 15 1HH2 ARG 15 3.878 -5.278 9.116 136 2HH1 ARG 15 2HH2 ARG 15 5.163 -4.119 9.179 137 1HH2 ARG 15 2HH1 ARG 15 3.404 -1.687 7.414 138 2HH2 ARG 15 1HH1 ARG 15 4.891 -2.072 8.213 139 H VAL 16 H VAL 16 0.785 -1.214 5.042 140 HA VAL 16 HA VAL 16 2.994 -3.127 4.685 141 HB VAL 16 HB VAL 16 1.695 -3.392 2.597 142 1HG1 VAL 16 1HG1 VAL 16 1.338 -1.545 1.087 143 2HG1 VAL 16 2HG1 VAL 16 2.272 -0.456 2.112 144 3HG1 VAL 16 3HG1 VAL 16 0.713 -1.067 2.664 145 1HG2 VAL 16 1HG2 VAL 16 4.188 -3.527 2.562 146 2HG2 VAL 16 2HG2 VAL 16 4.252 -1.811 2.161 147 3HG2 VAL 16 3HG2 VAL 16 3.526 -2.954 1.032 148 H LYS 17 H LYS 17 4.976 -2.102 4.838 149 HA LYS 17 HA LYS 17 4.900 0.870 5.138 150 1HB LYS 17 2HB LYS 17 7.067 0.539 6.402 151 2HB LYS 17 1HB LYS 17 5.650 -0.174 7.169 152 1HG LYS 17 2HG LYS 17 6.408 -2.304 6.881 153 2HG LYS 17 1HG LYS 17 7.066 -1.959 5.283 154 1HD LYS 17 2HD LYS 17 8.858 -0.576 6.555 155 2HD LYS 17 1HD LYS 17 8.331 -1.483 7.974 156 1HE LYS 17 2HE LYS 17 10.043 -2.845 7.151 157 2HE LYS 17 1HE LYS 17 8.617 -3.571 6.408 158 1HZ LYS 17 1HZ LYS 17 9.917 -3.318 4.581 159 2HZ LYS 17 2HZ LYS 17 10.738 -1.964 5.195 160 3HZ LYS 17 3HZ LYS 17 9.170 -1.796 4.563 161 H CYS 18 H CYS 18 6.143 2.139 3.832 162 HA CYS 18 HA CYS 18 8.439 1.082 2.348 163 1HB CYS 18 2HB CYS 18 7.491 1.662 0.111 164 2HB CYS 18 1HB CYS 18 6.630 0.329 0.881 165 HG CYS 18 HG CYS 18 4.627 1.841 1.310 166 H LEU 19 H LEU 19 9.577 2.856 1.182 167 HA LEU 19 HA LEU 19 9.274 5.401 2.617 168 1HB LEU 19 2HB LEU 19 11.396 4.029 1.284 169 2HB LEU 19 1HB LEU 19 11.188 5.592 0.496 170 HG LEU 19 HG LEU 19 11.190 5.461 3.494 171 1HD1 LEU 19 1HD1 LEU 19 13.725 5.703 1.861 172 2HD1 LEU 19 2HD1 LEU 19 13.192 4.173 2.559 173 3HD1 LEU 19 3HD1 LEU 19 13.573 5.536 3.610 174 1HD2 LEU 19 1HD2 LEU 19 11.069 7.688 3.158 175 2HD2 LEU 19 2HD2 LEU 19 11.230 7.467 1.417 176 3HD2 LEU 19 3HD2 LEU 19 12.670 7.630 2.421 177 H ALA 20 H ALA 20 8.727 7.396 1.651 178 HA ALA 20 HA ALA 20 6.816 7.327 -0.491 179 1HB ALA 20 1HB ALA 20 6.467 9.534 0.002 180 2HB ALA 20 2HB ALA 20 8.191 9.901 0.058 181 3HB ALA 20 3HB ALA 20 7.406 9.137 1.441 182 H GLU 21 H GLU 21 10.287 7.565 -0.479 183 HA GLU 21 HA GLU 21 10.489 8.751 -3.149 184 1HB GLU 21 2HB GLU 21 12.904 8.286 -2.918 185 2HB GLU 21 1HB GLU 21 12.280 9.107 -1.489 186 1HG GLU 21 2HG GLU 21 13.207 7.431 -0.286 187 2HG GLU 21 1HG GLU 21 11.905 6.413 -0.899 188 H ASP 22 H ASP 22 10.115 5.558 -1.819 189 HA ASP 22 HA ASP 22 11.267 4.053 -3.975 190 1HB ASP 22 2HB ASP 22 9.369 3.473 -1.737 191 2HB ASP 22 1HB ASP 22 9.454 2.319 -3.067 192 H SER 23 H SER 23 10.023 2.804 -5.601 193 HA SER 23 HA SER 23 7.886 4.481 -6.773 194 1HB SER 23 2HB SER 23 9.895 2.609 -7.786 195 2HB SER 23 1HB SER 23 8.307 2.353 -8.500 196 HG SER 23 HG SER 23 9.211 3.924 -9.716 197 H VAL 24 H VAL 24 6.063 3.193 -7.895 198 HA VAL 24 HA VAL 24 4.510 1.822 -5.928 199 HB VAL 24 HB VAL 24 4.227 1.759 -8.952 200 1HG1 VAL 24 1HG1 VAL 24 2.072 0.902 -8.660 201 2HG1 VAL 24 2HG1 VAL 24 1.986 1.422 -6.977 202 3HG1 VAL 24 3HG1 VAL 24 2.975 0.033 -7.422 203 1HG2 VAL 24 1HG2 VAL 24 4.221 4.038 -7.814 204 2HG2 VAL 24 2HG2 VAL 24 2.781 3.509 -6.945 205 3HG2 VAL 24 3HG2 VAL 24 2.751 3.641 -8.703 206 H GLY 25 H GLY 25 6.775 0.665 -8.383 207 1HA GLY 25 2HA GLY 25 6.122 -2.105 -8.368 208 2HA GLY 25 1HA GLY 25 7.731 -1.458 -8.700 209 H ASP 26 H ASP 26 8.284 -0.206 -6.249 210 HA ASP 26 HA ASP 26 9.147 -2.420 -4.618 211 1HB ASP 26 2HB ASP 26 8.916 0.530 -3.915 212 2HB ASP 26 1HB ASP 26 9.815 -0.672 -2.989 213 H PHE 27 H PHE 27 6.398 -0.191 -4.476 214 HA PHE 27 HA PHE 27 5.362 -0.869 -1.913 215 1HB PHE 27 2HB PHE 27 4.610 0.976 -3.573 216 2HB PHE 27 1HB PHE 27 3.638 -0.284 -4.329 217 HD1 PHE 27 HD1 PHE 27 2.188 -1.739 -2.615 218 HD2 PHE 27 HD2 PHE 27 3.647 2.232 -1.870 219 HE1 PHE 27 HE1 PHE 27 0.426 -1.413 -0.903 220 HE2 PHE 27 HE2 PHE 27 1.886 2.557 -0.159 221 HZ PHE 27 HZ PHE 27 0.274 0.735 0.325 222 H LYS 28 H LYS 28 4.639 -2.252 -5.136 223 HA LYS 28 HA LYS 28 2.859 -4.296 -4.170 224 1HB LYS 28 2HB LYS 28 4.506 -4.162 -6.716 225 2HB LYS 28 1HB LYS 28 3.226 -5.334 -6.410 226 1HG LYS 28 2HG LYS 28 1.540 -3.699 -6.455 227 2HG LYS 28 1HG LYS 28 2.677 -2.385 -6.153 228 1HD LYS 28 2HD LYS 28 3.590 -2.555 -8.374 229 2HD LYS 28 1HD LYS 28 2.708 -4.051 -8.682 230 1HE LYS 28 2HE LYS 28 0.612 -2.932 -8.757 231 2HE LYS 28 1HE LYS 28 1.274 -1.475 -8.016 232 1HZ LYS 28 1HZ LYS 28 1.790 -2.516 -10.742 233 2HZ LYS 28 2HZ LYS 28 2.730 -1.293 -10.031 234 3HZ LYS 28 3HZ LYS 28 1.073 -1.041 -10.311 235 H LYS 29 H LYS 29 6.363 -4.106 -4.466 236 HA LYS 29 HA LYS 29 6.898 -6.937 -4.280 237 1HB LYS 29 2HB LYS 29 8.519 -4.441 -3.831 238 2HB LYS 29 1HB LYS 29 9.177 -6.010 -3.372 239 1HG LYS 29 2HG LYS 29 7.948 -5.832 -6.077 240 2HG LYS 29 1HG LYS 29 9.474 -4.981 -5.848 241 1HD LYS 29 2HD LYS 29 9.772 -7.503 -4.589 242 2HD LYS 29 1HD LYS 29 9.027 -7.811 -6.158 243 1HE LYS 29 2HE LYS 29 10.887 -6.018 -6.924 244 2HE LYS 29 1HE LYS 29 11.717 -6.692 -5.522 245 1HZ LYS 29 1HZ LYS 29 10.514 -8.393 -7.630 246 2HZ LYS 29 2HZ LYS 29 11.625 -8.842 -6.429 247 3HZ LYS 29 3HZ LYS 29 12.114 -7.843 -7.711 248 H VAL 30 H VAL 30 6.822 -4.331 -1.814 249 HA VAL 30 HA VAL 30 7.374 -6.149 0.384 250 HB VAL 30 HB VAL 30 6.100 -3.395 0.503 251 1HG1 VAL 30 1HG1 VAL 30 7.206 -5.326 2.499 252 2HG1 VAL 30 2HG1 VAL 30 5.853 -4.207 2.652 253 3HG1 VAL 30 3HG1 VAL 30 7.508 -3.609 2.768 254 1HG2 VAL 30 1HG2 VAL 30 9.018 -4.239 0.576 255 2HG2 VAL 30 2HG2 VAL 30 8.433 -2.617 0.950 256 3HG2 VAL 30 3HG2 VAL 30 8.243 -3.268 -0.676 257 H LEU 31 H LEU 31 4.435 -4.854 -1.115 258 HA LEU 31 HA LEU 31 2.623 -5.852 0.905 259 1HB LEU 31 2HB LEU 31 2.093 -4.021 -0.747 260 2HB LEU 31 1HB LEU 31 2.011 -5.255 -2.004 261 HG LEU 31 HG LEU 31 0.270 -6.440 -0.602 262 1HD1 LEU 31 1HD1 LEU 31 -0.841 -5.116 1.160 263 2HD1 LEU 31 2HD1 LEU 31 0.335 -3.822 0.934 264 3HD1 LEU 31 3HD1 LEU 31 0.856 -5.388 1.557 265 1HD2 LEU 31 1HD2 LEU 31 -0.220 -4.851 -2.526 266 2HD2 LEU 31 2HD2 LEU 31 -0.494 -3.596 -1.318 267 3HD2 LEU 31 3HD2 LEU 31 -1.526 -5.025 -1.354 268 H SER 32 H SER 32 3.681 -7.098 -2.273 269 HA SER 32 HA SER 32 2.066 -9.404 -2.424 270 1HB SER 32 2HB SER 32 3.810 -10.336 -3.897 271 2HB SER 32 1HB SER 32 3.495 -8.647 -4.277 272 HG SER 32 HG SER 32 5.735 -9.102 -4.137 273 H LEU 33 H LEU 33 4.917 -8.846 -0.424 274 HA LEU 33 HA LEU 33 5.433 -11.625 0.176 275 1HB LEU 33 2HB LEU 33 6.428 -9.014 1.037 276 2HB LEU 33 1HB LEU 33 6.316 -10.155 2.376 277 HG LEU 33 HG LEU 33 8.521 -10.279 1.256 278 1HD1 LEU 33 1HD1 LEU 33 8.633 -12.645 1.151 279 2HD1 LEU 33 2HD1 LEU 33 6.968 -12.781 0.587 280 3HD1 LEU 33 3HD1 LEU 33 7.299 -12.312 2.254 281 1HD2 LEU 33 1HD2 LEU 33 8.675 -11.116 -1.047 282 2HD2 LEU 33 2HD2 LEU 33 7.733 -9.625 -1.009 283 3HD2 LEU 33 3HD2 LEU 33 6.915 -11.181 -1.159 284 H GLN 34 H GLN 34 3.345 -9.151 1.622 285 HA GLN 34 HA GLN 34 2.636 -10.851 3.903 286 1HB GLN 34 2HB GLN 34 1.622 -8.180 2.909 287 2HB GLN 34 1HB GLN 34 0.946 -8.994 4.321 288 1HG GLN 34 2HG GLN 34 2.940 -8.809 5.544 289 2HG GLN 34 1HG GLN 34 3.918 -8.573 4.097 290 1HE2 GLN 34 1HE2 GLN 34 3.221 -6.445 2.813 291 2HE2 GLN 34 2HE2 GLN 34 2.935 -5.081 3.781 292 H ILE 35 H ILE 35 0.841 -9.593 1.044 293 HA ILE 35 HA ILE 35 -1.445 -11.316 1.622 294 HB ILE 35 HB ILE 35 -2.203 -10.573 -0.712 295 1HG1 ILE 35 2HG1 ILE 35 0.170 -8.708 -0.404 296 2HG1 ILE 35 1HG1 ILE 35 0.086 -10.032 -1.562 297 1HG2 ILE 35 1HG2 ILE 35 -3.226 -8.842 0.316 298 2HG2 ILE 35 2HG2 ILE 35 -1.699 -8.072 0.744 299 3HG2 ILE 35 3HG2 ILE 35 -2.346 -9.367 1.751 300 1HD1 ILE 35 1HD1 ILE 35 -1.336 -8.896 -2.941 301 2HD1 ILE 35 2HD1 ILE 35 -0.693 -7.478 -2.116 302 3HD1 ILE 35 3HD1 ILE 35 -2.225 -8.180 -1.597 303 H GLY 36 H GLY 36 1.500 -11.696 -0.206 304 1HA GLY 36 2HA GLY 36 2.332 -13.592 -1.326 305 2HA GLY 36 1HA GLY 36 0.954 -14.495 -0.693 306 H THR 37 H THR 37 0.889 -11.567 -2.694 307 HA THR 37 HA THR 37 -0.633 -13.104 -4.759 308 HB THR 37 HB THR 37 -0.726 -10.107 -4.516 309 HG1 THR 37 HG1 THR 37 -2.229 -11.959 -2.977 310 1HG2 THR 37 1HG2 THR 37 -1.818 -11.652 -6.342 311 2HG2 THR 37 2HG2 THR 37 -2.728 -10.300 -5.670 312 3HG2 THR 37 3HG2 THR 37 -3.026 -11.938 -5.089 313 H GLN 38 H GLN 38 2.397 -11.828 -4.233 314 HA GLN 38 HA GLN 38 4.190 -11.358 -5.650 315 1HB GLN 38 2HB GLN 38 2.224 -12.429 -7.690 316 2HB GLN 38 1HB GLN 38 3.839 -11.883 -8.132 317 1HG GLN 38 2HG GLN 38 4.896 -13.585 -6.915 318 2HG GLN 38 1HG GLN 38 3.483 -13.858 -5.890 319 1HE2 GLN 38 1HE2 GLN 38 1.948 -15.410 -6.591 320 2HE2 GLN 38 2HE2 GLN 38 2.042 -16.225 -8.078 321 HA PRO 39 HA PRO 39 3.500 -7.209 -6.903 322 1HB PRO 39 2HB PRO 39 5.733 -6.837 -8.474 323 2HB PRO 39 1HB PRO 39 5.761 -6.865 -6.702 324 1HG PRO 39 2HG PRO 39 6.633 -8.974 -8.632 325 2HG PRO 39 1HG PRO 39 7.226 -8.633 -6.998 326 1HD PRO 39 2HD PRO 39 5.469 -10.715 -7.675 327 2HD PRO 39 1HD PRO 39 5.725 -10.080 -6.036 328 H ASN 40 H ASN 40 3.705 -9.734 -9.286 329 HA ASN 40 HA ASN 40 2.998 -7.978 -11.541 330 1HB ASN 40 2HB ASN 40 3.294 -10.983 -11.282 331 2HB ASN 40 1HB ASN 40 2.860 -10.168 -12.786 332 1HD2 ASN 40 1HD2 ASN 40 4.498 -8.680 -13.736 333 2HD2 ASN 40 2HD2 ASN 40 6.137 -8.858 -13.334 334 H LYS 41 H LYS 41 1.309 -9.760 -9.079 335 HA LYS 41 HA LYS 41 -1.208 -9.600 -10.685 336 1HB LYS 41 2HB LYS 41 -0.172 -11.789 -9.388 337 2HB LYS 41 1HB LYS 41 -1.276 -11.143 -8.172 338 1HG LYS 41 2HG LYS 41 -2.471 -11.112 -10.836 339 2HG LYS 41 1HG LYS 41 -1.979 -12.739 -10.354 340 1HD LYS 41 2HD LYS 41 -3.131 -12.140 -8.084 341 2HD LYS 41 1HD LYS 41 -3.946 -10.891 -9.023 342 1HE LYS 41 2HE LYS 41 -3.991 -13.387 -10.482 343 2HE LYS 41 1HE LYS 41 -4.638 -13.637 -8.858 344 1HZ LYS 41 1HZ LYS 41 -5.542 -11.218 -10.173 345 2HZ LYS 41 2HZ LYS 41 -6.423 -12.372 -9.288 346 3HZ LYS 41 3HZ LYS 41 -6.041 -12.656 -10.919 347 H ILE 42 H ILE 42 0.304 -7.611 -8.690 348 HA ILE 42 HA ILE 42 -2.098 -7.030 -7.001 349 HB ILE 42 HB ILE 42 0.828 -6.341 -6.620 350 1HG1 ILE 42 2HG1 ILE 42 -1.101 -7.743 -4.754 351 2HG1 ILE 42 1HG1 ILE 42 -0.132 -8.618 -5.941 352 1HG2 ILE 42 1HG2 ILE 42 -0.514 -5.499 -4.349 353 2HG2 ILE 42 2HG2 ILE 42 -1.590 -4.982 -5.646 354 3HG2 ILE 42 3HG2 ILE 42 0.088 -4.441 -5.624 355 1HD1 ILE 42 1HD1 ILE 42 1.738 -8.430 -4.690 356 2HD1 ILE 42 2HD1 ILE 42 0.687 -7.907 -3.377 357 3HD1 ILE 42 3HD1 ILE 42 1.467 -6.712 -4.411 358 H VAL 43 H VAL 43 -3.129 -5.088 -7.256 359 HA VAL 43 HA VAL 43 -1.906 -3.064 -9.094 360 HB VAL 43 HB VAL 43 -4.832 -3.868 -8.924 361 1HG1 VAL 43 1HG1 VAL 43 -3.472 -1.512 -9.975 362 2HG1 VAL 43 2HG1 VAL 43 -5.199 -1.812 -9.780 363 3HG1 VAL 43 3HG1 VAL 43 -4.369 -2.362 -11.235 364 1HG2 VAL 43 1HG2 VAL 43 -3.677 -5.584 -10.113 365 2HG2 VAL 43 2HG2 VAL 43 -2.647 -4.417 -10.945 366 3HG2 VAL 43 3HG2 VAL 43 -4.359 -4.534 -11.356 367 H LEU 44 H LEU 44 -1.625 -1.156 -8.035 368 HA LEU 44 HA LEU 44 -3.193 -0.659 -5.551 369 1HB LEU 44 2HB LEU 44 -0.626 0.534 -6.629 370 2HB LEU 44 1HB LEU 44 -1.450 1.157 -5.200 371 HG LEU 44 HG LEU 44 -0.906 -1.782 -5.335 372 1HD1 LEU 44 1HD1 LEU 44 1.188 -0.335 -5.993 373 2HD1 LEU 44 2HD1 LEU 44 1.357 -1.609 -4.785 374 3HD1 LEU 44 3HD1 LEU 44 1.208 0.074 -4.277 375 1HD2 LEU 44 1HD2 LEU 44 -0.569 0.125 -3.018 376 2HD2 LEU 44 2HD2 LEU 44 -0.927 -1.602 -2.976 377 3HD2 LEU 44 3HD2 LEU 44 -2.165 -0.456 -3.492 378 H GLN 45 H GLN 45 -4.497 1.167 -5.326 379 HA GLN 45 HA GLN 45 -4.676 3.013 -7.669 380 1HB GLN 45 2HB GLN 45 -7.160 2.193 -6.180 381 2HB GLN 45 1HB GLN 45 -7.010 2.847 -7.809 382 1HG GLN 45 2HG GLN 45 -5.651 0.606 -8.230 383 2HG GLN 45 1HG GLN 45 -6.586 0.041 -6.847 384 1HE2 GLN 45 1HE2 GLN 45 -6.681 0.165 -10.182 385 2HE2 GLN 45 2HE2 GLN 45 -8.362 0.117 -10.412 386 H LYS 46 H LYS 46 -4.590 5.120 -7.054 387 HA LYS 46 HA LYS 46 -4.807 5.751 -4.159 388 1HB LYS 46 2HB LYS 46 -3.251 6.777 -6.400 389 2HB LYS 46 1HB LYS 46 -4.075 8.079 -5.542 390 1HG LYS 46 2HG LYS 46 -2.648 5.962 -3.961 391 2HG LYS 46 1HG LYS 46 -1.712 7.253 -4.714 392 1HD LYS 46 2HD LYS 46 -3.683 8.730 -3.611 393 2HD LYS 46 1HD LYS 46 -3.653 7.389 -2.467 394 1HE LYS 46 2HE LYS 46 -1.010 7.805 -2.644 395 2HE LYS 46 1HE LYS 46 -1.553 9.431 -3.050 396 1HZ LYS 46 1HZ LYS 46 -1.604 8.068 -0.528 397 2HZ LYS 46 2HZ LYS 46 -3.107 8.753 -0.926 398 3HZ LYS 46 3HZ LYS 46 -1.716 9.727 -0.863 399 H GLY 47 H GLY 47 -7.132 5.657 -4.037 400 1HA GLY 47 2HA GLY 47 -9.197 6.793 -3.889 401 2HA GLY 47 1HA GLY 47 -8.453 8.171 -4.703 402 H GLY 48 H GLY 48 -8.321 8.134 -7.041 403 1HA GLY 48 2HA GLY 48 -10.000 6.069 -8.391 404 2HA GLY 48 1HA GLY 48 -10.334 7.779 -8.668 405 H SER 49 H SER 49 -7.248 5.983 -8.420 406 HA SER 49 HA SER 49 -6.668 6.481 -11.270 407 1HB SER 49 2HB SER 49 -4.544 7.661 -10.767 408 2HB SER 49 1HB SER 49 -5.940 8.577 -10.210 409 HG SER 49 HG SER 49 -4.699 8.567 -8.456 410 H VAL 50 H VAL 50 -5.225 4.956 -12.081 411 HA VAL 50 HA VAL 50 -4.503 2.742 -10.278 412 HB VAL 50 HB VAL 50 -3.997 3.084 -13.255 413 1HG1 VAL 50 1HG1 VAL 50 -3.939 0.487 -13.009 414 2HG1 VAL 50 2HG1 VAL 50 -3.632 0.815 -11.304 415 3HG1 VAL 50 3HG1 VAL 50 -2.513 1.407 -12.532 416 1HG2 VAL 50 1HG2 VAL 50 -6.424 3.073 -12.529 417 2HG2 VAL 50 2HG2 VAL 50 -6.149 1.468 -11.853 418 3HG2 VAL 50 3HG2 VAL 50 -5.976 1.735 -13.587 419 H LEU 51 H LEU 51 -2.506 2.469 -9.399 420 HA LEU 51 HA LEU 51 -0.395 4.436 -10.061 421 1HB LEU 51 2HB LEU 51 -0.268 2.262 -7.957 422 2HB LEU 51 1HB LEU 51 0.684 3.743 -8.038 423 HG LEU 51 HG LEU 51 -2.308 3.567 -7.556 424 1HD1 LEU 51 1HD1 LEU 51 -0.263 4.732 -5.686 425 2HD1 LEU 51 2HD1 LEU 51 -0.543 2.992 -5.710 426 3HD1 LEU 51 3HD1 LEU 51 -1.865 4.092 -5.323 427 1HD2 LEU 51 1HD2 LEU 51 -0.950 5.637 -8.783 428 2HD2 LEU 51 2HD2 LEU 51 -0.918 6.120 -7.088 429 3HD2 LEU 51 3HD2 LEU 51 -2.459 5.810 -7.888 430 H LYS 52 H LYS 52 1.395 3.926 -11.234 431 HA LYS 52 HA LYS 52 1.731 1.072 -12.060 432 1HB LYS 52 2HB LYS 52 1.829 3.616 -13.498 433 2HB LYS 52 1HB LYS 52 3.259 2.624 -13.787 434 1HG LYS 52 2HG LYS 52 0.754 1.090 -13.822 435 2HG LYS 52 1HG LYS 52 0.838 2.324 -15.080 436 1HD LYS 52 2HD LYS 52 2.486 1.241 -16.206 437 2HD LYS 52 1HD LYS 52 3.333 0.799 -14.724 438 1HE LYS 52 2HE LYS 52 1.293 -0.835 -14.390 439 2HE LYS 52 1HE LYS 52 1.114 -0.645 -16.134 440 1HZ LYS 52 1HZ LYS 52 2.536 -2.512 -15.620 441 2HZ LYS 52 2HZ LYS 52 3.575 -1.516 -14.719 442 3HZ LYS 52 3HZ LYS 52 3.432 -1.301 -16.398 443 H ASP 53 H ASP 53 3.798 0.145 -11.993 444 HA ASP 53 HA ASP 53 5.559 0.973 -9.906 445 1HB ASP 53 2HB ASP 53 7.076 -0.769 -10.749 446 2HB ASP 53 1HB ASP 53 5.416 -1.361 -10.728 447 H HIS 54 H HIS 54 5.438 1.831 -13.298 448 HA HIS 54 HA HIS 54 8.146 2.773 -13.568 449 1HB HIS 54 2HB HIS 54 5.593 3.410 -15.065 450 2HB HIS 54 1HB HIS 54 7.161 4.080 -15.517 451 HD1 HIS 54 HD1 HIS 54 5.250 0.842 -15.375 452 HD2 HIS 54 HD2 HIS 54 8.956 2.218 -16.695 453 HE1 HIS 54 HE1 HIS 54 6.267 -1.034 -16.737 454 H ILE 55 H ILE 55 5.449 4.079 -11.860 455 HA ILE 55 HA ILE 55 6.681 6.801 -11.885 456 HB ILE 55 HB ILE 55 3.893 5.918 -11.065 457 1HG1 ILE 55 2HG1 ILE 55 3.541 7.679 -13.077 458 2HG1 ILE 55 1HG1 ILE 55 5.113 7.034 -13.548 459 1HG2 ILE 55 1HG2 ILE 55 4.433 7.796 -9.706 460 2HG2 ILE 55 2HG2 ILE 55 3.543 8.469 -11.073 461 3HG2 ILE 55 3HG2 ILE 55 5.301 8.594 -11.018 462 1HD1 ILE 55 1HD1 ILE 55 2.871 5.853 -14.339 463 2HD1 ILE 55 2HD1 ILE 55 2.970 5.104 -12.746 464 3HD1 ILE 55 3HD1 ILE 55 4.287 4.898 -13.901 465 H SER 56 H SER 56 7.274 7.763 -9.927 466 HA SER 56 HA SER 56 7.877 5.940 -7.736 467 1HB SER 56 2HB SER 56 9.115 8.153 -8.637 468 2HB SER 56 1HB SER 56 8.152 8.876 -7.353 469 HG SER 56 HG SER 56 9.945 8.194 -6.333 470 H LEU 57 H LEU 57 7.110 6.168 -5.547 471 HA LEU 57 HA LEU 57 4.297 6.620 -5.282 472 1HB LEU 57 2HB LEU 57 6.513 6.386 -3.230 473 2HB LEU 57 1HB LEU 57 4.814 6.545 -2.785 474 HG LEU 57 HG LEU 57 5.738 4.415 -4.717 475 1HD1 LEU 57 1HD1 LEU 57 5.311 3.124 -2.312 476 2HD1 LEU 57 2HD1 LEU 57 6.169 4.582 -1.814 477 3HD1 LEU 57 3HD1 LEU 57 6.893 3.493 -2.997 478 1HD2 LEU 57 1HD2 LEU 57 3.320 4.835 -2.938 479 2HD2 LEU 57 2HD2 LEU 57 3.656 3.310 -3.759 480 3HD2 LEU 57 3HD2 LEU 57 3.358 4.772 -4.700 481 H GLU 58 H GLU 58 7.115 8.679 -4.644 482 HA GLU 58 HA GLU 58 5.801 10.807 -3.285 483 1HB GLU 58 2HB GLU 58 8.344 10.408 -3.768 484 2HB GLU 58 1HB GLU 58 8.027 11.307 -5.251 485 1HG GLU 58 2HG GLU 58 8.722 12.933 -3.640 486 2HG GLU 58 1HG GLU 58 6.973 13.109 -3.780 487 H ASP 59 H ASP 59 6.021 10.021 -6.731 488 HA ASP 59 HA ASP 59 5.016 12.506 -7.758 489 1HB ASP 59 2HB ASP 59 5.469 9.776 -8.774 490 2HB ASP 59 1HB ASP 59 4.120 10.607 -9.548 491 H TYR 60 H TYR 60 3.384 9.472 -6.807 492 HA TYR 60 HA TYR 60 0.718 10.469 -7.395 493 1HB TYR 60 2HB TYR 60 1.737 8.113 -5.789 494 2HB TYR 60 1HB TYR 60 0.020 8.458 -5.992 495 HD1 TYR 60 HD1 TYR 60 2.646 6.568 -7.275 496 HD2 TYR 60 HD2 TYR 60 -0.600 9.064 -8.583 497 HE1 TYR 60 HE1 TYR 60 2.676 5.452 -9.488 498 HE2 TYR 60 HE2 TYR 60 -0.566 7.945 -10.795 499 HH TYR 60 HH TYR 60 1.102 6.683 -12.194 500 H GLU 61 H GLU 61 2.923 10.913 -4.785 501 HA GLU 61 HA GLU 61 2.758 12.256 -2.884 502 1HB GLU 61 2HB GLU 61 0.802 13.311 -4.457 503 2HB GLU 61 1HB GLU 61 -0.161 12.739 -3.096 504 1HG GLU 61 2HG GLU 61 0.483 14.954 -2.510 505 2HG GLU 61 1HG GLU 61 1.560 13.905 -1.589 506 H VAL 62 H VAL 62 2.968 9.837 -2.209 507 HA VAL 62 HA VAL 62 0.584 8.839 -0.754 508 HB VAL 62 HB VAL 62 3.356 7.642 -1.109 509 1HG1 VAL 62 1HG1 VAL 62 2.268 6.861 0.954 510 2HG1 VAL 62 2HG1 VAL 62 2.299 5.572 -0.248 511 3HG1 VAL 62 3HG1 VAL 62 0.808 6.466 0.047 512 1HG2 VAL 62 1HG2 VAL 62 1.167 6.180 -2.308 513 2HG2 VAL 62 2HG2 VAL 62 2.610 6.837 -3.080 514 3HG2 VAL 62 3HG2 VAL 62 1.172 7.842 -2.902 515 H HIS 63 H HIS 63 0.279 9.562 1.291 516 HA HIS 63 HA HIS 63 2.602 10.607 2.824 517 1HB HIS 63 2HB HIS 63 -0.392 10.867 3.163 518 2HB HIS 63 1HB HIS 63 0.750 11.416 4.390 519 HD1 HIS 63 HD1 HIS 63 -0.398 12.134 0.878 520 HD2 HIS 63 HD2 HIS 63 2.211 13.746 3.698 521 HE1 HIS 63 HE1 HIS 63 0.302 14.400 -0.008 522 H ASP 64 H ASP 64 2.539 10.115 5.249 523 HA ASP 64 HA ASP 64 2.615 7.247 5.630 524 1HB ASP 64 2HB ASP 64 3.257 7.760 7.928 525 2HB ASP 64 1HB ASP 64 4.122 8.835 6.832 526 H GLN 65 H GLN 65 1.165 5.918 6.711 527 HA GLN 65 HA GLN 65 -0.896 5.188 7.543 528 1HB GLN 65 2HB GLN 65 -0.217 7.546 8.996 529 2HB GLN 65 1HB GLN 65 -1.943 7.622 8.653 530 1HG GLN 65 2HG GLN 65 -1.552 6.433 10.766 531 2HG GLN 65 1HG GLN 65 -2.213 5.330 9.559 532 1HE2 GLN 65 1HE2 GLN 65 1.095 6.500 10.483 533 2HE2 GLN 65 2HE2 GLN 65 1.802 4.958 10.435 534 H THR 66 H THR 66 -0.725 6.319 4.831 535 HA THR 66 HA THR 66 -3.280 7.750 4.457 536 HB THR 66 HB THR 66 -1.179 8.297 3.140 537 HG1 THR 66 HG1 THR 66 -2.617 9.087 1.866 538 1HG2 THR 66 1HG2 THR 66 -1.481 6.415 1.047 539 2HG2 THR 66 2HG2 THR 66 -1.379 5.484 2.542 540 3HG2 THR 66 3HG2 THR 66 -0.095 6.614 2.118 541 H ASN 67 H ASN 67 -4.919 6.899 2.941 542 HA ASN 67 HA ASN 67 -5.189 3.948 3.228 543 1HB ASN 67 2HB ASN 67 -7.075 6.233 3.056 544 2HB ASN 67 1HB ASN 67 -7.588 4.748 2.253 545 1HD2 ASN 67 1HD2 ASN 67 -8.137 2.926 3.583 546 2HD2 ASN 67 2HD2 ASN 67 -8.162 3.001 5.278 547 H LEU 68 H LEU 68 -4.684 2.738 1.491 548 HA LEU 68 HA LEU 68 -4.923 3.967 -1.228 549 1HB LEU 68 2HB LEU 68 -2.824 2.372 0.067 550 2HB LEU 68 1HB LEU 68 -3.294 1.746 -1.512 551 HG LEU 68 HG LEU 68 -3.029 4.666 -1.477 552 1HD1 LEU 68 1HD1 LEU 68 -0.610 4.736 -1.289 553 2HD1 LEU 68 2HD1 LEU 68 -0.535 2.986 -1.078 554 3HD1 LEU 68 3HD1 LEU 68 -1.256 3.995 0.176 555 1HD2 LEU 68 1HD2 LEU 68 -1.361 3.799 -3.386 556 2HD2 LEU 68 2HD2 LEU 68 -3.109 3.798 -3.617 557 3HD2 LEU 68 3HD2 LEU 68 -2.279 2.311 -3.159 558 H GLU 69 H GLU 69 -5.472 2.371 -2.969 559 HA GLU 69 HA GLU 69 -7.474 0.405 -1.954 560 1HB GLU 69 2HB GLU 69 -7.662 2.360 -3.924 561 2HB GLU 69 1HB GLU 69 -7.440 0.871 -4.843 562 1HG GLU 69 2HG GLU 69 -9.319 0.596 -2.594 563 2HG GLU 69 1HG GLU 69 -9.846 1.749 -3.820 564 H LEU 70 H LEU 70 -7.300 -1.763 -2.466 565 HA LEU 70 HA LEU 70 -4.859 -2.582 -3.992 566 1HB LEU 70 2HB LEU 70 -4.736 -3.216 -1.627 567 2HB LEU 70 1HB LEU 70 -6.302 -4.017 -1.740 568 HG LEU 70 HG LEU 70 -5.396 -5.622 -3.357 569 1HD1 LEU 70 1HD1 LEU 70 -3.668 -4.895 -4.626 570 2HD1 LEU 70 2HD1 LEU 70 -2.637 -5.312 -3.260 571 3HD1 LEU 70 3HD1 LEU 70 -3.221 -3.660 -3.450 572 1HD2 LEU 70 1HD2 LEU 70 -3.295 -5.586 -1.228 573 2HD2 LEU 70 2HD2 LEU 70 -4.300 -6.922 -1.789 574 3HD2 LEU 70 3HD2 LEU 70 -4.981 -5.695 -0.721 575 H TYR 71 H TYR 71 -5.160 -3.846 -5.754 576 HA TYR 71 HA TYR 71 -7.793 -5.202 -6.132 577 1HB TYR 71 2HB TYR 71 -6.781 -2.957 -7.623 578 2HB TYR 71 1HB TYR 71 -6.841 -4.366 -8.681 579 HD1 TYR 71 HD1 TYR 71 -8.827 -2.110 -6.529 580 HD2 TYR 71 HD2 TYR 71 -8.948 -5.422 -9.264 581 HE1 TYR 71 HE1 TYR 71 -11.288 -1.868 -6.717 582 HE2 TYR 71 HE2 TYR 71 -11.408 -5.179 -9.450 583 HH TYR 71 HH TYR 71 -13.062 -2.799 -8.945 584 H TYR 72 H TYR 72 -7.664 -7.116 -7.446 585 HA TYR 72 HA TYR 72 -4.874 -8.150 -7.746 586 1HB TYR 72 2HB TYR 72 -7.474 -9.666 -7.368 587 2HB TYR 72 1HB TYR 72 -5.890 -10.409 -7.581 588 HD1 TYR 72 HD1 TYR 72 -8.145 -9.942 -5.147 589 HD2 TYR 72 HD2 TYR 72 -4.087 -8.815 -5.991 590 HE1 TYR 72 HE1 TYR 72 -7.709 -9.692 -2.720 591 HE2 TYR 72 HE2 TYR 72 -3.650 -8.565 -3.565 592 HH TYR 72 HH TYR 72 -5.013 -9.788 -1.315 593 H LEU 73 HN LEU 73 -4.182 -8.303 -9.803 594 HA LEU 73 HA LEU 73 -6.108 -9.108 -11.916 595 1HB LEU 73 2HB LEU 73 -5.418 -6.458 -11.597 596 2HB LEU 73 1HB LEU 73 -4.239 -7.004 -12.790 597 HG LEU 73 HG LEU 73 -6.734 -8.148 -13.523 598 1HD1 LEU 73 1HD1 LEU 73 -6.947 -5.437 -12.351 599 2HD1 LEU 73 2HD1 LEU 73 -8.196 -6.656 -12.616 600 3HD1 LEU 73 3HD1 LEU 73 -7.679 -5.622 -13.945 601 1HD2 LEU 73 1HD2 LEU 73 -4.693 -7.283 -14.878 602 2HD2 LEU 73 2HD2 LEU 73 -5.480 -5.708 -14.791 603 3HD2 LEU 73 3HD2 LEU 73 -6.296 -7.059 -15.581
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