NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
11719 | 1rwu | 6102 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 1H MET 1 HT1 MET 1 5.693 10.045 -20.281 2 2H MET 1 HT2 MET 1 4.272 9.371 -20.925 3 3H MET 1 HT3 MET 1 4.366 11.042 -20.636 4 HA MET 1 HA MET 1 4.616 10.642 -22.997 5 1HB MET 1 HB2 MET 1 6.500 11.870 -21.170 6 2HB MET 1 HB1 MET 1 7.330 11.341 -22.632 7 1HG MET 1 HG2 MET 1 5.845 12.610 -24.033 8 2HG MET 1 HG1 MET 1 4.769 12.953 -22.678 9 1HE MET 1 HE1 MET 1 6.118 14.147 -20.274 10 2HE MET 1 HE2 MET 1 4.774 14.659 -21.293 11 3HE MET 1 HE3 MET 1 6.045 15.808 -20.878 12 H LYS 2 HN LYS 2 5.802 9.589 -24.707 13 HA LYS 2 HA LYS 2 7.711 7.431 -23.939 14 1HB LYS 2 HB2 LYS 2 4.995 6.993 -24.328 15 2HB LYS 2 HB1 LYS 2 5.684 6.593 -25.901 16 1HG LYS 2 HG2 LYS 2 7.319 5.521 -23.750 17 2HG LYS 2 HG1 LYS 2 5.654 4.955 -23.619 18 1HD LYS 2 HD2 LYS 2 5.706 3.885 -25.688 19 2HD LYS 2 HD1 LYS 2 6.996 4.920 -26.304 20 1HE LYS 2 HE2 LYS 2 8.256 3.700 -24.183 21 2HE LYS 2 HE1 LYS 2 7.193 2.406 -24.765 22 1HZ LYS 2 HZ1 LYS 2 9.284 2.441 -26.000 23 2HZ LYS 2 HZ2 LYS 2 9.000 4.050 -26.466 24 3HZ LYS 2 HZ3 LYS 2 7.977 2.810 -27.017 25 H THR 3 HN THR 3 9.302 8.734 -25.059 26 HA THR 3 HA THR 3 8.937 8.860 -28.040 27 HB THR 3 HB THR 3 10.550 10.815 -27.829 28 HG1 THR 3 HG1 THR 3 11.034 11.548 -25.855 29 1HG2 THR 3 HG21 THR 3 8.801 12.350 -26.854 30 2HG2 THR 3 HG22 THR 3 7.865 10.917 -26.432 31 3HG2 THR 3 HG23 THR 3 8.206 11.279 -28.124 32 H LYS 4 HN LYS 4 10.713 7.341 -25.564 33 HA LYS 4 HA LYS 4 12.685 6.049 -25.572 34 1HB LYS 4 HB2 LYS 4 11.291 5.751 -28.018 35 2HB LYS 4 HB1 LYS 4 12.998 5.868 -28.446 36 1HG LYS 4 HG2 LYS 4 12.376 4.150 -26.108 37 2HG LYS 4 HG1 LYS 4 11.810 3.552 -27.667 38 1HD LYS 4 HD2 LYS 4 13.902 2.991 -28.290 39 2HD LYS 4 HD1 LYS 4 14.508 4.598 -27.890 40 1HE LYS 4 HE2 LYS 4 14.237 3.665 -25.386 41 2HE LYS 4 HE1 LYS 4 14.485 2.119 -26.220 42 1HZ LYS 4 HZ1 LYS 4 16.611 3.119 -25.638 43 2HZ LYS 4 HZ2 LYS 4 16.205 4.534 -26.484 44 3HZ LYS 4 HZ3 LYS 4 16.429 3.073 -27.323 45 H LEU 5 HN LEU 5 13.081 8.874 -25.428 46 HA LEU 5 HA LEU 5 15.864 9.056 -26.325 47 1HB LEU 5 HB2 LEU 5 14.095 9.657 -28.237 48 2HB LEU 5 HB1 LEU 5 14.074 11.208 -27.398 49 HG LEU 5 HG LEU 5 16.799 10.398 -27.620 50 1HD1 LEU 5 HD11 LEU 5 16.973 10.332 -30.123 51 2HD1 LEU 5 HD12 LEU 5 15.215 10.198 -30.200 52 3HD1 LEU 5 HD13 LEU 5 16.164 8.920 -29.443 53 1HD2 LEU 5 HD21 LEU 5 16.433 12.430 -29.445 54 2HD2 LEU 5 HD22 LEU 5 16.641 12.668 -27.710 55 3HD2 LEU 5 HD23 LEU 5 15.020 12.619 -28.405 56 H ASN 6 HN ASN 6 13.102 11.175 -25.415 57 HA ASN 6 HA ASN 6 14.875 12.431 -23.345 58 1HB ASN 6 HB2 ASN 6 13.616 13.589 -25.449 59 2HB ASN 6 HB1 ASN 6 12.350 13.729 -24.228 60 1HD2 ASN 6 HD21 ASN 6 15.784 14.552 -24.861 61 2HD2 ASN 6 HD22 ASN 6 15.845 15.831 -23.747 62 H GLU 7 HN GLU 7 11.890 10.658 -23.858 63 HA GLU 7 HA GLU 7 11.494 10.479 -20.940 64 1HB GLU 7 HB2 GLU 7 10.247 12.487 -22.424 65 2HB GLU 7 HB1 GLU 7 9.008 11.243 -22.270 66 1HG GLU 7 HG2 GLU 7 10.548 12.568 -20.021 67 2HG GLU 7 HG1 GLU 7 8.824 12.718 -20.358 68 H LEU 8 HN LEU 8 10.437 8.566 -20.389 69 HA LEU 8 HA LEU 8 8.842 7.068 -22.366 70 1HB LEU 8 HB2 LEU 8 11.373 6.695 -22.740 71 2HB LEU 8 HB1 LEU 8 11.326 5.791 -21.227 72 HG LEU 8 HG LEU 8 9.144 5.058 -23.030 73 1HD1 LEU 8 HD11 LEU 8 11.192 5.687 -24.544 74 2HD1 LEU 8 HD12 LEU 8 10.335 4.174 -24.827 75 3HD1 LEU 8 HD13 LEU 8 11.862 4.168 -23.948 76 1HD2 LEU 8 HD21 LEU 8 10.293 2.775 -22.564 77 2HD2 LEU 8 HD22 LEU 8 9.583 3.634 -21.195 78 3HD2 LEU 8 HD23 LEU 8 11.326 3.683 -21.463 79 H LEU 9 HN LEU 9 10.683 6.564 -19.335 80 HA LEU 9 HA LEU 9 8.464 4.976 -18.198 81 1HB LEU 9 HB2 LEU 9 10.139 4.730 -16.312 82 2HB LEU 9 HB1 LEU 9 10.714 4.173 -17.881 83 HG LEU 9 HG LEU 9 11.298 6.988 -17.568 84 1HD1 LEU 9 HD11 LEU 9 13.046 5.634 -15.672 85 2HD1 LEU 9 HD12 LEU 9 11.373 5.636 -15.120 86 3HD1 LEU 9 HD13 LEU 9 12.178 7.158 -15.496 87 1HD2 LEU 9 HD21 LEU 9 13.542 6.240 -18.130 88 2HD2 LEU 9 HD22 LEU 9 12.393 5.315 -19.096 89 3HD2 LEU 9 HD23 LEU 9 13.144 4.581 -17.679 90 H GLU 10 HN GLU 10 9.473 8.275 -18.168 91 HA GLU 10 HA GLU 10 8.753 10.145 -16.943 92 1HB GLU 10 HB2 GLU 10 6.627 8.929 -17.803 93 2HB GLU 10 HB1 GLU 10 6.420 8.411 -16.131 94 1HG GLU 10 HG2 GLU 10 5.167 10.442 -16.361 95 2HG GLU 10 HG1 GLU 10 6.628 10.863 -15.469 96 H PHE 11 HN PHE 11 10.662 8.811 -15.526 97 HA PHE 11 HA PHE 11 9.695 9.083 -12.712 98 1HB PHE 11 HB2 PHE 11 9.856 6.660 -13.706 99 2HB PHE 11 HB1 PHE 11 11.596 6.893 -13.537 100 HD1 PHE 11 HD1 PHE 11 8.391 6.607 -11.735 101 HD2 PHE 11 HD2 PHE 11 12.644 7.085 -11.348 102 HE1 PHE 11 HE1 PHE 11 8.229 6.091 -9.315 103 HE2 PHE 11 HE2 PHE 11 12.482 6.569 -8.928 104 HZ PHE 11 HZ PHE 11 10.274 6.072 -7.912 105 HA PRO 12 HA PRO 12 13.404 11.615 -13.105 106 1HB PRO 12 HB2 PRO 12 13.088 12.908 -10.710 107 2HB PRO 12 HB1 PRO 12 12.209 13.362 -12.184 108 1HG PRO 12 HG2 PRO 12 11.293 11.737 -9.860 109 2HG PRO 12 HG1 PRO 12 10.420 12.961 -10.794 110 1HD PRO 12 HD2 PRO 12 10.056 10.295 -11.148 111 2HD PRO 12 HD1 PRO 12 9.855 11.483 -12.456 112 H THR 13 HN THR 13 15.158 10.274 -12.818 113 HA THR 13 HA THR 13 15.640 9.136 -10.084 114 HB THR 13 HB THR 13 15.380 7.545 -11.977 115 HG1 THR 13 HG1 THR 13 16.753 6.479 -10.834 116 1HG2 THR 13 HG21 THR 13 16.202 8.991 -13.787 117 2HG2 THR 13 HG22 THR 13 17.110 7.480 -13.741 118 3HG2 THR 13 HG23 THR 13 17.821 8.956 -13.090 119 HA PRO 14 HA PRO 14 19.034 11.916 -9.666 120 1HB PRO 14 HB2 PRO 14 20.556 10.508 -7.873 121 2HB PRO 14 HB1 PRO 14 19.068 11.365 -7.425 122 1HG PRO 14 HG2 PRO 14 19.489 8.466 -7.968 123 2HG PRO 14 HG1 PRO 14 18.503 9.249 -6.723 124 1HD PRO 14 HD2 PRO 14 17.449 8.200 -8.990 125 2HD PRO 14 HD1 PRO 14 16.736 9.593 -8.148 126 H PHE 15 HN PHE 15 20.429 12.110 -11.367 127 HA PHE 15 HA PHE 15 22.023 9.749 -12.261 128 1HB PHE 15 HB2 PHE 15 21.068 12.344 -13.447 129 2HB PHE 15 HB1 PHE 15 22.461 11.538 -14.161 130 HD1 PHE 15 HD1 PHE 15 19.067 11.897 -14.517 131 HD2 PHE 15 HD2 PHE 15 22.023 8.793 -14.255 132 HE1 PHE 15 HE1 PHE 15 17.554 10.356 -15.731 133 HE2 PHE 15 HE2 PHE 15 20.508 7.249 -15.468 134 HZ PHE 15 HZ PHE 15 18.274 8.032 -16.207 135 H THR 16 HN THR 16 23.853 9.736 -10.891 136 HA THR 16 HA THR 16 25.255 12.185 -10.120 137 HB THR 16 HB THR 16 26.204 9.297 -10.073 138 HG1 THR 16 HG1 THR 16 24.763 8.968 -8.602 139 1HG2 THR 16 HG21 THR 16 27.645 11.484 -9.494 140 2HG2 THR 16 HG22 THR 16 27.819 9.980 -8.588 141 3HG2 THR 16 HG23 THR 16 26.824 11.287 -7.944 142 H TYR 17 HN TYR 17 25.817 13.228 -12.124 143 HA TYR 17 HA TYR 17 27.629 11.677 -13.938 144 1HB TYR 17 HB2 TYR 17 25.587 13.840 -14.236 145 2HB TYR 17 HB1 TYR 17 26.938 13.840 -15.368 146 HD1 TYR 17 HD1 TYR 17 26.307 12.881 -17.402 147 HD2 TYR 17 HD2 TYR 17 24.933 11.106 -13.739 148 HE1 TYR 17 HE1 TYR 17 25.239 11.049 -18.687 149 HE2 TYR 17 HE2 TYR 17 23.868 9.277 -15.024 150 HH TYR 17 HH TYR 17 24.558 8.354 -17.822 151 H LYS 18 HN LYS 18 29.475 12.838 -14.818 152 HA LYS 18 HA LYS 18 30.421 15.168 -13.197 153 1HB LYS 18 HB2 LYS 18 31.345 12.451 -13.177 154 2HB LYS 18 HB1 LYS 18 32.605 13.451 -13.897 155 1HG LYS 18 HG2 LYS 18 31.916 15.030 -11.814 156 2HG LYS 18 HG1 LYS 18 31.540 13.452 -11.125 157 1HD LYS 18 HD2 LYS 18 33.762 13.469 -10.589 158 2HD LYS 18 HD1 LYS 18 33.942 12.901 -12.248 159 1HE LYS 18 HE2 LYS 18 35.428 14.717 -12.226 160 2HE LYS 18 HE1 LYS 18 33.944 15.505 -12.796 161 1HZ LYS 18 HZ1 LYS 18 34.910 16.696 -10.909 162 2HZ LYS 18 HZ2 LYS 18 34.801 15.295 -9.954 163 3HZ LYS 18 HZ3 LYS 18 33.388 16.059 -10.513 164 H VAL 19 HN VAL 19 30.264 16.682 -14.880 165 HA VAL 19 HA VAL 19 31.094 16.032 -17.619 166 HB VAL 19 HB VAL 19 30.579 18.772 -16.441 167 1HG1 VAL 19 HG11 VAL 19 29.767 17.675 -19.132 168 2HG1 VAL 19 HG12 VAL 19 31.361 18.380 -18.860 169 3HG1 VAL 19 HG13 VAL 19 29.914 19.362 -18.637 170 1HG2 VAL 19 HG21 VAL 19 28.153 18.031 -17.428 171 2HG2 VAL 19 HG22 VAL 19 28.588 17.904 -15.725 172 3HG2 VAL 19 HG23 VAL 19 28.713 16.492 -16.774 173 H MET 20 HN MET 20 33.307 15.511 -17.544 174 HA MET 20 HA MET 20 35.207 17.464 -16.343 175 1HB MET 20 HB2 MET 20 35.545 14.701 -17.561 176 2HB MET 20 HB1 MET 20 36.817 15.610 -16.744 177 1HG MET 20 HG2 MET 20 35.527 15.595 -14.661 178 2HG MET 20 HG1 MET 20 34.198 14.763 -15.466 179 1HE MET 20 HE1 MET 20 35.143 11.265 -15.969 180 2HE MET 20 HE2 MET 20 34.348 12.679 -16.658 181 3HE MET 20 HE3 MET 20 33.953 12.166 -15.018 182 H GLY 21 HN GLY 21 36.664 18.639 -17.616 183 1HA GLY 21 HA2 GLY 21 37.531 18.158 -20.217 184 2HA GLY 21 HA1 GLY 21 36.001 19.011 -20.421 185 H GLN 22 HN GLN 22 36.963 20.924 -21.245 186 HA GLN 22 HA GLN 22 39.124 22.291 -19.836 187 1HB GLN 22 HB2 GLN 22 38.170 22.318 -22.352 188 2HB GLN 22 HB1 GLN 22 37.292 23.711 -21.720 189 1HG GLN 22 HG2 GLN 22 40.147 23.632 -20.972 190 2HG GLN 22 HG1 GLN 22 39.853 23.813 -22.701 191 1HE2 GLN 22 HE21 GLN 22 38.493 25.704 -23.383 192 2HE2 GLN 22 HE22 GLN 22 38.388 27.065 -22.376 193 H ALA 23 HN ALA 23 38.926 24.239 -18.607 194 HA ALA 23 HA ALA 23 36.612 24.422 -16.881 195 1HB ALA 23 HB1 ALA 23 39.017 24.959 -16.338 196 2HB ALA 23 HB2 ALA 23 37.888 26.235 -15.883 197 3HB ALA 23 HB3 ALA 23 38.866 26.403 -17.340 198 H LEU 24 HN LEU 24 34.704 25.074 -17.857 199 HA LEU 24 HA LEU 24 34.759 27.519 -19.592 200 1HB LEU 24 HB2 LEU 24 33.317 24.938 -19.551 201 2HB LEU 24 HB1 LEU 24 32.285 26.329 -19.876 202 HG LEU 24 HG LEU 24 33.238 25.296 -21.949 203 1HD1 LEU 24 HD11 LEU 24 34.043 28.130 -21.256 204 2HD1 LEU 24 HD12 LEU 24 32.569 27.603 -22.067 205 3HD1 LEU 24 HD13 LEU 24 34.124 27.469 -22.889 206 1HD2 LEU 24 HD21 LEU 24 35.490 24.855 -20.663 207 2HD2 LEU 24 HD22 LEU 24 35.893 26.489 -21.193 208 3HD2 LEU 24 HD23 LEU 24 35.534 25.238 -22.383 209 HA PRO 25 HA PRO 25 32.739 29.467 -16.117 210 1HB PRO 25 HB2 PRO 25 32.123 31.827 -17.366 211 2HB PRO 25 HB1 PRO 25 33.749 31.438 -16.771 212 1HG PRO 25 HG2 PRO 25 32.663 31.292 -19.539 213 2HG PRO 25 HG1 PRO 25 34.255 31.825 -18.978 214 1HD PRO 25 HD2 PRO 25 33.803 29.377 -20.071 215 2HD PRO 25 HD1 PRO 25 35.081 29.688 -18.875 216 H GLU 26 HN GLU 26 31.306 29.203 -19.349 217 HA GLU 26 HA GLU 26 28.578 29.776 -18.416 218 1HB GLU 26 HB2 GLU 26 29.844 30.085 -20.754 219 2HB GLU 26 HB1 GLU 26 29.207 28.464 -21.029 220 1HG GLU 26 HG2 GLU 26 27.291 30.425 -19.889 221 2HG GLU 26 HG1 GLU 26 27.797 30.724 -21.552 222 H LEU 27 HN LEU 27 30.589 27.074 -18.138 223 HA LEU 27 HA LEU 27 28.953 24.867 -18.855 224 1HB LEU 27 HB2 LEU 27 31.416 25.061 -18.030 225 2HB LEU 27 HB1 LEU 27 30.725 24.955 -16.410 226 HG LEU 27 HG LEU 27 29.601 22.940 -18.193 227 1HD1 LEU 27 HD11 LEU 27 31.615 21.580 -18.444 228 2HD1 LEU 27 HD12 LEU 27 32.584 22.819 -17.647 229 3HD1 LEU 27 HD13 LEU 27 31.864 23.141 -19.225 230 1HD2 LEU 27 HD21 LEU 27 31.209 22.757 -15.622 231 2HD2 LEU 27 HD22 LEU 27 30.208 21.480 -16.312 232 3HD2 LEU 27 HD23 LEU 27 29.459 22.959 -15.710 233 H VAL 28 HN VAL 28 29.248 26.463 -15.643 234 HA VAL 28 HA VAL 28 27.180 24.955 -14.356 235 HB VAL 28 HB VAL 28 27.250 26.826 -12.709 236 1HG1 VAL 28 HG11 VAL 28 30.007 26.803 -12.806 237 2HG1 VAL 28 HG12 VAL 28 29.583 25.359 -13.726 238 3HG1 VAL 28 HG13 VAL 28 29.006 25.551 -12.071 239 1HG2 VAL 28 HG21 VAL 28 28.644 28.172 -15.002 240 2HG2 VAL 28 HG22 VAL 28 29.139 28.574 -13.358 241 3HG2 VAL 28 HG23 VAL 28 27.470 28.831 -13.864 242 H ASP 29 HN ASP 29 27.059 27.893 -16.345 243 HA ASP 29 HA ASP 29 24.334 28.635 -15.756 244 1HB ASP 29 HB2 ASP 29 26.191 29.101 -18.113 245 2HB ASP 29 HB1 ASP 29 24.630 29.901 -17.937 246 H GLN 30 HN GLN 30 25.794 26.715 -18.407 247 HA GLN 30 HA GLN 30 23.258 26.075 -19.670 248 1HB GLN 30 HB2 GLN 30 25.822 26.055 -20.446 249 2HB GLN 30 HB1 GLN 30 25.688 24.363 -19.965 250 1HG GLN 30 HG2 GLN 30 25.056 24.340 -22.237 251 2HG GLN 30 HG1 GLN 30 23.514 24.348 -21.382 252 1HE2 GLN 30 HE21 GLN 30 22.268 26.369 -21.386 253 2HE2 GLN 30 HE22 GLN 30 22.621 27.614 -22.483 254 H VAL 31 HN VAL 31 25.297 24.480 -17.235 255 HA VAL 31 HA VAL 31 24.038 21.923 -17.222 256 HB VAL 31 HB VAL 31 25.612 23.621 -15.310 257 1HG1 VAL 31 HG11 VAL 31 25.561 21.414 -13.851 258 2HG1 VAL 31 HG12 VAL 31 23.980 21.203 -14.603 259 3HG1 VAL 31 HG13 VAL 31 24.315 22.643 -13.643 260 1HG2 VAL 31 HG21 VAL 31 27.038 22.487 -16.748 261 2HG2 VAL 31 HG22 VAL 31 25.947 21.112 -16.912 262 3HG2 VAL 31 HG23 VAL 31 26.911 21.302 -15.448 263 H VAL 32 HN VAL 32 23.367 24.759 -15.097 264 HA VAL 32 HA VAL 32 21.036 23.539 -13.883 265 HB VAL 32 HB VAL 32 22.543 25.360 -12.960 266 1HG1 VAL 32 HG11 VAL 32 22.579 26.735 -15.047 267 2HG1 VAL 32 HG12 VAL 32 22.119 27.664 -13.622 268 3HG1 VAL 32 HG13 VAL 32 20.886 27.143 -14.770 269 1HG2 VAL 32 HG21 VAL 32 20.425 26.770 -12.192 270 2HG2 VAL 32 HG22 VAL 32 20.643 25.104 -11.657 271 3HG2 VAL 32 HG23 VAL 32 19.549 25.465 -12.993 272 H GLU 33 HN GLU 33 21.504 25.611 -16.725 273 HA GLU 33 HA GLU 33 18.706 26.287 -17.081 274 1HB GLU 33 HB2 GLU 33 20.594 27.595 -17.975 275 2HB GLU 33 HB1 GLU 33 21.067 26.233 -18.991 276 1HG GLU 33 HG2 GLU 33 18.290 26.743 -19.446 277 2HG GLU 33 HG1 GLU 33 19.147 28.279 -19.558 278 H VAL 34 HN VAL 34 20.845 23.840 -18.623 279 HA VAL 34 HA VAL 34 18.688 22.747 -20.247 280 HB VAL 34 HB VAL 34 21.148 22.754 -20.789 281 1HG1 VAL 34 HG11 VAL 34 21.598 21.863 -18.307 282 2HG1 VAL 34 HG12 VAL 34 22.692 21.495 -19.639 283 3HG1 VAL 34 HG13 VAL 34 21.501 20.303 -19.124 284 1HG2 VAL 34 HG21 VAL 34 19.417 20.314 -20.860 285 2HG2 VAL 34 HG22 VAL 34 21.090 20.169 -21.397 286 3HG2 VAL 34 HG23 VAL 34 20.005 21.311 -22.189 287 H VAL 35 HN VAL 35 20.025 21.975 -17.046 288 HA VAL 35 HA VAL 35 18.682 19.396 -16.851 289 HB VAL 35 HB VAL 35 20.770 20.269 -15.611 290 1HG1 VAL 35 HG11 VAL 35 19.504 22.367 -14.856 291 2HG1 VAL 35 HG12 VAL 35 20.454 21.537 -13.626 292 3HG1 VAL 35 HG13 VAL 35 18.704 21.328 -13.678 293 1HG2 VAL 35 HG21 VAL 35 19.753 18.128 -15.068 294 2HG2 VAL 35 HG22 VAL 35 18.494 18.924 -14.124 295 3HG2 VAL 35 HG23 VAL 35 20.167 18.953 -13.565 296 H GLN 36 HN GLN 36 17.839 22.744 -16.046 297 HA GLN 36 HA GLN 36 15.467 22.010 -14.491 298 1HB GLN 36 HB2 GLN 36 16.550 24.063 -13.963 299 2HB GLN 36 HB1 GLN 36 16.637 24.546 -15.657 300 1HG GLN 36 HG2 GLN 36 14.668 25.612 -15.452 301 2HG GLN 36 HG1 GLN 36 13.888 24.090 -15.028 302 1HE2 GLN 36 HE21 GLN 36 14.185 23.443 -12.602 303 2HE2 GLN 36 HE22 GLN 36 14.132 24.706 -11.469 304 H ARG 37 HN ARG 37 16.086 23.189 -17.821 305 HA ARG 37 HA ARG 37 13.355 23.445 -18.641 306 1HB ARG 37 HB2 ARG 37 16.036 23.127 -19.931 307 2HB ARG 37 HB1 ARG 37 14.607 22.928 -20.947 308 1HG ARG 37 HG2 ARG 37 13.827 25.158 -19.764 309 2HG ARG 37 HG1 ARG 37 15.553 25.362 -19.471 310 1HD ARG 37 HD2 ARG 37 14.900 24.540 -22.233 311 2HD ARG 37 HD1 ARG 37 14.286 26.140 -21.785 312 HE ARG 37 HE ARG 37 16.893 26.073 -20.781 313 1HH1 ARG 37 HH11 ARG 37 15.760 27.819 -23.079 314 2HH1 ARG 37 HH12 ARG 37 16.921 27.479 -24.321 315 1HH2 ARG 37 HH21 ARG 37 18.226 24.688 -22.719 316 2HH2 ARG 37 HH22 ARG 37 18.317 25.708 -24.119 317 H HIS 38 HN HIS 38 15.477 20.616 -18.456 318 HA HIS 38 HA HIS 38 13.461 18.928 -19.855 319 1HB HIS 38 HB2 HIS 38 16.329 18.652 -18.978 320 2HB HIS 38 HB1 HIS 38 15.399 17.236 -19.468 321 HD1 HIS 38 HD1 HIS 38 14.276 17.416 -21.946 322 HD2 HIS 38 HD2 HIS 38 17.337 20.118 -21.107 323 HE1 HIS 38 HE1 HIS 38 15.050 18.336 -24.175 324 H ALA 39 HN ALA 39 15.103 19.188 -16.686 325 HA ALA 39 HA ALA 39 13.028 17.332 -15.550 326 1HB ALA 39 HB1 ALA 39 15.527 16.648 -15.712 327 2HB ALA 39 HB2 ALA 39 14.730 16.447 -14.152 328 3HB ALA 39 HB3 ALA 39 15.790 17.828 -14.428 329 HA PRO 40 HA PRO 40 11.861 20.772 -13.032 330 1HB PRO 40 HB2 PRO 40 10.722 19.431 -10.930 331 2HB PRO 40 HB1 PRO 40 9.934 19.615 -12.510 332 1HG PRO 40 HG2 PRO 40 11.435 17.289 -11.405 333 2HG PRO 40 HG1 PRO 40 9.944 17.322 -12.360 334 1HD PRO 40 HD2 PRO 40 12.358 16.726 -13.439 335 2HD PRO 40 HD1 PRO 40 11.065 17.531 -14.357 336 H GLY 41 HN GLY 41 12.775 21.958 -11.353 337 1HA GLY 41 HA2 GLY 41 13.936 22.220 -9.244 338 2HA GLY 41 HA1 GLY 41 14.542 20.572 -9.402 339 H ASP 42 HN ASP 42 16.021 23.143 -8.980 340 HA ASP 42 HA ASP 42 17.569 23.443 -11.502 341 1HB ASP 42 HB2 ASP 42 17.306 24.883 -8.871 342 2HB ASP 42 HB1 ASP 42 18.714 25.185 -9.889 343 H TYR 43 HN TYR 43 19.687 22.696 -11.708 344 HA TYR 43 HA TYR 43 20.926 21.376 -9.314 345 1HB TYR 43 HB2 TYR 43 20.542 20.385 -12.147 346 2HB TYR 43 HB1 TYR 43 21.695 19.647 -11.037 347 HD1 TYR 43 HD1 TYR 43 18.117 20.325 -11.666 348 HD2 TYR 43 HD2 TYR 43 20.961 18.329 -9.141 349 HE1 TYR 43 HE1 TYR 43 16.280 19.039 -10.615 350 HE2 TYR 43 HE2 TYR 43 19.122 17.040 -8.091 351 HH TYR 43 HH TYR 43 16.645 17.313 -7.748 352 H THR 44 HN THR 44 23.326 21.080 -9.589 353 HA THR 44 HA THR 44 24.569 22.958 -11.546 354 HB THR 44 HB THR 44 25.993 23.527 -9.302 355 HG1 THR 44 HG1 THR 44 24.915 22.953 -7.617 356 1HG2 THR 44 HG21 THR 44 24.662 24.988 -10.996 357 2HG2 THR 44 HG22 THR 44 24.958 25.625 -9.379 358 3HG2 THR 44 HG23 THR 44 23.384 24.940 -9.782 359 HA PRO 45 HA PRO 45 27.797 19.906 -11.458 360 1HB PRO 45 HB2 PRO 45 29.559 21.277 -13.029 361 2HB PRO 45 HB1 PRO 45 28.058 20.582 -13.665 362 1HG PRO 45 HG2 PRO 45 28.769 23.374 -13.270 363 2HG PRO 45 HG1 PRO 45 27.433 22.678 -14.192 364 1HD PRO 45 HD2 PRO 45 27.404 23.820 -11.517 365 2HD PRO 45 HD1 PRO 45 26.036 23.346 -12.549 366 H THR 46 HN THR 46 29.184 19.576 -9.690 367 HA THR 46 HA THR 46 30.459 21.839 -8.306 368 HB THR 46 HB THR 46 30.793 18.840 -7.930 369 HG1 THR 46 HG1 THR 46 28.806 18.895 -7.308 370 1HG2 THR 46 HG21 THR 46 30.835 20.622 -5.600 371 2HG2 THR 46 HG22 THR 46 32.139 20.943 -6.745 372 3HG2 THR 46 HG23 THR 46 31.952 19.332 -6.050 373 H VAL 47 HN VAL 47 32.073 22.719 -9.664 374 HA VAL 47 HA VAL 47 33.881 21.059 -11.226 375 HB VAL 47 HB VAL 47 33.115 23.374 -11.794 376 1HG1 VAL 47 HG11 VAL 47 34.941 24.126 -9.490 377 2HG1 VAL 47 HG12 VAL 47 33.201 24.395 -9.582 378 3HG1 VAL 47 HG13 VAL 47 34.285 25.270 -10.661 379 1HG2 VAL 47 HG21 VAL 47 34.946 23.434 -13.103 380 2HG2 VAL 47 HG22 VAL 47 35.707 22.236 -12.057 381 3HG2 VAL 47 HG23 VAL 47 35.935 23.956 -11.739 382 H LYS 48 HN LYS 48 36.016 20.539 -10.822 383 HA LYS 48 HA LYS 48 37.258 21.369 -8.239 384 1HB LYS 48 HB2 LYS 48 36.267 18.708 -9.089 385 2HB LYS 48 HB1 LYS 48 37.892 18.703 -8.405 386 1HG LYS 48 HG2 LYS 48 36.842 18.642 -6.395 387 2HG LYS 48 HG1 LYS 48 36.553 20.360 -6.663 388 1HD LYS 48 HD2 LYS 48 34.386 19.625 -6.265 389 2HD LYS 48 HD1 LYS 48 34.460 19.474 -8.021 390 1HE LYS 48 HE2 LYS 48 35.471 17.042 -7.244 391 2HE LYS 48 HE1 LYS 48 34.279 17.355 -5.967 392 1HZ LYS 48 HZ1 LYS 48 33.280 16.311 -7.948 393 2HZ LYS 48 HZ2 LYS 48 33.755 17.648 -8.881 394 3HZ LYS 48 HZ3 LYS 48 32.625 17.841 -7.627 395 HA PRO 49 HA PRO 49 40.773 21.710 -10.901 396 1HB PRO 49 HB2 PRO 49 42.777 21.582 -9.034 397 2HB PRO 49 HB1 PRO 49 41.753 23.015 -9.260 398 1HG PRO 49 HG2 PRO 49 41.581 20.872 -7.199 399 2HG PRO 49 HG1 PRO 49 41.331 22.618 -7.036 400 1HD PRO 49 HD2 PRO 49 39.288 20.827 -7.186 401 2HD PRO 49 HD1 PRO 49 39.155 22.507 -7.750 402 H SER 50 HN SER 50 40.729 19.744 -12.076 403 HA SER 50 HA SER 50 41.638 17.231 -10.838 404 1HB SER 50 HB2 SER 50 39.800 17.775 -12.676 405 2HB SER 50 HB1 SER 50 41.168 17.623 -13.775 406 HG SER 50 HG SER 50 40.672 15.568 -13.597 407 H SER 51 HN SER 51 42.783 19.326 -13.549 408 HA SER 51 HA SER 51 45.515 18.144 -13.131 409 1HB SER 51 HB2 SER 51 43.753 18.110 -15.379 410 2HB SER 51 HB1 SER 51 45.146 19.100 -15.803 411 HG SER 51 HG SER 51 45.627 16.952 -16.228 412 H LYS 52 HN LYS 52 43.858 20.998 -14.583 413 HA LYS 52 HA LYS 52 45.848 22.795 -13.284 414 1HB LYS 52 HB2 LYS 52 45.992 21.862 -15.983 415 2HB LYS 52 HB1 LYS 52 45.538 23.566 -16.041 416 1HG LYS 52 HG2 LYS 52 47.434 24.074 -14.488 417 2HG LYS 52 HG1 LYS 52 47.920 22.382 -14.588 418 1HD LYS 52 HD2 LYS 52 48.005 22.689 -17.119 419 2HD LYS 52 HD1 LYS 52 47.853 24.421 -16.819 420 1HE LYS 52 HE2 LYS 52 49.918 24.491 -15.597 421 2HE LYS 52 HE1 LYS 52 50.007 22.720 -15.524 422 1HZ LYS 52 HZ1 LYS 52 51.265 24.039 -17.391 423 2HZ LYS 52 HZ2 LYS 52 49.750 23.998 -18.157 424 3HZ LYS 52 HZ3 LYS 52 50.529 22.549 -17.727 425 H GLY 53 HN GLY 53 45.203 25.197 -14.069 426 1HA GLY 53 HA2 GLY 53 42.451 25.624 -13.288 427 2HA GLY 53 HA1 GLY 53 43.550 26.867 -13.889 428 H ASN 54 HN ASN 54 44.099 25.265 -16.367 429 HA ASN 54 HA ASN 54 41.975 26.348 -18.029 430 1HB ASN 54 HB2 ASN 54 44.441 26.109 -18.561 431 2HB ASN 54 HB1 ASN 54 44.172 24.373 -18.713 432 1HD2 ASN 54 HD21 ASN 54 43.300 27.529 -20.142 433 2HD2 ASN 54 HD22 ASN 54 42.773 26.894 -21.625 434 H TYR 55 HN TYR 55 42.747 23.129 -16.731 435 HA TYR 55 HA TYR 55 40.359 22.008 -18.162 436 1HB TYR 55 HB2 TYR 55 42.669 21.031 -18.536 437 2HB TYR 55 HB1 TYR 55 42.676 20.564 -16.835 438 HD1 TYR 55 HD1 TYR 55 41.302 19.869 -20.151 439 HD2 TYR 55 HD2 TYR 55 41.033 18.911 -15.972 440 HE1 TYR 55 HE1 TYR 55 39.981 17.844 -20.700 441 HE2 TYR 55 HE2 TYR 55 39.713 16.885 -16.521 442 HH TYR 55 HH TYR 55 39.636 15.379 -19.083 443 H HIS 56 HN HIS 56 38.588 21.679 -16.863 444 HA HIS 56 HA HIS 56 39.061 21.158 -13.944 445 1HB HIS 56 HB2 HIS 56 37.564 23.254 -15.377 446 2HB HIS 56 HB1 HIS 56 36.660 22.490 -14.070 447 HD1 HIS 56 HD1 HIS 56 38.030 22.360 -11.702 448 HD2 HIS 56 HD2 HIS 56 39.394 25.138 -14.488 449 HE1 HIS 56 HE1 HIS 56 39.496 23.987 -10.431 450 H SER 57 HN SER 57 37.761 19.600 -13.019 451 HA SER 57 HA SER 57 35.872 18.129 -14.830 452 1HB SER 57 HB2 SER 57 37.663 17.362 -12.517 453 2HB SER 57 HB1 SER 57 36.359 16.305 -13.045 454 HG SER 57 HG SER 57 38.444 15.930 -14.060 455 H VAL 58 HN VAL 58 33.746 18.624 -14.323 456 HA VAL 58 HA VAL 58 33.139 19.412 -11.501 457 HB VAL 58 HB VAL 58 31.400 20.762 -12.409 458 1HG1 VAL 58 HG11 VAL 58 32.663 22.286 -13.552 459 2HG1 VAL 58 HG12 VAL 58 33.245 21.092 -14.713 460 3HG1 VAL 58 HG13 VAL 58 33.977 21.196 -13.112 461 1HG2 VAL 58 HG21 VAL 58 31.572 18.828 -14.655 462 2HG2 VAL 58 HG22 VAL 58 31.189 20.489 -15.098 463 3HG2 VAL 58 HG23 VAL 58 30.161 19.621 -13.959 464 H SER 59 HN SER 59 31.298 18.552 -10.453 465 HA SER 59 HA SER 59 30.299 15.947 -11.540 466 1HB SER 59 HB2 SER 59 31.260 16.890 -9.015 467 2HB SER 59 HB1 SER 59 29.557 16.492 -8.813 468 HG SER 59 HG SER 59 30.508 14.574 -8.566 469 H ILE 60 HN ILE 60 28.462 16.483 -12.749 470 HA ILE 60 HA ILE 60 26.631 18.588 -11.758 471 HB ILE 60 HB ILE 60 27.388 18.432 -14.130 472 1HG1 ILE 60 HG12 ILE 60 24.413 17.963 -13.738 473 2HG1 ILE 60 HG11 ILE 60 25.231 19.510 -13.527 474 1HG2 ILE 60 HG21 ILE 60 27.164 16.548 -15.383 475 2HG2 ILE 60 HG22 ILE 60 25.544 16.223 -14.767 476 3HG2 ILE 60 HG23 ILE 60 26.957 15.725 -13.839 477 1HD1 ILE 60 HD11 ILE 60 26.107 18.832 -16.012 478 2HD1 ILE 60 HD12 ILE 60 24.669 19.810 -15.721 479 3HD1 ILE 60 HD13 ILE 60 24.512 18.079 -16.019 480 H THR 61 HN THR 61 24.764 18.197 -10.720 481 HA THR 61 HA THR 61 23.864 15.361 -10.370 482 HB THR 61 HB THR 61 22.945 17.946 -9.053 483 HG1 THR 61 HG1 THR 61 24.740 17.826 -8.008 484 1HG2 THR 61 HG21 THR 61 21.912 16.558 -7.415 485 2HG2 THR 61 HG22 THR 61 22.736 15.117 -8.011 486 3HG2 THR 61 HG23 THR 61 21.458 15.862 -8.972 487 H ILE 62 HN ILE 62 21.961 14.648 -11.398 488 HA ILE 62 HA ILE 62 20.101 16.712 -12.503 489 HB ILE 62 HB ILE 62 21.531 14.513 -14.029 490 1HG1 ILE 62 HG12 ILE 62 21.467 17.540 -14.283 491 2HG1 ILE 62 HG11 ILE 62 22.841 16.555 -13.786 492 1HG2 ILE 62 HG21 ILE 62 18.980 15.935 -14.553 493 2HG2 ILE 62 HG22 ILE 62 19.545 14.376 -15.153 494 3HG2 ILE 62 HG23 ILE 62 20.100 15.867 -15.913 495 1HD1 ILE 62 HD11 ILE 62 22.050 15.458 -16.236 496 2HD1 ILE 62 HD12 ILE 62 23.451 16.492 -15.955 497 3HD1 ILE 62 HD13 ILE 62 21.919 17.202 -16.468 498 H ASN 63 HN ASN 63 17.961 16.056 -12.469 499 HA ASN 63 HA ASN 63 17.410 13.238 -11.598 500 1HB ASN 63 HB2 ASN 63 15.580 14.127 -10.347 501 2HB ASN 63 HB1 ASN 63 16.900 15.261 -10.081 502 1HD2 ASN 63 HD21 ASN 63 13.635 15.069 -10.993 503 2HD2 ASN 63 HD22 ASN 63 13.488 16.601 -11.710 504 H ALA 64 HN ALA 64 17.769 13.338 -14.232 505 HA ALA 64 HA ALA 64 15.560 14.236 -15.839 506 1HB ALA 64 HB1 ALA 64 16.756 12.162 -17.218 507 2HB ALA 64 HB2 ALA 64 18.027 12.645 -16.094 508 3HB ALA 64 HB3 ALA 64 17.336 13.828 -17.205 509 H THR 65 HN THR 65 13.597 13.307 -16.168 510 HA THR 65 HA THR 65 12.740 11.003 -14.661 511 HB THR 65 HB THR 65 10.649 11.365 -16.055 512 HG1 THR 65 HG1 THR 65 11.055 12.308 -17.879 513 1HG2 THR 65 HG21 THR 65 10.433 12.625 -14.163 514 2HG2 THR 65 HG22 THR 65 10.650 13.965 -15.288 515 3HG2 THR 65 HG23 THR 65 12.021 13.367 -14.353 516 H HIS 66 HN HIS 66 14.498 11.191 -17.566 517 HA HIS 66 HA HIS 66 13.685 8.402 -18.306 518 1HB HIS 66 HB2 HIS 66 12.797 10.214 -19.805 519 2HB HIS 66 HB1 HIS 66 14.458 10.682 -20.151 520 HD1 HIS 66 HD1 HIS 66 15.000 9.833 -22.428 521 HD2 HIS 66 HD2 HIS 66 12.841 7.031 -20.224 522 HE1 HIS 66 HE1 HIS 66 14.837 7.758 -23.870 523 H ILE 67 HN ILE 67 15.445 7.157 -19.301 524 HA ILE 67 HA ILE 67 18.023 7.558 -18.054 525 HB ILE 67 HB ILE 67 16.884 5.733 -20.182 526 1HG1 ILE 67 HG12 ILE 67 16.159 5.399 -17.837 527 2HG1 ILE 67 HG11 ILE 67 17.122 4.039 -18.408 528 1HG2 ILE 67 HG21 ILE 67 19.661 5.552 -18.977 529 2HG2 ILE 67 HG22 ILE 67 19.322 6.115 -20.614 530 3HG2 ILE 67 HG23 ILE 67 18.950 4.452 -20.158 531 1HD1 ILE 67 HD11 ILE 67 19.142 5.286 -17.371 532 2HD1 ILE 67 HD12 ILE 67 18.010 4.505 -16.266 533 3HD1 ILE 67 HD13 ILE 67 17.935 6.249 -16.520 534 H GLU 68 HN GLU 68 16.990 7.752 -21.492 535 HA GLU 68 HA GLU 68 19.546 8.728 -22.441 536 1HB GLU 68 HB2 GLU 68 16.735 8.575 -23.531 537 2HB GLU 68 HB1 GLU 68 18.054 9.263 -24.477 538 1HG GLU 68 HG2 GLU 68 18.888 7.224 -24.958 539 2HG GLU 68 HG1 GLU 68 18.826 6.731 -23.266 540 H GLN 69 HN GLN 69 16.918 10.346 -20.844 541 HA GLN 69 HA GLN 69 17.064 12.936 -22.051 542 1HB GLN 69 HB2 GLN 69 15.348 12.014 -20.432 543 2HB GLN 69 HB1 GLN 69 16.525 12.262 -19.143 544 1HG GLN 69 HG2 GLN 69 16.643 14.674 -19.760 545 2HG GLN 69 HG1 GLN 69 15.395 14.400 -20.975 546 1HE2 GLN 69 HE21 GLN 69 15.678 15.675 -17.979 547 2HE2 GLN 69 HE22 GLN 69 14.178 15.240 -17.313 548 H VAL 70 HN VAL 70 18.840 11.583 -19.231 549 HA VAL 70 HA VAL 70 20.344 13.931 -18.614 550 HB VAL 70 HB VAL 70 20.006 11.762 -17.294 551 1HG1 VAL 70 HG11 VAL 70 22.477 10.810 -18.730 552 2HG1 VAL 70 HG12 VAL 70 20.874 10.394 -19.334 553 3HG1 VAL 70 HG13 VAL 70 21.362 9.891 -17.716 554 1HG2 VAL 70 HG21 VAL 70 22.171 11.977 -16.162 555 2HG2 VAL 70 HG22 VAL 70 21.569 13.572 -16.616 556 3HG2 VAL 70 HG23 VAL 70 22.843 12.806 -17.566 557 H GLU 71 HN GLU 71 20.790 11.501 -21.138 558 HA GLU 71 HA GLU 71 23.549 12.077 -21.773 559 1HB GLU 71 HB2 GLU 71 21.243 10.597 -22.866 560 2HB GLU 71 HB1 GLU 71 22.339 11.205 -24.104 561 1HG GLU 71 HG2 GLU 71 23.263 9.111 -23.564 562 2HG GLU 71 HG1 GLU 71 24.224 10.230 -22.598 563 H THR 72 HN THR 72 20.465 13.196 -23.255 564 HA THR 72 HA THR 72 21.670 15.018 -25.122 565 HB THR 72 HB THR 72 19.325 16.008 -25.098 566 HG1 THR 72 HG1 THR 72 18.127 15.566 -23.456 567 1HG2 THR 72 HG21 THR 72 19.323 12.987 -25.222 568 2HG2 THR 72 HG22 THR 72 20.076 13.992 -26.461 569 3HG2 THR 72 HG23 THR 72 18.341 14.111 -26.163 570 H LEU 73 HN LEU 73 20.581 15.401 -21.749 571 HA LEU 73 HA LEU 73 20.851 18.235 -21.522 572 1HB LEU 73 HB2 LEU 73 20.700 15.851 -19.778 573 2HB LEU 73 HB1 LEU 73 21.526 17.227 -19.049 574 HG LEU 73 HG LEU 73 19.585 18.673 -19.661 575 1HD1 LEU 73 HD11 LEU 73 18.593 17.586 -21.513 576 2HD1 LEU 73 HD12 LEU 73 17.449 17.316 -20.200 577 3HD1 LEU 73 HD13 LEU 73 18.547 16.032 -20.684 578 1HD2 LEU 73 HD21 LEU 73 18.887 16.210 -18.028 579 2HD2 LEU 73 HD22 LEU 73 18.043 17.757 -17.959 580 3HD2 LEU 73 HD23 LEU 73 19.718 17.643 -17.420 581 H TYR 74 HN TYR 74 23.232 15.595 -21.137 582 HA TYR 74 HA TYR 74 25.441 17.210 -20.265 583 1HB TYR 74 HB2 TYR 74 25.847 14.950 -19.992 584 2HB TYR 74 HB1 TYR 74 24.962 14.512 -21.450 585 HD1 TYR 74 HD1 TYR 74 26.275 13.546 -23.109 586 HD2 TYR 74 HD2 TYR 74 27.979 16.615 -20.630 587 HE1 TYR 74 HE1 TYR 74 28.409 13.373 -24.359 588 HE2 TYR 74 HE2 TYR 74 30.113 16.439 -21.880 589 HH TYR 74 HH TYR 74 30.612 15.509 -24.541 590 H GLU 75 HN GLU 75 24.397 16.143 -23.526 591 HA GLU 75 HA GLU 75 26.479 17.396 -25.030 592 1HB GLU 75 HB2 GLU 75 24.986 15.731 -25.967 593 2HB GLU 75 HB1 GLU 75 23.577 16.733 -25.627 594 1HG GLU 75 HG2 GLU 75 25.609 18.105 -27.248 595 2HG GLU 75 HG1 GLU 75 24.942 16.672 -28.030 596 H GLU 76 HN GLU 76 23.363 18.641 -23.832 597 HA GLU 76 HA GLU 76 23.369 21.157 -25.195 598 1HB GLU 76 HB2 GLU 76 22.002 19.813 -22.967 599 2HB GLU 76 HB1 GLU 76 22.064 21.569 -22.803 600 1HG GLU 76 HG2 GLU 76 20.233 21.538 -24.153 601 2HG GLU 76 HG1 GLU 76 21.407 21.307 -25.448 602 H LEU 77 HN LEU 77 24.706 20.199 -22.009 603 HA LEU 77 HA LEU 77 25.706 22.921 -21.498 604 1HB LEU 77 HB2 LEU 77 25.947 22.151 -19.349 605 2HB LEU 77 HB1 LEU 77 24.857 20.892 -19.920 606 HG LEU 77 HG LEU 77 27.179 19.773 -20.680 607 1HD1 LEU 77 HD11 LEU 77 28.005 22.022 -19.153 608 2HD1 LEU 77 HD12 LEU 77 29.013 20.724 -19.790 609 3HD1 LEU 77 HD13 LEU 77 28.325 20.592 -18.172 610 1HD2 LEU 77 HD21 LEU 77 26.563 19.597 -17.755 611 2HD2 LEU 77 HD22 LEU 77 26.894 18.305 -18.908 612 3HD2 LEU 77 HD23 LEU 77 25.324 19.109 -18.910 613 H GLY 78 HN GLY 78 26.971 19.873 -22.741 614 1HA GLY 78 HA2 GLY 78 29.720 21.030 -22.805 615 2HA GLY 78 HA1 GLY 78 29.351 19.309 -22.907 616 H LYS 79 HN LYS 79 28.356 22.262 -24.659 617 HA LYS 79 HA LYS 79 28.673 20.741 -27.219 618 1HB LYS 79 HB2 LYS 79 27.277 22.833 -28.033 619 2HB LYS 79 HB1 LYS 79 26.476 21.516 -27.188 620 1HG LYS 79 HG2 LYS 79 25.722 23.637 -26.264 621 2HG LYS 79 HG1 LYS 79 26.693 22.805 -25.056 622 1HD LYS 79 HD2 LYS 79 28.619 24.193 -25.566 623 2HD LYS 79 HD1 LYS 79 27.774 24.933 -26.926 624 1HE LYS 79 HE2 LYS 79 27.389 26.550 -25.292 625 2HE LYS 79 HE1 LYS 79 25.983 25.506 -25.010 626 1HZ LYS 79 HZ1 LYS 79 26.955 25.633 -22.921 627 2HZ LYS 79 HZ2 LYS 79 28.539 25.603 -23.532 628 3HZ LYS 79 HZ3 LYS 79 27.601 24.186 -23.526 629 H ILE 80 HN ILE 80 30.468 22.747 -25.351 630 HA ILE 80 HA ILE 80 31.341 24.852 -27.081 631 HB ILE 80 HB ILE 80 32.939 23.349 -24.980 632 1HG1 ILE 80 HG12 ILE 80 31.777 25.656 -23.846 633 2HG1 ILE 80 HG11 ILE 80 30.470 24.854 -24.717 634 1HG2 ILE 80 HG21 ILE 80 33.780 25.354 -26.593 635 2HG2 ILE 80 HG22 ILE 80 34.354 25.145 -24.939 636 3HG2 ILE 80 HG23 ILE 80 33.067 26.300 -25.287 637 1HD1 ILE 80 HD11 ILE 80 30.302 23.453 -22.954 638 2HD1 ILE 80 HD12 ILE 80 31.808 24.049 -22.256 639 3HD1 ILE 80 HD13 ILE 80 31.844 22.765 -23.464 640 H ASP 81 HN ASP 81 33.250 24.948 -28.429 641 HA ASP 81 HA ASP 81 33.795 22.578 -29.997 642 1HB ASP 81 HB2 ASP 81 34.820 25.395 -29.787 643 2HB ASP 81 HB1 ASP 81 35.690 24.239 -30.795 644 H ILE 82 HN ILE 82 35.076 23.649 -26.982 645 HA ILE 82 HA ILE 82 37.749 22.472 -27.323 646 HB ILE 82 HB ILE 82 36.346 23.318 -24.768 647 1HG1 ILE 82 HG12 ILE 82 36.113 25.142 -26.421 648 2HG1 ILE 82 HG11 ILE 82 37.265 25.585 -25.165 649 1HG2 ILE 82 HG21 ILE 82 38.850 24.072 -24.396 650 2HG2 ILE 82 HG22 ILE 82 39.180 22.881 -25.654 651 3HG2 ILE 82 HG23 ILE 82 38.389 22.388 -24.157 652 1HD1 ILE 82 HD11 ILE 82 37.822 25.890 -27.772 653 2HD1 ILE 82 HD12 ILE 82 38.360 24.223 -27.583 654 3HD1 ILE 82 HD13 ILE 82 39.070 25.498 -26.590 655 H VAL 83 HN VAL 83 38.391 20.823 -25.475 656 HA VAL 83 HA VAL 83 36.968 18.384 -25.887 657 HB VAL 83 HB VAL 83 38.981 19.276 -23.797 658 1HG1 VAL 83 HG11 VAL 83 38.046 17.332 -22.848 659 2HG1 VAL 83 HG12 VAL 83 39.416 16.708 -23.767 660 3HG1 VAL 83 HG13 VAL 83 37.783 16.579 -24.421 661 1HG2 VAL 83 HG21 VAL 83 39.165 17.927 -26.501 662 2HG2 VAL 83 HG22 VAL 83 40.482 17.854 -25.330 663 3HG2 VAL 83 HG23 VAL 83 39.955 19.412 -25.969 664 H ARG 84 HN ARG 84 34.929 18.031 -25.150 665 HA ARG 84 HA ARG 84 34.257 18.777 -22.317 666 1HB ARG 84 HB2 ARG 84 31.943 19.081 -23.141 667 2HB ARG 84 HB1 ARG 84 33.060 20.123 -24.019 668 1HG ARG 84 HG2 ARG 84 33.003 17.675 -25.434 669 2HG ARG 84 HG1 ARG 84 31.326 18.058 -25.051 670 1HD ARG 84 HD2 ARG 84 31.484 20.213 -26.114 671 2HD ARG 84 HD1 ARG 84 33.246 20.067 -26.271 672 HE ARG 84 HE ARG 84 32.835 18.140 -27.818 673 1HH1 ARG 84 HH11 ARG 84 31.814 20.566 -29.204 674 2HH1 ARG 84 HH12 ARG 84 30.219 20.086 -29.680 675 1HH2 ARG 84 HH21 ARG 84 30.098 17.380 -27.501 676 2HH2 ARG 84 HH22 ARG 84 29.244 18.276 -28.712 677 H MET 85 HN MET 85 33.492 17.060 -21.061 678 HA MET 85 HA MET 85 32.562 14.559 -22.386 679 1HB MET 85 HB2 MET 85 35.221 15.041 -21.474 680 2HB MET 85 HB1 MET 85 34.486 13.892 -20.356 681 1HG MET 85 HG2 MET 85 33.926 12.387 -22.153 682 2HG MET 85 HG1 MET 85 34.383 13.579 -23.368 683 1HE MET 85 HE1 MET 85 36.604 11.838 -24.597 684 2HE MET 85 HE2 MET 85 37.666 13.193 -24.219 685 3HE MET 85 HE3 MET 85 35.956 13.483 -24.534 686 H VAL 86 HN VAL 86 31.611 13.037 -20.777 687 HA VAL 86 HA VAL 86 31.058 14.222 -18.093 688 HB VAL 86 HB VAL 86 29.303 14.814 -19.843 689 1HG1 VAL 86 HG11 VAL 86 28.675 11.856 -19.592 690 2HG1 VAL 86 HG12 VAL 86 29.354 12.627 -21.025 691 3HG1 VAL 86 HG13 VAL 86 27.728 13.044 -20.485 692 1HG2 VAL 86 HG21 VAL 86 27.504 14.538 -18.300 693 2HG2 VAL 86 HG22 VAL 86 28.958 14.658 -17.310 694 3HG2 VAL 86 HG23 VAL 86 28.225 13.084 -17.611 695 H LEU 87 HN LEU 87 30.453 12.628 -16.512 696 HA LEU 87 HA LEU 87 31.368 9.875 -17.146 697 1HB LEU 87 HB2 LEU 87 32.362 10.732 -15.197 698 2HB LEU 87 HB1 LEU 87 30.892 11.560 -14.696 699 HG LEU 87 HG LEU 87 30.652 8.618 -14.882 700 1HD1 LEU 87 HD11 LEU 87 31.869 9.312 -12.338 701 2HD1 LEU 87 HD12 LEU 87 32.971 9.641 -13.674 702 3HD1 LEU 87 HD13 LEU 87 32.299 8.024 -13.464 703 1HD2 LEU 87 HD21 LEU 87 29.900 9.515 -12.356 704 2HD2 LEU 87 HD22 LEU 87 28.826 9.335 -13.743 705 3HD2 LEU 87 HD23 LEU 87 29.562 10.900 -13.396 Start of MODEL 2 1 1H MET 1 HT1 MET 1 21.672 8.427 -26.817 2 2H MET 1 HT2 MET 1 20.760 9.518 -27.746 3 3H MET 1 HT3 MET 1 20.587 9.485 -26.057 4 HA MET 1 HA MET 1 22.921 10.218 -25.817 5 1HB MET 1 HB2 MET 1 22.924 9.329 -28.481 6 2HB MET 1 HB1 MET 1 23.127 11.077 -28.595 7 1HG MET 1 HG2 MET 1 24.890 10.763 -26.706 8 2HG MET 1 HG1 MET 1 24.871 9.067 -27.186 9 1HE MET 1 HE1 MET 1 28.013 11.142 -28.422 10 2HE MET 1 HE2 MET 1 27.751 9.444 -28.039 11 3HE MET 1 HE3 MET 1 27.130 10.689 -26.957 12 H LYS 2 HN LYS 2 20.956 11.605 -28.491 13 HA LYS 2 HA LYS 2 20.430 13.987 -26.758 14 1HB LYS 2 HB2 LYS 2 22.215 13.811 -28.956 15 2HB LYS 2 HB1 LYS 2 20.815 14.718 -29.528 16 1HG LYS 2 HG2 LYS 2 21.651 15.505 -26.831 17 2HG LYS 2 HG1 LYS 2 22.908 15.765 -28.042 18 1HD LYS 2 HD2 LYS 2 20.441 16.600 -29.194 19 2HD LYS 2 HD1 LYS 2 20.532 17.308 -27.580 20 1HE LYS 2 HE2 LYS 2 22.890 18.073 -28.154 21 2HE LYS 2 HE1 LYS 2 22.557 17.577 -29.825 22 1HZ LYS 2 HZ1 LYS 2 21.941 19.874 -29.559 23 2HZ LYS 2 HZ2 LYS 2 20.980 19.512 -28.205 24 3HZ LYS 2 HZ3 LYS 2 20.529 18.953 -29.746 25 H THR 3 HN THR 3 19.682 12.674 -30.022 26 HA THR 3 HA THR 3 16.937 13.740 -29.887 27 HB THR 3 HB THR 3 16.854 12.620 -32.169 28 HG1 THR 3 HG1 THR 3 18.313 11.155 -32.443 29 1HG2 THR 3 HG21 THR 3 18.677 14.141 -33.133 30 2HG2 THR 3 HG22 THR 3 19.026 14.593 -31.465 31 3HG2 THR 3 HG23 THR 3 17.436 14.920 -32.152 32 H LYS 4 HN LYS 4 15.295 11.921 -30.899 33 HA LYS 4 HA LYS 4 14.030 9.994 -30.435 34 1HB LYS 4 HB2 LYS 4 16.580 9.220 -30.948 35 2HB LYS 4 HB1 LYS 4 16.405 8.596 -29.308 36 1HG LYS 4 HG2 LYS 4 14.052 8.066 -30.968 37 2HG LYS 4 HG1 LYS 4 15.520 7.339 -31.621 38 1HD LYS 4 HD2 LYS 4 15.517 5.755 -30.024 39 2HD LYS 4 HD1 LYS 4 15.425 6.973 -28.753 40 1HE LYS 4 HE2 LYS 4 12.901 6.521 -30.263 41 2HE LYS 4 HE1 LYS 4 13.430 5.186 -29.221 42 1HZ LYS 4 HZ1 LYS 4 12.865 7.989 -28.481 43 2HZ LYS 4 HZ2 LYS 4 13.896 7.039 -27.525 44 3HZ LYS 4 HZ3 LYS 4 12.287 6.568 -27.768 45 H LEU 5 HN LEU 5 13.243 11.523 -28.638 46 HA LEU 5 HA LEU 5 13.900 10.394 -25.936 47 1HB LEU 5 HB2 LEU 5 14.134 12.979 -26.886 48 2HB LEU 5 HB1 LEU 5 12.551 13.013 -26.110 49 HG LEU 5 HG LEU 5 14.642 11.624 -24.556 50 1HD1 LEU 5 HD11 LEU 5 15.484 13.934 -25.802 51 2HD1 LEU 5 HD12 LEU 5 16.128 13.315 -24.282 52 3HD1 LEU 5 HD13 LEU 5 14.863 14.543 -24.267 53 1HD2 LEU 5 HD21 LEU 5 12.357 12.131 -23.723 54 2HD2 LEU 5 HD22 LEU 5 12.686 13.854 -23.910 55 3HD2 LEU 5 HD23 LEU 5 13.596 12.905 -22.734 56 H ASN 6 HN ASN 6 12.262 8.713 -26.376 57 HA ASN 6 HA ASN 6 9.442 9.640 -26.587 58 1HB ASN 6 HB2 ASN 6 10.726 7.698 -27.868 59 2HB ASN 6 HB1 ASN 6 10.308 6.773 -26.426 60 1HD2 ASN 6 HD21 ASN 6 8.053 6.258 -26.073 61 2HD2 ASN 6 HD22 ASN 6 6.860 6.573 -27.238 62 H GLU 7 HN GLU 7 11.712 8.275 -24.276 63 HA GLU 7 HA GLU 7 11.513 7.879 -21.966 64 1HB GLU 7 HB2 GLU 7 9.721 9.964 -22.666 65 2HB GLU 7 HB1 GLU 7 8.838 8.905 -21.567 66 1HG GLU 7 HG2 GLU 7 11.649 9.839 -20.970 67 2HG GLU 7 HG1 GLU 7 10.236 10.778 -20.495 68 H LEU 8 HN LEU 8 11.354 5.621 -21.948 69 HA LEU 8 HA LEU 8 8.574 4.481 -21.993 70 1HB LEU 8 HB2 LEU 8 11.175 3.659 -23.232 71 2HB LEU 8 HB1 LEU 8 10.051 2.391 -22.741 72 HG LEU 8 HG LEU 8 8.708 4.579 -24.140 73 1HD1 LEU 8 HD11 LEU 8 10.310 2.934 -26.019 74 2HD1 LEU 8 HD12 LEU 8 11.192 4.195 -25.158 75 3HD1 LEU 8 HD13 LEU 8 9.796 4.616 -26.150 76 1HD2 LEU 8 HD21 LEU 8 7.797 2.656 -25.420 77 2HD2 LEU 8 HD22 LEU 8 7.701 2.384 -23.680 78 3HD2 LEU 8 HD23 LEU 8 8.961 1.594 -24.628 79 H LEU 9 HN LEU 9 10.491 5.438 -19.751 80 HA LEU 9 HA LEU 9 10.511 2.882 -18.172 81 1HB LEU 9 HB2 LEU 9 12.393 5.266 -18.193 82 2HB LEU 9 HB1 LEU 9 12.479 3.959 -17.012 83 HG LEU 9 HG LEU 9 12.400 2.561 -19.371 84 1HD1 LEU 9 HD11 LEU 9 13.708 5.235 -19.820 85 2HD1 LEU 9 HD12 LEU 9 12.627 4.340 -20.886 86 3HD1 LEU 9 HD13 LEU 9 14.294 3.808 -20.671 87 1HD2 LEU 9 HD21 LEU 9 14.592 1.943 -18.819 88 2HD2 LEU 9 HD22 LEU 9 13.985 2.556 -17.281 89 3HD2 LEU 9 HD23 LEU 9 15.021 3.569 -18.286 90 H GLU 10 HN GLU 10 10.397 6.445 -17.917 91 HA GLU 10 HA GLU 10 9.220 7.868 -16.461 92 1HB GLU 10 HB2 GLU 10 7.599 5.318 -16.428 93 2HB GLU 10 HB1 GLU 10 7.116 6.709 -15.462 94 1HG GLU 10 HG2 GLU 10 5.961 7.077 -17.464 95 2HG GLU 10 HG1 GLU 10 7.417 8.045 -17.690 96 H PHE 11 HN PHE 11 11.507 6.246 -15.452 97 HA PHE 11 HA PHE 11 10.739 5.974 -12.565 98 1HB PHE 11 HB2 PHE 11 12.821 4.708 -14.354 99 2HB PHE 11 HB1 PHE 11 12.982 4.654 -12.599 100 HD1 PHE 11 HD1 PHE 11 10.543 4.102 -11.418 101 HD2 PHE 11 HD2 PHE 11 11.874 2.807 -15.293 102 HE1 PHE 11 HE1 PHE 11 8.951 2.203 -11.330 103 HE2 PHE 11 HE2 PHE 11 10.281 0.909 -15.205 104 HZ PHE 11 HZ PHE 11 8.820 0.607 -13.224 105 HA PRO 12 HA PRO 12 13.176 9.775 -12.460 106 1HB PRO 12 HB2 PRO 12 12.487 10.440 -9.895 107 2HB PRO 12 HB1 PRO 12 11.447 10.764 -11.295 108 1HG PRO 12 HG2 PRO 12 11.294 8.567 -9.290 109 2HG PRO 12 HG1 PRO 12 9.992 9.496 -10.049 110 1HD PRO 12 HD2 PRO 12 10.674 6.979 -10.822 111 2HD PRO 12 HD1 PRO 12 9.964 8.180 -11.924 112 H THR 13 HN THR 13 15.326 9.253 -12.321 113 HA THR 13 HA THR 13 16.332 8.191 -9.703 114 HB THR 13 HB THR 13 16.204 6.410 -11.413 115 HG1 THR 13 HG1 THR 13 17.980 5.762 -10.549 116 1HG2 THR 13 HG21 THR 13 16.860 8.437 -13.199 117 2HG2 THR 13 HG22 THR 13 16.791 6.716 -13.572 118 3HG2 THR 13 HG23 THR 13 18.326 7.461 -13.128 119 HA PRO 14 HA PRO 14 19.088 11.626 -9.977 120 1HB PRO 14 HB2 PRO 14 21.057 10.748 -8.287 121 2HB PRO 14 HB1 PRO 14 19.482 11.334 -7.717 122 1HG PRO 14 HG2 PRO 14 20.450 8.540 -8.059 123 2HG PRO 14 HG1 PRO 14 19.445 9.238 -6.779 124 1HD PRO 14 HD2 PRO 14 18.439 7.750 -8.823 125 2HD PRO 14 HD1 PRO 14 17.515 9.020 -7.992 126 H PHE 15 HN PHE 15 20.477 12.059 -11.638 127 HA PHE 15 HA PHE 15 22.217 9.863 -12.691 128 1HB PHE 15 HB2 PHE 15 20.933 12.352 -13.810 129 2HB PHE 15 HB1 PHE 15 22.276 11.585 -14.654 130 HD1 PHE 15 HD1 PHE 15 18.816 11.732 -14.516 131 HD2 PHE 15 HD2 PHE 15 22.002 8.856 -14.713 132 HE1 PHE 15 HE1 PHE 15 17.256 10.068 -15.486 133 HE2 PHE 15 HE2 PHE 15 20.439 7.192 -15.681 134 HZ PHE 15 HZ PHE 15 18.065 7.799 -16.067 135 H THR 16 HN THR 16 24.106 10.074 -11.429 136 HA THR 16 HA THR 16 25.315 12.682 -10.862 137 HB THR 16 HB THR 16 26.534 9.899 -10.731 138 HG1 THR 16 HG1 THR 16 25.288 9.516 -9.094 139 1HG2 THR 16 HG21 THR 16 27.337 11.461 -8.556 140 2HG2 THR 16 HG22 THR 16 27.365 12.570 -9.927 141 3HG2 THR 16 HG23 THR 16 28.302 11.077 -9.981 142 H TYR 17 HN TYR 17 25.636 13.635 -12.959 143 HA TYR 17 HA TYR 17 27.291 12.103 -14.908 144 1HB TYR 17 HB2 TYR 17 25.342 14.354 -14.926 145 2HB TYR 17 HB1 TYR 17 26.604 14.402 -16.156 146 HD1 TYR 17 HD1 TYR 17 25.618 13.728 -18.169 147 HD2 TYR 17 HD2 TYR 17 24.816 11.484 -14.593 148 HE1 TYR 17 HE1 TYR 17 24.403 12.034 -19.506 149 HE2 TYR 17 HE2 TYR 17 23.601 9.789 -15.933 150 HH TYR 17 HH TYR 17 23.882 9.198 -18.843 151 H LYS 18 HN LYS 18 29.456 12.326 -14.441 152 HA LYS 18 HA LYS 18 30.549 14.820 -13.336 153 1HB LYS 18 HB2 LYS 18 31.197 12.145 -13.259 154 2HB LYS 18 HB1 LYS 18 32.361 12.754 -14.435 155 1HG LYS 18 HG2 LYS 18 31.932 14.259 -11.870 156 2HG LYS 18 HG1 LYS 18 32.946 12.816 -11.869 157 1HD LYS 18 HD2 LYS 18 34.614 14.219 -12.502 158 2HD LYS 18 HD1 LYS 18 33.862 14.154 -14.096 159 1HE LYS 18 HE2 LYS 18 33.955 16.471 -13.717 160 2HE LYS 18 HE1 LYS 18 32.333 16.088 -13.108 161 1HZ LYS 18 HZ1 LYS 18 33.362 15.705 -10.900 162 2HZ LYS 18 HZ2 LYS 18 33.494 17.314 -11.426 163 3HZ LYS 18 HZ3 LYS 18 34.836 16.276 -11.514 164 H VAL 19 HN VAL 19 30.047 16.331 -15.052 165 HA VAL 19 HA VAL 19 30.997 15.867 -17.785 166 HB VAL 19 HB VAL 19 30.042 18.414 -16.429 167 1HG1 VAL 19 HG11 VAL 19 30.243 19.339 -18.466 168 2HG1 VAL 19 HG12 VAL 19 29.200 18.093 -19.151 169 3HG1 VAL 19 HG13 VAL 19 30.942 17.837 -19.069 170 1HG2 VAL 19 HG21 VAL 19 28.070 17.010 -18.047 171 2HG2 VAL 19 HG22 VAL 19 27.935 17.599 -16.391 172 3HG2 VAL 19 HG23 VAL 19 28.623 16.007 -16.707 173 H MET 20 HN MET 20 33.267 15.606 -17.654 174 HA MET 20 HA MET 20 34.842 17.876 -16.502 175 1HB MET 20 HB2 MET 20 35.215 15.582 -15.632 176 2HB MET 20 HB1 MET 20 35.615 15.039 -17.262 177 1HG MET 20 HG2 MET 20 37.495 16.650 -17.329 178 2HG MET 20 HG1 MET 20 37.109 17.156 -15.684 179 1HE MET 20 HE1 MET 20 40.354 15.373 -15.158 180 2HE MET 20 HE2 MET 20 39.601 16.791 -15.882 181 3HE MET 20 HE3 MET 20 40.093 15.446 -16.908 182 H GLY 21 HN GLY 21 35.779 19.252 -17.933 183 1HA GLY 21 HA2 GLY 21 36.807 18.269 -20.513 184 2HA GLY 21 HA1 GLY 21 35.512 19.462 -20.624 185 H GLN 22 HN GLN 22 37.165 20.856 -21.661 186 HA GLN 22 HA GLN 22 39.519 21.752 -20.255 187 1HB GLN 22 HB2 GLN 22 38.232 22.111 -22.746 188 2HB GLN 22 HB1 GLN 22 38.390 23.723 -22.051 189 1HG GLN 22 HG2 GLN 22 40.605 23.744 -22.448 190 2HG GLN 22 HG1 GLN 22 40.815 22.203 -21.617 191 1HE2 GLN 22 HE21 GLN 22 41.442 23.556 -24.537 192 2HE2 GLN 22 HE22 GLN 22 41.245 22.206 -25.547 193 H ALA 23 HN ALA 23 39.771 24.102 -19.522 194 HA ALA 23 HA ALA 23 37.948 24.721 -17.401 195 1HB ALA 23 HB1 ALA 23 40.043 26.364 -18.861 196 2HB ALA 23 HB2 ALA 23 40.300 25.378 -17.422 197 3HB ALA 23 HB3 ALA 23 39.306 26.831 -17.328 198 H LEU 24 HN LEU 24 35.812 25.144 -17.985 199 HA LEU 24 HA LEU 24 35.351 27.380 -19.938 200 1HB LEU 24 HB2 LEU 24 34.455 24.629 -19.854 201 2HB LEU 24 HB1 LEU 24 33.066 25.709 -19.764 202 HG LEU 24 HG LEU 24 33.614 25.185 -22.107 203 1HD1 LEU 24 HD11 LEU 24 33.176 27.308 -22.819 204 2HD1 LEU 24 HD12 LEU 24 34.549 27.992 -21.949 205 3HD1 LEU 24 HD13 LEU 24 33.047 27.643 -21.092 206 1HD2 LEU 24 HD21 LEU 24 36.205 26.688 -21.781 207 2HD2 LEU 24 HD22 LEU 24 35.717 25.594 -23.074 208 3HD2 LEU 24 HD23 LEU 24 36.140 24.950 -21.488 209 HA PRO 25 HA PRO 25 33.455 29.107 -16.263 210 1HB PRO 25 HB2 PRO 25 32.750 31.497 -17.393 211 2HB PRO 25 HB1 PRO 25 34.402 31.126 -16.862 212 1HG PRO 25 HG2 PRO 25 33.242 31.095 -19.600 213 2HG PRO 25 HG1 PRO 25 34.847 31.609 -19.058 214 1HD PRO 25 HD2 PRO 25 34.345 29.205 -20.257 215 2HD PRO 25 HD1 PRO 25 35.695 29.490 -19.137 216 H GLU 26 HN GLU 26 31.951 28.677 -19.411 217 HA GLU 26 HA GLU 26 29.254 29.425 -18.571 218 1HB GLU 26 HB2 GLU 26 28.675 28.685 -20.808 219 2HB GLU 26 HB1 GLU 26 30.207 29.551 -20.899 220 1HG GLU 26 HG2 GLU 26 30.991 27.725 -21.988 221 2HG GLU 26 HG1 GLU 26 31.012 26.944 -20.408 222 H LEU 27 HN LEU 27 31.123 26.761 -17.742 223 HA LEU 27 HA LEU 27 29.522 24.480 -18.111 224 1HB LEU 27 HB2 LEU 27 31.535 25.453 -16.133 225 2HB LEU 27 HB1 LEU 27 30.614 24.015 -15.693 226 HG LEU 27 HG LEU 27 31.974 24.282 -18.380 227 1HD1 LEU 27 HD11 LEU 27 33.278 22.550 -16.403 228 2HD1 LEU 27 HD12 LEU 27 33.332 24.257 -15.964 229 3HD1 LEU 27 HD13 LEU 27 33.989 23.724 -17.511 230 1HD2 LEU 27 HD21 LEU 27 30.461 22.501 -18.478 231 2HD2 LEU 27 HD22 LEU 27 30.669 22.099 -16.774 232 3HD2 LEU 27 HD23 LEU 27 31.927 21.684 -17.939 233 H VAL 28 HN VAL 28 29.519 26.545 -15.158 234 HA VAL 28 HA VAL 28 27.199 25.322 -13.997 235 HB VAL 28 HB VAL 28 29.009 26.696 -12.886 236 1HG1 VAL 28 HG11 VAL 28 28.931 28.543 -14.606 237 2HG1 VAL 28 HG12 VAL 28 28.871 29.105 -12.936 238 3HG1 VAL 28 HG13 VAL 28 27.396 29.052 -13.901 239 1HG2 VAL 28 HG21 VAL 28 26.147 27.588 -12.409 240 2HG2 VAL 28 HG22 VAL 28 27.476 27.739 -11.259 241 3HG2 VAL 28 HG23 VAL 28 26.896 26.142 -11.731 242 H ASP 29 HN ASP 29 27.544 27.992 -16.295 243 HA ASP 29 HA ASP 29 24.894 29.086 -16.029 244 1HB ASP 29 HB2 ASP 29 26.946 29.038 -18.262 245 2HB ASP 29 HB1 ASP 29 25.478 30.012 -18.322 246 H GLN 30 HN GLN 30 26.228 26.920 -18.575 247 HA GLN 30 HA GLN 30 23.652 26.360 -19.753 248 1HB GLN 30 HB2 GLN 30 26.198 26.116 -20.539 249 2HB GLN 30 HB1 GLN 30 25.948 24.462 -19.977 250 1HG GLN 30 HG2 GLN 30 24.559 23.962 -21.701 251 2HG GLN 30 HG1 GLN 30 23.721 25.508 -21.589 252 1HE2 GLN 30 HE21 GLN 30 24.369 27.187 -23.025 253 2HE2 GLN 30 HE22 GLN 30 25.619 27.012 -24.160 254 H VAL 31 HN VAL 31 25.634 24.641 -17.328 255 HA VAL 31 HA VAL 31 24.160 22.220 -17.198 256 HB VAL 31 HB VAL 31 25.860 23.841 -15.321 257 1HG1 VAL 31 HG11 VAL 31 25.616 21.535 -13.926 258 2HG1 VAL 31 HG12 VAL 31 23.980 21.664 -14.567 259 3HG1 VAL 31 HG13 VAL 31 24.645 22.967 -13.585 260 1HG2 VAL 31 HG21 VAL 31 26.937 22.492 -17.060 261 2HG2 VAL 31 HG22 VAL 31 26.049 21.064 -16.532 262 3HG2 VAL 31 HG23 VAL 31 27.265 21.785 -15.478 263 H VAL 32 HN VAL 32 23.742 25.137 -15.114 264 HA VAL 32 HA VAL 32 21.382 24.148 -13.807 265 HB VAL 32 HB VAL 32 23.008 25.985 -13.101 266 1HG1 VAL 32 HG11 VAL 32 21.241 27.711 -14.857 267 2HG1 VAL 32 HG12 VAL 32 22.871 27.209 -15.302 268 3HG1 VAL 32 HG13 VAL 32 22.619 28.233 -13.890 269 1HG2 VAL 32 HG21 VAL 32 20.043 26.626 -13.045 270 2HG2 VAL 32 HG22 VAL 32 21.255 27.267 -11.937 271 3HG2 VAL 32 HG23 VAL 32 20.876 25.545 -11.928 272 H GLU 33 HN GLU 33 21.808 26.067 -16.785 273 HA GLU 33 HA GLU 33 18.990 26.727 -17.064 274 1HB GLU 33 HB2 GLU 33 21.486 27.317 -18.293 275 2HB GLU 33 HB1 GLU 33 20.427 26.698 -19.559 276 1HG GLU 33 HG2 GLU 33 19.520 28.811 -17.596 277 2HG GLU 33 HG1 GLU 33 20.312 29.220 -19.117 278 H VAL 34 HN VAL 34 21.083 24.369 -18.802 279 HA VAL 34 HA VAL 34 18.910 23.181 -20.270 280 HB VAL 34 HB VAL 34 21.403 23.194 -20.778 281 1HG1 VAL 34 HG11 VAL 34 21.632 20.692 -19.154 282 2HG1 VAL 34 HG12 VAL 34 21.812 22.241 -18.330 283 3HG1 VAL 34 HG13 VAL 34 22.888 21.821 -19.662 284 1HG2 VAL 34 HG21 VAL 34 21.235 20.572 -21.392 285 2HG2 VAL 34 HG22 VAL 34 20.346 21.816 -22.270 286 3HG2 VAL 34 HG23 VAL 34 19.543 20.885 -21.007 287 H VAL 35 HN VAL 35 20.209 22.539 -17.039 288 HA VAL 35 HA VAL 35 18.888 19.936 -16.807 289 HB VAL 35 HB VAL 35 21.027 20.826 -15.647 290 1HG1 VAL 35 HG11 VAL 35 19.814 22.891 -14.794 291 2HG1 VAL 35 HG12 VAL 35 20.741 22.007 -13.585 292 3HG1 VAL 35 HG13 VAL 35 18.987 21.832 -13.653 293 1HG2 VAL 35 HG21 VAL 35 20.816 19.097 -14.163 294 2HG2 VAL 35 HG22 VAL 35 19.359 18.768 -15.100 295 3HG2 VAL 35 HG23 VAL 35 19.248 19.653 -13.581 296 H GLN 36 HN GLN 36 18.122 23.291 -15.866 297 HA GLN 36 HA GLN 36 15.751 22.476 -14.335 298 1HB GLN 36 HB2 GLN 36 15.576 24.783 -13.858 299 2HB GLN 36 HB1 GLN 36 17.310 24.537 -14.051 300 1HG GLN 36 HG2 GLN 36 17.264 25.428 -16.292 301 2HG GLN 36 HG1 GLN 36 15.501 25.454 -16.305 302 1HE2 GLN 36 HE21 GLN 36 18.366 27.159 -15.166 303 2HE2 GLN 36 HE22 GLN 36 17.541 28.496 -14.526 304 H ARG 37 HN ARG 37 16.458 23.316 -17.668 305 HA ARG 37 HA ARG 37 13.723 23.992 -18.422 306 1HB ARG 37 HB2 ARG 37 16.364 23.486 -19.743 307 2HB ARG 37 HB1 ARG 37 14.914 23.445 -20.747 308 1HG ARG 37 HG2 ARG 37 14.287 25.694 -19.761 309 2HG ARG 37 HG1 ARG 37 15.890 25.738 -19.026 310 1HD ARG 37 HD2 ARG 37 15.487 25.313 -22.003 311 2HD ARG 37 HD1 ARG 37 15.711 26.920 -21.284 312 HE ARG 37 HE ARG 37 17.838 25.829 -20.226 313 1HH1 ARG 37 HH11 ARG 37 17.366 23.254 -21.795 314 2HH1 ARG 37 HH12 ARG 37 18.445 23.474 -23.131 315 1HH2 ARG 37 HH21 ARG 37 18.848 26.882 -22.587 316 2HH2 ARG 37 HH22 ARG 37 19.285 25.532 -23.581 317 H HIS 38 HN HIS 38 15.770 21.064 -18.768 318 HA HIS 38 HA HIS 38 13.479 19.554 -19.899 319 1HB HIS 38 HB2 HIS 38 16.411 18.995 -19.406 320 2HB HIS 38 HB1 HIS 38 15.306 17.780 -20.049 321 HD1 HIS 38 HD1 HIS 38 13.928 18.639 -22.290 322 HD2 HIS 38 HD2 HIS 38 17.482 20.620 -21.368 323 HE1 HIS 38 HE1 HIS 38 14.640 19.850 -24.397 324 H ALA 39 HN ALA 39 15.672 19.363 -17.063 325 HA ALA 39 HA ALA 39 13.977 17.245 -15.862 326 1HB ALA 39 HB1 ALA 39 15.865 16.780 -14.635 327 2HB ALA 39 HB2 ALA 39 16.256 18.483 -14.403 328 3HB ALA 39 HB3 ALA 39 16.651 17.687 -15.926 329 HA PRO 40 HA PRO 40 11.710 20.104 -13.388 330 1HB PRO 40 HB2 PRO 40 11.019 18.471 -11.304 331 2HB PRO 40 HB1 PRO 40 10.269 18.362 -12.909 332 1HG PRO 40 HG2 PRO 40 12.402 16.678 -11.700 333 2HG PRO 40 HG1 PRO 40 11.045 16.215 -12.735 334 1HD PRO 40 HD2 PRO 40 13.602 16.483 -13.641 335 2HD PRO 40 HD1 PRO 40 12.167 16.720 -14.663 336 H GLY 41 HN GLY 41 12.196 21.552 -11.747 337 1HA GLY 41 HA2 GLY 41 13.242 22.423 -9.810 338 2HA GLY 41 HA1 GLY 41 13.954 20.835 -9.521 339 H ASP 42 HN ASP 42 15.334 23.402 -9.387 340 HA ASP 42 HA ASP 42 17.055 23.497 -11.792 341 1HB ASP 42 HB2 ASP 42 16.323 25.191 -9.518 342 2HB ASP 42 HB1 ASP 42 18.058 25.215 -9.836 343 H TYR 43 HN TYR 43 19.223 22.851 -11.799 344 HA TYR 43 HA TYR 43 20.247 21.509 -9.316 345 1HB TYR 43 HB2 TYR 43 20.191 20.656 -12.211 346 2HB TYR 43 HB1 TYR 43 21.326 19.941 -11.069 347 HD1 TYR 43 HD1 TYR 43 17.978 19.883 -12.332 348 HD2 TYR 43 HD2 TYR 43 20.354 18.965 -8.875 349 HE1 TYR 43 HE1 TYR 43 16.185 18.390 -11.498 350 HE2 TYR 43 HE2 TYR 43 18.561 17.473 -8.037 351 HH TYR 43 HH TYR 43 15.724 16.715 -9.987 352 H THR 44 HN THR 44 22.736 21.171 -9.537 353 HA THR 44 HA THR 44 24.037 23.386 -11.063 354 HB THR 44 HB THR 44 24.778 22.890 -8.191 355 HG1 THR 44 HG1 THR 44 22.957 23.634 -7.502 356 1HG2 THR 44 HG21 THR 44 25.057 25.021 -10.240 357 2HG2 THR 44 HG22 THR 44 26.183 24.514 -8.980 358 3HG2 THR 44 HG23 THR 44 24.822 25.561 -8.578 359 HA PRO 45 HA PRO 45 27.201 20.279 -11.399 360 1HB PRO 45 HB2 PRO 45 29.061 21.817 -12.673 361 2HB PRO 45 HB1 PRO 45 27.576 21.260 -13.466 362 1HG PRO 45 HG2 PRO 45 28.317 23.944 -12.604 363 2HG PRO 45 HG1 PRO 45 27.046 23.431 -13.719 364 1HD PRO 45 HD2 PRO 45 26.812 24.189 -10.939 365 2HD PRO 45 HD1 PRO 45 25.521 23.821 -12.103 366 H THR 46 HN THR 46 29.502 19.902 -10.724 367 HA THR 46 HA THR 46 30.388 21.716 -8.498 368 HB THR 46 HB THR 46 30.808 18.717 -8.771 369 HG1 THR 46 HG1 THR 46 28.863 18.498 -8.056 370 1HG2 THR 46 HG21 THR 46 32.414 19.728 -7.293 371 2HG2 THR 46 HG22 THR 46 31.193 18.956 -6.281 372 3HG2 THR 46 HG23 THR 46 31.167 20.704 -6.517 373 H VAL 47 HN VAL 47 31.886 22.901 -9.779 374 HA VAL 47 HA VAL 47 33.708 21.615 -11.643 375 HB VAL 47 HB VAL 47 32.781 23.976 -11.712 376 1HG1 VAL 47 HG11 VAL 47 33.688 25.672 -10.324 377 2HG1 VAL 47 HG12 VAL 47 34.986 24.624 -9.751 378 3HG1 VAL 47 HG13 VAL 47 33.327 24.345 -9.220 379 1HG2 VAL 47 HG21 VAL 47 35.807 23.809 -11.752 380 2HG2 VAL 47 HG22 VAL 47 34.791 24.904 -12.689 381 3HG2 VAL 47 HG23 VAL 47 34.773 23.174 -13.032 382 H LYS 48 HN LYS 48 35.880 21.116 -11.373 383 HA LYS 48 HA LYS 48 37.085 21.501 -8.659 384 1HB LYS 48 HB2 LYS 48 36.389 19.041 -10.155 385 2HB LYS 48 HB1 LYS 48 38.004 19.044 -9.447 386 1HG LYS 48 HG2 LYS 48 36.926 18.351 -7.564 387 2HG LYS 48 HG1 LYS 48 36.534 20.060 -7.381 388 1HD LYS 48 HD2 LYS 48 34.409 19.151 -7.248 389 2HD LYS 48 HD1 LYS 48 34.516 19.419 -8.988 390 1HE LYS 48 HE2 LYS 48 35.212 17.082 -9.332 391 2HE LYS 48 HE1 LYS 48 35.162 16.801 -7.580 392 1HZ LYS 48 HZ1 LYS 48 32.868 17.754 -9.217 393 2HZ LYS 48 HZ2 LYS 48 32.842 17.409 -7.553 394 3HZ LYS 48 HZ3 LYS 48 33.073 16.159 -8.679 395 HA PRO 49 HA PRO 49 40.180 22.888 -11.665 396 1HB PRO 49 HB2 PRO 49 41.517 24.500 -9.908 397 2HB PRO 49 HB1 PRO 49 40.036 25.004 -10.743 398 1HG PRO 49 HG2 PRO 49 40.414 24.093 -7.949 399 2HG PRO 49 HG1 PRO 49 39.293 25.293 -8.605 400 1HD PRO 49 HD2 PRO 49 38.611 22.712 -7.900 401 2HD PRO 49 HD1 PRO 49 37.690 23.738 -9.019 402 H SER 50 HN SER 50 40.506 21.281 -8.580 403 HA SER 50 HA SER 50 43.328 20.957 -8.393 404 1HB SER 50 HB2 SER 50 42.696 19.056 -6.939 405 2HB SER 50 HB1 SER 50 41.678 20.457 -6.628 406 HG SER 50 HG SER 50 40.296 18.770 -6.848 407 H SER 51 HN SER 51 40.991 19.391 -10.509 408 HA SER 51 HA SER 51 42.444 17.015 -11.163 409 1HB SER 51 HB2 SER 51 40.426 18.757 -12.594 410 2HB SER 51 HB1 SER 51 41.028 17.262 -13.303 411 HG SER 51 HG SER 51 39.562 16.345 -12.113 412 H LYS 52 HN LYS 52 42.253 20.110 -12.993 413 HA LYS 52 HA LYS 52 45.096 19.810 -13.784 414 1HB LYS 52 HB2 LYS 52 42.845 18.987 -15.370 415 2HB LYS 52 HB1 LYS 52 43.628 20.354 -16.162 416 1HG LYS 52 HG2 LYS 52 45.745 19.229 -16.199 417 2HG LYS 52 HG1 LYS 52 45.156 17.957 -15.129 418 1HD LYS 52 HD2 LYS 52 44.202 16.817 -16.830 419 2HD LYS 52 HD1 LYS 52 43.513 18.281 -17.534 420 1HE LYS 52 HE2 LYS 52 46.237 18.591 -18.002 421 2HE LYS 52 HE1 LYS 52 45.969 16.857 -18.266 422 1HZ LYS 52 HZ1 LYS 52 45.459 18.051 -20.279 423 2HZ LYS 52 HZ2 LYS 52 44.400 19.091 -19.453 424 3HZ LYS 52 HZ3 LYS 52 44.019 17.442 -19.626 425 H GLY 53 HN GLY 53 45.823 21.785 -15.033 426 1HA GLY 53 HA2 GLY 53 44.727 24.201 -13.819 427 2HA GLY 53 HA1 GLY 53 46.087 24.132 -14.939 428 H ASN 54 HN ASN 54 45.053 23.038 -17.202 429 HA ASN 54 HA ASN 54 43.152 25.134 -18.103 430 1HB ASN 54 HB2 ASN 54 43.906 24.489 -20.310 431 2HB ASN 54 HB1 ASN 54 45.325 24.560 -19.267 432 1HD2 ASN 54 HD21 ASN 54 43.407 22.466 -21.279 433 2HD2 ASN 54 HD22 ASN 54 44.270 21.037 -20.972 434 H TYR 55 HN TYR 55 42.546 22.385 -16.573 435 HA TYR 55 HA TYR 55 40.235 21.662 -18.337 436 1HB TYR 55 HB2 TYR 55 42.524 20.141 -17.780 437 2HB TYR 55 HB1 TYR 55 41.288 19.477 -16.712 438 HD1 TYR 55 HD1 TYR 55 39.744 17.936 -17.555 439 HD2 TYR 55 HD2 TYR 55 41.796 20.561 -20.267 440 HE1 TYR 55 HE1 TYR 55 38.716 16.754 -19.476 441 HE2 TYR 55 HE2 TYR 55 40.767 19.379 -22.188 442 HH TYR 55 HH TYR 55 38.270 17.772 -22.231 443 H HIS 56 HN HIS 56 38.316 21.758 -17.234 444 HA HIS 56 HA HIS 56 38.409 21.913 -14.241 445 1HB HIS 56 HB2 HIS 56 36.998 23.315 -16.417 446 2HB HIS 56 HB1 HIS 56 35.953 22.858 -15.074 447 HD1 HIS 56 HD1 HIS 56 37.794 23.235 -12.685 448 HD2 HIS 56 HD2 HIS 56 37.621 25.953 -15.843 449 HE1 HIS 56 HE1 HIS 56 38.632 25.445 -11.777 450 H SER 57 HN SER 57 37.412 20.281 -13.118 451 HA SER 57 HA SER 57 35.822 18.268 -14.646 452 1HB SER 57 HB2 SER 57 37.853 18.005 -12.888 453 2HB SER 57 HB1 SER 57 36.507 17.973 -11.754 454 HG SER 57 HG SER 57 37.203 15.905 -12.738 455 H VAL 58 HN VAL 58 33.735 19.182 -14.789 456 HA VAL 58 HA VAL 58 32.479 20.174 -12.271 457 HB VAL 58 HB VAL 58 32.427 20.855 -15.102 458 1HG1 VAL 58 HG11 VAL 58 30.307 19.845 -15.361 459 2HG1 VAL 58 HG12 VAL 58 29.925 21.521 -14.973 460 3HG1 VAL 58 HG13 VAL 58 29.801 20.279 -13.728 461 1HG2 VAL 58 HG21 VAL 58 31.525 22.133 -12.516 462 2HG2 VAL 58 HG22 VAL 58 31.367 22.941 -14.076 463 3HG2 VAL 58 HG23 VAL 58 32.963 22.504 -13.467 464 H SER 59 HN SER 59 31.177 18.770 -11.205 465 HA SER 59 HA SER 59 29.997 16.449 -12.675 466 1HB SER 59 HB2 SER 59 31.417 16.208 -10.572 467 2HB SER 59 HB1 SER 59 30.120 17.015 -9.695 468 HG SER 59 HG SER 59 30.233 14.529 -10.015 469 H ILE 60 HN ILE 60 27.937 16.874 -13.416 470 HA ILE 60 HA ILE 60 26.278 18.891 -12.015 471 HB ILE 60 HB ILE 60 26.551 18.966 -14.461 472 1HG1 ILE 60 HG12 ILE 60 23.751 18.152 -13.609 473 2HG1 ILE 60 HG11 ILE 60 24.437 19.769 -13.461 474 1HG2 ILE 60 HG21 ILE 60 25.361 16.185 -14.323 475 2HG2 ILE 60 HG22 ILE 60 26.890 16.671 -15.049 476 3HG2 ILE 60 HG23 ILE 60 25.370 17.142 -15.802 477 1HD1 ILE 60 HD11 ILE 60 24.790 18.836 -16.164 478 2HD1 ILE 60 HD12 ILE 60 23.884 20.236 -15.593 479 3HD1 ILE 60 HD13 ILE 60 23.097 18.663 -15.703 480 H THR 61 HN THR 61 24.577 18.406 -10.740 481 HA THR 61 HA THR 61 23.841 15.528 -10.367 482 HB THR 61 HB THR 61 23.404 18.088 -8.789 483 HG1 THR 61 HG1 THR 61 25.244 17.484 -8.018 484 1HG2 THR 61 HG21 THR 61 22.559 16.438 -7.009 485 2HG2 THR 61 HG22 THR 61 22.365 15.289 -8.332 486 3HG2 THR 61 HG23 THR 61 21.459 16.802 -8.339 487 H ILE 62 HN ILE 62 21.783 14.813 -11.008 488 HA ILE 62 HA ILE 62 19.576 16.712 -11.415 489 HB ILE 62 HB ILE 62 20.774 17.149 -13.441 490 1HG1 ILE 62 HG12 ILE 62 18.653 15.047 -14.007 491 2HG1 ILE 62 HG11 ILE 62 18.365 16.772 -13.782 492 1HG2 ILE 62 HG21 ILE 62 21.217 14.170 -13.447 493 2HG2 ILE 62 HG22 ILE 62 22.398 15.467 -13.613 494 3HG2 ILE 62 HG23 ILE 62 21.319 15.082 -14.952 495 1HD1 ILE 62 HD11 ILE 62 19.832 15.409 -16.046 496 2HD1 ILE 62 HD12 ILE 62 19.985 17.139 -15.738 497 3HD1 ILE 62 HD13 ILE 62 18.412 16.451 -16.140 498 H ASN 63 HN ASN 63 17.674 15.632 -11.062 499 HA ASN 63 HA ASN 63 17.727 12.639 -11.101 500 1HB ASN 63 HB2 ASN 63 17.181 13.941 -8.994 501 2HB ASN 63 HB1 ASN 63 15.742 14.544 -9.817 502 1HD2 ASN 63 HD21 ASN 63 14.075 12.919 -10.443 503 2HD2 ASN 63 HD22 ASN 63 14.006 11.427 -9.640 504 H ALA 64 HN ALA 64 17.154 12.133 -13.234 505 HA ALA 64 HA ALA 64 14.649 13.389 -14.309 506 1HB ALA 64 HB1 ALA 64 15.632 13.184 -16.455 507 2HB ALA 64 HB2 ALA 64 16.793 11.979 -15.900 508 3HB ALA 64 HB3 ALA 64 16.976 13.666 -15.421 509 H THR 65 HN THR 65 13.056 12.010 -15.163 510 HA THR 65 HA THR 65 13.005 9.268 -14.152 511 HB THR 65 HB THR 65 10.744 9.318 -15.248 512 HG1 THR 65 HG1 THR 65 10.550 10.681 -16.812 513 1HG2 THR 65 HG21 THR 65 11.610 11.583 -13.448 514 2HG2 THR 65 HG22 THR 65 10.791 10.087 -13.005 515 3HG2 THR 65 HG23 THR 65 9.921 11.337 -13.891 516 H HIS 66 HN HIS 66 14.413 10.607 -16.907 517 HA HIS 66 HA HIS 66 14.158 8.014 -18.394 518 1HB HIS 66 HB2 HIS 66 12.841 10.035 -19.258 519 2HB HIS 66 HB1 HIS 66 14.400 10.773 -19.618 520 HD1 HIS 66 HD1 HIS 66 14.178 10.645 -22.176 521 HD2 HIS 66 HD2 HIS 66 13.758 6.940 -20.312 522 HE1 HIS 66 HE1 HIS 66 14.221 8.907 -24.018 523 H ILE 67 HN ILE 67 16.069 7.303 -19.423 524 HA ILE 67 HA ILE 67 18.600 8.328 -18.360 525 HB ILE 67 HB ILE 67 17.614 6.063 -20.063 526 1HG1 ILE 67 HG12 ILE 67 19.512 5.160 -18.259 527 2HG1 ILE 67 HG11 ILE 67 18.780 6.519 -17.406 528 1HG2 ILE 67 HG21 ILE 67 20.469 7.058 -19.962 529 2HG2 ILE 67 HG22 ILE 67 19.496 6.693 -21.387 530 3HG2 ILE 67 HG23 ILE 67 20.064 5.385 -20.350 531 1HD1 ILE 67 HD11 ILE 67 17.451 4.026 -18.456 532 2HD1 ILE 67 HD12 ILE 67 16.517 5.486 -18.128 533 3HD1 ILE 67 HD13 ILE 67 17.402 4.693 -16.825 534 H GLU 68 HN GLU 68 16.984 8.247 -21.546 535 HA GLU 68 HA GLU 68 19.107 9.455 -23.057 536 1HB GLU 68 HB2 GLU 68 16.735 8.262 -23.589 537 2HB GLU 68 HB1 GLU 68 16.266 9.949 -23.795 538 1HG GLU 68 HG2 GLU 68 18.768 8.879 -25.092 539 2HG GLU 68 HG1 GLU 68 17.195 8.676 -25.862 540 H GLN 69 HN GLN 69 16.466 10.840 -21.118 541 HA GLN 69 HA GLN 69 16.563 13.531 -22.047 542 1HB GLN 69 HB2 GLN 69 14.936 12.303 -20.458 543 2HB GLN 69 HB1 GLN 69 16.092 12.684 -19.182 544 1HG GLN 69 HG2 GLN 69 15.706 15.070 -20.675 545 2HG GLN 69 HG1 GLN 69 14.106 14.394 -20.372 546 1HE2 GLN 69 HE21 GLN 69 17.049 15.602 -18.766 547 2HE2 GLN 69 HE22 GLN 69 16.339 15.784 -17.235 548 H VAL 70 HN VAL 70 18.203 12.146 -19.146 549 HA VAL 70 HA VAL 70 19.755 14.471 -18.555 550 HB VAL 70 HB VAL 70 19.296 12.546 -17.038 551 1HG1 VAL 70 HG11 VAL 70 21.137 11.135 -18.970 552 2HG1 VAL 70 HG12 VAL 70 19.548 10.628 -18.400 553 3HG1 VAL 70 HG13 VAL 70 20.934 10.575 -17.312 554 1HG2 VAL 70 HG21 VAL 70 21.996 12.274 -16.573 555 2HG2 VAL 70 HG22 VAL 70 21.008 13.619 -16.009 556 3HG2 VAL 70 HG23 VAL 70 21.932 13.770 -17.503 557 H GLU 71 HN GLU 71 20.306 11.828 -20.849 558 HA GLU 71 HA GLU 71 23.104 12.352 -21.353 559 1HB GLU 71 HB2 GLU 71 20.949 10.666 -22.311 560 2HB GLU 71 HB1 GLU 71 21.850 11.319 -23.678 561 1HG GLU 71 HG2 GLU 71 23.068 9.890 -21.294 562 2HG GLU 71 HG1 GLU 71 22.833 9.189 -22.895 563 H THR 72 HN THR 72 20.080 13.446 -22.919 564 HA THR 72 HA THR 72 21.244 15.024 -25.000 565 HB THR 72 HB THR 72 18.671 15.456 -23.434 566 HG1 THR 72 HG1 THR 72 18.205 13.582 -24.235 567 1HG2 THR 72 HG21 THR 72 17.859 16.466 -25.518 568 2HG2 THR 72 HG22 THR 72 19.421 16.171 -26.282 569 3HG2 THR 72 HG23 THR 72 19.294 17.313 -24.945 570 H LEU 73 HN LEU 73 20.432 15.764 -21.609 571 HA LEU 73 HA LEU 73 21.006 18.577 -21.665 572 1HB LEU 73 HB2 LEU 73 20.668 16.387 -19.678 573 2HB LEU 73 HB1 LEU 73 21.545 17.808 -19.110 574 HG LEU 73 HG LEU 73 19.695 19.260 -19.810 575 1HD1 LEU 73 HD11 LEU 73 18.381 16.662 -20.663 576 2HD1 LEU 73 HD12 LEU 73 18.909 17.958 -21.734 577 3HD1 LEU 73 HD13 LEU 73 17.582 18.228 -20.612 578 1HD2 LEU 73 HD21 LEU 73 18.736 16.882 -18.185 579 2HD2 LEU 73 HD22 LEU 73 18.010 18.489 -18.185 580 3HD2 LEU 73 HD23 LEU 73 19.636 18.257 -17.546 581 H TYR 74 HN TYR 74 23.058 15.710 -21.083 582 HA TYR 74 HA TYR 74 25.456 17.046 -20.290 583 1HB TYR 74 HB2 TYR 74 25.651 14.771 -20.014 584 2HB TYR 74 HB1 TYR 74 24.606 14.418 -21.385 585 HD1 TYR 74 HD1 TYR 74 27.916 16.162 -20.915 586 HD2 TYR 74 HD2 TYR 74 25.660 13.194 -23.050 587 HE1 TYR 74 HE1 TYR 74 29.901 15.658 -22.313 588 HE2 TYR 74 HE2 TYR 74 27.645 12.690 -24.446 589 HH TYR 74 HH TYR 74 30.009 14.468 -24.993 590 H GLU 75 HN GLU 75 24.306 16.055 -23.541 591 HA GLU 75 HA GLU 75 26.516 17.163 -25.017 592 1HB GLU 75 HB2 GLU 75 23.782 16.109 -25.503 593 2HB GLU 75 HB1 GLU 75 24.417 17.176 -26.756 594 1HG GLU 75 HG2 GLU 75 25.843 15.592 -27.494 595 2HG GLU 75 HG1 GLU 75 26.442 15.286 -25.865 596 H GLU 76 HN GLU 76 23.497 18.566 -23.800 597 HA GLU 76 HA GLU 76 23.537 21.000 -25.332 598 1HB GLU 76 HB2 GLU 76 22.104 19.776 -23.123 599 2HB GLU 76 HB1 GLU 76 22.356 21.497 -22.836 600 1HG GLU 76 HG2 GLU 76 20.585 21.853 -24.191 601 2HG GLU 76 HG1 GLU 76 21.638 21.381 -25.524 602 H LEU 77 HN LEU 77 24.646 20.320 -21.978 603 HA LEU 77 HA LEU 77 25.889 22.945 -21.699 604 1HB LEU 77 HB2 LEU 77 26.140 22.290 -19.498 605 2HB LEU 77 HB1 LEU 77 24.899 21.139 -19.980 606 HG LEU 77 HG LEU 77 27.051 19.706 -20.696 607 1HD1 LEU 77 HD11 LEU 77 28.262 20.685 -18.219 608 2HD1 LEU 77 HD12 LEU 77 28.251 21.907 -19.490 609 3HD1 LEU 77 HD13 LEU 77 29.016 20.344 -19.776 610 1HD2 LEU 77 HD21 LEU 77 26.371 18.364 -19.003 611 2HD2 LEU 77 HD22 LEU 77 25.188 19.624 -18.649 612 3HD2 LEU 77 HD23 LEU 77 26.724 19.588 -17.783 613 H GLY 78 HN GLY 78 26.946 19.789 -22.824 614 1HA GLY 78 HA2 GLY 78 29.784 20.681 -22.793 615 2HA GLY 78 HA1 GLY 78 29.241 19.022 -23.039 616 H LYS 79 HN LYS 79 28.003 21.936 -24.658 617 HA LYS 79 HA LYS 79 28.661 20.680 -27.281 618 1HB LYS 79 HB2 LYS 79 26.357 21.668 -26.371 619 2HB LYS 79 HB1 LYS 79 27.051 23.183 -26.951 620 1HG LYS 79 HG2 LYS 79 27.419 22.176 -29.170 621 2HG LYS 79 HG1 LYS 79 26.737 20.654 -28.596 622 1HD LYS 79 HD2 LYS 79 25.024 23.002 -28.114 623 2HD LYS 79 HD1 LYS 79 25.294 22.641 -29.820 624 1HE LYS 79 HE2 LYS 79 23.891 20.862 -29.710 625 2HE LYS 79 HE1 LYS 79 24.794 20.187 -28.339 626 1HZ LYS 79 HZ1 LYS 79 22.585 22.152 -28.304 627 2HZ LYS 79 HZ2 LYS 79 23.674 22.044 -27.004 628 3HZ LYS 79 HZ3 LYS 79 22.726 20.704 -27.433 629 H ILE 80 HN ILE 80 30.197 22.729 -25.204 630 HA ILE 80 HA ILE 80 30.899 25.030 -26.721 631 HB ILE 80 HB ILE 80 32.721 23.519 -24.829 632 1HG1 ILE 80 HG12 ILE 80 31.241 25.473 -23.404 633 2HG1 ILE 80 HG11 ILE 80 30.061 24.525 -24.310 634 1HG2 ILE 80 HG21 ILE 80 33.582 25.555 -26.005 635 2HG2 ILE 80 HG22 ILE 80 33.520 25.741 -24.253 636 3HG2 ILE 80 HG23 ILE 80 32.282 26.487 -25.264 637 1HD1 ILE 80 HD11 ILE 80 30.471 23.463 -22.146 638 2HD1 ILE 80 HD12 ILE 80 32.204 23.428 -22.467 639 3HD1 ILE 80 HD13 ILE 80 31.107 22.442 -23.434 640 H ASP 81 HN ASP 81 32.798 25.431 -28.038 641 HA ASP 81 HA ASP 81 33.510 23.399 -29.918 642 1HB ASP 81 HB2 ASP 81 34.438 26.128 -29.125 643 2HB ASP 81 HB1 ASP 81 35.519 25.177 -30.144 644 H ILE 82 HN ILE 82 34.867 24.286 -26.793 645 HA ILE 82 HA ILE 82 37.407 22.948 -27.046 646 HB ILE 82 HB ILE 82 36.033 24.602 -25.253 647 1HG1 ILE 82 HG12 ILE 82 38.254 24.312 -23.929 648 2HG1 ILE 82 HG11 ILE 82 38.715 23.238 -25.250 649 1HG2 ILE 82 HG21 ILE 82 35.105 22.565 -24.155 650 2HG2 ILE 82 HG22 ILE 82 36.162 23.488 -23.087 651 3HG2 ILE 82 HG23 ILE 82 36.751 22.012 -23.848 652 1HD1 ILE 82 HD11 ILE 82 37.996 25.159 -26.816 653 2HD1 ILE 82 HD12 ILE 82 39.507 25.364 -25.929 654 3HD1 ILE 82 HD13 ILE 82 38.042 26.177 -25.377 655 H VAL 83 HN VAL 83 37.909 20.996 -25.526 656 HA VAL 83 HA VAL 83 36.119 18.792 -26.268 657 HB VAL 83 HB VAL 83 38.675 18.940 -24.633 658 1HG1 VAL 83 HG11 VAL 83 37.567 16.889 -24.074 659 2HG1 VAL 83 HG12 VAL 83 38.790 16.476 -25.275 660 3HG1 VAL 83 HG13 VAL 83 37.098 16.611 -25.751 661 1HG2 VAL 83 HG21 VAL 83 39.848 18.689 -26.601 662 2HG2 VAL 83 HG22 VAL 83 38.448 19.544 -27.248 663 3HG2 VAL 83 HG23 VAL 83 38.548 17.788 -27.382 664 H ARG 84 HN ARG 84 34.284 18.521 -25.059 665 HA ARG 84 HA ARG 84 34.516 18.688 -22.070 666 1HB ARG 84 HB2 ARG 84 33.172 20.497 -23.071 667 2HB ARG 84 HB1 ARG 84 32.176 19.305 -23.905 668 1HG ARG 84 HG2 ARG 84 31.063 20.090 -21.846 669 2HG ARG 84 HG1 ARG 84 31.455 18.377 -21.732 670 1HD ARG 84 HD2 ARG 84 32.177 19.239 -19.646 671 2HD ARG 84 HD1 ARG 84 33.671 19.225 -20.599 672 HE ARG 84 HE ARG 84 31.959 21.676 -20.517 673 1HH1 ARG 84 HH21 ARG 84 33.990 21.131 -18.260 674 2HH1 ARG 84 HH22 ARG 84 35.336 22.071 -18.811 675 1HH2 ARG 84 HH11 ARG 84 34.112 22.412 -22.046 676 2HH2 ARG 84 HH12 ARG 84 35.407 22.797 -20.961 677 H MET 85 HN MET 85 33.979 16.799 -21.008 678 HA MET 85 HA MET 85 32.449 14.696 -22.515 679 1HB MET 85 HB2 MET 85 35.122 14.719 -21.258 680 2HB MET 85 HB1 MET 85 34.136 13.317 -20.842 681 1HG MET 85 HG2 MET 85 33.778 12.817 -23.204 682 2HG MET 85 HG1 MET 85 34.647 14.278 -23.673 683 1HE MET 85 HE1 MET 85 36.743 13.822 -24.828 684 2HE MET 85 HE2 MET 85 38.156 13.433 -23.851 685 3HE MET 85 HE3 MET 85 37.079 14.735 -23.352 686 H VAL 86 HN VAL 86 31.602 12.974 -20.898 687 HA VAL 86 HA VAL 86 30.975 14.152 -18.224 688 HB VAL 86 HB VAL 86 29.210 14.604 -20.001 689 1HG1 VAL 86 HG11 VAL 86 29.399 12.429 -21.169 690 2HG1 VAL 86 HG12 VAL 86 27.749 12.721 -20.621 691 3HG1 VAL 86 HG13 VAL 86 28.790 11.610 -19.731 692 1HG2 VAL 86 HG21 VAL 86 28.938 14.204 -17.371 693 2HG2 VAL 86 HG22 VAL 86 27.971 12.841 -17.934 694 3HG2 VAL 86 HG23 VAL 86 27.542 14.483 -18.412 695 H LEU 87 HN LEU 87 30.351 12.543 -16.634 696 HA LEU 87 HA LEU 87 30.611 10.483 -15.533 697 1HB LEU 87 HB2 LEU 87 28.997 10.214 -17.762 698 2HB LEU 87 HB1 LEU 87 30.168 8.921 -18.000 699 HG LEU 87 HG LEU 87 28.242 8.105 -16.712 700 1HD1 LEU 87 HD11 LEU 87 30.810 8.407 -15.133 701 2HD1 LEU 87 HD12 LEU 87 30.351 7.063 -16.178 702 3HD1 LEU 87 HD13 LEU 87 29.495 7.332 -14.660 703 1HD2 LEU 87 HD21 LEU 87 27.508 9.084 -14.700 704 2HD2 LEU 87 HD22 LEU 87 27.864 10.482 -15.713 705 3HD2 LEU 87 HD23 LEU 87 29.014 9.975 -14.476 Start of MODEL 3 1 1H MET 1 HT1 MET 1 8.509 15.508 -24.107 2 2H MET 1 HT2 MET 1 8.885 14.309 -22.964 3 3H MET 1 HT3 MET 1 7.396 14.272 -23.780 4 HA MET 1 HA MET 1 8.509 13.833 -25.882 5 1HB MET 1 HB2 MET 1 10.689 14.837 -24.264 6 2HB MET 1 HB1 MET 1 11.133 13.278 -24.960 7 1HG MET 1 HG2 MET 1 10.404 14.114 -27.200 8 2HG MET 1 HG1 MET 1 10.107 15.694 -26.474 9 1HE MET 1 HE1 MET 1 12.590 14.755 -28.958 10 2HE MET 1 HE2 MET 1 12.162 13.311 -28.040 11 3HE MET 1 HE3 MET 1 13.829 13.879 -28.047 12 H LYS 2 HN LYS 2 8.349 11.660 -26.393 13 HA LYS 2 HA LYS 2 7.845 9.700 -24.339 14 1HB LYS 2 HB2 LYS 2 7.601 9.992 -27.155 15 2HB LYS 2 HB1 LYS 2 8.557 8.535 -26.882 16 1HG LYS 2 HG2 LYS 2 6.093 8.987 -25.231 17 2HG LYS 2 HG1 LYS 2 5.921 8.402 -26.886 18 1HD LYS 2 HD2 LYS 2 6.470 6.326 -26.221 19 2HD LYS 2 HD1 LYS 2 8.024 6.917 -25.636 20 1HE LYS 2 HE2 LYS 2 6.699 7.719 -23.544 21 2HE LYS 2 HE1 LYS 2 5.438 6.605 -24.107 22 1HZ LYS 2 HZ1 LYS 2 8.290 5.935 -23.599 23 2HZ LYS 2 HZ2 LYS 2 7.157 4.870 -24.284 24 3HZ LYS 2 HZ3 LYS 2 6.958 5.417 -22.688 25 H THR 3 HN THR 3 9.157 8.053 -23.551 26 HA THR 3 HA THR 3 11.158 7.013 -22.876 27 HB THR 3 HB THR 3 12.020 7.584 -25.723 28 HG1 THR 3 HG1 THR 3 10.273 6.604 -26.307 29 1HG2 THR 3 HG21 THR 3 12.470 5.335 -23.751 30 2HG2 THR 3 HG22 THR 3 13.679 6.411 -24.451 31 3HG2 THR 3 HG23 THR 3 12.877 5.210 -25.461 32 H LYS 4 HN LYS 4 11.082 9.818 -22.272 33 HA LYS 4 HA LYS 4 13.922 10.355 -21.925 34 1HB LYS 4 HB2 LYS 4 13.336 10.933 -24.363 35 2HB LYS 4 HB1 LYS 4 12.389 12.266 -23.706 36 1HG LYS 4 HG2 LYS 4 14.774 12.523 -22.349 37 2HG LYS 4 HG1 LYS 4 15.303 11.981 -23.942 38 1HD LYS 4 HD2 LYS 4 14.282 13.811 -25.036 39 2HD LYS 4 HD1 LYS 4 13.275 14.194 -23.639 40 1HE LYS 4 HE2 LYS 4 15.239 14.926 -22.371 41 2HE LYS 4 HE1 LYS 4 16.304 14.446 -23.707 42 1HZ LYS 4 HZ1 LYS 4 15.763 16.804 -23.839 43 2HZ LYS 4 HZ2 LYS 4 14.102 16.440 -23.873 44 3HZ LYS 4 HZ3 LYS 4 15.107 15.965 -25.161 45 H LEU 5 HN LEU 5 11.028 12.473 -22.311 46 HA LEU 5 HA LEU 5 11.496 13.430 -19.511 47 1HB LEU 5 HB2 LEU 5 11.131 14.732 -21.969 48 2HB LEU 5 HB1 LEU 5 9.593 14.935 -21.130 49 HG LEU 5 HG LEU 5 11.992 15.339 -19.446 50 1HD1 LEU 5 HD11 LEU 5 12.334 17.652 -20.340 51 2HD1 LEU 5 HD12 LEU 5 11.288 17.241 -21.701 52 3HD1 LEU 5 HD13 LEU 5 12.819 16.392 -21.474 53 1HD2 LEU 5 HD21 LEU 5 10.399 17.531 -19.180 54 2HD2 LEU 5 HD22 LEU 5 10.142 16.028 -18.294 55 3HD2 LEU 5 HD23 LEU 5 9.223 16.353 -19.763 56 H ASN 6 HN ASN 6 8.863 12.497 -21.763 57 HA ASN 6 HA ASN 6 7.177 11.813 -19.373 58 1HB ASN 6 HB2 ASN 6 6.744 13.412 -21.792 59 2HB ASN 6 HB1 ASN 6 5.498 12.185 -21.571 60 1HD2 ASN 6 HD21 ASN 6 4.152 12.315 -19.626 61 2HD2 ASN 6 HD22 ASN 6 4.113 13.722 -18.679 62 H GLU 7 HN GLU 7 7.189 9.586 -19.208 63 HA GLU 7 HA GLU 7 6.577 7.996 -21.655 64 1HB GLU 7 HB2 GLU 7 8.445 6.457 -21.091 65 2HB GLU 7 HB1 GLU 7 9.024 8.089 -21.417 66 1HG GLU 7 HG2 GLU 7 8.343 7.414 -18.590 67 2HG GLU 7 HG1 GLU 7 9.819 6.720 -19.257 68 H LEU 8 HN LEU 8 6.786 5.450 -20.515 69 HA LEU 8 HA LEU 8 4.379 5.352 -18.862 70 1HB LEU 8 HB2 LEU 8 6.063 3.604 -20.462 71 2HB LEU 8 HB1 LEU 8 5.654 2.835 -18.931 72 HG LEU 8 HG LEU 8 3.967 2.324 -20.657 73 1HD1 LEU 8 HD11 LEU 8 2.124 2.617 -19.271 74 2HD1 LEU 8 HD12 LEU 8 2.602 4.250 -18.805 75 3HD1 LEU 8 HD13 LEU 8 3.444 2.858 -18.126 76 1HD2 LEU 8 HD21 LEU 8 4.373 4.626 -21.798 77 2HD2 LEU 8 HD22 LEU 8 3.188 5.239 -20.643 78 3HD2 LEU 8 HD23 LEU 8 2.732 3.980 -21.792 79 H LEU 9 HN LEU 9 7.865 5.010 -18.284 80 HA LEU 9 HA LEU 9 7.609 3.960 -15.582 81 1HB LEU 9 HB2 LEU 9 9.871 5.366 -17.047 82 2HB LEU 9 HB1 LEU 9 10.046 4.476 -15.535 83 HG LEU 9 HG LEU 9 8.688 2.727 -17.277 84 1HD1 LEU 9 HD11 LEU 9 10.905 4.269 -18.636 85 2HD1 LEU 9 HD12 LEU 9 9.281 3.942 -19.238 86 3HD1 LEU 9 HD13 LEU 9 10.461 2.637 -19.133 87 1HD2 LEU 9 HD21 LEU 9 10.867 1.477 -17.165 88 2HD2 LEU 9 HD22 LEU 9 10.289 2.027 -15.592 89 3HD2 LEU 9 HD23 LEU 9 11.590 2.897 -16.407 90 H GLU 10 HN GLU 10 8.712 7.159 -16.788 91 HA GLU 10 HA GLU 10 8.602 9.299 -15.820 92 1HB GLU 10 HB2 GLU 10 6.136 8.248 -15.908 93 2HB GLU 10 HB1 GLU 10 6.287 8.395 -14.157 94 1HG GLU 10 HG2 GLU 10 5.302 10.441 -14.998 95 2HG GLU 10 HG1 GLU 10 6.950 10.800 -14.485 96 H PHE 11 HN PHE 11 10.308 7.345 -14.469 97 HA PHE 11 HA PHE 11 9.957 8.061 -11.585 98 1HB PHE 11 HB2 PHE 11 10.116 5.670 -12.228 99 2HB PHE 11 HB1 PHE 11 11.678 5.982 -12.984 100 HD1 PHE 11 HD1 PHE 11 9.853 6.098 -9.731 101 HD2 PHE 11 HD2 PHE 11 13.672 6.050 -11.697 102 HE1 PHE 11 HE1 PHE 11 10.977 5.794 -7.541 103 HE2 PHE 11 HE2 PHE 11 14.795 5.745 -9.508 104 HZ PHE 11 HZ PHE 11 13.447 5.617 -7.430 105 HA PRO 12 HA PRO 12 13.264 10.962 -12.642 106 1HB PRO 12 HB2 PRO 12 13.127 12.364 -10.299 107 2HB PRO 12 HB1 PRO 12 12.014 12.632 -11.656 108 1HG PRO 12 HG2 PRO 12 11.598 11.083 -9.145 109 2HG PRO 12 HG1 PRO 12 10.478 12.142 -10.017 110 1HD PRO 12 HD2 PRO 12 10.383 9.429 -10.168 111 2HD PRO 12 HD1 PRO 12 9.859 10.497 -11.488 112 H THR 13 HN THR 13 15.196 9.851 -12.523 113 HA THR 13 HA THR 13 16.111 8.910 -9.825 114 HB THR 13 HB THR 13 15.798 7.244 -11.681 115 HG1 THR 13 HG1 THR 13 17.294 6.314 -10.576 116 1HG2 THR 13 HG21 THR 13 17.023 7.316 -13.662 117 2HG2 THR 13 HG22 THR 13 18.252 8.382 -12.982 118 3HG2 THR 13 HG23 THR 13 16.666 9.023 -13.407 119 HA PRO 14 HA PRO 14 19.193 12.066 -9.949 120 1HB PRO 14 HB2 PRO 14 20.977 10.996 -8.166 121 2HB PRO 14 HB1 PRO 14 19.441 11.740 -7.675 122 1HG PRO 14 HG2 PRO 14 20.141 8.862 -7.968 123 2HG PRO 14 HG1 PRO 14 19.140 9.663 -6.746 124 1HD PRO 14 HD2 PRO 14 18.114 8.272 -8.852 125 2HD PRO 14 HD1 PRO 14 17.269 9.621 -8.062 126 H PHE 15 HN PHE 15 20.515 12.267 -11.705 127 HA PHE 15 HA PHE 15 22.216 9.962 -12.554 128 1HB PHE 15 HB2 PHE 15 20.979 12.383 -13.828 129 2HB PHE 15 HB1 PHE 15 22.389 11.648 -14.586 130 HD1 PHE 15 HD1 PHE 15 22.203 8.893 -14.530 131 HD2 PHE 15 HD2 PHE 15 18.941 11.684 -14.668 132 HE1 PHE 15 HE1 PHE 15 20.752 7.149 -15.528 133 HE2 PHE 15 HE2 PHE 15 17.491 9.940 -15.663 134 HZ PHE 15 HZ PHE 15 18.395 7.672 -16.095 135 H THR 16 HN THR 16 24.092 10.176 -11.266 136 HA THR 16 HA THR 16 25.391 12.753 -10.783 137 HB THR 16 HB THR 16 26.566 9.961 -10.572 138 HG1 THR 16 HG1 THR 16 25.288 9.586 -8.954 139 1HG2 THR 16 HG21 THR 16 27.856 10.947 -8.744 140 2HG2 THR 16 HG22 THR 16 26.997 12.475 -8.934 141 3HG2 THR 16 HG23 THR 16 28.075 11.904 -10.209 142 H TYR 17 HN TYR 17 25.788 13.639 -12.906 143 HA TYR 17 HA TYR 17 27.476 11.998 -14.741 144 1HB TYR 17 HB2 TYR 17 25.526 14.244 -14.944 145 2HB TYR 17 HB1 TYR 17 26.812 14.197 -16.150 146 HD1 TYR 17 HD1 TYR 17 24.929 11.440 -14.411 147 HD2 TYR 17 HD2 TYR 17 25.908 13.348 -18.135 148 HE1 TYR 17 HE1 TYR 17 23.732 9.656 -15.643 149 HE2 TYR 17 HE2 TYR 17 24.709 11.562 -19.364 150 HH TYR 17 HH TYR 17 24.098 8.787 -18.439 151 H LYS 18 HN LYS 18 29.628 12.269 -14.252 152 HA LYS 18 HA LYS 18 30.704 14.781 -13.204 153 1HB LYS 18 HB2 LYS 18 31.448 12.027 -13.456 154 2HB LYS 18 HB1 LYS 18 32.711 12.993 -14.218 155 1HG LYS 18 HG2 LYS 18 31.769 14.129 -11.680 156 2HG LYS 18 HG1 LYS 18 32.478 12.525 -11.500 157 1HD LYS 18 HD2 LYS 18 34.485 13.565 -11.527 158 2HD LYS 18 HD1 LYS 18 34.219 13.791 -13.255 159 1HE LYS 18 HE2 LYS 18 34.157 16.030 -12.935 160 2HE LYS 18 HE1 LYS 18 32.753 15.830 -11.870 161 1HZ LYS 18 HZ1 LYS 18 34.257 15.264 -10.055 162 2HZ LYS 18 HZ2 LYS 18 34.610 16.810 -10.666 163 3HZ LYS 18 HZ3 LYS 18 35.597 15.489 -11.071 164 H VAL 19 HN VAL 19 30.176 16.304 -14.892 165 HA VAL 19 HA VAL 19 31.033 15.869 -17.649 166 HB VAL 19 HB VAL 19 30.161 18.399 -16.212 167 1HG1 VAL 19 HG11 VAL 19 29.411 19.077 -18.471 168 2HG1 VAL 19 HG12 VAL 19 30.069 17.581 -19.133 169 3HG1 VAL 19 HG13 VAL 19 31.149 18.788 -18.431 170 1HG2 VAL 19 HG21 VAL 19 28.476 16.674 -15.877 171 2HG2 VAL 19 HG22 VAL 19 28.538 16.232 -17.583 172 3HG2 VAL 19 HG23 VAL 19 27.890 17.799 -17.102 173 H MET 20 HN MET 20 33.297 15.588 -17.658 174 HA MET 20 HA MET 20 35.017 17.661 -16.388 175 1HB MET 20 HB2 MET 20 35.623 15.041 -17.801 176 2HB MET 20 HB1 MET 20 36.805 16.028 -16.944 177 1HG MET 20 HG2 MET 20 36.106 15.304 -14.906 178 2HG MET 20 HG1 MET 20 34.404 15.376 -15.358 179 1HE MET 20 HE1 MET 20 37.674 13.298 -15.223 180 2HE MET 20 HE2 MET 20 36.885 11.799 -14.737 181 3HE MET 20 HE3 MET 20 36.582 13.280 -13.832 182 H GLY 21 HN GLY 21 36.509 18.903 -17.651 183 1HA GLY 21 HA2 GLY 21 37.099 18.633 -20.376 184 2HA GLY 21 HA1 GLY 21 35.621 19.593 -20.313 185 H GLN 22 HN GLN 22 36.718 21.465 -21.111 186 HA GLN 22 HA GLN 22 39.040 22.562 -19.699 187 1HB GLN 22 HB2 GLN 22 37.914 22.790 -22.200 188 2HB GLN 22 HB1 GLN 22 37.427 24.311 -21.451 189 1HG GLN 22 HG2 GLN 22 39.512 24.902 -22.286 190 2HG GLN 22 HG1 GLN 22 39.957 24.362 -20.667 191 1HE2 GLN 22 HE21 GLN 22 41.087 22.308 -20.460 192 2HE2 GLN 22 HE22 GLN 22 41.712 21.495 -21.811 193 H ALA 23 HN ALA 23 39.025 24.482 -18.406 194 HA ALA 23 HA ALA 23 36.677 24.824 -16.711 195 1HB ALA 23 HB1 ALA 23 39.037 24.947 -15.943 196 2HB ALA 23 HB2 ALA 23 38.165 26.435 -15.575 197 3HB ALA 23 HB3 ALA 23 39.277 26.380 -16.942 198 H LEU 24 HN LEU 24 34.974 25.705 -17.961 199 HA LEU 24 HA LEU 24 35.442 28.471 -19.035 200 1HB LEU 24 HB2 LEU 24 34.486 26.009 -20.263 201 2HB LEU 24 HB1 LEU 24 33.286 27.293 -20.403 202 HG LEU 24 HG LEU 24 35.528 28.684 -21.027 203 1HD1 LEU 24 HD11 LEU 24 36.102 26.278 -22.635 204 2HD1 LEU 24 HD12 LEU 24 36.512 26.122 -20.926 205 3HD1 LEU 24 HD13 LEU 24 37.215 27.424 -21.886 206 1HD2 LEU 24 HD21 LEU 24 33.341 27.386 -22.467 207 2HD2 LEU 24 HD22 LEU 24 34.777 27.572 -23.475 208 3HD2 LEU 24 HD23 LEU 24 34.047 28.985 -22.711 209 HA PRO 25 HA PRO 25 32.050 29.660 -16.473 210 1HB PRO 25 HB2 PRO 25 31.045 31.761 -17.912 211 2HB PRO 25 HB1 PRO 25 32.565 31.851 -16.998 212 1HG PRO 25 HG2 PRO 25 32.130 31.466 -19.915 213 2HG PRO 25 HG1 PRO 25 33.373 32.404 -19.073 214 1HD PRO 25 HD2 PRO 25 33.813 29.937 -20.158 215 2HD PRO 25 HD1 PRO 25 34.730 30.588 -18.783 216 H GLU 26 HN GLU 26 31.507 28.821 -19.841 217 HA GLU 26 HA GLU 26 28.616 28.872 -19.825 218 1HB GLU 26 HB2 GLU 26 30.670 28.554 -21.650 219 2HB GLU 26 HB1 GLU 26 29.960 26.940 -21.594 220 1HG GLU 26 HG2 GLU 26 28.301 29.451 -21.937 221 2HG GLU 26 HG1 GLU 26 28.931 28.527 -23.301 222 H LEU 27 HN LEU 27 30.939 26.627 -18.512 223 HA LEU 27 HA LEU 27 29.548 24.159 -18.670 224 1HB LEU 27 HB2 LEU 27 31.692 25.415 -17.101 225 2HB LEU 27 HB1 LEU 27 30.824 24.178 -16.198 226 HG LEU 27 HG LEU 27 32.730 23.200 -17.413 227 1HD1 LEU 27 HD11 LEU 27 30.335 22.100 -17.187 228 2HD1 LEU 27 HD12 LEU 27 31.586 21.320 -18.155 229 3HD1 LEU 27 HD13 LEU 27 30.325 22.269 -18.943 230 1HD2 LEU 27 HD21 LEU 27 33.011 24.649 -19.281 231 2HD2 LEU 27 HD22 LEU 27 31.337 24.442 -19.794 232 3HD2 LEU 27 HD23 LEU 27 32.482 23.114 -19.971 233 H VAL 28 HN VAL 28 29.642 26.241 -15.737 234 HA VAL 28 HA VAL 28 27.396 24.993 -14.476 235 HB VAL 28 HB VAL 28 29.236 26.394 -13.452 236 1HG1 VAL 28 HG11 VAL 28 27.546 28.735 -14.372 237 2HG1 VAL 28 HG12 VAL 28 29.039 28.240 -15.169 238 3HG1 VAL 28 HG13 VAL 28 29.076 28.797 -13.497 239 1HG2 VAL 28 HG21 VAL 28 27.845 26.408 -11.683 240 2HG2 VAL 28 HG22 VAL 28 26.465 26.223 -12.766 241 3HG2 VAL 28 HG23 VAL 28 27.032 27.834 -12.328 242 H ASP 29 HN ASP 29 27.588 27.652 -16.803 243 HA ASP 29 HA ASP 29 24.963 28.747 -16.421 244 1HB ASP 29 HB2 ASP 29 26.855 29.793 -17.658 245 2HB ASP 29 HB1 ASP 29 26.689 28.566 -18.914 246 H GLN 30 HN GLN 30 26.105 26.486 -18.981 247 HA GLN 30 HA GLN 30 23.435 25.844 -19.896 248 1HB GLN 30 HB2 GLN 30 25.931 25.603 -20.885 249 2HB GLN 30 HB1 GLN 30 25.703 23.957 -20.297 250 1HG GLN 30 HG2 GLN 30 24.905 23.978 -22.558 251 2HG GLN 30 HG1 GLN 30 23.474 23.951 -21.528 252 1HE2 GLN 30 HE21 GLN 30 22.079 25.809 -21.556 253 2HE2 GLN 30 HE22 GLN 30 22.331 27.129 -22.594 254 H VAL 31 HN VAL 31 25.564 24.426 -17.442 255 HA VAL 31 HA VAL 31 24.271 21.904 -17.139 256 HB VAL 31 HB VAL 31 25.948 23.748 -15.477 257 1HG1 VAL 31 HG11 VAL 31 24.153 21.623 -14.401 258 2HG1 VAL 31 HG12 VAL 31 24.755 23.087 -13.623 259 3HG1 VAL 31 HG13 VAL 31 25.800 21.675 -13.773 260 1HG2 VAL 31 HG21 VAL 31 27.098 21.333 -15.317 261 2HG2 VAL 31 HG22 VAL 31 27.306 22.362 -16.732 262 3HG2 VAL 31 HG23 VAL 31 26.124 21.055 -16.761 263 H VAL 32 HN VAL 32 23.707 24.930 -15.258 264 HA VAL 32 HA VAL 32 21.382 23.877 -13.897 265 HB VAL 32 HB VAL 32 22.958 25.734 -13.174 266 1HG1 VAL 32 HG11 VAL 32 22.922 26.934 -15.376 267 2HG1 VAL 32 HG12 VAL 32 22.555 27.981 -14.006 268 3HG1 VAL 32 HG13 VAL 32 21.255 27.405 -15.048 269 1HG2 VAL 32 HG21 VAL 32 20.055 26.585 -13.204 270 2HG2 VAL 32 HG22 VAL 32 21.257 26.885 -11.950 271 3HG2 VAL 32 HG23 VAL 32 20.642 25.253 -12.209 272 H GLU 33 HN GLU 33 21.799 25.739 -16.901 273 HA GLU 33 HA GLU 33 18.984 26.395 -17.213 274 1HB GLU 33 HB2 GLU 33 21.531 26.613 -18.704 275 2HB GLU 33 HB1 GLU 33 20.091 26.517 -19.715 276 1HG GLU 33 HG2 GLU 33 19.363 28.574 -19.090 277 2HG GLU 33 HG1 GLU 33 19.810 28.321 -17.402 278 H VAL 34 HN VAL 34 21.096 23.975 -18.820 279 HA VAL 34 HA VAL 34 18.982 22.729 -20.314 280 HB VAL 34 HB VAL 34 21.540 22.713 -20.625 281 1HG1 VAL 34 HG11 VAL 34 21.756 21.741 -18.191 282 2HG1 VAL 34 HG12 VAL 34 22.857 21.196 -19.455 283 3HG1 VAL 34 HG13 VAL 34 21.480 20.197 -18.993 284 1HG2 VAL 34 HG21 VAL 34 20.424 21.434 -22.201 285 2HG2 VAL 34 HG22 VAL 34 19.670 20.401 -20.986 286 3HG2 VAL 34 HG23 VAL 34 21.373 20.187 -21.393 287 H VAL 35 HN VAL 35 20.172 22.200 -17.009 288 HA VAL 35 HA VAL 35 18.757 19.653 -16.712 289 HB VAL 35 HB VAL 35 20.894 20.441 -15.533 290 1HG1 VAL 35 HG11 VAL 35 20.674 21.811 -13.586 291 2HG1 VAL 35 HG12 VAL 35 18.913 21.774 -13.676 292 3HG1 VAL 35 HG13 VAL 35 19.839 22.662 -14.883 293 1HG2 VAL 35 HG21 VAL 35 18.676 19.482 -13.708 294 2HG2 VAL 35 HG22 VAL 35 20.398 19.123 -13.585 295 3HG2 VAL 35 HG23 VAL 35 19.448 18.448 -14.908 296 H GLN 36 HN GLN 36 18.060 23.067 -15.985 297 HA GLN 36 HA GLN 36 15.647 22.396 -14.441 298 1HB GLN 36 HB2 GLN 36 15.480 24.761 -14.156 299 2HB GLN 36 HB1 GLN 36 17.204 24.406 -14.142 300 1HG GLN 36 HG2 GLN 36 17.578 25.517 -16.102 301 2HG GLN 36 HG1 GLN 36 16.064 24.978 -16.817 302 1HE2 GLN 36 HE21 GLN 36 14.215 26.353 -16.613 303 2HE2 GLN 36 HE22 GLN 36 14.278 27.874 -15.861 304 H ARG 37 HN ARG 37 16.431 22.990 -17.798 305 HA ARG 37 HA ARG 37 13.724 23.727 -18.627 306 1HB ARG 37 HB2 ARG 37 16.380 23.127 -19.873 307 2HB ARG 37 HB1 ARG 37 14.952 23.058 -20.905 308 1HG ARG 37 HG2 ARG 37 14.330 25.354 -20.077 309 2HG ARG 37 HG1 ARG 37 15.885 25.417 -19.247 310 1HD ARG 37 HD2 ARG 37 15.811 24.743 -22.183 311 2HD ARG 37 HD1 ARG 37 15.706 26.437 -21.663 312 HE ARG 37 HE ARG 37 17.812 25.798 -20.228 313 1HH1 ARG 37 HH21 ARG 37 17.616 23.126 -21.944 314 2HH1 ARG 37 HH22 ARG 37 18.957 23.392 -23.006 315 1HH2 ARG 37 HH11 ARG 37 19.279 26.756 -22.193 316 2HH2 ARG 37 HH12 ARG 37 19.900 25.452 -23.149 317 H HIS 38 HN HIS 38 15.711 20.749 -18.752 318 HA HIS 38 HA HIS 38 13.407 19.234 -19.858 319 1HB HIS 38 HB2 HIS 38 16.330 18.634 -19.365 320 2HB HIS 38 HB1 HIS 38 15.195 17.442 -20.002 321 HD1 HIS 38 HD1 HIS 38 13.864 18.272 -22.260 322 HD2 HIS 38 HD2 HIS 38 17.387 20.296 -21.324 323 HE1 HIS 38 HE1 HIS 38 14.563 19.502 -24.360 324 H ALA 39 HN ALA 39 15.564 19.187 -16.996 325 HA ALA 39 HA ALA 39 13.786 17.172 -15.700 326 1HB ALA 39 HB1 ALA 39 16.475 17.368 -15.857 327 2HB ALA 39 HB2 ALA 39 15.666 16.620 -14.481 328 3HB ALA 39 HB3 ALA 39 16.215 18.292 -14.377 329 HA PRO 40 HA PRO 40 11.868 20.305 -13.250 330 1HB PRO 40 HB2 PRO 40 11.127 18.831 -11.069 331 2HB PRO 40 HB1 PRO 40 10.308 18.714 -12.639 332 1HG PRO 40 HG2 PRO 40 12.323 16.903 -11.417 333 2HG PRO 40 HG1 PRO 40 10.908 16.521 -12.405 334 1HD PRO 40 HD2 PRO 40 13.472 16.544 -13.359 335 2HD PRO 40 HD1 PRO 40 12.034 16.814 -14.368 336 H GLY 41 HN GLY 41 12.540 21.778 -11.700 337 1HA GLY 41 HA2 GLY 41 13.701 22.618 -9.809 338 2HA GLY 41 HA1 GLY 41 14.342 21.001 -9.520 339 H ASP 42 HN ASP 42 15.843 23.503 -9.501 340 HA ASP 42 HA ASP 42 17.511 23.386 -11.959 341 1HB ASP 42 HB2 ASP 42 17.032 25.249 -9.669 342 2HB ASP 42 HB1 ASP 42 18.607 25.325 -10.460 343 H TYR 43 HN TYR 43 19.746 22.845 -11.863 344 HA TYR 43 HA TYR 43 20.750 21.736 -9.265 345 1HB TYR 43 HB2 TYR 43 20.631 20.478 -12.014 346 2HB TYR 43 HB1 TYR 43 21.705 19.870 -10.753 347 HD1 TYR 43 HD1 TYR 43 18.295 20.001 -11.978 348 HD2 TYR 43 HD2 TYR 43 20.719 19.131 -8.539 349 HE1 TYR 43 HE1 TYR 43 16.401 18.778 -10.951 350 HE2 TYR 43 HE2 TYR 43 18.823 17.908 -7.512 351 HH TYR 43 HH TYR 43 16.717 16.690 -8.405 352 H THR 44 HN THR 44 23.231 21.207 -9.572 353 HA THR 44 HA THR 44 24.549 23.207 -11.354 354 HB THR 44 HB THR 44 25.731 23.131 -8.685 355 HG1 THR 44 HG1 THR 44 24.055 23.567 -7.504 356 1HG2 THR 44 HG21 THR 44 26.359 24.939 -10.003 357 2HG2 THR 44 HG22 THR 44 25.103 25.664 -9.001 358 3HG2 THR 44 HG23 THR 44 24.734 25.163 -10.651 359 HA PRO 45 HA PRO 45 27.648 20.025 -11.506 360 1HB PRO 45 HB2 PRO 45 29.503 21.439 -12.923 361 2HB PRO 45 HB1 PRO 45 27.982 20.876 -13.638 362 1HG PRO 45 HG2 PRO 45 28.817 23.586 -12.985 363 2HG PRO 45 HG1 PRO 45 27.471 23.038 -13.990 364 1HD PRO 45 HD2 PRO 45 27.433 23.946 -11.230 365 2HD PRO 45 HD1 PRO 45 26.068 23.620 -12.319 366 H THR 46 HN THR 46 28.929 19.489 -9.706 367 HA THR 46 HA THR 46 30.289 21.519 -8.096 368 HB THR 46 HB THR 46 30.551 18.489 -8.103 369 HG1 THR 46 HG1 THR 46 28.602 18.484 -7.370 370 1HG2 THR 46 HG21 THR 46 32.258 19.593 -6.762 371 2HG2 THR 46 HG22 THR 46 31.067 18.859 -5.687 372 3HG2 THR 46 HG23 THR 46 31.037 20.598 -5.981 373 H VAL 47 HN VAL 47 32.008 22.524 -9.168 374 HA VAL 47 HA VAL 47 33.734 21.112 -11.035 375 HB VAL 47 HB VAL 47 33.123 23.513 -11.176 376 1HG1 VAL 47 HG11 VAL 47 34.890 24.797 -9.472 377 2HG1 VAL 47 HG12 VAL 47 34.230 23.512 -8.462 378 3HG1 VAL 47 HG13 VAL 47 33.147 24.668 -9.233 379 1HG2 VAL 47 HG21 VAL 47 36.106 23.276 -10.749 380 2HG2 VAL 47 HG22 VAL 47 35.248 24.261 -11.934 381 3HG2 VAL 47 HG23 VAL 47 35.295 22.508 -12.114 382 H LYS 48 HN LYS 48 35.807 20.353 -10.739 383 HA LYS 48 HA LYS 48 37.101 20.621 -8.063 384 1HB LYS 48 HB2 LYS 48 35.963 18.209 -9.385 385 2HB LYS 48 HB1 LYS 48 37.541 17.997 -8.628 386 1HG LYS 48 HG2 LYS 48 36.410 17.717 -6.689 387 2HG LYS 48 HG1 LYS 48 36.135 19.457 -6.735 388 1HD LYS 48 HD2 LYS 48 33.946 18.743 -6.594 389 2HD LYS 48 HD1 LYS 48 34.135 18.730 -8.347 390 1HE LYS 48 HE2 LYS 48 34.953 16.262 -7.997 391 2HE LYS 48 HE1 LYS 48 34.121 16.399 -6.435 392 1HZ LYS 48 HZ1 LYS 48 32.633 15.638 -8.229 393 2HZ LYS 48 HZ2 LYS 48 32.911 17.091 -9.063 394 3HZ LYS 48 HZ3 LYS 48 32.129 17.111 -7.554 395 HA PRO 49 HA PRO 49 40.540 21.181 -10.836 396 1HB PRO 49 HB2 PRO 49 42.534 21.185 -8.957 397 2HB PRO 49 HB1 PRO 49 41.455 22.569 -9.225 398 1HG PRO 49 HG2 PRO 49 41.375 20.491 -7.099 399 2HG PRO 49 HG1 PRO 49 41.025 22.223 -7.000 400 1HD PRO 49 HD2 PRO 49 39.099 20.287 -7.110 401 2HD PRO 49 HD1 PRO 49 38.858 21.955 -7.674 402 H SER 50 HN SER 50 40.688 19.220 -11.986 403 HA SER 50 HA SER 50 41.600 16.754 -10.645 404 1HB SER 50 HB2 SER 50 40.284 17.587 -13.127 405 2HB SER 50 HB1 SER 50 41.481 16.322 -13.390 406 HG SER 50 HG SER 50 39.934 15.073 -12.692 407 H SER 51 HN SER 51 42.795 18.800 -13.360 408 HA SER 51 HA SER 51 45.537 17.679 -12.848 409 1HB SER 51 HB2 SER 51 43.939 18.293 -15.303 410 2HB SER 51 HB1 SER 51 45.688 18.479 -15.389 411 HG SER 51 HG SER 51 45.243 16.376 -15.901 412 H LYS 52 HN LYS 52 43.984 20.562 -14.352 413 HA LYS 52 HA LYS 52 45.809 22.322 -12.783 414 1HB LYS 52 HB2 LYS 52 46.334 21.500 -15.402 415 2HB LYS 52 HB1 LYS 52 45.616 23.100 -15.598 416 1HG LYS 52 HG2 LYS 52 47.225 23.918 -13.806 417 2HG LYS 52 HG1 LYS 52 48.041 22.360 -13.943 418 1HD LYS 52 HD2 LYS 52 49.201 23.175 -15.690 419 2HD LYS 52 HD1 LYS 52 47.690 23.288 -16.591 420 1HE LYS 52 HE2 LYS 52 47.638 25.518 -14.889 421 2HE LYS 52 HE1 LYS 52 49.309 25.437 -15.478 422 1HZ LYS 52 HZ1 LYS 52 48.380 25.064 -17.736 423 2HZ LYS 52 HZ2 LYS 52 48.016 26.597 -17.099 424 3HZ LYS 52 HZ3 LYS 52 46.833 25.379 -17.116 425 H GLY 53 HN GLY 53 45.205 24.744 -13.534 426 1HA GLY 53 HA2 GLY 53 42.410 25.122 -12.902 427 2HA GLY 53 HA1 GLY 53 43.536 26.395 -13.375 428 H ASN 54 HN ASN 54 44.278 25.067 -15.900 429 HA ASN 54 HA ASN 54 42.335 26.217 -17.663 430 1HB ASN 54 HB2 ASN 54 44.758 25.818 -18.107 431 2HB ASN 54 HB1 ASN 54 44.440 24.085 -18.164 432 1HD2 ASN 54 HD21 ASN 54 44.566 26.916 -20.080 433 2HD2 ASN 54 HD22 ASN 54 43.775 26.304 -21.451 434 H TYR 55 HN TYR 55 42.761 22.883 -16.462 435 HA TYR 55 HA TYR 55 40.339 22.051 -18.023 436 1HB TYR 55 HB2 TYR 55 42.599 20.878 -18.272 437 2HB TYR 55 HB1 TYR 55 42.385 20.311 -16.616 438 HD1 TYR 55 HD1 TYR 55 41.302 19.963 -20.091 439 HD2 TYR 55 HD2 TYR 55 40.486 18.803 -16.035 440 HE1 TYR 55 HE1 TYR 55 39.851 18.125 -20.908 441 HE2 TYR 55 HE2 TYR 55 39.037 16.965 -16.853 442 HH TYR 55 HH TYR 55 37.656 16.745 -19.492 443 H HIS 56 HN HIS 56 38.491 22.017 -16.807 444 HA HIS 56 HA HIS 56 38.733 21.464 -13.866 445 1HB HIS 56 HB2 HIS 56 37.238 23.402 -15.540 446 2HB HIS 56 HB1 HIS 56 36.333 22.713 -14.195 447 HD1 HIS 56 HD1 HIS 56 36.682 25.464 -13.572 448 HD2 HIS 56 HD2 HIS 56 39.896 22.870 -13.005 449 HE1 HIS 56 HE1 HIS 56 38.256 26.616 -11.957 450 H SER 57 HN SER 57 37.561 19.770 -13.056 451 HA SER 57 HA SER 57 35.761 18.279 -14.934 452 1HB SER 57 HB2 SER 57 37.474 17.526 -12.554 453 2HB SER 57 HB1 SER 57 36.262 16.428 -13.209 454 HG SER 57 HG SER 57 38.500 16.295 -14.064 455 H VAL 58 HN VAL 58 33.710 19.179 -14.508 456 HA VAL 58 HA VAL 58 32.917 19.519 -11.650 457 HB VAL 58 HB VAL 58 31.279 21.055 -12.465 458 1HG1 VAL 58 HG11 VAL 58 33.281 22.232 -12.586 459 2HG1 VAL 58 HG12 VAL 58 32.671 22.413 -14.228 460 3HG1 VAL 58 HG13 VAL 58 33.923 21.222 -13.880 461 1HG2 VAL 58 HG21 VAL 58 30.781 21.300 -14.889 462 2HG2 VAL 58 HG22 VAL 58 30.366 19.697 -14.285 463 3HG2 VAL 58 HG23 VAL 58 31.840 19.930 -15.225 464 H SER 59 HN SER 59 31.054 18.501 -10.826 465 HA SER 59 HA SER 59 29.985 16.227 -12.464 466 1HB SER 59 HB2 SER 59 31.251 15.916 -10.232 467 2HB SER 59 HB1 SER 59 29.828 16.615 -9.463 468 HG SER 59 HG SER 59 29.426 14.474 -9.502 469 H ILE 60 HN ILE 60 28.007 16.794 -13.338 470 HA ILE 60 HA ILE 60 26.342 18.827 -11.973 471 HB ILE 60 HB ILE 60 26.829 18.914 -14.414 472 1HG1 ILE 60 HG12 ILE 60 23.924 18.430 -13.672 473 2HG1 ILE 60 HG11 ILE 60 24.786 19.963 -13.550 474 1HG2 ILE 60 HG21 ILE 60 24.917 16.680 -14.924 475 2HG2 ILE 60 HG22 ILE 60 26.553 16.238 -14.450 476 3HG2 ILE 60 HG23 ILE 60 26.290 17.224 -15.886 477 1HD1 ILE 60 HD11 ILE 60 23.941 18.472 -16.028 478 2HD1 ILE 60 HD12 ILE 60 25.255 19.645 -16.089 479 3HD1 ILE 60 HD13 ILE 60 23.640 20.156 -15.599 480 H THR 61 HN THR 61 24.531 18.392 -10.846 481 HA THR 61 HA THR 61 23.682 15.569 -10.478 482 HB THR 61 HB THR 61 22.637 18.182 -9.315 483 HG1 THR 61 HG1 THR 61 24.322 18.133 -8.088 484 1HG2 THR 61 HG21 THR 61 21.656 16.811 -7.591 485 2HG2 THR 61 HG22 THR 61 22.441 15.364 -8.224 486 3HG2 THR 61 HG23 THR 61 21.154 16.144 -9.144 487 H ILE 62 HN ILE 62 22.198 14.743 -11.944 488 HA ILE 62 HA ILE 62 20.268 16.660 -13.215 489 HB ILE 62 HB ILE 62 21.403 14.001 -14.139 490 1HG1 ILE 62 HG12 ILE 62 23.002 15.932 -14.146 491 2HG1 ILE 62 HG11 ILE 62 22.651 15.324 -15.762 492 1HG2 ILE 62 HG21 ILE 62 19.398 14.025 -15.273 493 2HG2 ILE 62 HG22 ILE 62 20.338 15.043 -16.363 494 3HG2 ILE 62 HG23 ILE 62 19.248 15.780 -15.190 495 1HD1 ILE 62 HD11 ILE 62 20.680 17.215 -15.432 496 2HD1 ILE 62 HD12 ILE 62 22.208 17.494 -16.264 497 3HD1 ILE 62 HD13 ILE 62 22.033 17.944 -14.568 498 H ASN 63 HN ASN 63 18.109 16.319 -12.880 499 HA ASN 63 HA ASN 63 17.267 13.821 -11.448 500 1HB ASN 63 HB2 ASN 63 16.985 16.162 -10.446 501 2HB ASN 63 HB1 ASN 63 15.800 16.464 -11.715 502 1HD2 ASN 63 HD21 ASN 63 13.804 15.112 -11.695 503 2HD2 ASN 63 HD22 ASN 63 13.315 14.341 -10.266 504 H ALA 64 HN ALA 64 17.533 13.145 -13.963 505 HA ALA 64 HA ALA 64 15.153 13.853 -15.577 506 1HB ALA 64 HB1 ALA 64 16.965 13.731 -16.979 507 2HB ALA 64 HB2 ALA 64 16.543 12.019 -17.016 508 3HB ALA 64 HB3 ALA 64 17.818 12.590 -15.940 509 H THR 65 HN THR 65 13.390 12.527 -15.791 510 HA THR 65 HA THR 65 13.054 10.204 -14.097 511 HB THR 65 HB THR 65 10.887 10.054 -15.412 512 HG1 THR 65 HG1 THR 65 10.939 10.985 -17.277 513 1HG2 THR 65 HG21 THR 65 11.780 12.668 -14.183 514 2HG2 THR 65 HG22 THR 65 10.863 11.370 -13.420 515 3HG2 THR 65 HG23 THR 65 10.110 12.367 -14.664 516 H HIS 66 HN HIS 66 14.352 10.636 -17.279 517 HA HIS 66 HA HIS 66 14.371 7.663 -17.681 518 1HB HIS 66 HB2 HIS 66 12.854 9.371 -19.107 519 2HB HIS 66 HB1 HIS 66 14.360 9.532 -20.010 520 HD1 HIS 66 HD1 HIS 66 11.910 6.862 -18.862 521 HD2 HIS 66 HD2 HIS 66 14.927 7.382 -21.692 522 HE1 HIS 66 HE1 HIS 66 11.856 4.814 -20.351 523 H ILE 67 HN ILE 67 16.252 6.923 -18.965 524 HA ILE 67 HA ILE 67 18.711 8.307 -18.250 525 HB ILE 67 HB ILE 67 18.298 5.811 -18.401 526 1HG1 ILE 67 HG12 ILE 67 20.568 6.076 -20.203 527 2HG1 ILE 67 HG11 ILE 67 20.596 7.327 -18.960 528 1HG2 ILE 67 HG21 ILE 67 17.726 4.825 -20.347 529 2HG2 ILE 67 HG22 ILE 67 18.971 5.697 -21.242 530 3HG2 ILE 67 HG23 ILE 67 17.400 6.447 -20.958 531 1HD1 ILE 67 HD11 ILE 67 19.958 5.229 -17.408 532 2HD1 ILE 67 HD12 ILE 67 21.630 5.656 -17.771 533 3HD1 ILE 67 HD13 ILE 67 20.831 4.371 -18.678 534 H GLU 68 HN GLU 68 16.575 8.477 -20.981 535 HA GLU 68 HA GLU 68 18.581 9.364 -22.922 536 1HB GLU 68 HB2 GLU 68 16.050 8.311 -23.008 537 2HB GLU 68 HB1 GLU 68 15.722 10.015 -23.320 538 1HG GLU 68 HG2 GLU 68 18.004 8.770 -24.789 539 2HG GLU 68 HG1 GLU 68 16.374 8.318 -25.290 540 H GLN 69 HN GLN 69 16.375 10.890 -20.609 541 HA GLN 69 HA GLN 69 16.484 13.571 -21.638 542 1HB GLN 69 HB2 GLN 69 15.047 12.303 -19.775 543 2HB GLN 69 HB1 GLN 69 16.267 12.996 -18.708 544 1HG GLN 69 HG2 GLN 69 15.682 15.150 -20.280 545 2HG GLN 69 HG1 GLN 69 14.117 14.338 -20.234 546 1HE2 GLN 69 HE21 GLN 69 13.135 13.976 -18.062 547 2HE2 GLN 69 HE22 GLN 69 13.615 14.933 -16.746 548 H VAL 70 HN VAL 70 18.403 11.951 -19.064 549 HA VAL 70 HA VAL 70 20.101 14.226 -18.545 550 HB VAL 70 HB VAL 70 19.700 12.299 -17.012 551 1HG1 VAL 70 HG11 VAL 70 19.725 10.486 -18.669 552 2HG1 VAL 70 HG12 VAL 70 20.940 10.187 -17.427 553 3HG1 VAL 70 HG13 VAL 70 21.427 10.797 -19.007 554 1HG2 VAL 70 HG21 VAL 70 22.072 12.034 -16.304 555 2HG2 VAL 70 HG22 VAL 70 21.672 13.711 -16.673 556 3HG2 VAL 70 HG23 VAL 70 22.587 12.747 -17.831 557 H GLU 71 HN GLU 71 20.222 11.618 -20.923 558 HA GLU 71 HA GLU 71 22.972 11.861 -21.714 559 1HB GLU 71 HB2 GLU 71 21.540 9.967 -22.297 560 2HB GLU 71 HB1 GLU 71 20.449 11.026 -23.188 561 1HG GLU 71 HG2 GLU 71 23.170 11.361 -24.128 562 2HG GLU 71 HG1 GLU 71 22.693 9.665 -24.209 563 H THR 72 HN THR 72 19.998 13.271 -23.169 564 HA THR 72 HA THR 72 21.348 14.935 -25.082 565 HB THR 72 HB THR 72 19.099 16.166 -24.990 566 HG1 THR 72 HG1 THR 72 18.215 15.856 -23.095 567 1HG2 THR 72 HG21 THR 72 19.571 14.242 -26.497 568 2HG2 THR 72 HG22 THR 72 17.885 14.298 -25.982 569 3HG2 THR 72 HG23 THR 72 18.996 13.149 -25.238 570 H LEU 73 HN LEU 73 20.390 15.443 -21.697 571 HA LEU 73 HA LEU 73 20.898 18.249 -21.499 572 1HB LEU 73 HB2 LEU 73 20.528 15.898 -19.760 573 2HB LEU 73 HB1 LEU 73 21.546 17.142 -19.038 574 HG LEU 73 HG LEU 73 19.826 18.819 -19.337 575 1HD1 LEU 73 HD11 LEU 73 18.045 16.706 -20.566 576 2HD1 LEU 73 HD12 LEU 73 19.023 17.795 -21.548 577 3HD1 LEU 73 HD13 LEU 73 17.777 18.444 -20.488 578 1HD2 LEU 73 HD21 LEU 73 18.596 18.117 -17.559 579 2HD2 LEU 73 HD22 LEU 73 19.611 16.676 -17.620 580 3HD2 LEU 73 HD23 LEU 73 18.031 16.676 -18.404 581 H TYR 74 HN TYR 74 23.043 15.415 -21.149 582 HA TYR 74 HA TYR 74 25.406 16.829 -20.322 583 1HB TYR 74 HB2 TYR 74 25.641 14.558 -20.017 584 2HB TYR 74 HB1 TYR 74 24.627 14.169 -21.404 585 HD1 TYR 74 HD1 TYR 74 25.750 12.956 -23.037 586 HD2 TYR 74 HD2 TYR 74 27.869 16.023 -20.901 587 HE1 TYR 74 HE1 TYR 74 27.773 12.507 -24.396 588 HE2 TYR 74 HE2 TYR 74 29.892 15.573 -22.261 589 HH TYR 74 HH TYR 74 30.640 13.140 -23.690 590 H GLU 75 HN GLU 75 24.284 15.754 -23.562 591 HA GLU 75 HA GLU 75 26.451 16.875 -25.069 592 1HB GLU 75 HB2 GLU 75 23.647 15.943 -25.548 593 2HB GLU 75 HB1 GLU 75 24.430 16.868 -26.829 594 1HG GLU 75 HG2 GLU 75 25.763 15.137 -27.393 595 2HG GLU 75 HG1 GLU 75 26.213 14.847 -25.713 596 H GLU 76 HN GLU 76 23.357 18.252 -23.974 597 HA GLU 76 HA GLU 76 23.477 20.709 -25.453 598 1HB GLU 76 HB2 GLU 76 22.092 19.652 -23.015 599 2HB GLU 76 HB1 GLU 76 21.980 21.376 -23.375 600 1HG GLU 76 HG2 GLU 76 21.066 20.915 -25.576 601 2HG GLU 76 HG1 GLU 76 21.320 19.182 -25.362 602 H LEU 77 HN LEU 77 24.505 19.936 -22.092 603 HA LEU 77 HA LEU 77 25.614 22.601 -21.669 604 1HB LEU 77 HB2 LEU 77 25.724 21.896 -19.498 605 2HB LEU 77 HB1 LEU 77 24.708 20.583 -20.078 606 HG LEU 77 HG LEU 77 27.045 19.462 -20.658 607 1HD1 LEU 77 HD11 LEU 77 27.836 21.857 -19.352 608 2HD1 LEU 77 HD12 LEU 77 28.865 20.515 -19.851 609 3HD1 LEU 77 HD13 LEU 77 28.167 20.536 -18.232 610 1HD2 LEU 77 HD21 LEU 77 26.766 19.313 -17.769 611 2HD2 LEU 77 HD22 LEU 77 26.424 18.082 -18.984 612 3HD2 LEU 77 HD23 LEU 77 25.189 19.267 -18.558 613 H GLY 78 HN GLY 78 26.871 19.503 -22.796 614 1HA GLY 78 HA2 GLY 78 29.642 20.603 -22.793 615 2HA GLY 78 HA1 GLY 78 29.225 18.898 -22.981 616 H LYS 79 HN LYS 79 28.004 21.820 -24.645 617 HA LYS 79 HA LYS 79 28.574 20.469 -27.253 618 1HB LYS 79 HB2 LYS 79 26.260 21.419 -26.284 619 2HB LYS 79 HB1 LYS 79 26.874 22.914 -26.993 620 1HG LYS 79 HG2 LYS 79 26.999 21.958 -29.167 621 2HG LYS 79 HG1 LYS 79 26.826 20.320 -28.541 622 1HD LYS 79 HD2 LYS 79 24.594 22.073 -27.792 623 2HD LYS 79 HD1 LYS 79 24.763 21.873 -29.537 624 1HE LYS 79 HE2 LYS 79 24.874 19.370 -29.163 625 2HE LYS 79 HE1 LYS 79 24.455 19.672 -27.466 626 1HZ LYS 79 HZ1 LYS 79 22.638 21.184 -28.646 627 2HZ LYS 79 HZ2 LYS 79 22.366 19.541 -28.311 628 3HZ LYS 79 HZ3 LYS 79 22.832 20.025 -29.871 629 H ILE 80 HN ILE 80 30.081 22.651 -25.277 630 HA ILE 80 HA ILE 80 30.673 24.859 -27.045 631 HB ILE 80 HB ILE 80 32.348 23.760 -24.766 632 1HG1 ILE 80 HG12 ILE 80 30.682 25.860 -23.850 633 2HG1 ILE 80 HG11 ILE 80 29.628 24.745 -24.720 634 1HG2 ILE 80 HG21 ILE 80 31.894 26.628 -25.623 635 2HG2 ILE 80 HG22 ILE 80 33.226 25.648 -26.234 636 3HG2 ILE 80 HG23 ILE 80 33.119 26.013 -24.513 637 1HD1 ILE 80 HD11 ILE 80 29.674 23.848 -22.544 638 2HD1 ILE 80 HD12 ILE 80 31.392 24.194 -22.340 639 3HD1 ILE 80 HD13 ILE 80 30.876 22.883 -23.402 640 H ASP 81 HN ASP 81 32.659 25.216 -28.242 641 HA ASP 81 HA ASP 81 33.678 22.980 -29.712 642 1HB ASP 81 HB2 ASP 81 33.746 25.742 -29.842 643 2HB ASP 81 HB1 ASP 81 35.426 25.342 -29.485 644 H ILE 82 HN ILE 82 34.682 24.438 -26.670 645 HA ILE 82 HA ILE 82 37.355 23.429 -26.512 646 HB ILE 82 HB ILE 82 35.620 25.032 -25.057 647 1HG1 ILE 82 HG12 ILE 82 37.630 25.100 -23.423 648 2HG1 ILE 82 HG11 ILE 82 38.376 23.938 -24.522 649 1HG2 ILE 82 HG21 ILE 82 36.377 22.710 -23.264 650 2HG2 ILE 82 HG22 ILE 82 34.761 22.938 -23.931 651 3HG2 ILE 82 HG23 ILE 82 35.437 24.137 -22.829 652 1HD1 ILE 82 HD11 ILE 82 37.315 26.677 -25.280 653 2HD1 ILE 82 HD12 ILE 82 38.002 25.507 -26.407 654 3HD1 ILE 82 HD13 ILE 82 39.015 26.222 -25.154 655 H VAL 83 HN VAL 83 37.918 21.744 -24.689 656 HA VAL 83 HA VAL 83 36.939 19.164 -25.462 657 HB VAL 83 HB VAL 83 38.455 20.162 -23.026 658 1HG1 VAL 83 HG11 VAL 83 37.857 17.365 -24.010 659 2HG1 VAL 83 HG12 VAL 83 37.592 18.032 -22.399 660 3HG1 VAL 83 HG13 VAL 83 39.233 17.716 -22.963 661 1HG2 VAL 83 HG21 VAL 83 39.145 19.716 -25.802 662 2HG2 VAL 83 HG22 VAL 83 40.071 18.628 -24.768 663 3HG2 VAL 83 HG23 VAL 83 40.146 20.370 -24.506 664 H ARG 84 HN ARG 84 34.940 18.363 -24.998 665 HA ARG 84 HA ARG 84 33.693 19.034 -22.347 666 1HB ARG 84 HB2 ARG 84 31.531 18.881 -23.553 667 2HB ARG 84 HB1 ARG 84 32.577 20.109 -24.258 668 1HG ARG 84 HG2 ARG 84 33.202 17.683 -25.584 669 2HG ARG 84 HG1 ARG 84 31.443 17.770 -25.510 670 1HD ARG 84 HD2 ARG 84 31.351 19.735 -26.768 671 2HD ARG 84 HD1 ARG 84 32.996 20.218 -26.315 672 HE ARG 84 HE ARG 84 32.441 17.897 -28.129 673 1HH1 ARG 84 HH21 ARG 84 33.042 20.468 -29.481 674 2HH1 ARG 84 HH22 ARG 84 34.762 20.405 -29.677 675 1HH2 ARG 84 HH11 ARG 84 35.198 17.869 -27.339 676 2HH2 ARG 84 HH12 ARG 84 35.987 18.928 -28.460 677 H MET 85 HN MET 85 33.158 17.256 -21.098 678 HA MET 85 HA MET 85 32.666 14.614 -22.354 679 1HB MET 85 HB2 MET 85 35.223 15.409 -21.479 680 2HB MET 85 HB1 MET 85 34.610 14.355 -20.205 681 1HG MET 85 HG2 MET 85 33.884 12.838 -22.248 682 2HG MET 85 HG1 MET 85 35.155 13.727 -23.086 683 1HE MET 85 HE1 MET 85 34.255 10.788 -21.086 684 2HE MET 85 HE2 MET 85 35.821 9.985 -21.154 685 3HE MET 85 HE3 MET 85 35.090 10.599 -22.635 686 H VAL 86 HN VAL 86 31.823 13.045 -20.732 687 HA VAL 86 HA VAL 86 31.017 14.240 -18.119 688 HB VAL 86 HB VAL 86 29.294 14.579 -19.958 689 1HG1 VAL 86 HG11 VAL 86 29.637 12.383 -21.070 690 2HG1 VAL 86 HG12 VAL 86 27.953 12.621 -20.604 691 3HG1 VAL 86 HG13 VAL 86 28.994 11.574 -19.641 692 1HG2 VAL 86 HG21 VAL 86 27.594 14.425 -18.417 693 2HG2 VAL 86 HG22 VAL 86 28.959 14.189 -17.325 694 3HG2 VAL 86 HG23 VAL 86 28.051 12.797 -17.916 695 H LEU 87 HN LEU 87 30.380 12.621 -16.533 696 HA LEU 87 HA LEU 87 30.775 10.615 -15.367 697 1HB LEU 87 HB2 LEU 87 29.947 9.673 -18.133 698 2HB LEU 87 HB1 LEU 87 30.013 8.621 -16.720 699 HG LEU 87 HG LEU 87 28.399 11.182 -16.769 700 1HD1 LEU 87 HD11 LEU 87 26.555 9.173 -16.891 701 2HD1 LEU 87 HD12 LEU 87 27.826 8.521 -17.925 702 3HD1 LEU 87 HD13 LEU 87 27.108 10.089 -18.294 703 1HD2 LEU 87 HD21 LEU 87 27.172 9.837 -14.942 704 2HD2 LEU 87 HD22 LEU 87 28.771 10.453 -14.533 705 3HD2 LEU 87 HD23 LEU 87 28.565 8.757 -14.966 Start of MODEL 4 1 1H MET 1 HT1 MET 1 29.261 13.076 -29.429 2 2H MET 1 HT2 MET 1 29.824 12.303 -28.025 3 3H MET 1 HT3 MET 1 29.054 13.815 -27.916 4 HA MET 1 HA MET 1 27.773 11.262 -28.764 5 1HB MET 1 HB2 MET 1 28.544 11.909 -26.298 6 2HB MET 1 HB1 MET 1 27.083 12.895 -26.345 7 1HG MET 1 HG2 MET 1 25.685 11.067 -26.430 8 2HG MET 1 HG1 MET 1 26.853 10.088 -27.318 9 1HE MET 1 HE1 MET 1 25.103 8.953 -24.775 10 2HE MET 1 HE2 MET 1 26.406 7.867 -24.293 11 3HE MET 1 HE3 MET 1 26.118 8.176 -26.000 12 H LYS 2 HN LYS 2 25.402 11.531 -28.984 13 HA LYS 2 HA LYS 2 24.534 14.331 -29.607 14 1HB LYS 2 HB2 LYS 2 23.511 13.438 -31.679 15 2HB LYS 2 HB1 LYS 2 25.249 13.146 -31.660 16 1HG LYS 2 HG2 LYS 2 24.978 10.847 -31.177 17 2HG LYS 2 HG1 LYS 2 23.314 11.066 -30.635 18 1HD LYS 2 HD2 LYS 2 23.588 11.997 -33.356 19 2HD LYS 2 HD1 LYS 2 24.183 10.341 -33.224 20 1HE LYS 2 HE2 LYS 2 22.058 9.701 -32.073 21 2HE LYS 2 HE1 LYS 2 21.456 11.349 -32.336 22 1HZ LYS 2 HZ1 LYS 2 22.399 9.489 -34.460 23 2HZ LYS 2 HZ2 LYS 2 21.854 11.079 -34.712 24 3HZ LYS 2 HZ3 LYS 2 20.781 9.890 -34.148 25 H THR 3 HN THR 3 22.059 14.388 -29.855 26 HA THR 3 HA THR 3 20.799 13.304 -27.508 27 HB THR 3 HB THR 3 20.185 15.409 -28.684 28 HG1 THR 3 HG1 THR 3 18.263 15.153 -27.918 29 1HG2 THR 3 HG21 THR 3 19.831 15.435 -30.901 30 2HG2 THR 3 HG22 THR 3 18.484 14.312 -30.719 31 3HG2 THR 3 HG23 THR 3 20.120 13.697 -30.954 32 H LYS 4 HN LYS 4 19.182 11.641 -27.353 33 HA LYS 4 HA LYS 4 18.999 9.778 -29.700 34 1HB LYS 4 HB2 LYS 4 20.190 9.437 -27.064 35 2HB LYS 4 HB1 LYS 4 18.928 8.239 -27.347 36 1HG LYS 4 HG2 LYS 4 20.769 7.174 -28.294 37 2HG LYS 4 HG1 LYS 4 20.099 8.001 -29.700 38 1HD LYS 4 HD2 LYS 4 22.027 9.130 -29.955 39 2HD LYS 4 HD1 LYS 4 21.818 9.840 -28.355 40 1HE LYS 4 HE2 LYS 4 22.824 7.722 -27.380 41 2HE LYS 4 HE1 LYS 4 23.233 7.244 -29.038 42 1HZ LYS 4 HZ1 LYS 4 24.689 8.970 -29.286 43 2HZ LYS 4 HZ2 LYS 4 24.878 8.696 -27.622 44 3HZ LYS 4 HZ3 LYS 4 23.895 9.969 -28.167 45 H LEU 5 HN LEU 5 17.589 10.549 -26.482 46 HA LEU 5 HA LEU 5 14.868 10.259 -27.650 47 1HB LEU 5 HB2 LEU 5 16.245 8.277 -26.099 48 2HB LEU 5 HB1 LEU 5 14.912 8.906 -25.134 49 HG LEU 5 HG LEU 5 14.023 8.535 -27.847 50 1HD1 LEU 5 HD11 LEU 5 15.516 6.809 -28.302 51 2HD1 LEU 5 HD12 LEU 5 14.181 5.916 -27.573 52 3HD1 LEU 5 HD13 LEU 5 15.610 6.307 -26.614 53 1HD2 LEU 5 HD21 LEU 5 12.208 8.206 -26.550 54 2HD2 LEU 5 HD22 LEU 5 13.211 7.994 -25.116 55 3HD2 LEU 5 HD23 LEU 5 12.852 6.614 -26.151 56 H ASN 6 HN ASN 6 13.191 10.898 -25.912 57 HA ASN 6 HA ASN 6 14.316 13.077 -24.177 58 1HB ASN 6 HB2 ASN 6 12.708 13.339 -26.344 59 2HB ASN 6 HB1 ASN 6 11.484 13.132 -25.090 60 1HD2 ASN 6 HD21 ASN 6 11.056 14.931 -23.743 61 2HD2 ASN 6 HD22 ASN 6 11.963 16.366 -23.761 62 H GLU 7 HN GLU 7 11.552 10.793 -24.478 63 HA GLU 7 HA GLU 7 11.717 10.185 -21.597 64 1HB GLU 7 HB2 GLU 7 10.436 12.350 -21.870 65 2HB GLU 7 HB1 GLU 7 9.229 11.449 -22.788 66 1HG GLU 7 HG2 GLU 7 8.541 11.635 -20.437 67 2HG GLU 7 HG1 GLU 7 8.882 9.954 -20.841 68 H LEU 8 HN LEU 8 10.743 8.189 -21.122 69 HA LEU 8 HA LEU 8 8.883 6.910 -23.013 70 1HB LEU 8 HB2 LEU 8 11.407 6.718 -23.754 71 2HB LEU 8 HB1 LEU 8 11.484 5.491 -22.490 72 HG LEU 8 HG LEU 8 9.198 4.734 -23.743 73 1HD1 LEU 8 HD11 LEU 8 9.170 6.242 -25.547 74 2HD1 LEU 8 HD12 LEU 8 9.935 4.815 -26.244 75 3HD1 LEU 8 HD13 LEU 8 10.921 6.188 -25.740 76 1HD2 LEU 8 HD21 LEU 8 11.112 3.284 -23.216 77 2HD2 LEU 8 HD22 LEU 8 12.037 4.005 -24.533 78 3HD2 LEU 8 HD23 LEU 8 10.606 3.037 -24.888 79 H LEU 9 HN LEU 9 11.234 5.922 -20.476 80 HA LEU 9 HA LEU 9 9.312 4.084 -19.259 81 1HB LEU 9 HB2 LEU 9 11.192 3.844 -17.578 82 2HB LEU 9 HB1 LEU 9 11.661 3.540 -19.247 83 HG LEU 9 HG LEU 9 11.968 6.351 -18.663 84 1HD1 LEU 9 HD11 LEU 9 13.944 4.886 -17.032 85 2HD1 LEU 9 HD12 LEU 9 12.315 4.904 -16.358 86 3HD1 LEU 9 HD13 LEU 9 13.139 6.422 -16.713 87 1HD2 LEU 9 HD21 LEU 9 13.865 4.078 -19.329 88 2HD2 LEU 9 HD22 LEU 9 14.350 5.773 -19.280 89 3HD2 LEU 9 HD23 LEU 9 13.152 5.233 -20.456 90 H GLU 10 HN GLU 10 10.242 7.427 -18.749 91 HA GLU 10 HA GLU 10 9.468 9.058 -17.250 92 1HB GLU 10 HB2 GLU 10 7.375 7.937 -18.338 93 2HB GLU 10 HB1 GLU 10 7.136 7.218 -16.746 94 1HG GLU 10 HG2 GLU 10 5.876 9.298 -16.859 95 2HG GLU 10 HG1 GLU 10 7.228 9.514 -15.747 96 H PHE 11 HN PHE 11 11.327 7.316 -16.065 97 HA PHE 11 HA PHE 11 10.224 6.961 -13.294 98 1HB PHE 11 HB2 PHE 11 10.956 4.906 -14.591 99 2HB PHE 11 HB1 PHE 11 12.589 5.573 -14.598 100 HD1 PHE 11 HD1 PHE 11 13.955 5.591 -12.611 101 HD2 PHE 11 HD2 PHE 11 9.871 4.265 -12.447 102 HE1 PHE 11 HE1 PHE 11 14.340 4.687 -10.335 103 HE2 PHE 11 HE2 PHE 11 10.258 3.360 -10.170 104 HZ PHE 11 HZ PHE 11 12.492 3.572 -9.114 105 HA PRO 12 HA PRO 12 13.139 10.376 -12.801 106 1HB PRO 12 HB2 PRO 12 12.340 11.035 -10.269 107 2HB PRO 12 HB1 PRO 12 11.470 11.548 -11.727 108 1HG PRO 12 HG2 PRO 12 10.862 9.319 -9.848 109 2HG PRO 12 HG1 PRO 12 9.761 10.449 -10.653 110 1HD PRO 12 HD2 PRO 12 10.154 7.894 -11.500 111 2HD PRO 12 HD1 PRO 12 9.711 9.226 -12.591 112 H THR 13 HN THR 13 15.188 9.623 -12.498 113 HA THR 13 HA THR 13 15.827 8.298 -9.884 114 HB THR 13 HB THR 13 15.635 6.655 -11.733 115 HG1 THR 13 HG1 THR 13 17.301 5.664 -10.949 116 1HG2 THR 13 HG21 THR 13 18.050 7.772 -13.079 117 2HG2 THR 13 HG22 THR 13 16.509 8.567 -13.393 118 3HG2 THR 13 HG23 THR 13 16.708 6.853 -13.759 119 HA PRO 14 HA PRO 14 18.951 11.408 -9.707 120 1HB PRO 14 HB2 PRO 14 20.642 10.229 -7.902 121 2HB PRO 14 HB1 PRO 14 19.094 10.967 -7.445 122 1HG PRO 14 HG2 PRO 14 19.774 8.098 -7.855 123 2HG PRO 14 HG1 PRO 14 18.734 8.849 -6.634 124 1HD PRO 14 HD2 PRO 14 17.771 7.583 -8.842 125 2HD PRO 14 HD1 PRO 14 16.919 8.914 -8.028 126 H PHE 15 HN PHE 15 20.459 11.739 -11.276 127 HA PHE 15 HA PHE 15 22.128 9.443 -12.223 128 1HB PHE 15 HB2 PHE 15 21.063 12.003 -13.395 129 2HB PHE 15 HB1 PHE 15 22.463 11.226 -14.128 130 HD1 PHE 15 HD1 PHE 15 19.042 11.489 -14.396 131 HD2 PHE 15 HD2 PHE 15 22.103 8.481 -14.224 132 HE1 PHE 15 HE1 PHE 15 17.544 9.900 -15.568 133 HE2 PHE 15 HE2 PHE 15 20.605 6.891 -15.396 134 HZ PHE 15 HZ PHE 15 18.326 7.600 -16.070 135 H THR 16 HN THR 16 23.933 9.522 -10.811 136 HA THR 16 HA THR 16 25.230 12.026 -10.054 137 HB THR 16 HB THR 16 27.064 10.276 -9.401 138 HG1 THR 16 HG1 THR 16 26.657 8.432 -10.319 139 1HG2 THR 16 HG21 THR 16 25.590 11.222 -7.743 140 2HG2 THR 16 HG22 THR 16 25.637 9.478 -7.485 141 3HG2 THR 16 HG23 THR 16 24.249 10.214 -8.288 142 H TYR 17 HN TYR 17 25.878 13.170 -11.917 143 HA TYR 17 HA TYR 17 27.628 11.694 -13.853 144 1HB TYR 17 HB2 TYR 17 25.558 13.837 -14.010 145 2HB TYR 17 HB1 TYR 17 26.901 13.947 -15.145 146 HD1 TYR 17 HD1 TYR 17 26.258 13.146 -17.230 147 HD2 TYR 17 HD2 TYR 17 24.985 11.044 -13.708 148 HE1 TYR 17 HE1 TYR 17 25.218 11.401 -18.648 149 HE2 TYR 17 HE2 TYR 17 23.947 9.300 -15.124 150 HH TYR 17 HH TYR 17 23.757 8.495 -17.221 151 H LYS 18 HN LYS 18 29.443 12.901 -14.729 152 HA LYS 18 HA LYS 18 30.394 15.208 -13.090 153 1HB LYS 18 HB2 LYS 18 31.563 12.483 -13.447 154 2HB LYS 18 HB1 LYS 18 32.693 13.836 -13.460 155 1HG LYS 18 HG2 LYS 18 32.559 13.994 -11.221 156 2HG LYS 18 HG1 LYS 18 30.819 14.246 -11.333 157 1HD LYS 18 HD2 LYS 18 30.806 11.617 -11.720 158 2HD LYS 18 HD1 LYS 18 32.337 11.715 -10.848 159 1HE LYS 18 HE2 LYS 18 31.049 11.655 -8.962 160 2HE LYS 18 HE1 LYS 18 30.663 13.346 -9.340 161 1HZ LYS 18 HZ1 LYS 18 28.652 11.971 -9.151 162 2HZ LYS 18 HZ2 LYS 18 29.209 10.983 -10.415 163 3HZ LYS 18 HZ3 LYS 18 28.831 12.613 -10.710 164 H VAL 19 HN VAL 19 30.255 16.714 -14.744 165 HA VAL 19 HA VAL 19 31.021 16.062 -17.497 166 HB VAL 19 HB VAL 19 30.419 18.750 -16.223 167 1HG1 VAL 19 HG11 VAL 19 29.396 18.976 -18.641 168 2HG1 VAL 19 HG12 VAL 19 30.520 17.673 -19.023 169 3HG1 VAL 19 HG13 VAL 19 31.126 19.206 -18.395 170 1HG2 VAL 19 HG21 VAL 19 28.652 17.011 -15.742 171 2HG2 VAL 19 HG22 VAL 19 28.453 16.812 -17.481 172 3HG2 VAL 19 HG23 VAL 19 28.078 18.358 -16.723 173 H MET 20 HN MET 20 33.236 15.631 -17.610 174 HA MET 20 HA MET 20 35.182 17.509 -16.373 175 1HB MET 20 HB2 MET 20 35.435 14.874 -17.870 176 2HB MET 20 HB1 MET 20 36.788 15.733 -17.134 177 1HG MET 20 HG2 MET 20 35.809 15.509 -14.931 178 2HG MET 20 HG1 MET 20 34.333 14.822 -15.607 179 1HE MET 20 HE1 MET 20 34.924 11.438 -14.637 180 2HE MET 20 HE2 MET 20 33.937 12.894 -14.752 181 3HE MET 20 HE3 MET 20 35.170 12.771 -13.503 182 H GLY 21 HN GLY 21 36.835 18.542 -17.712 183 1HA GLY 21 HA2 GLY 21 37.326 18.437 -20.403 184 2HA GLY 21 HA1 GLY 21 35.827 19.362 -20.346 185 H GLN 22 HN GLN 22 36.847 21.284 -21.109 186 HA GLN 22 HA GLN 22 39.182 22.418 -19.770 187 1HB GLN 22 HB2 GLN 22 38.074 22.673 -22.202 188 2HB GLN 22 HB1 GLN 22 37.309 24.056 -21.424 189 1HG GLN 22 HG2 GLN 22 40.180 23.848 -20.837 190 2HG GLN 22 HG1 GLN 22 39.835 24.056 -22.553 191 1HE2 GLN 22 HE21 GLN 22 40.547 25.874 -19.906 192 2HE2 GLN 22 HE22 GLN 22 39.676 27.286 -20.266 193 H ALA 23 HN ALA 23 39.132 24.516 -18.634 194 HA ALA 23 HA ALA 23 36.900 24.680 -16.716 195 1HB ALA 23 HB1 ALA 23 39.499 26.219 -17.046 196 2HB ALA 23 HB2 ALA 23 39.264 24.804 -16.022 197 3HB ALA 23 HB3 ALA 23 38.438 26.314 -15.640 198 H LEU 24 HN LEU 24 35.162 25.518 -18.009 199 HA LEU 24 HA LEU 24 35.527 28.370 -18.867 200 1HB LEU 24 HB2 LEU 24 33.948 27.821 -20.722 201 2HB LEU 24 HB1 LEU 24 35.428 26.870 -20.800 202 HG LEU 24 HG LEU 24 33.452 25.518 -19.165 203 1HD1 LEU 24 HD11 LEU 24 32.020 26.936 -20.820 204 2HD1 LEU 24 HD12 LEU 24 31.674 25.214 -20.667 205 3HD1 LEU 24 HD13 LEU 24 32.609 25.809 -22.041 206 1HD2 LEU 24 HD21 LEU 24 34.440 24.650 -21.877 207 2HD2 LEU 24 HD22 LEU 24 34.109 23.662 -20.454 208 3HD2 LEU 24 HD23 LEU 24 35.538 24.693 -20.499 209 HA PRO 25 HA PRO 25 32.100 29.198 -16.227 210 1HB PRO 25 HB2 PRO 25 31.130 31.472 -17.402 211 2HB PRO 25 HB1 PRO 25 32.626 31.433 -16.447 212 1HG PRO 25 HG2 PRO 25 32.266 31.426 -19.401 213 2HG PRO 25 HG1 PRO 25 33.481 32.253 -18.413 214 1HD PRO 25 HD2 PRO 25 33.974 29.953 -19.789 215 2HD PRO 25 HD1 PRO 25 34.836 30.413 -18.305 216 H GLU 26 HN GLU 26 31.589 28.833 -19.696 217 HA GLU 26 HA GLU 26 28.707 28.912 -19.708 218 1HB GLU 26 HB2 GLU 26 30.770 28.752 -21.537 219 2HB GLU 26 HB1 GLU 26 30.042 27.150 -21.656 220 1HG GLU 26 HG2 GLU 26 28.410 29.699 -21.750 221 2HG GLU 26 HG1 GLU 26 29.048 28.921 -23.197 222 H LEU 27 HN LEU 27 30.957 26.482 -18.613 223 HA LEU 27 HA LEU 27 29.456 24.097 -19.048 224 1HB LEU 27 HB2 LEU 27 31.875 24.777 -18.002 225 2HB LEU 27 HB1 LEU 27 30.993 24.396 -16.523 226 HG LEU 27 HG LEU 27 30.827 22.521 -18.866 227 1HD1 LEU 27 HD11 LEU 27 33.179 23.015 -17.086 228 2HD1 LEU 27 HD12 LEU 27 33.135 22.484 -18.767 229 3HD1 LEU 27 HD13 LEU 27 32.777 21.342 -17.472 230 1HD2 LEU 27 HD21 LEU 27 29.529 21.517 -17.302 231 2HD2 LEU 27 HD22 LEU 27 30.119 22.579 -16.024 232 3HD2 LEU 27 HD23 LEU 27 31.029 21.134 -16.460 233 H VAL 28 HN VAL 28 29.699 25.908 -15.945 234 HA VAL 28 HA VAL 28 27.445 24.595 -14.737 235 HB VAL 28 HB VAL 28 29.355 25.783 -13.603 236 1HG1 VAL 28 HG11 VAL 28 29.280 27.788 -15.140 237 2HG1 VAL 28 HG12 VAL 28 29.354 28.188 -13.424 238 3HG1 VAL 28 HG13 VAL 28 27.822 28.306 -14.291 239 1HG2 VAL 28 HG21 VAL 28 26.500 25.995 -12.954 240 2HG2 VAL 28 HG22 VAL 28 27.482 27.226 -12.161 241 3HG2 VAL 28 HG23 VAL 28 27.853 25.519 -11.929 242 H ASP 29 HN ASP 29 27.720 27.515 -16.728 243 HA ASP 29 HA ASP 29 25.143 28.650 -16.195 244 1HB ASP 29 HB2 ASP 29 27.014 29.803 -17.316 245 2HB ASP 29 HB1 ASP 29 26.901 28.685 -18.675 246 H GLN 30 HN GLN 30 26.203 26.555 -18.922 247 HA GLN 30 HA GLN 30 23.541 26.179 -19.977 248 1HB GLN 30 HB2 GLN 30 26.019 25.829 -20.916 249 2HB GLN 30 HB1 GLN 30 25.712 24.174 -20.392 250 1HG GLN 30 HG2 GLN 30 24.948 24.254 -22.644 251 2HG GLN 30 HG1 GLN 30 23.486 24.353 -21.664 252 1HE2 GLN 30 HE21 GLN 30 25.335 25.973 -24.094 253 2HE2 GLN 30 HE22 GLN 30 24.440 27.416 -24.121 254 H VAL 31 HN VAL 31 25.499 24.342 -17.636 255 HA VAL 31 HA VAL 31 23.935 21.972 -17.519 256 HB VAL 31 HB VAL 31 25.722 23.512 -15.657 257 1HG1 VAL 31 HG11 VAL 31 24.305 22.738 -13.971 258 2HG1 VAL 31 HG12 VAL 31 25.417 21.379 -14.133 259 3HG1 VAL 31 HG13 VAL 31 23.826 21.310 -14.889 260 1HG2 VAL 31 HG21 VAL 31 27.021 22.178 -17.023 261 2HG2 VAL 31 HG22 VAL 31 25.749 20.978 -17.235 262 3HG2 VAL 31 HG23 VAL 31 26.688 21.012 -15.744 263 H VAL 32 HN VAL 32 23.576 25.019 -15.652 264 HA VAL 32 HA VAL 32 21.208 24.152 -14.222 265 HB VAL 32 HB VAL 32 22.429 26.867 -14.821 266 1HG1 VAL 32 HG11 VAL 32 21.023 27.192 -12.508 267 2HG1 VAL 32 HG12 VAL 32 19.968 26.075 -13.374 268 3HG1 VAL 32 HG13 VAL 32 20.399 27.624 -14.100 269 1HG2 VAL 32 HG21 VAL 32 23.313 24.760 -13.207 270 2HG2 VAL 32 HG22 VAL 32 22.523 25.862 -12.081 271 3HG2 VAL 32 HG23 VAL 32 23.838 26.440 -13.102 272 H GLU 33 HN GLU 33 21.723 26.005 -17.234 273 HA GLU 33 HA GLU 33 18.938 26.721 -17.602 274 1HB GLU 33 HB2 GLU 33 21.515 26.868 -19.042 275 2HB GLU 33 HB1 GLU 33 20.102 26.773 -20.093 276 1HG GLU 33 HG2 GLU 33 19.756 28.966 -19.734 277 2HG GLU 33 HG1 GLU 33 19.404 28.587 -18.048 278 H VAL 34 HN VAL 34 20.981 24.265 -19.259 279 HA VAL 34 HA VAL 34 18.857 23.073 -20.749 280 HB VAL 34 HB VAL 34 21.359 22.910 -21.096 281 1HG1 VAL 34 HG11 VAL 34 22.710 21.577 -19.778 282 2HG1 VAL 34 HG12 VAL 34 21.372 20.553 -19.253 283 3HG1 VAL 34 HG13 VAL 34 21.579 22.160 -18.557 284 1HG2 VAL 34 HG21 VAL 34 20.160 21.481 -22.492 285 2HG2 VAL 34 HG22 VAL 34 19.503 20.550 -21.149 286 3HG2 VAL 34 HG23 VAL 34 21.186 20.340 -21.626 287 H VAL 35 HN VAL 35 20.011 22.413 -17.432 288 HA VAL 35 HA VAL 35 18.407 19.985 -17.162 289 HB VAL 35 HB VAL 35 20.570 20.697 -15.928 290 1HG1 VAL 35 HG11 VAL 35 19.559 22.914 -15.223 291 2HG1 VAL 35 HG12 VAL 35 20.306 21.988 -13.923 292 3HG1 VAL 35 HG13 VAL 35 18.550 22.011 -14.096 293 1HG2 VAL 35 HG21 VAL 35 19.040 18.718 -15.421 294 2HG2 VAL 35 HG22 VAL 35 18.297 19.727 -14.182 295 3HG2 VAL 35 HG23 VAL 35 20.005 19.302 -14.067 296 H GLN 36 HN GLN 36 17.912 23.429 -16.533 297 HA GLN 36 HA GLN 36 15.509 23.089 -14.920 298 1HB GLN 36 HB2 GLN 36 16.815 25.099 -14.731 299 2HB GLN 36 HB1 GLN 36 16.769 25.366 -16.474 300 1HG GLN 36 HG2 GLN 36 14.429 25.875 -16.428 301 2HG GLN 36 HG1 GLN 36 14.277 25.317 -14.761 302 1HE2 GLN 36 HE21 GLN 36 15.956 27.837 -16.720 303 2HE2 GLN 36 HE22 GLN 36 15.994 28.989 -15.473 304 H ARG 37 HN ARG 37 16.191 23.543 -18.383 305 HA ARG 37 HA ARG 37 13.435 23.942 -19.197 306 1HB ARG 37 HB2 ARG 37 16.117 23.554 -20.393 307 2HB ARG 37 HB1 ARG 37 14.771 23.029 -21.404 308 1HG ARG 37 HG2 ARG 37 14.221 25.159 -21.882 309 2HG ARG 37 HG1 ARG 37 14.154 25.573 -20.169 310 1HD ARG 37 HD2 ARG 37 15.879 26.970 -21.019 311 2HD ARG 37 HD1 ARG 37 16.766 25.606 -20.315 312 HE ARG 37 HE ARG 37 16.104 25.797 -23.232 313 1HH1 ARG 37 HH21 ARG 37 18.860 26.504 -22.074 314 2HH1 ARG 37 HH22 ARG 37 19.734 25.043 -22.397 315 1HH2 ARG 37 HH11 ARG 37 16.876 23.159 -23.014 316 2HH2 ARG 37 HH12 ARG 37 18.606 23.142 -22.933 317 H HIS 38 HN HIS 38 15.390 21.095 -18.531 318 HA HIS 38 HA HIS 38 13.368 19.319 -19.828 319 1HB HIS 38 HB2 HIS 38 16.181 19.347 -19.585 320 2HB HIS 38 HB1 HIS 38 15.629 17.996 -18.593 321 HD1 HIS 38 HD1 HIS 38 13.652 16.497 -19.930 322 HD2 HIS 38 HD2 HIS 38 16.399 18.623 -22.235 323 HE1 HIS 38 HE1 HIS 38 13.598 15.465 -22.242 324 H ALA 39 HN ALA 39 15.046 19.762 -16.691 325 HA ALA 39 HA ALA 39 12.991 18.031 -15.380 326 1HB ALA 39 HB1 ALA 39 15.241 17.365 -14.921 327 2HB ALA 39 HB2 ALA 39 14.715 18.231 -13.476 328 3HB ALA 39 HB3 ALA 39 15.756 19.030 -14.654 329 HA PRO 40 HA PRO 40 11.066 21.574 -13.602 330 1HB PRO 40 HB2 PRO 40 10.096 20.489 -11.279 331 2HB PRO 40 HB1 PRO 40 9.383 20.174 -12.874 332 1HG PRO 40 HG2 PRO 40 11.236 18.488 -11.264 333 2HG PRO 40 HG1 PRO 40 9.842 18.012 -12.247 334 1HD PRO 40 HD2 PRO 40 12.410 17.740 -13.089 335 2HD PRO 40 HD1 PRO 40 11.048 18.010 -14.198 336 H GLY 41 HN GLY 41 13.130 19.665 -11.373 337 1HA GLY 41 HA2 GLY 41 13.634 22.029 -9.693 338 2HA GLY 41 HA1 GLY 41 14.298 20.415 -9.438 339 H ASP 42 HN ASP 42 15.628 23.133 -9.591 340 HA ASP 42 HA ASP 42 17.260 23.047 -12.028 341 1HB ASP 42 HB2 ASP 42 16.932 24.747 -9.591 342 2HB ASP 42 HB1 ASP 42 18.472 24.851 -10.445 343 H TYR 43 HN TYR 43 19.530 22.586 -12.047 344 HA TYR 43 HA TYR 43 20.626 21.185 -9.637 345 1HB TYR 43 HB2 TYR 43 20.323 20.243 -12.489 346 2HB TYR 43 HB1 TYR 43 21.528 19.529 -11.419 347 HD1 TYR 43 HD1 TYR 43 18.166 19.345 -12.496 348 HD2 TYR 43 HD2 TYR 43 20.625 18.849 -9.011 349 HE1 TYR 43 HE1 TYR 43 16.405 17.950 -11.453 350 HE2 TYR 43 HE2 TYR 43 18.865 17.453 -7.967 351 HH TYR 43 HH TYR 43 15.979 17.411 -8.531 352 H THR 44 HN THR 44 23.019 21.051 -9.669 353 HA THR 44 HA THR 44 24.363 22.905 -11.592 354 HB THR 44 HB THR 44 24.655 23.008 -8.572 355 HG1 THR 44 HG1 THR 44 22.898 24.123 -8.607 356 1HG2 THR 44 HG21 THR 44 26.600 23.885 -9.695 357 2HG2 THR 44 HG22 THR 44 25.650 25.258 -9.127 358 3HG2 THR 44 HG23 THR 44 25.598 24.793 -10.827 359 HA PRO 45 HA PRO 45 27.608 19.883 -11.079 360 1HB PRO 45 HB2 PRO 45 29.379 21.063 -12.790 361 2HB PRO 45 HB1 PRO 45 27.910 20.244 -13.351 362 1HG PRO 45 HG2 PRO 45 28.543 23.081 -13.347 363 2HG PRO 45 HG1 PRO 45 27.247 22.223 -14.186 364 1HD PRO 45 HD2 PRO 45 27.129 23.735 -11.705 365 2HD PRO 45 HD1 PRO 45 25.796 23.084 -12.682 366 H THR 46 HN THR 46 29.331 19.698 -9.608 367 HA THR 46 HA THR 46 30.389 22.193 -8.366 368 HB THR 46 HB THR 46 30.795 19.269 -7.642 369 HG1 THR 46 HG1 THR 46 28.795 19.381 -7.055 370 1HG2 THR 46 HG21 THR 46 32.210 21.397 -6.751 371 2HG2 THR 46 HG22 THR 46 31.855 19.989 -5.750 372 3HG2 THR 46 HG23 THR 46 30.857 21.438 -5.620 373 H VAL 47 HN VAL 47 32.116 22.999 -9.554 374 HA VAL 47 HA VAL 47 33.864 21.299 -11.139 375 HB VAL 47 HB VAL 47 33.188 23.672 -11.631 376 1HG1 VAL 47 HG11 VAL 47 35.289 24.484 -9.619 377 2HG1 VAL 47 HG12 VAL 47 33.588 24.365 -9.169 378 3HG1 VAL 47 HG13 VAL 47 34.090 25.496 -10.425 379 1HG2 VAL 47 HG21 VAL 47 35.832 22.472 -11.818 380 2HG2 VAL 47 HG22 VAL 47 35.939 24.232 -11.757 381 3HG2 VAL 47 HG23 VAL 47 34.967 23.451 -13.003 382 H LYS 48 HN LYS 48 35.929 20.601 -10.702 383 HA LYS 48 HA LYS 48 37.209 21.361 -8.107 384 1HB LYS 48 HB2 LYS 48 36.361 18.657 -9.133 385 2HB LYS 48 HB1 LYS 48 37.742 18.783 -8.044 386 1HG LYS 48 HG2 LYS 48 36.421 19.733 -6.306 387 2HG LYS 48 HG1 LYS 48 35.078 20.059 -7.402 388 1HD LYS 48 HD2 LYS 48 35.912 17.224 -7.263 389 2HD LYS 48 HD1 LYS 48 35.214 17.870 -5.777 390 1HE LYS 48 HE2 LYS 48 33.208 17.385 -6.770 391 2HE LYS 48 HE1 LYS 48 33.496 18.869 -7.698 392 1HZ LYS 48 HZ1 LYS 48 34.293 16.107 -8.456 393 2HZ LYS 48 HZ2 LYS 48 34.801 17.502 -9.285 394 3HZ LYS 48 HZ3 LYS 48 33.155 17.090 -9.239 395 HA PRO 49 HA PRO 49 40.783 21.504 -10.720 396 1HB PRO 49 HB2 PRO 49 42.746 21.266 -8.825 397 2HB PRO 49 HB1 PRO 49 41.799 22.752 -9.053 398 1HG PRO 49 HG2 PRO 49 41.508 20.619 -7.001 399 2HG PRO 49 HG1 PRO 49 41.317 22.372 -6.844 400 1HD PRO 49 HD2 PRO 49 39.222 20.626 -7.038 401 2HD PRO 49 HD1 PRO 49 39.143 22.328 -7.545 402 H SER 50 HN SER 50 40.715 19.557 -11.915 403 HA SER 50 HA SER 50 41.443 16.998 -10.622 404 1HB SER 50 HB2 SER 50 40.944 16.174 -12.980 405 2HB SER 50 HB1 SER 50 39.610 16.985 -12.168 406 HG SER 50 HG SER 50 39.806 17.838 -14.221 407 H SER 51 HN SER 51 42.705 19.003 -13.338 408 HA SER 51 HA SER 51 45.356 17.644 -12.944 409 1HB SER 51 HB2 SER 51 43.672 18.240 -15.330 410 2HB SER 51 HB1 SER 51 45.413 18.411 -15.530 411 HG SER 51 HG SER 51 44.723 16.278 -15.962 412 H LYS 52 HN LYS 52 44.007 20.571 -14.553 413 HA LYS 52 HA LYS 52 45.990 22.241 -13.076 414 1HB LYS 52 HB2 LYS 52 46.415 21.274 -15.644 415 2HB LYS 52 HB1 LYS 52 45.764 22.887 -15.933 416 1HG LYS 52 HG2 LYS 52 47.450 23.663 -14.123 417 2HG LYS 52 HG1 LYS 52 48.234 22.108 -14.396 418 1HD LYS 52 HD2 LYS 52 49.203 22.888 -16.270 419 2HD LYS 52 HD1 LYS 52 47.625 23.305 -16.938 420 1HE LYS 52 HE2 LYS 52 48.234 25.240 -14.923 421 2HE LYS 52 HE1 LYS 52 49.645 25.096 -15.991 422 1HZ LYS 52 HZ1 LYS 52 48.086 26.620 -16.972 423 2HZ LYS 52 HZ2 LYS 52 46.818 25.505 -16.828 424 3HZ LYS 52 HZ3 LYS 52 48.100 25.204 -17.902 425 H GLY 53 HN GLY 53 45.555 24.676 -13.871 426 1HA GLY 53 HA2 GLY 53 42.847 25.325 -13.152 427 2HA GLY 53 HA1 GLY 53 44.036 26.465 -13.782 428 H ASN 54 HN ASN 54 44.481 24.902 -16.255 429 HA ASN 54 HA ASN 54 42.413 26.083 -17.900 430 1HB ASN 54 HB2 ASN 54 44.884 25.601 -18.407 431 2HB ASN 54 HB1 ASN 54 44.390 23.928 -18.673 432 1HD2 ASN 54 HD21 ASN 54 43.035 23.465 -20.554 433 2HD2 ASN 54 HD22 ASN 54 42.799 24.613 -21.782 434 H TYR 55 HN TYR 55 43.007 22.772 -16.700 435 HA TYR 55 HA TYR 55 40.543 21.843 -18.125 436 1HB TYR 55 HB2 TYR 55 42.838 20.714 -18.340 437 2HB TYR 55 HB1 TYR 55 42.624 20.194 -16.668 438 HD1 TYR 55 HD1 TYR 55 40.770 18.668 -16.046 439 HD2 TYR 55 HD2 TYR 55 41.534 19.750 -20.134 440 HE1 TYR 55 HE1 TYR 55 39.340 16.793 -16.810 441 HE2 TYR 55 HE2 TYR 55 40.105 17.874 -20.897 442 HH TYR 55 HH TYR 55 37.941 16.502 -19.440 443 H HIS 56 HN HIS 56 38.707 21.551 -16.912 444 HA HIS 56 HA HIS 56 39.014 21.252 -13.939 445 1HB HIS 56 HB2 HIS 56 37.480 23.095 -15.661 446 2HB HIS 56 HB1 HIS 56 36.562 22.412 -14.321 447 HD1 HIS 56 HD1 HIS 56 37.007 25.295 -13.976 448 HD2 HIS 56 HD2 HIS 56 39.930 22.551 -12.832 449 HE1 HIS 56 HE1 HIS 56 38.483 26.478 -12.293 450 H SER 57 HN SER 57 37.661 19.778 -12.929 451 HA SER 57 HA SER 57 35.913 18.091 -14.696 452 1HB SER 57 HB2 SER 57 37.844 16.841 -13.988 453 2HB SER 57 HB1 SER 57 37.731 17.469 -12.348 454 HG SER 57 HG SER 57 36.796 15.516 -12.214 455 H VAL 58 HN VAL 58 33.849 18.882 -14.214 456 HA VAL 58 HA VAL 58 33.231 19.497 -11.361 457 HB VAL 58 HB VAL 58 31.540 20.925 -12.202 458 1HG1 VAL 58 HG11 VAL 58 33.333 21.191 -14.569 459 2HG1 VAL 58 HG12 VAL 58 34.076 21.335 -12.977 460 3HG1 VAL 58 HG13 VAL 58 32.767 22.423 -13.440 461 1HG2 VAL 58 HG21 VAL 58 30.592 20.796 -14.420 462 2HG2 VAL 58 HG22 VAL 58 30.560 19.173 -13.737 463 3HG2 VAL 58 HG23 VAL 58 31.791 19.607 -14.919 464 H SER 59 HN SER 59 31.490 18.517 -10.294 465 HA SER 59 HA SER 59 30.448 16.010 -11.547 466 1HB SER 59 HB2 SER 59 29.903 15.512 -9.100 467 2HB SER 59 HB1 SER 59 31.618 15.659 -9.468 468 HG SER 59 HG SER 59 30.360 16.958 -7.647 469 H ILE 60 HN ILE 60 28.494 16.436 -12.527 470 HA ILE 60 HA ILE 60 26.732 18.536 -11.413 471 HB ILE 60 HB ILE 60 27.257 18.427 -13.828 472 1HG1 ILE 60 HG12 ILE 60 24.357 17.772 -13.209 473 2HG1 ILE 60 HG11 ILE 60 25.092 19.368 -13.057 474 1HG2 ILE 60 HG21 ILE 60 27.478 15.952 -13.987 475 2HG2 ILE 60 HG22 ILE 60 26.384 16.601 -15.206 476 3HG2 ILE 60 HG23 ILE 60 25.735 15.802 -13.776 477 1HD1 ILE 60 HD11 ILE 60 24.587 17.771 -15.567 478 2HD1 ILE 60 HD12 ILE 60 25.761 19.086 -15.538 479 3HD1 ILE 60 HD13 ILE 60 24.064 19.411 -15.187 480 H THR 61 HN THR 61 25.020 18.129 -10.169 481 HA THR 61 HA THR 61 24.150 15.295 -9.749 482 HB THR 61 HB THR 61 23.694 17.931 -8.305 483 HG1 THR 61 HG1 THR 61 25.474 17.303 -7.417 484 1HG2 THR 61 HG21 THR 61 22.692 16.351 -6.525 485 2HG2 THR 61 HG22 THR 61 22.515 15.193 -7.842 486 3HG2 THR 61 HG23 THR 61 21.684 16.746 -7.917 487 H ILE 62 HN ILE 62 22.261 14.623 -10.773 488 HA ILE 62 HA ILE 62 20.124 16.605 -11.321 489 HB ILE 62 HB ILE 62 21.638 16.840 -13.213 490 1HG1 ILE 62 HG12 ILE 62 19.293 15.093 -14.030 491 2HG1 ILE 62 HG11 ILE 62 19.170 16.811 -13.648 492 1HG2 ILE 62 HG21 ILE 62 22.775 14.639 -12.950 493 2HG2 ILE 62 HG22 ILE 62 22.269 14.931 -14.613 494 3HG2 ILE 62 HG23 ILE 62 21.337 13.843 -13.587 495 1HD1 ILE 62 HD11 ILE 62 21.046 15.739 -15.767 496 2HD1 ILE 62 HD12 ILE 62 20.566 17.415 -15.498 497 3HD1 ILE 62 HD13 ILE 62 19.396 16.252 -16.122 498 H ASN 63 HN ASN 63 18.104 15.660 -11.415 499 HA ASN 63 HA ASN 63 17.963 12.663 -11.289 500 1HB ASN 63 HB2 ASN 63 17.394 14.014 -9.211 501 2HB ASN 63 HB1 ASN 63 16.055 14.717 -10.118 502 1HD2 ASN 63 HD21 ASN 63 14.309 13.219 -10.836 503 2HD2 ASN 63 HD22 ASN 63 14.080 11.740 -10.039 504 H ALA 64 HN ALA 64 17.444 12.178 -13.437 505 HA ALA 64 HA ALA 64 15.252 13.752 -14.736 506 1HB ALA 64 HB1 ALA 64 17.694 12.264 -15.628 507 2HB ALA 64 HB2 ALA 64 17.117 13.857 -16.115 508 3HB ALA 64 HB3 ALA 64 16.345 12.406 -16.753 509 H THR 65 HN THR 65 13.410 12.706 -15.461 510 HA THR 65 HA THR 65 12.751 10.084 -14.397 511 HB THR 65 HB THR 65 10.650 10.555 -15.812 512 HG1 THR 65 HG1 THR 65 10.946 12.060 -17.228 513 1HG2 THR 65 HG21 THR 65 10.095 12.600 -14.322 514 2HG2 THR 65 HG22 THR 65 11.708 12.366 -13.648 515 3HG2 THR 65 HG23 THR 65 10.504 11.083 -13.522 516 H HIS 66 HN HIS 66 14.515 10.971 -17.150 517 HA HIS 66 HA HIS 66 13.869 8.350 -18.454 518 1HB HIS 66 HB2 HIS 66 12.924 10.431 -19.570 519 2HB HIS 66 HB1 HIS 66 14.586 10.939 -19.858 520 HD1 HIS 66 HD1 HIS 66 12.862 7.554 -20.274 521 HD2 HIS 66 HD2 HIS 66 15.167 10.252 -22.459 522 HE1 HIS 66 HE1 HIS 66 13.286 6.475 -22.525 523 H ILE 67 HN ILE 67 15.679 7.237 -19.296 524 HA ILE 67 HA ILE 67 18.244 7.745 -18.085 525 HB ILE 67 HB ILE 67 17.256 5.537 -18.797 526 1HG1 ILE 67 HG12 ILE 67 19.687 5.261 -20.260 527 2HG1 ILE 67 HG11 ILE 67 19.965 6.472 -19.008 528 1HG2 ILE 67 HG21 ILE 67 17.391 4.877 -21.129 529 2HG2 ILE 67 HG22 ILE 67 18.126 6.420 -21.563 530 3HG2 ILE 67 HG23 ILE 67 16.448 6.363 -21.023 531 1HD1 ILE 67 HD11 ILE 67 18.873 3.673 -18.599 532 2HD1 ILE 67 HD12 ILE 67 18.993 4.892 -17.331 533 3HD1 ILE 67 HD13 ILE 67 20.455 4.269 -18.095 534 H GLU 68 HN GLU 68 16.859 8.620 -21.222 535 HA GLU 68 HA GLU 68 19.463 9.530 -22.279 536 1HB GLU 68 HB2 GLU 68 16.945 8.669 -23.285 537 2HB GLU 68 HB1 GLU 68 17.181 10.327 -23.838 538 1HG GLU 68 HG2 GLU 68 18.213 8.965 -25.496 539 2HG GLU 68 HG1 GLU 68 19.542 9.600 -24.526 540 H GLN 69 HN GLN 69 16.938 10.879 -20.364 541 HA GLN 69 HA GLN 69 16.864 13.586 -21.285 542 1HB GLN 69 HB2 GLN 69 15.566 12.161 -19.429 543 2HB GLN 69 HB1 GLN 69 16.748 12.924 -18.370 544 1HG GLN 69 HG2 GLN 69 16.066 15.133 -19.115 545 2HG GLN 69 HG1 GLN 69 14.979 14.430 -20.312 546 1HE2 GLN 69 HE21 GLN 69 15.098 15.632 -17.132 547 2HE2 GLN 69 HE22 GLN 69 13.645 14.963 -16.565 548 H VAL 70 HN VAL 70 18.928 12.011 -18.820 549 HA VAL 70 HA VAL 70 20.490 14.382 -18.247 550 HB VAL 70 HB VAL 70 20.112 12.340 -16.791 551 1HG1 VAL 70 HG11 VAL 70 22.295 11.083 -18.469 552 2HG1 VAL 70 HG12 VAL 70 20.585 10.723 -18.712 553 3HG1 VAL 70 HG13 VAL 70 21.357 10.337 -17.174 554 1HG2 VAL 70 HG21 VAL 70 21.949 14.047 -16.455 555 2HG2 VAL 70 HG22 VAL 70 23.036 12.940 -17.296 556 3HG2 VAL 70 HG23 VAL 70 22.287 12.455 -15.775 557 H GLU 71 HN GLU 71 20.723 11.787 -20.633 558 HA GLU 71 HA GLU 71 23.463 12.257 -21.443 559 1HB GLU 71 HB2 GLU 71 22.198 10.175 -21.856 560 2HB GLU 71 HB1 GLU 71 21.063 11.058 -22.876 561 1HG GLU 71 HG2 GLU 71 23.642 11.675 -23.860 562 2HG GLU 71 HG1 GLU 71 23.626 9.934 -23.582 563 H THR 72 HN THR 72 20.305 13.251 -22.844 564 HA THR 72 HA THR 72 21.363 14.878 -24.952 565 HB THR 72 HB THR 72 19.039 15.904 -24.823 566 HG1 THR 72 HG1 THR 72 17.975 15.642 -23.053 567 1HG2 THR 72 HG21 THR 72 19.307 12.887 -24.763 568 2HG2 THR 72 HG22 THR 72 19.409 13.930 -26.181 569 3HG2 THR 72 HG23 THR 72 17.875 13.746 -25.331 570 H LEU 73 HN LEU 73 20.460 15.632 -21.583 571 HA LEU 73 HA LEU 73 20.867 18.459 -21.659 572 1HB LEU 73 HB2 LEU 73 20.606 16.274 -19.699 573 2HB LEU 73 HB1 LEU 73 21.569 17.628 -19.111 574 HG LEU 73 HG LEU 73 19.783 19.183 -19.480 575 1HD1 LEU 73 HD11 LEU 73 19.095 17.833 -21.662 576 2HD1 LEU 73 HD12 LEU 73 17.913 18.822 -20.811 577 3HD1 LEU 73 HD13 LEU 73 17.943 17.077 -20.564 578 1HD2 LEU 73 HD21 LEU 73 18.131 18.374 -17.967 579 2HD2 LEU 73 HD22 LEU 73 19.617 17.540 -17.516 580 3HD2 LEU 73 HD23 LEU 73 18.388 16.701 -18.462 581 H TYR 74 HN TYR 74 23.131 15.754 -21.138 582 HA TYR 74 HA TYR 74 25.442 17.303 -20.424 583 1HB TYR 74 HB2 TYR 74 25.772 15.063 -20.015 584 2HB TYR 74 HB1 TYR 74 24.770 14.565 -21.373 585 HD1 TYR 74 HD1 TYR 74 27.968 16.497 -20.889 586 HD2 TYR 74 HD2 TYR 74 25.893 13.413 -23.042 587 HE1 TYR 74 HE1 TYR 74 30.004 16.070 -22.238 588 HE2 TYR 74 HE2 TYR 74 27.929 12.986 -24.391 589 HH TYR 74 HH TYR 74 30.382 13.314 -24.176 590 H GLU 75 HN GLU 75 24.238 16.121 -23.593 591 HA GLU 75 HA GLU 75 26.347 17.176 -25.221 592 1HB GLU 75 HB2 GLU 75 23.475 16.369 -25.567 593 2HB GLU 75 HB1 GLU 75 24.287 17.185 -26.902 594 1HG GLU 75 HG2 GLU 75 25.238 15.230 -27.478 595 2HG GLU 75 HG1 GLU 75 26.098 15.225 -25.939 596 H GLU 76 HN GLU 76 23.356 18.646 -23.974 597 HA GLU 76 HA GLU 76 23.500 21.092 -25.490 598 1HB GLU 76 HB2 GLU 76 22.040 19.948 -23.189 599 2HB GLU 76 HB1 GLU 76 22.145 21.709 -23.200 600 1HG GLU 76 HG2 GLU 76 20.331 21.576 -24.571 601 2HG GLU 76 HG1 GLU 76 21.528 21.217 -25.815 602 H LEU 77 HN LEU 77 24.510 20.310 -22.126 603 HA LEU 77 HA LEU 77 25.703 22.918 -21.678 604 1HB LEU 77 HB2 LEU 77 25.955 22.122 -19.537 605 2HB LEU 77 HB1 LEU 77 24.823 20.901 -20.106 606 HG LEU 77 HG LEU 77 27.059 19.684 -20.891 607 1HD1 LEU 77 HD11 LEU 77 28.987 20.525 -20.081 608 2HD1 LEU 77 HD12 LEU 77 28.325 20.598 -18.448 609 3HD1 LEU 77 HD13 LEU 77 28.079 21.945 -19.559 610 1HD2 LEU 77 HD21 LEU 77 26.601 18.239 -19.199 611 2HD2 LEU 77 HD22 LEU 77 25.280 19.344 -18.821 612 3HD2 LEU 77 HD23 LEU 77 26.815 19.478 -17.963 613 H GLY 78 HN GLY 78 26.877 19.879 -23.011 614 1HA GLY 78 HA2 GLY 78 29.651 20.983 -23.075 615 2HA GLY 78 HA1 GLY 78 29.249 19.272 -23.220 616 H LYS 79 HN LYS 79 27.663 21.975 -24.898 617 HA LYS 79 HA LYS 79 28.189 20.625 -27.486 618 1HB LYS 79 HB2 LYS 79 25.995 21.765 -26.422 619 2HB LYS 79 HB1 LYS 79 26.660 23.174 -27.248 620 1HG LYS 79 HG2 LYS 79 26.340 22.272 -29.340 621 2HG LYS 79 HG1 LYS 79 26.603 20.620 -28.781 622 1HD LYS 79 HD2 LYS 79 24.284 21.488 -27.446 623 2HD LYS 79 HD1 LYS 79 24.106 22.059 -29.106 624 1HE LYS 79 HE2 LYS 79 24.167 19.889 -29.999 625 2HE LYS 79 HE1 LYS 79 25.018 19.230 -28.587 626 1HZ LYS 79 HZ1 LYS 79 23.072 19.628 -27.237 627 2HZ LYS 79 HZ2 LYS 79 22.640 18.669 -28.572 628 3HZ LYS 79 HZ3 LYS 79 22.250 20.322 -28.550 629 H ILE 80 HN ILE 80 29.919 22.758 -25.648 630 HA ILE 80 HA ILE 80 30.567 24.850 -27.549 631 HB ILE 80 HB ILE 80 32.330 23.853 -25.302 632 1HG1 ILE 80 HG12 ILE 80 30.688 25.884 -24.271 633 2HG1 ILE 80 HG11 ILE 80 29.582 24.791 -25.105 634 1HG2 ILE 80 HG21 ILE 80 31.702 26.664 -26.239 635 2HG2 ILE 80 HG22 ILE 80 33.065 25.720 -26.838 636 3HG2 ILE 80 HG23 ILE 80 32.982 26.166 -25.134 637 1HD1 ILE 80 HD11 ILE 80 29.726 23.765 -23.022 638 2HD1 ILE 80 HD12 ILE 80 31.411 24.232 -22.795 639 3HD1 ILE 80 HD13 ILE 80 31.000 22.921 -23.901 640 H ASP 81 HN ASP 81 32.590 25.041 -28.742 641 HA ASP 81 HA ASP 81 33.477 22.613 -30.042 642 1HB ASP 81 HB2 ASP 81 33.404 25.092 -30.830 643 2HB ASP 81 HB1 ASP 81 34.948 25.251 -29.993 644 H ILE 82 HN ILE 82 34.396 24.162 -27.091 645 HA ILE 82 HA ILE 82 37.166 23.330 -26.948 646 HB ILE 82 HB ILE 82 35.133 23.974 -24.777 647 1HG1 ILE 82 HG12 ILE 82 35.253 25.786 -26.431 648 2HG1 ILE 82 HG11 ILE 82 36.043 26.285 -24.937 649 1HG2 ILE 82 HG21 ILE 82 37.030 23.065 -23.702 650 2HG2 ILE 82 HG22 ILE 82 37.293 24.808 -23.637 651 3HG2 ILE 82 HG23 ILE 82 38.147 23.832 -24.832 652 1HD1 ILE 82 HD11 ILE 82 38.006 24.993 -26.558 653 2HD1 ILE 82 HD12 ILE 82 37.937 26.688 -26.079 654 3HD1 ILE 82 HD13 ILE 82 37.158 26.161 -27.571 655 H VAL 83 HN VAL 83 37.863 21.723 -25.163 656 HA VAL 83 HA VAL 83 36.846 19.110 -25.700 657 HB VAL 83 HB VAL 83 38.535 20.266 -23.457 658 1HG1 VAL 83 HG11 VAL 83 39.320 17.810 -23.302 659 2HG1 VAL 83 HG12 VAL 83 37.830 17.411 -24.158 660 3HG1 VAL 83 HG13 VAL 83 37.758 18.201 -22.583 661 1HG2 VAL 83 HG21 VAL 83 40.374 19.206 -24.804 662 2HG2 VAL 83 HG22 VAL 83 39.544 20.505 -25.659 663 3HG2 VAL 83 HG23 VAL 83 39.184 18.823 -26.048 664 H ARG 84 HN ARG 84 34.868 18.382 -25.100 665 HA ARG 84 HA ARG 84 33.800 19.114 -22.388 666 1HB ARG 84 HB2 ARG 84 31.590 19.068 -23.409 667 2HB ARG 84 HB1 ARG 84 32.628 20.099 -24.391 668 1HG ARG 84 HG2 ARG 84 31.849 18.835 -26.120 669 2HG ARG 84 HG1 ARG 84 33.053 17.670 -25.573 670 1HD ARG 84 HD2 ARG 84 31.385 16.495 -24.229 671 2HD ARG 84 HD1 ARG 84 30.166 17.724 -24.615 672 HE ARG 84 HE ARG 84 31.383 15.866 -26.620 673 1HH1 ARG 84 HH21 ARG 84 28.514 15.554 -25.784 674 2HH1 ARG 84 HH22 ARG 84 27.677 16.396 -27.044 675 1HH2 ARG 84 HH11 ARG 84 30.510 18.059 -28.180 676 2HH2 ARG 84 HH12 ARG 84 28.810 17.818 -28.405 677 H MET 85 HN MET 85 33.087 17.357 -21.118 678 HA MET 85 HA MET 85 32.693 14.681 -22.311 679 1HB MET 85 HB2 MET 85 35.226 15.577 -21.289 680 2HB MET 85 HB1 MET 85 34.600 14.331 -20.210 681 1HG MET 85 HG2 MET 85 34.122 12.955 -22.318 682 2HG MET 85 HG1 MET 85 35.119 14.125 -23.181 683 1HE MET 85 HE1 MET 85 35.178 10.767 -21.775 684 2HE MET 85 HE2 MET 85 34.812 11.662 -20.301 685 3HE MET 85 HE3 MET 85 36.320 10.759 -20.425 686 H VAL 86 HN VAL 86 31.695 13.205 -20.765 687 HA VAL 86 HA VAL 86 31.045 14.337 -18.082 688 HB VAL 86 HB VAL 86 29.328 14.920 -19.884 689 1HG1 VAL 86 HG11 VAL 86 27.764 13.114 -20.512 690 2HG1 VAL 86 HG12 VAL 86 28.759 11.948 -19.644 691 3HG1 VAL 86 HG13 VAL 86 29.396 12.756 -21.076 692 1HG2 VAL 86 HG21 VAL 86 27.603 14.816 -18.327 693 2HG2 VAL 86 HG22 VAL 86 29.004 14.586 -17.281 694 3HG2 VAL 86 HG23 VAL 86 28.047 13.195 -17.791 695 H LEU 87 HN LEU 87 30.284 12.695 -16.569 696 HA LEU 87 HA LEU 87 31.301 9.967 -17.221 697 1HB LEU 87 HB2 LEU 87 32.305 10.840 -15.280 698 2HB LEU 87 HB1 LEU 87 30.818 11.611 -14.746 699 HG LEU 87 HG LEU 87 30.661 8.668 -14.975 700 1HD1 LEU 87 HD11 LEU 87 31.965 8.195 -13.009 701 2HD1 LEU 87 HD12 LEU 87 32.268 9.909 -12.727 702 3HD1 LEU 87 HD13 LEU 87 33.004 9.100 -14.110 703 1HD2 LEU 87 HD21 LEU 87 29.991 9.631 -12.398 704 2HD2 LEU 87 HD22 LEU 87 28.877 9.213 -13.699 705 3HD2 LEU 87 HD23 LEU 87 29.454 10.871 -13.532 Start of MODEL 5 1 1H MET 1 HT1 MET 1 14.487 0.221 -19.127 2 2H MET 1 HT2 MET 1 14.755 -1.258 -19.917 3 3H MET 1 HT3 MET 1 14.858 0.201 -20.782 4 HA MET 1 HA MET 1 16.704 -0.688 -18.619 5 1HB MET 1 HB2 MET 1 16.571 -1.630 -21.115 6 2HB MET 1 HB1 MET 1 17.441 -0.138 -21.469 7 1HG MET 1 HG2 MET 1 19.255 -0.727 -20.060 8 2HG MET 1 HG1 MET 1 18.326 -1.994 -19.259 9 1HE MET 1 HE1 MET 1 21.093 -3.845 -20.714 10 2HE MET 1 HE2 MET 1 19.642 -4.629 -20.092 11 3HE MET 1 HE3 MET 1 20.226 -3.147 -19.338 12 H LYS 2 HN LYS 2 17.928 0.966 -17.750 13 HA LYS 2 HA LYS 2 17.393 3.736 -18.644 14 1HB LYS 2 HB2 LYS 2 17.560 2.651 -16.225 15 2HB LYS 2 HB1 LYS 2 19.282 2.960 -16.441 16 1HG LYS 2 HG2 LYS 2 18.920 5.097 -15.834 17 2HG LYS 2 HG1 LYS 2 17.968 5.306 -17.302 18 1HD LYS 2 HD2 LYS 2 16.304 3.927 -15.473 19 2HD LYS 2 HD1 LYS 2 17.064 5.235 -14.565 20 1HE LYS 2 HE2 LYS 2 16.297 6.886 -16.181 21 2HE LYS 2 HE1 LYS 2 15.665 5.608 -17.238 22 1HZ LYS 2 HZ1 LYS 2 13.900 6.477 -15.847 23 2HZ LYS 2 HZ2 LYS 2 14.802 6.157 -14.444 24 3HZ LYS 2 HZ3 LYS 2 14.238 4.874 -15.408 25 H THR 3 HN THR 3 18.660 2.863 -20.748 26 HA THR 3 HA THR 3 21.491 3.795 -20.453 27 HB THR 3 HB THR 3 21.984 1.931 -22.179 28 HG1 THR 3 HG1 THR 3 20.403 0.660 -22.673 29 1HG2 THR 3 HG21 THR 3 22.368 0.317 -20.447 30 2HG2 THR 3 HG22 THR 3 21.081 0.992 -19.448 31 3HG2 THR 3 HG23 THR 3 22.565 1.908 -19.712 32 H LYS 4 HN LYS 4 19.100 2.784 -22.940 33 HA LYS 4 HA LYS 4 19.384 5.409 -24.288 34 1HB LYS 4 HB2 LYS 4 21.152 3.579 -24.989 35 2HB LYS 4 HB1 LYS 4 19.800 2.895 -25.892 36 1HG LYS 4 HG2 LYS 4 20.613 4.332 -27.501 37 2HG LYS 4 HG1 LYS 4 19.524 5.441 -26.668 38 1HD LYS 4 HD2 LYS 4 21.772 5.706 -25.145 39 2HD LYS 4 HD1 LYS 4 22.483 5.393 -26.728 40 1HE LYS 4 HE2 LYS 4 21.699 7.370 -27.623 41 2HE LYS 4 HE1 LYS 4 20.237 7.363 -26.618 42 1HZ LYS 4 HZ1 LYS 4 21.558 7.872 -24.689 43 2HZ LYS 4 HZ2 LYS 4 21.861 9.039 -25.887 44 3HZ LYS 4 HZ3 LYS 4 22.993 7.805 -25.594 45 H LEU 5 HN LEU 5 17.120 4.472 -22.980 46 HA LEU 5 HA LEU 5 15.324 3.421 -25.134 47 1HB LEU 5 HB2 LEU 5 15.641 3.066 -22.240 48 2HB LEU 5 HB1 LEU 5 13.972 3.394 -22.699 49 HG LEU 5 HG LEU 5 14.383 0.983 -22.732 50 1HD1 LEU 5 HD11 LEU 5 14.311 1.864 -25.618 51 2HD1 LEU 5 HD12 LEU 5 12.961 2.175 -24.525 52 3HD1 LEU 5 HD13 LEU 5 13.462 0.518 -24.857 53 1HD2 LEU 5 HD21 LEU 5 16.714 1.818 -24.442 54 2HD2 LEU 5 HD22 LEU 5 15.999 0.221 -24.659 55 3HD2 LEU 5 HD23 LEU 5 16.674 0.680 -23.095 56 H ASN 6 HN ASN 6 13.131 4.398 -25.226 57 HA ASN 6 HA ASN 6 12.999 7.213 -24.204 58 1HB ASN 6 HB2 ASN 6 13.117 6.168 -26.942 59 2HB ASN 6 HB1 ASN 6 11.720 7.212 -26.680 60 1HD2 ASN 6 HD21 ASN 6 12.155 9.459 -25.935 61 2HD2 ASN 6 HD22 ASN 6 13.682 10.157 -26.192 62 H GLU 7 HN GLU 7 11.080 7.594 -23.177 63 HA GLU 7 HA GLU 7 8.908 7.232 -22.338 64 1HB GLU 7 HB2 GLU 7 8.944 7.236 -25.213 65 2HB GLU 7 HB1 GLU 7 7.697 6.115 -24.668 66 1HG GLU 7 HG2 GLU 7 6.635 8.248 -24.791 67 2HG GLU 7 HG1 GLU 7 6.928 7.960 -23.076 68 H LEU 8 HN LEU 8 10.304 5.269 -21.301 69 HA LEU 8 HA LEU 8 8.614 2.838 -21.658 70 1HB LEU 8 HB2 LEU 8 10.975 3.073 -22.957 71 2HB LEU 8 HB1 LEU 8 11.555 2.440 -21.418 72 HG LEU 8 HG LEU 8 9.338 0.863 -21.936 73 1HD1 LEU 8 HD11 LEU 8 10.861 1.339 -24.517 74 2HD1 LEU 8 HD12 LEU 8 9.180 1.781 -24.217 75 3HD1 LEU 8 HD13 LEU 8 9.651 0.082 -24.261 76 1HD2 LEU 8 HD21 LEU 8 12.114 0.149 -22.884 77 2HD2 LEU 8 HD22 LEU 8 10.916 -0.891 -22.113 78 3HD2 LEU 8 HD23 LEU 8 11.756 0.338 -21.167 79 H LEU 9 HN LEU 9 11.262 4.376 -19.795 80 HA LEU 9 HA LEU 9 10.680 2.713 -17.424 81 1HB LEU 9 HB2 LEU 9 12.619 4.990 -17.960 82 2HB LEU 9 HB1 LEU 9 12.623 3.977 -16.517 83 HG LEU 9 HG LEU 9 12.616 2.128 -18.592 84 1HD1 LEU 9 HD11 LEU 9 14.371 2.825 -20.127 85 2HD1 LEU 9 HD12 LEU 9 14.560 4.356 -19.271 86 3HD1 LEU 9 HD13 LEU 9 13.078 4.022 -20.167 87 1HD2 LEU 9 HD21 LEU 9 14.215 2.878 -16.392 88 2HD2 LEU 9 HD22 LEU 9 15.314 2.792 -17.769 89 3HD2 LEU 9 HD23 LEU 9 14.335 1.391 -17.333 90 H GLU 10 HN GLU 10 10.752 6.231 -18.150 91 HA GLU 10 HA GLU 10 9.583 8.033 -17.179 92 1HB GLU 10 HB2 GLU 10 7.789 5.680 -17.259 93 2HB GLU 10 HB1 GLU 10 7.285 6.947 -16.142 94 1HG GLU 10 HG2 GLU 10 6.281 7.499 -18.236 95 2HG GLU 10 HG1 GLU 10 7.651 8.596 -18.060 96 H PHE 11 HN PHE 11 11.522 6.520 -15.499 97 HA PHE 11 HA PHE 11 10.305 6.893 -12.783 98 1HB PHE 11 HB2 PHE 11 11.099 4.629 -13.321 99 2HB PHE 11 HB1 PHE 11 12.680 5.273 -13.765 100 HD1 PHE 11 HD1 PHE 11 14.353 5.596 -12.131 101 HD2 PHE 11 HD2 PHE 11 10.273 5.024 -10.914 102 HE1 PHE 11 HE1 PHE 11 15.077 5.461 -9.764 103 HE2 PHE 11 HE2 PHE 11 10.998 4.889 -8.547 104 HZ PHE 11 HZ PHE 11 13.400 5.107 -7.972 105 HA PRO 12 HA PRO 12 13.012 10.475 -12.785 106 1HB PRO 12 HB2 PRO 12 12.293 11.370 -10.300 107 2HB PRO 12 HB1 PRO 12 11.309 11.640 -11.752 108 1HG PRO 12 HG2 PRO 12 10.990 9.602 -9.600 109 2HG PRO 12 HG1 PRO 12 9.757 10.549 -10.450 110 1HD PRO 12 HD2 PRO 12 10.295 7.954 -11.041 111 2HD PRO 12 HD1 PRO 12 9.709 9.121 -12.248 112 H THR 13 HN THR 13 15.117 9.796 -12.562 113 HA THR 13 HA THR 13 15.988 8.901 -9.829 114 HB THR 13 HB THR 13 15.843 7.011 -11.396 115 HG1 THR 13 HG1 THR 13 17.584 6.380 -10.455 116 1HG2 THR 13 HG21 THR 13 16.048 8.236 -13.506 117 2HG2 THR 13 HG22 THR 13 17.279 6.977 -13.422 118 3HG2 THR 13 HG23 THR 13 17.715 8.658 -13.119 119 HA PRO 14 HA PRO 14 18.897 12.200 -10.245 120 1HB PRO 14 HB2 PRO 14 20.696 11.413 -8.335 121 2HB PRO 14 HB1 PRO 14 19.118 12.125 -7.944 122 1HG PRO 14 HG2 PRO 14 19.964 9.272 -7.925 123 2HG PRO 14 HG1 PRO 14 18.902 10.143 -6.807 124 1HD PRO 14 HD2 PRO 14 17.985 8.490 -8.770 125 2HD PRO 14 HD1 PRO 14 17.059 9.867 -8.135 126 H PHE 15 HN PHE 15 20.456 12.413 -11.802 127 HA PHE 15 HA PHE 15 22.132 10.030 -12.500 128 1HB PHE 15 HB2 PHE 15 21.027 12.414 -13.978 129 2HB PHE 15 HB1 PHE 15 22.400 11.528 -14.632 130 HD1 PHE 15 HD1 PHE 15 22.009 8.795 -14.331 131 HD2 PHE 15 HD2 PHE 15 18.979 11.792 -14.866 132 HE1 PHE 15 HE1 PHE 15 20.470 7.078 -15.242 133 HE2 PHE 15 HE2 PHE 15 17.442 10.075 -15.776 134 HZ PHE 15 HZ PHE 15 18.186 7.718 -15.964 135 H THR 16 HN THR 16 23.960 10.314 -11.154 136 HA THR 16 HA THR 16 25.244 12.908 -10.759 137 HB THR 16 HB THR 16 26.404 10.123 -10.395 138 HG1 THR 16 HG1 THR 16 25.095 9.846 -8.781 139 1HG2 THR 16 HG21 THR 16 27.292 12.790 -9.794 140 2HG2 THR 16 HG22 THR 16 28.123 11.261 -9.503 141 3HG2 THR 16 HG23 THR 16 27.032 11.917 -8.283 142 H TYR 17 HN TYR 17 25.679 13.705 -12.900 143 HA TYR 17 HA TYR 17 27.434 12.006 -14.624 144 1HB TYR 17 HB2 TYR 17 25.387 14.135 -14.984 145 2HB TYR 17 HB1 TYR 17 26.707 14.122 -16.151 146 HD1 TYR 17 HD1 TYR 17 25.917 13.149 -18.127 147 HD2 TYR 17 HD2 TYR 17 24.942 11.324 -14.361 148 HE1 TYR 17 HE1 TYR 17 24.865 11.248 -19.320 149 HE2 TYR 17 HE2 TYR 17 23.891 9.425 -15.555 150 HH TYR 17 HH TYR 17 22.789 9.155 -17.979 151 H LYS 18 HN LYS 18 29.558 12.383 -14.074 152 HA LYS 18 HA LYS 18 30.515 15.012 -13.208 153 1HB LYS 18 HB2 LYS 18 31.282 12.390 -12.883 154 2HB LYS 18 HB1 LYS 18 32.447 12.951 -14.082 155 1HG LYS 18 HG2 LYS 18 32.023 14.892 -11.929 156 2HG LYS 18 HG1 LYS 18 32.635 13.347 -11.341 157 1HD LYS 18 HD2 LYS 18 33.895 14.575 -13.771 158 2HD LYS 18 HD1 LYS 18 34.316 15.204 -12.177 159 1HE LYS 18 HE2 LYS 18 34.731 12.734 -11.512 160 2HE LYS 18 HE1 LYS 18 34.740 12.413 -13.257 161 1HZ LYS 18 HZ1 LYS 18 36.359 14.527 -11.940 162 2HZ LYS 18 HZ2 LYS 18 36.425 14.058 -13.573 163 3HZ LYS 18 HZ3 LYS 18 36.959 12.996 -12.359 164 H VAL 19 HN VAL 19 30.092 16.409 -15.005 165 HA VAL 19 HA VAL 19 31.030 15.753 -17.694 166 HB VAL 19 HB VAL 19 30.171 18.424 -16.531 167 1HG1 VAL 19 HG11 VAL 19 29.745 17.362 -19.326 168 2HG1 VAL 19 HG12 VAL 19 31.212 18.235 -18.880 169 3HG1 VAL 19 HG13 VAL 19 29.644 19.029 -18.762 170 1HG2 VAL 19 HG21 VAL 19 28.671 15.969 -16.817 171 2HG2 VAL 19 HG22 VAL 19 28.033 17.187 -17.921 172 3HG2 VAL 19 HG23 VAL 19 28.129 17.526 -16.192 173 H MET 20 HN MET 20 33.295 15.455 -17.588 174 HA MET 20 HA MET 20 34.967 17.630 -16.429 175 1HB MET 20 HB2 MET 20 35.385 15.272 -15.822 176 2HB MET 20 HB1 MET 20 35.618 14.871 -17.523 177 1HG MET 20 HG2 MET 20 37.598 16.216 -17.660 178 2HG MET 20 HG1 MET 20 37.284 16.954 -16.091 179 1HE MET 20 HE1 MET 20 37.778 14.009 -18.124 180 2HE MET 20 HE2 MET 20 38.377 12.695 -17.115 181 3HE MET 20 HE3 MET 20 39.488 13.941 -17.676 182 H GLY 21 HN GLY 21 36.507 18.753 -17.706 183 1HA GLY 21 HA2 GLY 21 37.307 18.283 -20.334 184 2HA GLY 21 HA1 GLY 21 35.781 19.155 -20.485 185 H GLN 22 HN GLN 22 36.877 21.003 -21.389 186 HA GLN 22 HA GLN 22 39.022 22.352 -19.958 187 1HB GLN 22 HB2 GLN 22 38.151 22.356 -22.484 188 2HB GLN 22 HB1 GLN 22 37.230 23.744 -21.909 189 1HG GLN 22 HG2 GLN 22 39.289 24.639 -22.716 190 2HG GLN 22 HG1 GLN 22 39.434 24.634 -20.959 191 1HE2 GLN 22 HE21 GLN 22 41.432 23.845 -20.290 192 2HE2 GLN 22 HE22 GLN 22 42.329 22.646 -21.088 193 H ALA 23 HN ALA 23 38.870 24.017 -18.474 194 HA ALA 23 HA ALA 23 36.422 24.430 -17.006 195 1HB ALA 23 HB1 ALA 23 38.459 24.674 -15.835 196 2HB ALA 23 HB2 ALA 23 37.918 26.339 -16.042 197 3HB ALA 23 HB3 ALA 23 39.168 25.679 -17.099 198 H LEU 24 HN LEU 24 34.724 25.587 -17.811 199 HA LEU 24 HA LEU 24 35.295 28.146 -19.265 200 1HB LEU 24 HB2 LEU 24 33.702 25.737 -19.991 201 2HB LEU 24 HB1 LEU 24 32.983 27.295 -20.394 202 HG LEU 24 HG LEU 24 35.761 27.376 -21.096 203 1HD1 LEU 24 HD11 LEU 24 34.504 24.779 -21.476 204 2HD1 LEU 24 HD12 LEU 24 36.178 25.260 -21.751 205 3HD1 LEU 24 HD13 LEU 24 34.974 25.496 -23.018 206 1HD2 LEU 24 HD21 LEU 24 33.745 28.635 -22.031 207 2HD2 LEU 24 HD22 LEU 24 33.364 27.169 -22.935 208 3HD2 LEU 24 HD23 LEU 24 34.882 28.017 -23.229 209 HA PRO 25 HA PRO 25 32.444 29.849 -16.353 210 1HB PRO 25 HB2 PRO 25 31.608 32.051 -17.746 211 2HB PRO 25 HB1 PRO 25 33.216 31.928 -17.006 212 1HG PRO 25 HG2 PRO 25 32.409 31.562 -19.844 213 2HG PRO 25 HG1 PRO 25 33.862 32.316 -19.171 214 1HD PRO 25 HD2 PRO 25 33.804 29.791 -20.214 215 2HD PRO 25 HD1 PRO 25 34.961 30.323 -18.975 216 H GLU 26 HN GLU 26 31.401 29.101 -19.637 217 HA GLU 26 HA GLU 26 28.552 29.498 -19.131 218 1HB GLU 26 HB2 GLU 26 28.333 28.652 -21.390 219 2HB GLU 26 HB1 GLU 26 29.741 29.709 -21.338 220 1HG GLU 26 HG2 GLU 26 30.856 27.978 -22.291 221 2HG GLU 26 HG1 GLU 26 30.830 27.257 -20.684 222 H LEU 27 HN LEU 27 30.715 27.016 -18.207 223 HA LEU 27 HA LEU 27 29.193 24.647 -18.624 224 1HB LEU 27 HB2 LEU 27 31.511 25.545 -17.165 225 2HB LEU 27 HB1 LEU 27 30.552 24.490 -16.130 226 HG LEU 27 HG LEU 27 30.587 23.321 -18.728 227 1HD1 LEU 27 HD11 LEU 27 32.552 24.213 -19.501 228 2HD1 LEU 27 HD12 LEU 27 33.243 22.938 -18.495 229 3HD1 LEU 27 HD13 LEU 27 33.139 24.589 -17.882 230 1HD2 LEU 27 HD21 LEU 27 32.267 22.403 -16.402 231 2HD2 LEU 27 HD22 LEU 27 31.337 21.435 -17.548 232 3HD2 LEU 27 HD23 LEU 27 30.507 22.363 -16.299 233 H VAL 28 HN VAL 28 29.386 26.559 -15.573 234 HA VAL 28 HA VAL 28 27.188 25.236 -14.296 235 HB VAL 28 HB VAL 28 29.025 26.634 -13.264 236 1HG1 VAL 28 HG11 VAL 28 28.724 28.526 -14.946 237 2HG1 VAL 28 HG12 VAL 28 28.869 29.023 -13.260 238 3HG1 VAL 28 HG13 VAL 28 27.286 28.990 -14.036 239 1HG2 VAL 28 HG21 VAL 28 27.438 26.191 -11.662 240 2HG2 VAL 28 HG22 VAL 28 26.119 26.846 -12.632 241 3HG2 VAL 28 HG23 VAL 28 27.205 27.935 -11.769 242 H ASP 29 HN ASP 29 27.305 28.006 -16.506 243 HA ASP 29 HA ASP 29 24.611 28.946 -16.061 244 1HB ASP 29 HB2 ASP 29 26.377 30.291 -17.101 245 2HB ASP 29 HB1 ASP 29 26.515 29.133 -18.424 246 H GLN 30 HN GLN 30 25.987 27.000 -18.761 247 HA GLN 30 HA GLN 30 23.466 26.324 -19.952 248 1HB GLN 30 HB2 GLN 30 26.004 26.141 -20.712 249 2HB GLN 30 HB1 GLN 30 25.844 24.505 -20.073 250 1HG GLN 30 HG2 GLN 30 25.065 24.063 -22.182 251 2HG GLN 30 HG1 GLN 30 23.551 24.665 -21.510 252 1HE2 GLN 30 HE21 GLN 30 26.360 25.598 -23.505 253 2HE2 GLN 30 HE22 GLN 30 25.617 26.953 -24.206 254 H VAL 31 HN VAL 31 25.438 24.678 -17.479 255 HA VAL 31 HA VAL 31 24.014 22.232 -17.309 256 HB VAL 31 HB VAL 31 25.681 23.946 -15.499 257 1HG1 VAL 31 HG11 VAL 31 23.780 21.836 -14.595 258 2HG1 VAL 31 HG12 VAL 31 24.409 23.233 -13.723 259 3HG1 VAL 31 HG13 VAL 31 25.404 21.790 -13.911 260 1HG2 VAL 31 HG21 VAL 31 25.949 21.574 -17.150 261 2HG2 VAL 31 HG22 VAL 31 26.494 21.251 -15.504 262 3HG2 VAL 31 HG23 VAL 31 27.210 22.571 -16.428 263 H VAL 32 HN VAL 32 23.481 25.235 -15.404 264 HA VAL 32 HA VAL 32 21.164 24.310 -14.000 265 HB VAL 32 HB VAL 32 22.282 27.020 -14.759 266 1HG1 VAL 32 HG11 VAL 32 20.033 27.596 -14.437 267 2HG1 VAL 32 HG12 VAL 32 20.699 27.769 -12.813 268 3HG1 VAL 32 HG13 VAL 32 19.778 26.327 -13.240 269 1HG2 VAL 32 HG21 VAL 32 22.044 25.837 -12.000 270 2HG2 VAL 32 HG22 VAL 32 23.204 27.022 -12.602 271 3HG2 VAL 32 HG23 VAL 32 23.353 25.327 -13.067 272 H GLU 33 HN GLU 33 21.458 26.115 -17.085 273 HA GLU 33 HA GLU 33 18.610 26.488 -17.446 274 1HB GLU 33 HB2 GLU 33 21.140 26.829 -18.971 275 2HB GLU 33 HB1 GLU 33 19.670 26.686 -19.935 276 1HG GLU 33 HG2 GLU 33 19.254 28.855 -19.504 277 2HG GLU 33 HG1 GLU 33 19.003 28.416 -17.816 278 H VAL 34 HN VAL 34 20.916 24.190 -18.975 279 HA VAL 34 HA VAL 34 18.883 22.769 -20.444 280 HB VAL 34 HB VAL 34 21.376 22.944 -20.890 281 1HG1 VAL 34 HG11 VAL 34 21.786 22.172 -18.375 282 2HG1 VAL 34 HG12 VAL 34 22.937 21.784 -19.653 283 3HG1 VAL 34 HG13 VAL 34 21.772 20.572 -19.118 284 1HG2 VAL 34 HG21 VAL 34 20.299 21.403 -22.268 285 2HG2 VAL 34 HG22 VAL 34 19.831 20.369 -20.920 286 3HG2 VAL 34 HG23 VAL 34 21.504 20.389 -21.477 287 H VAL 35 HN VAL 35 20.141 22.385 -17.153 288 HA VAL 35 HA VAL 35 18.937 19.723 -16.822 289 HB VAL 35 HB VAL 35 21.063 20.772 -15.729 290 1HG1 VAL 35 HG11 VAL 35 19.677 22.751 -14.873 291 2HG1 VAL 35 HG12 VAL 35 20.745 21.981 -13.703 292 3HG1 VAL 35 HG13 VAL 35 19.015 21.635 -13.679 293 1HG2 VAL 35 HG21 VAL 35 20.818 19.300 -13.817 294 2HG2 VAL 35 HG22 VAL 35 20.044 18.542 -15.209 295 3HG2 VAL 35 HG23 VAL 35 19.061 19.326 -13.973 296 H GLN 36 HN GLN 36 18.008 23.067 -16.209 297 HA GLN 36 HA GLN 36 15.801 22.396 -14.407 298 1HB GLN 36 HB2 GLN 36 16.989 24.539 -14.317 299 2HB GLN 36 HB1 GLN 36 16.536 24.884 -15.986 300 1HG GLN 36 HG2 GLN 36 14.439 25.529 -15.410 301 2HG GLN 36 HG1 GLN 36 14.256 24.213 -14.249 302 1HE2 GLN 36 HE21 GLN 36 14.580 24.708 -12.034 303 2HE2 GLN 36 HE22 GLN 36 15.102 26.222 -11.473 304 H ARG 37 HN ARG 37 16.125 23.194 -17.879 305 HA ARG 37 HA ARG 37 13.294 23.220 -18.441 306 1HB ARG 37 HB2 ARG 37 14.024 23.351 -20.727 307 2HB ARG 37 HB1 ARG 37 15.203 24.243 -19.764 308 1HG ARG 37 HG2 ARG 37 16.604 22.161 -19.683 309 2HG ARG 37 HG1 ARG 37 15.477 21.418 -20.814 310 1HD ARG 37 HD2 ARG 37 15.918 23.407 -22.365 311 2HD ARG 37 HD1 ARG 37 17.275 23.810 -21.294 312 HE ARG 37 HE ARG 37 17.915 21.288 -21.699 313 1HH1 ARG 37 HH21 ARG 37 18.883 23.345 -23.716 314 2HH1 ARG 37 HH22 ARG 37 18.431 22.597 -25.212 315 1HH2 ARG 37 HH11 ARG 37 16.249 20.337 -23.724 316 2HH2 ARG 37 HH12 ARG 37 16.934 20.888 -25.215 317 H HIS 38 HN HIS 38 15.573 20.606 -18.020 318 HA HIS 38 HA HIS 38 13.685 18.680 -19.320 319 1HB HIS 38 HB2 HIS 38 16.577 18.967 -19.020 320 2HB HIS 38 HB1 HIS 38 16.021 17.351 -18.582 321 HD1 HIS 38 HD1 HIS 38 14.104 16.430 -20.473 322 HD2 HIS 38 HD2 HIS 38 17.017 19.134 -21.727 323 HE1 HIS 38 HE1 HIS 38 14.228 16.230 -22.995 324 H ALA 39 HN ALA 39 15.597 19.125 -16.318 325 HA ALA 39 HA ALA 39 13.898 17.058 -14.981 326 1HB ALA 39 HB1 ALA 39 15.905 16.454 -14.138 327 2HB ALA 39 HB2 ALA 39 16.030 18.024 -13.344 328 3HB ALA 39 HB3 ALA 39 16.671 17.807 -14.972 329 HA PRO 40 HA PRO 40 11.773 20.213 -12.750 330 1HB PRO 40 HB2 PRO 40 11.078 18.821 -10.498 331 2HB PRO 40 HB1 PRO 40 10.290 18.576 -12.069 332 1HG PRO 40 HG2 PRO 40 12.405 16.957 -10.741 333 2HG PRO 40 HG1 PRO 40 11.005 16.433 -11.686 334 1HD PRO 40 HD2 PRO 40 13.534 16.516 -12.687 335 2HD PRO 40 HD1 PRO 40 12.080 16.717 -13.689 336 H GLY 41 HN GLY 41 12.334 21.804 -11.273 337 1HA GLY 41 HA2 GLY 41 13.427 22.802 -9.413 338 2HA GLY 41 HA1 GLY 41 14.171 21.245 -9.049 339 H ASP 42 HN ASP 42 15.841 23.352 -8.878 340 HA ASP 42 HA ASP 42 17.285 23.599 -11.479 341 1HB ASP 42 HB2 ASP 42 16.555 25.517 -9.847 342 2HB ASP 42 HB1 ASP 42 17.959 25.014 -8.905 343 H TYR 43 HN TYR 43 19.435 22.879 -11.686 344 HA TYR 43 HA TYR 43 20.595 21.391 -9.348 345 1HB TYR 43 HB2 TYR 43 20.393 20.631 -12.276 346 2HB TYR 43 HB1 TYR 43 21.394 19.763 -11.116 347 HD1 TYR 43 HD1 TYR 43 18.074 20.195 -12.440 348 HD2 TYR 43 HD2 TYR 43 20.269 18.803 -9.020 349 HE1 TYR 43 HE1 TYR 43 16.089 18.920 -11.686 350 HE2 TYR 43 HE2 TYR 43 18.282 17.527 -8.265 351 HH TYR 43 HH TYR 43 15.293 18.063 -9.200 352 H THR 44 HN THR 44 23.017 21.097 -9.596 353 HA THR 44 HA THR 44 24.305 23.152 -11.337 354 HB THR 44 HB THR 44 25.462 23.085 -8.659 355 HG1 THR 44 HG1 THR 44 23.755 23.365 -7.490 356 1HG2 THR 44 HG21 THR 44 25.982 24.891 -10.102 357 2HG2 THR 44 HG22 THR 44 24.895 25.576 -8.896 358 3HG2 THR 44 HG23 THR 44 24.286 25.167 -10.499 359 HA PRO 45 HA PRO 45 27.490 20.045 -11.469 360 1HB PRO 45 HB2 PRO 45 29.285 21.505 -12.921 361 2HB PRO 45 HB1 PRO 45 27.782 20.873 -13.618 362 1HG PRO 45 HG2 PRO 45 28.520 23.622 -13.026 363 2HG PRO 45 HG1 PRO 45 27.180 23.005 -13.998 364 1HD PRO 45 HD2 PRO 45 27.156 23.957 -11.248 365 2HD PRO 45 HD1 PRO 45 25.786 23.583 -12.317 366 H THR 46 HN THR 46 29.147 19.502 -10.016 367 HA THR 46 HA THR 46 30.335 21.654 -8.339 368 HB THR 46 HB THR 46 30.563 18.625 -8.185 369 HG1 THR 46 HG1 THR 46 28.577 18.742 -7.558 370 1HG2 THR 46 HG21 THR 46 32.258 20.082 -6.953 371 2HG2 THR 46 HG22 THR 46 31.332 18.965 -5.950 372 3HG2 THR 46 HG23 THR 46 30.904 20.675 -5.989 373 H VAL 47 HN VAL 47 31.859 22.569 -9.846 374 HA VAL 47 HA VAL 47 33.735 20.913 -11.335 375 HB VAL 47 HB VAL 47 32.876 23.157 -12.021 376 1HG1 VAL 47 HG11 VAL 47 34.842 24.545 -10.285 377 2HG1 VAL 47 HG12 VAL 47 33.395 23.947 -9.474 378 3HG1 VAL 47 HG13 VAL 47 33.248 25.070 -10.826 379 1HG2 VAL 47 HG21 VAL 47 35.450 24.061 -12.279 380 2HG2 VAL 47 HG22 VAL 47 34.732 22.820 -13.305 381 3HG2 VAL 47 HG23 VAL 47 35.723 22.355 -11.923 382 H LYS 48 HN LYS 48 35.840 20.408 -10.858 383 HA LYS 48 HA LYS 48 37.105 21.527 -8.406 384 1HB LYS 48 HB2 LYS 48 37.564 19.295 -7.564 385 2HB LYS 48 HB1 LYS 48 35.837 19.396 -7.903 386 1HG LYS 48 HG2 LYS 48 36.554 18.470 -10.271 387 2HG LYS 48 HG1 LYS 48 37.976 17.908 -9.394 388 1HD LYS 48 HD2 LYS 48 36.709 16.103 -8.865 389 2HD LYS 48 HD1 LYS 48 35.931 17.172 -7.700 390 1HE LYS 48 HE2 LYS 48 34.123 17.651 -9.188 391 2HE LYS 48 HE1 LYS 48 34.986 16.955 -10.573 392 1HZ LYS 48 HZ1 LYS 48 34.228 15.434 -8.135 393 2HZ LYS 48 HZ2 LYS 48 34.926 14.806 -9.553 394 3HZ LYS 48 HZ3 LYS 48 33.341 15.417 -9.580 395 HA PRO 49 HA PRO 49 40.641 21.545 -11.027 396 1HB PRO 49 HB2 PRO 49 42.665 21.318 -9.193 397 2HB PRO 49 HB1 PRO 49 41.717 22.802 -9.412 398 1HG PRO 49 HG2 PRO 49 41.474 20.693 -7.328 399 2HG PRO 49 HG1 PRO 49 41.307 22.449 -7.182 400 1HD PRO 49 HD2 PRO 49 39.186 20.738 -7.286 401 2HD PRO 49 HD1 PRO 49 39.115 22.427 -7.836 402 H SER 50 HN SER 50 40.518 19.598 -12.210 403 HA SER 50 HA SER 50 41.307 17.042 -10.951 404 1HB SER 50 HB2 SER 50 40.701 16.219 -13.289 405 2HB SER 50 HB1 SER 50 39.404 17.016 -12.407 406 HG SER 50 HG SER 50 39.502 17.867 -14.476 407 H SER 51 HN SER 51 42.459 19.097 -13.674 408 HA SER 51 HA SER 51 45.117 17.714 -13.441 409 1HB SER 51 HB2 SER 51 43.366 17.545 -15.508 410 2HB SER 51 HB1 SER 51 44.282 18.963 -16.007 411 HG SER 51 HG SER 51 45.193 16.954 -16.721 412 H LYS 52 HN LYS 52 43.595 20.742 -14.665 413 HA LYS 52 HA LYS 52 45.739 22.341 -13.360 414 1HB LYS 52 HB2 LYS 52 45.504 21.682 -16.218 415 2HB LYS 52 HB1 LYS 52 45.595 23.416 -15.919 416 1HG LYS 52 HG2 LYS 52 47.784 23.295 -15.416 417 2HG LYS 52 HG1 LYS 52 47.508 21.987 -14.266 418 1HD LYS 52 HD2 LYS 52 47.434 20.374 -16.160 419 2HD LYS 52 HD1 LYS 52 47.796 21.694 -17.272 420 1HE LYS 52 HE2 LYS 52 49.993 21.899 -16.535 421 2HE LYS 52 HE1 LYS 52 49.614 21.272 -14.919 422 1HZ LYS 52 HZ1 LYS 52 49.278 19.097 -15.819 423 2HZ LYS 52 HZ2 LYS 52 50.794 19.647 -16.351 424 3HZ LYS 52 HZ3 LYS 52 49.465 19.656 -17.409 425 H GLY 53 HN GLY 53 45.238 24.799 -13.913 426 1HA GLY 53 HA2 GLY 53 42.561 25.400 -13.063 427 2HA GLY 53 HA1 GLY 53 43.719 26.578 -13.679 428 H ASN 54 HN ASN 54 44.055 25.027 -16.223 429 HA ASN 54 HA ASN 54 41.870 26.257 -17.731 430 1HB ASN 54 HB2 ASN 54 44.530 25.338 -18.144 431 2HB ASN 54 HB1 ASN 54 43.501 24.414 -19.238 432 1HD2 ASN 54 HD21 ASN 54 44.697 27.655 -18.499 433 2HD2 ASN 54 HD22 ASN 54 44.062 28.398 -19.886 434 H TYR 55 HN TYR 55 42.669 23.002 -16.584 435 HA TYR 55 HA TYR 55 40.297 21.914 -18.063 436 1HB TYR 55 HB2 TYR 55 42.724 21.038 -18.338 437 2HB TYR 55 HB1 TYR 55 42.504 20.337 -16.733 438 HD1 TYR 55 HD1 TYR 55 41.012 18.471 -16.366 439 HD2 TYR 55 HD2 TYR 55 41.298 20.321 -20.233 440 HE1 TYR 55 HE1 TYR 55 39.757 16.581 -17.363 441 HE2 TYR 55 HE2 TYR 55 40.045 18.431 -21.229 442 HH TYR 55 HH TYR 55 38.185 16.473 -19.747 443 H HIS 56 HN HIS 56 38.513 21.718 -16.760 444 HA HIS 56 HA HIS 56 38.934 20.940 -13.887 445 1HB HIS 56 HB2 HIS 56 37.599 23.236 -15.166 446 2HB HIS 56 HB1 HIS 56 36.638 22.445 -13.918 447 HD1 HIS 56 HD1 HIS 56 40.041 24.055 -14.413 448 HD2 HIS 56 HD2 HIS 56 37.498 22.935 -11.305 449 HE1 HIS 56 HE1 HIS 56 41.060 24.974 -12.283 450 H SER 57 HN SER 57 37.376 19.536 -13.013 451 HA SER 57 HA SER 57 35.478 18.307 -14.984 452 1HB SER 57 HB2 SER 57 35.816 16.252 -13.705 453 2HB SER 57 HB1 SER 57 37.391 16.924 -14.114 454 HG SER 57 HG SER 57 37.516 16.503 -11.982 455 H VAL 58 HN VAL 58 33.321 18.645 -14.505 456 HA VAL 58 HA VAL 58 32.652 19.473 -11.701 457 HB VAL 58 HB VAL 58 31.100 20.996 -12.607 458 1HG1 VAL 58 HG11 VAL 58 33.659 21.250 -13.340 459 2HG1 VAL 58 HG12 VAL 58 32.425 22.392 -13.870 460 3HG1 VAL 58 HG13 VAL 58 32.949 21.097 -14.947 461 1HG2 VAL 58 HG21 VAL 58 31.260 19.376 -15.166 462 2HG2 VAL 58 HG22 VAL 58 30.380 20.896 -15.013 463 3HG2 VAL 58 HG23 VAL 58 29.882 19.492 -14.072 464 H SER 59 HN SER 59 30.946 18.448 -10.664 465 HA SER 59 HA SER 59 29.764 16.072 -12.043 466 1HB SER 59 HB2 SER 59 31.082 16.183 -9.726 467 2HB SER 59 HB1 SER 59 29.502 16.662 -9.111 468 HG SER 59 HG SER 59 29.858 14.371 -9.103 469 H ILE 60 HN ILE 60 27.869 16.770 -13.046 470 HA ILE 60 HA ILE 60 26.177 18.796 -11.698 471 HB ILE 60 HB ILE 60 26.780 18.907 -14.126 472 1HG1 ILE 60 HG12 ILE 60 23.847 18.569 -13.421 473 2HG1 ILE 60 HG11 ILE 60 24.784 20.062 -13.361 474 1HG2 ILE 60 HG21 ILE 60 26.301 16.217 -14.161 475 2HG2 ILE 60 HG22 ILE 60 26.322 17.228 -15.604 476 3HG2 ILE 60 HG23 ILE 60 24.790 16.829 -14.829 477 1HD1 ILE 60 HD11 ILE 60 25.222 19.649 -15.882 478 2HD1 ILE 60 HD12 ILE 60 23.618 20.212 -15.412 479 3HD1 ILE 60 HD13 ILE 60 23.881 18.509 -15.785 480 H THR 61 HN THR 61 24.334 18.327 -10.628 481 HA THR 61 HA THR 61 23.478 15.491 -10.382 482 HB THR 61 HB THR 61 22.457 18.076 -9.136 483 HG1 THR 61 HG1 THR 61 24.221 17.919 -8.036 484 1HG2 THR 61 HG21 THR 61 20.741 16.500 -8.824 485 2HG2 THR 61 HG22 THR 61 21.705 16.332 -7.356 486 3HG2 THR 61 HG23 THR 61 21.876 15.160 -8.662 487 H ILE 62 HN ILE 62 21.791 14.673 -11.640 488 HA ILE 62 HA ILE 62 19.836 16.632 -12.794 489 HB ILE 62 HB ILE 62 21.367 14.440 -14.234 490 1HG1 ILE 62 HG12 ILE 62 21.396 17.469 -14.467 491 2HG1 ILE 62 HG11 ILE 62 22.702 16.459 -13.855 492 1HG2 ILE 62 HG21 ILE 62 19.069 14.582 -15.070 493 2HG2 ILE 62 HG22 ILE 62 20.173 15.278 -16.254 494 3HG2 ILE 62 HG23 ILE 62 19.209 16.335 -15.221 495 1HD1 ILE 62 HD11 ILE 62 21.802 15.614 -16.504 496 2HD1 ILE 62 HD12 ILE 62 23.431 15.976 -15.937 497 3HD1 ILE 62 HD13 ILE 62 22.380 17.280 -16.491 498 H ASN 63 HN ASN 63 18.012 15.934 -11.653 499 HA ASN 63 HA ASN 63 17.455 13.052 -11.324 500 1HB ASN 63 HB2 ASN 63 16.984 14.866 -9.614 501 2HB ASN 63 HB1 ASN 63 15.733 15.473 -10.699 502 1HD2 ASN 63 HD21 ASN 63 13.827 14.087 -11.071 503 2HD2 ASN 63 HD22 ASN 63 13.461 12.814 -10.011 504 H ALA 64 HN ALA 64 17.378 12.631 -13.696 505 HA ALA 64 HA ALA 64 14.996 13.743 -15.107 506 1HB ALA 64 HB1 ALA 64 16.520 13.809 -16.774 507 2HB ALA 64 HB2 ALA 64 16.562 12.047 -16.760 508 3HB ALA 64 HB3 ALA 64 17.697 12.963 -15.770 509 H THR 65 HN THR 65 13.257 12.430 -15.611 510 HA THR 65 HA THR 65 12.941 9.869 -14.329 511 HB THR 65 HB THR 65 10.812 9.864 -15.684 512 HG1 THR 65 HG1 THR 65 10.950 10.976 -17.447 513 1HG2 THR 65 HG21 THR 65 11.272 12.588 -14.481 514 2HG2 THR 65 HG22 THR 65 11.231 11.142 -13.474 515 3HG2 THR 65 HG23 THR 65 9.818 11.592 -14.428 516 H HIS 66 HN HIS 66 14.408 10.750 -17.327 517 HA HIS 66 HA HIS 66 14.412 7.869 -18.159 518 1HB HIS 66 HB2 HIS 66 13.223 10.108 -19.434 519 2HB HIS 66 HB1 HIS 66 14.643 9.681 -20.393 520 HD1 HIS 66 HD1 HIS 66 14.751 7.199 -21.313 521 HD2 HIS 66 HD2 HIS 66 11.122 8.249 -19.553 522 HE1 HIS 66 HE1 HIS 66 13.086 5.412 -21.982 523 H ILE 67 HN ILE 67 16.320 7.271 -19.454 524 HA ILE 67 HA ILE 67 18.778 8.508 -18.476 525 HB ILE 67 HB ILE 67 18.389 6.054 -18.890 526 1HG1 ILE 67 HG12 ILE 67 20.606 5.723 -20.121 527 2HG1 ILE 67 HG11 ILE 67 20.659 7.476 -20.302 528 1HG2 ILE 67 HG21 ILE 67 17.146 6.464 -21.068 529 2HG2 ILE 67 HG22 ILE 67 18.365 5.191 -21.128 530 3HG2 ILE 67 HG23 ILE 67 18.714 6.779 -21.812 531 1HD1 ILE 67 HD11 ILE 67 21.916 6.811 -18.309 532 2HD1 ILE 67 HD12 ILE 67 20.508 5.955 -17.682 533 3HD1 ILE 67 HD13 ILE 67 20.478 7.713 -17.834 534 H GLU 68 HN GLU 68 16.851 8.719 -21.421 535 HA GLU 68 HA GLU 68 18.898 9.888 -23.107 536 1HB GLU 68 HB2 GLU 68 16.202 8.999 -23.264 537 2HB GLU 68 HB1 GLU 68 16.213 10.678 -23.803 538 1HG GLU 68 HG2 GLU 68 16.666 9.427 -25.764 539 2HG GLU 68 HG1 GLU 68 18.245 10.018 -25.246 540 H GLN 69 HN GLN 69 16.664 11.183 -20.707 541 HA GLN 69 HA GLN 69 16.687 13.944 -21.487 542 1HB GLN 69 HB2 GLN 69 16.110 12.300 -19.064 543 2HB GLN 69 HB1 GLN 69 16.357 14.027 -18.810 544 1HG GLN 69 HG2 GLN 69 14.642 14.521 -20.523 545 2HG GLN 69 HG1 GLN 69 14.378 12.789 -20.746 546 1HE2 GLN 69 HE21 GLN 69 13.870 15.497 -18.514 547 2HE2 GLN 69 HE22 GLN 69 12.821 14.667 -17.470 548 H VAL 70 HN VAL 70 18.650 12.242 -19.001 549 HA VAL 70 HA VAL 70 20.365 14.482 -18.442 550 HB VAL 70 HB VAL 70 19.918 12.455 -17.015 551 1HG1 VAL 70 HG11 VAL 70 21.267 10.427 -17.458 552 2HG1 VAL 70 HG12 VAL 70 21.814 11.133 -18.978 553 3HG1 VAL 70 HG13 VAL 70 20.112 10.736 -18.752 554 1HG2 VAL 70 HG21 VAL 70 22.330 13.916 -17.391 555 2HG2 VAL 70 HG22 VAL 70 22.777 12.246 -17.045 556 3HG2 VAL 70 HG23 VAL 70 21.755 13.135 -15.917 557 H GLU 71 HN GLU 71 20.453 11.983 -20.937 558 HA GLU 71 HA GLU 71 23.210 12.264 -21.729 559 1HB GLU 71 HB2 GLU 71 20.762 10.961 -22.590 560 2HB GLU 71 HB1 GLU 71 21.602 11.645 -23.981 561 1HG GLU 71 HG2 GLU 71 22.896 9.791 -23.921 562 2HG GLU 71 HG1 GLU 71 23.660 10.514 -22.505 563 H THR 72 HN THR 72 20.196 13.778 -22.948 564 HA THR 72 HA THR 72 21.437 15.505 -24.886 565 HB THR 72 HB THR 72 18.866 15.820 -23.287 566 HG1 THR 72 HG1 THR 72 18.193 14.219 -24.433 567 1HG2 THR 72 HG21 THR 72 20.026 17.651 -24.971 568 2HG2 THR 72 HG22 THR 72 18.292 17.525 -24.672 569 3HG2 THR 72 HG23 THR 72 19.002 16.742 -26.084 570 H LEU 73 HN LEU 73 20.746 15.837 -21.419 571 HA LEU 73 HA LEU 73 21.299 18.632 -21.126 572 1HB LEU 73 HB2 LEU 73 21.019 16.201 -19.465 573 2HB LEU 73 HB1 LEU 73 22.022 17.458 -18.744 574 HG LEU 73 HG LEU 73 20.240 19.090 -18.956 575 1HD1 LEU 73 HD11 LEU 73 18.035 17.447 -19.760 576 2HD1 LEU 73 HD12 LEU 73 19.297 17.306 -20.980 577 3HD1 LEU 73 HD13 LEU 73 18.662 18.893 -20.550 578 1HD2 LEU 73 HD21 LEU 73 20.110 17.717 -16.962 579 2HD2 LEU 73 HD22 LEU 73 19.292 16.431 -17.848 580 3HD2 LEU 73 HD23 LEU 73 18.470 17.964 -17.561 581 H TYR 74 HN TYR 74 23.403 15.751 -20.982 582 HA TYR 74 HA TYR 74 25.830 17.099 -20.224 583 1HB TYR 74 HB2 TYR 74 25.952 14.801 -19.970 584 2HB TYR 74 HB1 TYR 74 24.974 14.488 -21.401 585 HD1 TYR 74 HD1 TYR 74 28.218 16.292 -20.755 586 HD2 TYR 74 HD2 TYR 74 26.135 13.295 -23.021 587 HE1 TYR 74 HE1 TYR 74 30.273 15.861 -22.074 588 HE2 TYR 74 HE2 TYR 74 28.190 12.865 -24.339 589 HH TYR 74 HH TYR 74 30.988 13.379 -23.604 590 H GLU 75 HN GLU 75 24.443 16.234 -23.416 591 HA GLU 75 HA GLU 75 26.613 17.261 -25.001 592 1HB GLU 75 HB2 GLU 75 24.165 15.927 -25.347 593 2HB GLU 75 HB1 GLU 75 23.989 17.432 -26.249 594 1HG GLU 75 HG2 GLU 75 24.954 15.747 -27.717 595 2HG GLU 75 HG1 GLU 75 26.182 16.962 -27.363 596 H GLU 76 HN GLU 76 23.720 18.806 -23.625 597 HA GLU 76 HA GLU 76 23.924 21.265 -25.133 598 1HB GLU 76 HB2 GLU 76 22.149 20.046 -23.381 599 2HB GLU 76 HB1 GLU 76 22.729 21.443 -22.473 600 1HG GLU 76 HG2 GLU 76 21.885 21.743 -25.348 601 2HG GLU 76 HG1 GLU 76 20.681 21.755 -24.061 602 H LEU 77 HN LEU 77 24.760 20.536 -21.706 603 HA LEU 77 HA LEU 77 26.141 23.050 -21.315 604 1HB LEU 77 HB2 LEU 77 26.261 22.312 -19.146 605 2HB LEU 77 HB1 LEU 77 25.076 21.143 -19.716 606 HG LEU 77 HG LEU 77 27.311 19.808 -20.393 607 1HD1 LEU 77 HD11 LEU 77 29.178 20.728 -19.536 608 2HD1 LEU 77 HD12 LEU 77 28.523 20.476 -17.918 609 3HD1 LEU 77 HD13 LEU 77 28.232 21.997 -18.760 610 1HD2 LEU 77 HD21 LEU 77 26.642 19.715 -17.484 611 2HD2 LEU 77 HD22 LEU 77 26.800 18.395 -18.643 612 3HD2 LEU 77 HD23 LEU 77 25.344 19.390 -18.633 613 H GLY 78 HN GLY 78 27.126 19.875 -22.480 614 1HA GLY 78 HA2 GLY 78 29.974 20.773 -22.541 615 2HA GLY 78 HA1 GLY 78 29.450 19.089 -22.604 616 H LYS 79 HN LYS 79 28.612 22.053 -24.430 617 HA LYS 79 HA LYS 79 28.811 20.465 -26.959 618 1HB LYS 79 HB2 LYS 79 26.752 21.874 -26.035 619 2HB LYS 79 HB1 LYS 79 27.638 23.218 -26.756 620 1HG LYS 79 HG2 LYS 79 27.574 22.233 -28.924 621 2HG LYS 79 HG1 LYS 79 27.067 20.671 -28.281 622 1HD LYS 79 HD2 LYS 79 25.174 22.631 -27.417 623 2HD LYS 79 HD1 LYS 79 25.416 22.836 -29.152 624 1HE LYS 79 HE2 LYS 79 24.551 20.752 -29.658 625 2HE LYS 79 HE1 LYS 79 25.097 20.040 -28.128 626 1HZ LYS 79 HZ1 LYS 79 22.896 22.014 -28.458 627 2HZ LYS 79 HZ2 LYS 79 23.460 21.421 -26.968 628 3HZ LYS 79 HZ3 LYS 79 22.713 20.371 -28.074 629 H ILE 80 HN ILE 80 30.781 22.407 -25.157 630 HA ILE 80 HA ILE 80 31.725 24.411 -26.968 631 HB ILE 80 HB ILE 80 33.170 22.883 -24.770 632 1HG1 ILE 80 HG12 ILE 80 32.307 25.480 -23.959 633 2HG1 ILE 80 HG11 ILE 80 30.918 24.670 -24.683 634 1HG2 ILE 80 HG21 ILE 80 34.006 25.558 -24.842 635 2HG2 ILE 80 HG22 ILE 80 33.957 25.059 -26.533 636 3HG2 ILE 80 HG23 ILE 80 34.932 24.154 -25.375 637 1HD1 ILE 80 HD11 ILE 80 30.949 22.933 -23.125 638 2HD1 ILE 80 HD12 ILE 80 31.445 24.305 -22.134 639 3HD1 ILE 80 HD13 ILE 80 32.654 23.174 -22.740 640 H ASP 81 HN ASP 81 33.403 24.353 -28.509 641 HA ASP 81 HA ASP 81 33.903 21.827 -29.847 642 1HB ASP 81 HB2 ASP 81 34.310 24.683 -30.230 643 2HB ASP 81 HB1 ASP 81 35.715 23.765 -30.769 644 H ILE 82 HN ILE 82 35.372 23.169 -27.083 645 HA ILE 82 HA ILE 82 38.111 22.295 -27.646 646 HB ILE 82 HB ILE 82 36.747 23.126 -25.057 647 1HG1 ILE 82 HG12 ILE 82 36.513 24.868 -26.781 648 2HG1 ILE 82 HG11 ILE 82 37.670 25.377 -25.555 649 1HG2 ILE 82 HG21 ILE 82 38.896 23.445 -24.157 650 2HG2 ILE 82 HG22 ILE 82 39.667 23.434 -25.741 651 3HG2 ILE 82 HG23 ILE 82 39.057 21.934 -25.047 652 1HD1 ILE 82 HD11 ILE 82 38.153 25.444 -28.250 653 2HD1 ILE 82 HD12 ILE 82 38.862 23.889 -27.812 654 3HD1 ILE 82 HD13 ILE 82 39.412 25.365 -27.018 655 H VAL 83 HN VAL 83 37.082 21.347 -24.489 656 HA VAL 83 HA VAL 83 36.979 18.478 -25.367 657 HB VAL 83 HB VAL 83 38.258 19.725 -22.907 658 1HG1 VAL 83 HG11 VAL 83 37.211 17.221 -23.054 659 2HG1 VAL 83 HG12 VAL 83 38.636 17.618 -22.097 660 3HG1 VAL 83 HG13 VAL 83 38.821 16.922 -23.706 661 1HG2 VAL 83 HG21 VAL 83 39.366 18.608 -25.494 662 2HG2 VAL 83 HG22 VAL 83 40.352 18.756 -24.040 663 3HG2 VAL 83 HG23 VAL 83 39.658 20.196 -24.783 664 H ARG 84 HN ARG 84 34.900 17.813 -25.032 665 HA ARG 84 HA ARG 84 33.562 18.605 -22.464 666 1HB ARG 84 HB2 ARG 84 31.447 18.528 -23.731 667 2HB ARG 84 HB1 ARG 84 32.575 19.651 -24.485 668 1HG ARG 84 HG2 ARG 84 33.161 17.220 -25.710 669 2HG ARG 84 HG1 ARG 84 31.405 17.198 -25.559 670 1HD ARG 84 HD2 ARG 84 31.622 19.693 -26.450 671 2HD ARG 84 HD1 ARG 84 33.145 19.073 -27.120 672 HE ARG 84 HE ARG 84 31.763 17.226 -28.161 673 1HH1 ARG 84 HH11 ARG 84 31.153 19.965 -29.378 674 2HH1 ARG 84 HH12 ARG 84 29.422 19.923 -29.439 675 1HH2 ARG 84 HH21 ARG 84 29.147 17.236 -27.252 676 2HH2 ARG 84 HH22 ARG 84 28.284 18.374 -28.231 677 H MET 85 HN MET 85 33.291 16.864 -21.144 678 HA MET 85 HA MET 85 32.619 14.207 -22.322 679 1HB MET 85 HB2 MET 85 35.202 14.989 -21.532 680 2HB MET 85 HB1 MET 85 34.601 14.009 -20.193 681 1HG MET 85 HG2 MET 85 34.322 12.113 -21.531 682 2HG MET 85 HG1 MET 85 34.239 13.052 -23.021 683 1HE MET 85 HE1 MET 85 37.627 13.776 -24.142 684 2HE MET 85 HE2 MET 85 35.970 14.351 -23.988 685 3HE MET 85 HE3 MET 85 36.280 12.764 -24.687 686 H VAL 86 HN VAL 86 31.712 12.732 -20.668 687 HA VAL 86 HA VAL 86 31.024 14.014 -18.064 688 HB VAL 86 HB VAL 86 29.284 14.427 -19.858 689 1HG1 VAL 86 HG11 VAL 86 29.500 12.210 -20.966 690 2HG1 VAL 86 HG12 VAL 86 27.837 12.564 -20.500 691 3HG1 VAL 86 HG13 VAL 86 28.805 11.451 -19.534 692 1HG2 VAL 86 HG21 VAL 86 27.558 14.289 -18.314 693 2HG2 VAL 86 HG22 VAL 86 28.956 14.138 -17.249 694 3HG2 VAL 86 HG23 VAL 86 28.062 12.700 -17.738 695 H LEU 87 HN LEU 87 30.434 12.489 -16.410 696 HA LEU 87 HA LEU 87 30.700 10.483 -15.218 697 1HB LEU 87 HB2 LEU 87 29.000 10.143 -17.347 698 2HB LEU 87 HB1 LEU 87 30.161 8.850 -17.631 699 HG LEU 87 HG LEU 87 28.339 8.014 -16.238 700 1HD1 LEU 87 HD11 LEU 87 29.672 6.901 -14.718 701 2HD1 LEU 87 HD12 LEU 87 30.521 8.367 -14.227 702 3HD1 LEU 87 HD13 LEU 87 30.928 7.579 -15.753 703 1HD2 LEU 87 HD21 LEU 87 27.914 8.990 -14.008 704 2HD2 LEU 87 HD22 LEU 87 27.634 10.179 -15.280 705 3HD2 LEU 87 HD23 LEU 87 29.115 10.242 -14.324 Start of MODEL 6 1 1H MET 1 HT1 MET 1 14.109 10.819 -28.511 2 2H MET 1 HT2 MET 1 13.910 10.658 -26.831 3 3H MET 1 HT3 MET 1 14.126 9.279 -27.798 4 HA MET 1 HA MET 1 16.203 9.661 -26.747 5 1HB MET 1 HB2 MET 1 15.768 9.437 -29.408 6 2HB MET 1 HB1 MET 1 16.676 10.948 -29.392 7 1HG MET 1 HG2 MET 1 17.926 9.061 -27.609 8 2HG MET 1 HG1 MET 1 17.707 8.316 -29.190 9 1HE MET 1 HE1 MET 1 19.087 10.677 -26.954 10 2HE MET 1 HE2 MET 1 20.311 11.649 -27.767 11 3HE MET 1 HE3 MET 1 20.628 9.949 -27.428 12 H LYS 2 HN LYS 2 15.399 12.615 -28.654 13 HA LYS 2 HA LYS 2 17.232 14.231 -27.005 14 1HB LYS 2 HB2 LYS 2 16.561 14.306 -29.590 15 2HB LYS 2 HB1 LYS 2 15.291 15.370 -28.986 16 1HG LYS 2 HG2 LYS 2 16.993 16.905 -29.382 17 2HG LYS 2 HG1 LYS 2 17.280 16.514 -27.687 18 1HD LYS 2 HD2 LYS 2 18.859 14.673 -28.551 19 2HD LYS 2 HD1 LYS 2 18.762 15.488 -30.112 20 1HE LYS 2 HE2 LYS 2 20.191 17.115 -29.433 21 2HE LYS 2 HE1 LYS 2 19.267 17.383 -27.942 22 1HZ LYS 2 HZ1 LYS 2 21.420 16.509 -27.379 23 2HZ LYS 2 HZ2 LYS 2 21.224 15.200 -28.441 24 3HZ LYS 2 HZ3 LYS 2 20.254 15.324 -27.053 25 H THR 3 HN THR 3 13.763 14.606 -27.867 26 HA THR 3 HA THR 3 13.198 15.391 -25.037 27 HB THR 3 HB THR 3 12.337 16.886 -27.541 28 HG1 THR 3 HG1 THR 3 14.181 17.827 -27.340 29 1HG2 THR 3 HG21 THR 3 12.085 18.483 -25.236 30 2HG2 THR 3 HG22 THR 3 11.418 16.912 -24.795 31 3HG2 THR 3 HG23 THR 3 10.779 17.781 -26.190 32 H LYS 4 HN LYS 4 12.196 13.232 -24.957 33 HA LYS 4 HA LYS 4 9.476 13.202 -26.208 34 1HB LYS 4 HB2 LYS 4 11.782 11.464 -26.682 35 2HB LYS 4 HB1 LYS 4 10.362 10.550 -26.174 36 1HG LYS 4 HG2 LYS 4 9.328 10.888 -28.150 37 2HG LYS 4 HG1 LYS 4 9.669 12.619 -28.107 38 1HD LYS 4 HD2 LYS 4 12.150 11.343 -28.572 39 2HD LYS 4 HD1 LYS 4 10.988 10.559 -29.640 40 1HE LYS 4 HE2 LYS 4 10.730 12.432 -30.928 41 2HE LYS 4 HE1 LYS 4 10.751 13.509 -29.520 42 1HZ LYS 4 HZ1 LYS 4 12.809 13.256 -31.209 43 2HZ LYS 4 HZ2 LYS 4 13.234 12.094 -30.047 44 3HZ LYS 4 HZ3 LYS 4 12.978 13.708 -29.584 45 H LEU 5 HN LEU 5 11.584 11.353 -23.953 46 HA LEU 5 HA LEU 5 11.112 10.367 -21.864 47 1HB LEU 5 HB2 LEU 5 9.796 13.029 -22.007 48 2HB LEU 5 HB1 LEU 5 9.257 11.985 -20.692 49 HG LEU 5 HG LEU 5 12.015 11.672 -20.650 50 1HD1 LEU 5 HD11 LEU 5 12.923 13.455 -21.695 51 2HD1 LEU 5 HD12 LEU 5 12.240 14.453 -20.410 52 3HD1 LEU 5 HD13 LEU 5 11.346 14.212 -21.912 53 1HD2 LEU 5 HD21 LEU 5 9.975 12.436 -18.937 54 2HD2 LEU 5 HD22 LEU 5 11.025 13.851 -18.946 55 3HD2 LEU 5 HD23 LEU 5 11.673 12.274 -18.491 56 H ASN 6 HN ASN 6 9.851 8.928 -23.764 57 HA ASN 6 HA ASN 6 6.968 8.704 -23.009 58 1HB ASN 6 HB2 ASN 6 8.698 7.813 -25.322 59 2HB ASN 6 HB1 ASN 6 7.090 7.129 -25.081 60 1HD2 ASN 6 HD21 ASN 6 5.230 8.690 -25.100 61 2HD2 ASN 6 HD22 ASN 6 5.383 10.158 -25.939 62 H GLU 7 HN GLU 7 7.843 7.764 -20.878 63 HA GLU 7 HA GLU 7 8.705 4.908 -21.140 64 1HB GLU 7 HB2 GLU 7 9.703 6.973 -19.676 65 2HB GLU 7 HB1 GLU 7 8.570 6.291 -18.513 66 1HG GLU 7 HG2 GLU 7 9.616 4.122 -18.654 67 2HG GLU 7 HG1 GLU 7 10.627 4.642 -20.003 68 H LEU 8 HN LEU 8 7.573 3.298 -19.839 69 HA LEU 8 HA LEU 8 4.681 3.783 -19.629 70 1HB LEU 8 HB2 LEU 8 6.546 1.570 -19.835 71 2HB LEU 8 HB1 LEU 8 5.415 1.280 -18.517 72 HG LEU 8 HG LEU 8 4.544 0.388 -20.645 73 1HD1 LEU 8 HD11 LEU 8 2.681 0.906 -19.426 74 2HD1 LEU 8 HD12 LEU 8 2.463 2.127 -20.679 75 3HD1 LEU 8 HD13 LEU 8 3.201 2.565 -19.138 76 1HD2 LEU 8 HD21 LEU 8 5.556 1.802 -22.281 77 2HD2 LEU 8 HD22 LEU 8 4.903 3.260 -21.534 78 3HD2 LEU 8 HD23 LEU 8 3.828 2.141 -22.373 79 H LEU 9 HN LEU 9 7.394 3.114 -17.433 80 HA LEU 9 HA LEU 9 5.650 3.507 -15.063 81 1HB LEU 9 HB2 LEU 9 7.698 2.736 -13.864 82 2HB LEU 9 HB1 LEU 9 7.196 1.610 -15.121 83 HG LEU 9 HG LEU 9 8.944 3.484 -16.353 84 1HD1 LEU 9 HD11 LEU 9 9.565 3.710 -13.783 85 2HD1 LEU 9 HD12 LEU 9 10.831 3.628 -15.008 86 3HD1 LEU 9 HD13 LEU 9 10.407 2.188 -14.082 87 1HD2 LEU 9 HD21 LEU 9 10.387 1.407 -16.543 88 2HD2 LEU 9 HD22 LEU 9 8.724 1.201 -17.092 89 3HD2 LEU 9 HD23 LEU 9 9.215 0.584 -15.515 90 H GLU 10 HN GLU 10 8.254 5.109 -16.844 91 HA GLU 10 HA GLU 10 9.323 7.186 -16.530 92 1HB GLU 10 HB2 GLU 10 6.728 7.477 -16.965 93 2HB GLU 10 HB1 GLU 10 6.738 8.102 -15.316 94 1HG GLU 10 HG2 GLU 10 7.057 9.972 -16.825 95 2HG GLU 10 HG1 GLU 10 8.582 9.674 -15.994 96 H PHE 11 HN PHE 11 10.459 5.923 -14.640 97 HA PHE 11 HA PHE 11 9.720 6.947 -11.950 98 1HB PHE 11 HB2 PHE 11 10.233 4.575 -12.219 99 2HB PHE 11 HB1 PHE 11 11.778 4.961 -12.976 100 HD1 PHE 11 HD1 PHE 11 13.709 5.435 -11.668 101 HD2 PHE 11 HD2 PHE 11 9.843 5.243 -9.802 102 HE1 PHE 11 HE1 PHE 11 14.781 5.529 -9.435 103 HE2 PHE 11 HE2 PHE 11 10.917 5.337 -7.569 104 HZ PHE 11 HZ PHE 11 13.385 5.481 -7.387 105 HA PRO 12 HA PRO 12 12.732 10.196 -12.527 106 1HB PRO 12 HB2 PRO 12 12.516 11.248 -10.010 107 2HB PRO 12 HB1 PRO 12 11.327 11.552 -11.292 108 1HG PRO 12 HG2 PRO 12 11.203 9.648 -9.007 109 2HG PRO 12 HG1 PRO 12 9.927 10.659 -9.703 110 1HD PRO 12 HD2 PRO 12 10.162 8.000 -10.214 111 2HD PRO 12 HD1 PRO 12 9.459 9.155 -11.368 112 H THR 13 HN THR 13 14.825 9.432 -12.566 113 HA THR 13 HA THR 13 15.952 8.341 -10.003 114 HB THR 13 HB THR 13 15.618 6.680 -11.832 115 HG1 THR 13 HG1 THR 13 17.403 5.786 -11.212 116 1HG2 THR 13 HG21 THR 13 17.722 8.227 -13.359 117 2HG2 THR 13 HG22 THR 13 15.996 8.402 -13.676 118 3HG2 THR 13 HG23 THR 13 16.779 6.842 -13.913 119 HA PRO 14 HA PRO 14 18.803 11.703 -10.305 120 1HB PRO 14 HB2 PRO 14 20.697 10.783 -8.555 121 2HB PRO 14 HB1 PRO 14 19.135 11.446 -8.032 122 1HG PRO 14 HG2 PRO 14 20.003 8.611 -8.274 123 2HG PRO 14 HG1 PRO 14 18.981 9.379 -7.049 124 1HD PRO 14 HD2 PRO 14 18.007 7.871 -9.107 125 2HD PRO 14 HD1 PRO 14 17.086 9.163 -8.308 126 H PHE 15 HN PHE 15 20.335 12.083 -11.855 127 HA PHE 15 HA PHE 15 21.973 9.782 -12.861 128 1HB PHE 15 HB2 PHE 15 20.808 12.296 -14.051 129 2HB PHE 15 HB1 PHE 15 22.154 11.481 -14.844 130 HD1 PHE 15 HD1 PHE 15 21.834 8.803 -15.000 131 HD2 PHE 15 HD2 PHE 15 18.664 11.687 -14.702 132 HE1 PHE 15 HE1 PHE 15 20.256 7.176 -16.005 133 HE2 PHE 15 HE2 PHE 15 17.088 10.060 -15.705 134 HZ PHE 15 HZ PHE 15 17.883 7.803 -16.358 135 H THR 16 HN THR 16 23.842 9.940 -11.558 136 HA THR 16 HA THR 16 25.125 12.490 -10.941 137 HB THR 16 HB THR 16 26.331 9.701 -10.907 138 HG1 THR 16 HG1 THR 16 24.671 10.952 -8.969 139 1HG2 THR 16 HG21 THR 16 26.979 12.348 -9.742 140 2HG2 THR 16 HG22 THR 16 28.048 11.017 -10.186 141 3HG2 THR 16 HG23 THR 16 27.169 10.969 -8.657 142 H TYR 17 HN TYR 17 25.478 13.505 -13.004 143 HA TYR 17 HA TYR 17 27.169 12.020 -14.970 144 1HB TYR 17 HB2 TYR 17 25.145 14.201 -14.990 145 2HB TYR 17 HB1 TYR 17 26.425 14.314 -16.196 146 HD1 TYR 17 HD1 TYR 17 24.703 11.317 -14.711 147 HD2 TYR 17 HD2 TYR 17 25.518 13.639 -18.232 148 HE1 TYR 17 HE1 TYR 17 23.570 9.609 -16.102 149 HE2 TYR 17 HE2 TYR 17 24.385 11.931 -19.623 150 HH TYR 17 HH TYR 17 23.922 9.052 -18.984 151 H LYS 18 HN LYS 18 29.316 12.308 -14.347 152 HA LYS 18 HA LYS 18 30.274 14.893 -13.327 153 1HB LYS 18 HB2 LYS 18 31.169 12.119 -13.557 154 2HB LYS 18 HB1 LYS 18 32.454 13.255 -13.968 155 1HG LYS 18 HG2 LYS 18 31.616 14.506 -11.792 156 2HG LYS 18 HG1 LYS 18 30.989 12.909 -11.377 157 1HD LYS 18 HD2 LYS 18 33.740 12.851 -12.413 158 2HD LYS 18 HD1 LYS 18 33.574 13.759 -10.909 159 1HE LYS 18 HE2 LYS 18 33.179 11.871 -9.688 160 2HE LYS 18 HE1 LYS 18 32.094 11.202 -10.925 161 1HZ LYS 18 HZ1 LYS 18 35.038 11.383 -11.270 162 2HZ LYS 18 HZ2 LYS 18 33.930 10.546 -12.249 163 3HZ LYS 18 HZ3 LYS 18 34.263 9.995 -10.678 164 H VAL 19 HN VAL 19 30.067 16.427 -15.019 165 HA VAL 19 HA VAL 19 30.978 15.821 -17.740 166 HB VAL 19 HB VAL 19 30.303 18.503 -16.476 167 1HG1 VAL 19 HG11 VAL 19 31.330 18.028 -18.925 168 2HG1 VAL 19 HG12 VAL 19 30.173 19.321 -18.614 169 3HG1 VAL 19 HG13 VAL 19 29.619 17.786 -19.282 170 1HG2 VAL 19 HG21 VAL 19 27.999 18.128 -17.027 171 2HG2 VAL 19 HG22 VAL 19 28.523 16.690 -16.151 172 3HG2 VAL 19 HG23 VAL 19 28.380 16.648 -17.908 173 H MET 20 HN MET 20 33.195 15.357 -17.646 174 HA MET 20 HA MET 20 35.021 17.348 -16.376 175 1HB MET 20 HB2 MET 20 35.314 14.514 -17.416 176 2HB MET 20 HB1 MET 20 36.675 15.462 -16.815 177 1HG MET 20 HG2 MET 20 35.394 15.780 -14.663 178 2HG MET 20 HG1 MET 20 34.205 14.629 -15.270 179 1HE MET 20 HE1 MET 20 34.307 12.215 -14.787 180 2HE MET 20 HE2 MET 20 35.738 11.268 -15.185 181 3HE MET 20 HE3 MET 20 35.035 12.339 -16.394 182 H GLY 21 HN GLY 21 36.087 18.788 -17.671 183 1HA GLY 21 HA2 GLY 21 36.912 18.048 -20.391 184 2HA GLY 21 HA1 GLY 21 35.703 19.330 -20.317 185 H GLN 22 HN GLN 22 37.375 20.738 -21.268 186 HA GLN 22 HA GLN 22 39.865 21.313 -19.918 187 1HB GLN 22 HB2 GLN 22 38.514 21.981 -22.299 188 2HB GLN 22 HB1 GLN 22 38.775 23.515 -21.469 189 1HG GLN 22 HG2 GLN 22 40.887 23.463 -22.253 190 2HG GLN 22 HG1 GLN 22 41.184 22.128 -21.140 191 1HE2 GLN 22 HE21 GLN 22 41.048 19.915 -22.011 192 2HE2 GLN 22 HE22 GLN 22 41.106 19.633 -23.683 193 H ALA 23 HN ALA 23 40.233 23.762 -19.222 194 HA ALA 23 HA ALA 23 38.497 24.253 -16.919 195 1HB ALA 23 HB1 ALA 23 40.917 24.548 -16.809 196 2HB ALA 23 HB2 ALA 23 40.145 26.115 -16.571 197 3HB ALA 23 HB3 ALA 23 40.866 25.715 -18.130 198 H LEU 24 HN LEU 24 36.445 24.827 -17.863 199 HA LEU 24 HA LEU 24 36.392 27.577 -19.047 200 1HB LEU 24 HB2 LEU 24 34.582 26.738 -20.562 201 2HB LEU 24 HB1 LEU 24 36.130 25.945 -20.841 202 HG LEU 24 HG LEU 24 34.830 24.406 -18.857 203 1HD1 LEU 24 HD11 LEU 24 32.966 25.586 -20.853 204 2HD1 LEU 24 HD12 LEU 24 32.646 24.999 -19.221 205 3HD1 LEU 24 HD13 LEU 24 32.806 23.856 -20.553 206 1HD2 LEU 24 HD21 LEU 24 34.863 23.767 -21.810 207 2HD2 LEU 24 HD22 LEU 24 35.070 22.665 -20.448 208 3HD2 LEU 24 HD23 LEU 24 36.352 23.802 -20.865 209 HA PRO 25 HA PRO 25 33.478 28.049 -15.726 210 1HB PRO 25 HB2 PRO 25 32.767 30.634 -16.258 211 2HB PRO 25 HB1 PRO 25 34.307 30.187 -15.498 212 1HG PRO 25 HG2 PRO 25 33.740 30.990 -18.295 213 2HG PRO 25 HG1 PRO 25 35.164 31.301 -17.294 214 1HD PRO 25 HD2 PRO 25 35.008 29.376 -19.268 215 2HD PRO 25 HD1 PRO 25 36.178 29.373 -17.933 216 H GLU 26 HN GLU 26 32.678 27.898 -19.036 217 HA GLU 26 HA GLU 26 29.872 28.706 -18.827 218 1HB GLU 26 HB2 GLU 26 31.689 28.475 -20.831 219 2HB GLU 26 HB1 GLU 26 30.819 26.954 -21.032 220 1HG GLU 26 HG2 GLU 26 29.237 29.473 -20.650 221 2HG GLU 26 HG1 GLU 26 29.963 29.162 -22.226 222 H LEU 27 HN LEU 27 31.528 25.909 -17.793 223 HA LEU 27 HA LEU 27 29.670 23.853 -18.550 224 1HB LEU 27 HB2 LEU 27 30.831 22.556 -16.817 225 2HB LEU 27 HB1 LEU 27 31.991 23.489 -17.754 226 HG LEU 27 HG LEU 27 31.548 25.286 -15.821 227 1HD1 LEU 27 HD11 LEU 27 31.400 22.798 -14.168 228 2HD1 LEU 27 HD12 LEU 27 29.904 23.420 -14.855 229 3HD1 LEU 27 HD13 LEU 27 30.866 24.432 -13.780 230 1HD2 LEU 27 HD21 LEU 27 33.642 23.797 -16.541 231 2HD2 LEU 27 HD22 LEU 27 33.284 22.983 -15.018 232 3HD2 LEU 27 HD23 LEU 27 33.648 24.708 -15.031 233 H VAL 28 HN VAL 28 29.781 26.020 -15.704 234 HA VAL 28 HA VAL 28 27.539 24.712 -14.369 235 HB VAL 28 HB VAL 28 29.446 26.026 -13.325 236 1HG1 VAL 28 HG11 VAL 28 27.810 28.439 -14.148 237 2HG1 VAL 28 HG12 VAL 28 29.267 27.926 -15.000 238 3HG1 VAL 28 HG13 VAL 28 29.363 28.427 -13.312 239 1HG2 VAL 28 HG21 VAL 28 27.210 25.467 -12.221 240 2HG2 VAL 28 HG22 VAL 28 26.720 27.119 -12.595 241 3HG2 VAL 28 HG23 VAL 28 28.092 26.827 -11.526 242 H ASP 29 HN ASP 29 27.881 27.400 -16.650 243 HA ASP 29 HA ASP 29 25.251 28.531 -16.267 244 1HB ASP 29 HB2 ASP 29 27.133 29.720 -17.307 245 2HB ASP 29 HB1 ASP 29 27.180 28.539 -18.615 246 H GLN 30 HN GLN 30 26.542 26.379 -18.846 247 HA GLN 30 HA GLN 30 23.973 25.891 -20.062 248 1HB GLN 30 HB2 GLN 30 26.576 25.502 -20.722 249 2HB GLN 30 HB1 GLN 30 26.121 23.858 -20.272 250 1HG GLN 30 HG2 GLN 30 25.557 23.939 -22.550 251 2HG GLN 30 HG1 GLN 30 24.020 24.287 -21.759 252 1HE2 GLN 30 HE21 GLN 30 26.417 25.556 -23.931 253 2HE2 GLN 30 HE22 GLN 30 25.735 27.099 -24.118 254 H VAL 31 HN VAL 31 25.850 24.109 -17.596 255 HA VAL 31 HA VAL 31 24.231 21.770 -17.477 256 HB VAL 31 HB VAL 31 26.067 23.265 -15.631 257 1HG1 VAL 31 HG11 VAL 31 24.676 22.517 -13.926 258 2HG1 VAL 31 HG12 VAL 31 25.729 21.117 -14.128 259 3HG1 VAL 31 HG13 VAL 31 24.121 21.122 -14.853 260 1HG2 VAL 31 HG21 VAL 31 26.658 21.587 -17.558 261 2HG2 VAL 31 HG22 VAL 31 26.172 20.355 -16.392 262 3HG2 VAL 31 HG23 VAL 31 27.502 21.450 -16.016 263 H VAL 32 HN VAL 32 24.047 24.653 -15.312 264 HA VAL 32 HA VAL 32 21.652 23.834 -13.986 265 HB VAL 32 HB VAL 32 23.409 25.597 -13.364 266 1HG1 VAL 32 HG11 VAL 32 21.608 27.405 -14.997 267 2HG1 VAL 32 HG12 VAL 32 23.173 26.826 -15.567 268 3HG1 VAL 32 HG13 VAL 32 23.082 27.851 -14.136 269 1HG2 VAL 32 HG21 VAL 32 20.431 25.955 -13.094 270 2HG2 VAL 32 HG22 VAL 32 21.538 27.112 -12.355 271 3HG2 VAL 32 HG23 VAL 32 21.594 25.415 -11.884 272 H GLU 33 HN GLU 33 22.101 25.693 -16.998 273 HA GLU 33 HA GLU 33 19.308 26.496 -17.204 274 1HB GLU 33 HB2 GLU 33 21.823 26.669 -18.740 275 2HB GLU 33 HB1 GLU 33 20.370 26.624 -19.736 276 1HG GLU 33 HG2 GLU 33 19.836 28.740 -19.178 277 2HG GLU 33 HG1 GLU 33 19.984 28.378 -17.458 278 H VAL 34 HN VAL 34 21.242 24.103 -19.070 279 HA VAL 34 HA VAL 34 18.989 22.981 -20.444 280 HB VAL 34 HB VAL 34 21.477 22.905 -21.002 281 1HG1 VAL 34 HG11 VAL 34 21.875 21.886 -18.574 282 2HG1 VAL 34 HG12 VAL 34 22.920 21.462 -19.929 283 3HG1 VAL 34 HG13 VAL 34 21.631 20.366 -19.433 284 1HG2 VAL 34 HG21 VAL 34 19.546 20.637 -21.201 285 2HG2 VAL 34 HG22 VAL 34 21.210 20.340 -21.699 286 3HG2 VAL 34 HG23 VAL 34 20.270 21.612 -22.478 287 H VAL 35 HN VAL 35 20.269 22.350 -17.218 288 HA VAL 35 HA VAL 35 18.845 19.782 -16.982 289 HB VAL 35 HB VAL 35 21.108 20.546 -15.935 290 1HG1 VAL 35 HG11 VAL 35 19.223 21.509 -13.773 291 2HG1 VAL 35 HG12 VAL 35 20.022 22.601 -14.903 292 3HG1 VAL 35 HG13 VAL 35 20.983 21.620 -13.799 293 1HG2 VAL 35 HG21 VAL 35 20.718 19.047 -14.003 294 2HG2 VAL 35 HG22 VAL 35 20.026 18.386 -15.484 295 3HG2 VAL 35 HG23 VAL 35 18.980 19.148 -14.285 296 H GLN 36 HN GLN 36 18.334 23.163 -15.971 297 HA GLN 36 HA GLN 36 16.060 22.487 -14.252 298 1HB GLN 36 HB2 GLN 36 15.974 24.829 -13.865 299 2HB GLN 36 HB1 GLN 36 17.684 24.486 -14.109 300 1HG GLN 36 HG2 GLN 36 17.599 25.299 -16.378 301 2HG GLN 36 HG1 GLN 36 15.841 25.423 -16.326 302 1HE2 GLN 36 HE21 GLN 36 18.843 26.991 -15.336 303 2HE2 GLN 36 HE22 GLN 36 18.119 28.396 -14.723 304 H ARG 37 HN ARG 37 16.507 23.313 -17.653 305 HA ARG 37 HA ARG 37 13.692 23.946 -18.143 306 1HB ARG 37 HB2 ARG 37 16.255 23.737 -19.615 307 2HB ARG 37 HB1 ARG 37 14.817 23.396 -20.574 308 1HG ARG 37 HG2 ARG 37 14.574 25.628 -20.786 309 2HG ARG 37 HG1 ARG 37 14.103 25.643 -19.088 310 1HD ARG 37 HD2 ARG 37 16.500 25.923 -18.450 311 2HD ARG 37 HD1 ARG 37 16.918 26.011 -20.172 312 HE ARG 37 HE ARG 37 15.445 28.020 -20.324 313 1HH1 ARG 37 HH21 ARG 37 17.648 28.868 -18.550 314 2HH1 ARG 37 HH22 ARG 37 16.818 29.486 -17.162 315 1HH2 ARG 37 HH11 ARG 37 13.801 27.950 -17.954 316 2HH2 ARG 37 HH12 ARG 37 14.633 28.966 -16.824 317 H HIS 38 HN HIS 38 15.791 21.084 -18.613 318 HA HIS 38 HA HIS 38 13.584 19.511 -19.782 319 1HB HIS 38 HB2 HIS 38 16.384 19.527 -19.838 320 2HB HIS 38 HB1 HIS 38 15.969 18.059 -18.956 321 HD1 HIS 38 HD1 HIS 38 13.343 17.321 -20.442 322 HD2 HIS 38 HD2 HIS 38 16.868 18.450 -22.361 323 HE1 HIS 38 HE1 HIS 38 13.215 16.378 -22.790 324 H ALA 39 HN ALA 39 15.540 19.451 -16.777 325 HA ALA 39 HA ALA 39 13.643 17.470 -15.600 326 1HB ALA 39 HB1 ALA 39 16.454 17.936 -15.539 327 2HB ALA 39 HB2 ALA 39 15.558 16.665 -14.709 328 3HB ALA 39 HB3 ALA 39 15.851 18.206 -13.904 329 HA PRO 40 HA PRO 40 11.740 20.591 -13.136 330 1HB PRO 40 HB2 PRO 40 10.999 19.118 -10.952 331 2HB PRO 40 HB1 PRO 40 10.177 19.005 -12.521 332 1HG PRO 40 HG2 PRO 40 12.213 17.198 -11.318 333 2HG PRO 40 HG1 PRO 40 10.773 16.807 -12.269 334 1HD PRO 40 HD2 PRO 40 13.291 16.805 -13.303 335 2HD PRO 40 HD1 PRO 40 11.837 17.140 -14.269 336 H GLY 41 HN GLY 41 12.404 22.062 -11.580 337 1HA GLY 41 HA2 GLY 41 13.595 22.925 -9.722 338 2HA GLY 41 HA1 GLY 41 14.195 21.300 -9.394 339 H ASP 42 HN ASP 42 15.894 23.548 -9.288 340 HA ASP 42 HA ASP 42 17.466 23.505 -11.818 341 1HB ASP 42 HB2 ASP 42 17.070 25.276 -9.482 342 2HB ASP 42 HB1 ASP 42 18.731 25.205 -10.071 343 H TYR 43 HN TYR 43 19.573 22.667 -11.893 344 HA TYR 43 HA TYR 43 20.559 21.277 -9.418 345 1HB TYR 43 HB2 TYR 43 20.537 20.416 -12.325 346 2HB TYR 43 HB1 TYR 43 21.399 19.549 -11.055 347 HD1 TYR 43 HD1 TYR 43 20.043 18.785 -8.993 348 HD2 TYR 43 HD2 TYR 43 18.240 20.023 -12.690 349 HE1 TYR 43 HE1 TYR 43 17.942 17.636 -8.353 350 HE2 TYR 43 HE2 TYR 43 16.140 18.872 -12.052 351 HH TYR 43 HH TYR 43 15.140 18.199 -9.432 352 H THR 44 HN THR 44 22.979 20.873 -9.514 353 HA THR 44 HA THR 44 24.445 22.870 -11.193 354 HB THR 44 HB THR 44 24.949 22.517 -8.231 355 HG1 THR 44 HG1 THR 44 23.217 23.607 -7.845 356 1HG2 THR 44 HG21 THR 44 25.765 24.912 -8.577 357 2HG2 THR 44 HG22 THR 44 25.605 24.612 -10.307 358 3HG2 THR 44 HG23 THR 44 26.727 23.650 -9.345 359 HA PRO 45 HA PRO 45 27.434 19.571 -11.224 360 1HB PRO 45 HB2 PRO 45 29.298 20.874 -12.732 361 2HB PRO 45 HB1 PRO 45 27.767 20.285 -13.406 362 1HG PRO 45 HG2 PRO 45 28.634 23.020 -12.922 363 2HG PRO 45 HG1 PRO 45 27.277 22.426 -13.887 364 1HD PRO 45 HD2 PRO 45 27.263 23.503 -11.189 365 2HD PRO 45 HD1 PRO 45 25.889 23.121 -12.249 366 H THR 46 HN THR 46 28.839 19.064 -9.527 367 HA THR 46 HA THR 46 30.146 21.133 -7.926 368 HB THR 46 HB THR 46 30.518 18.112 -8.015 369 HG1 THR 46 HG1 THR 46 28.607 18.061 -7.187 370 1HG2 THR 46 HG21 THR 46 32.217 18.740 -6.609 371 2HG2 THR 46 HG22 THR 46 30.898 18.813 -5.439 372 3HG2 THR 46 HG23 THR 46 31.465 20.289 -6.221 373 H VAL 47 HN VAL 47 31.557 22.237 -9.401 374 HA VAL 47 HA VAL 47 33.456 20.776 -11.070 375 HB VAL 47 HB VAL 47 32.432 22.896 -11.751 376 1HG1 VAL 47 HG11 VAL 47 33.569 23.813 -9.149 377 2HG1 VAL 47 HG12 VAL 47 32.060 24.263 -9.938 378 3HG1 VAL 47 HG13 VAL 47 33.583 24.963 -10.486 379 1HG2 VAL 47 HG21 VAL 47 34.525 22.547 -12.804 380 2HG2 VAL 47 HG22 VAL 47 35.421 22.875 -11.322 381 3HG2 VAL 47 HG23 VAL 47 34.627 24.193 -12.181 382 H LYS 48 HN LYS 48 35.594 20.411 -10.731 383 HA LYS 48 HA LYS 48 36.982 21.634 -8.403 384 1HB LYS 48 HB2 LYS 48 37.812 19.339 -7.769 385 2HB LYS 48 HB1 LYS 48 36.078 19.541 -7.546 386 1HG LYS 48 HG2 LYS 48 36.519 18.623 -10.219 387 2HG LYS 48 HG1 LYS 48 37.440 17.590 -9.129 388 1HD LYS 48 HD2 LYS 48 35.437 17.200 -7.765 389 2HD LYS 48 HD1 LYS 48 34.502 18.272 -8.806 390 1HE LYS 48 HE2 LYS 48 35.527 16.568 -10.674 391 2HE LYS 48 HE1 LYS 48 35.370 15.476 -9.284 392 1HZ LYS 48 HZ1 LYS 48 33.116 15.957 -9.057 393 2HZ LYS 48 HZ2 LYS 48 33.314 15.828 -10.738 394 3HZ LYS 48 HZ3 LYS 48 33.205 17.358 -10.009 395 HA PRO 49 HA PRO 49 39.709 21.794 -11.987 396 1HB PRO 49 HB2 PRO 49 41.298 23.795 -11.019 397 2HB PRO 49 HB1 PRO 49 39.711 24.092 -11.751 398 1HG PRO 49 HG2 PRO 49 40.498 24.060 -8.894 399 2HG PRO 49 HG1 PRO 49 39.299 25.058 -9.726 400 1HD PRO 49 HD2 PRO 49 38.719 22.849 -8.171 401 2HD PRO 49 HD1 PRO 49 37.643 23.538 -9.404 402 H SER 50 HN SER 50 41.403 20.374 -12.227 403 HA SER 50 HA SER 50 42.839 19.295 -9.915 404 1HB SER 50 HB2 SER 50 44.036 18.048 -11.769 405 2HB SER 50 HB1 SER 50 42.285 17.873 -11.796 406 HG SER 50 HG SER 50 43.191 18.378 -13.862 407 H SER 51 HN SER 51 43.688 21.347 -12.712 408 HA SER 51 HA SER 51 46.158 22.214 -11.241 409 1HB SER 51 HB2 SER 51 45.670 21.122 -13.914 410 2HB SER 51 HB1 SER 51 46.535 22.655 -13.976 411 HG SER 51 HG SER 51 47.877 20.742 -13.724 412 H LYS 52 HN LYS 52 46.819 24.375 -12.877 413 HA LYS 52 HA LYS 52 44.605 26.260 -12.260 414 1HB LYS 52 HB2 LYS 52 47.381 26.268 -12.000 415 2HB LYS 52 HB1 LYS 52 47.096 27.325 -13.384 416 1HG LYS 52 HG2 LYS 52 45.126 27.950 -11.425 417 2HG LYS 52 HG1 LYS 52 46.683 27.883 -10.599 418 1HD LYS 52 HD2 LYS 52 47.522 29.690 -11.736 419 2HD LYS 52 HD1 LYS 52 46.666 29.275 -13.223 420 1HE LYS 52 HE2 LYS 52 45.208 30.316 -10.779 421 2HE LYS 52 HE1 LYS 52 45.839 31.393 -12.036 422 1HZ LYS 52 HZ1 LYS 52 44.686 29.739 -13.628 423 2HZ LYS 52 HZ2 LYS 52 43.734 30.892 -12.827 424 3HZ LYS 52 HZ3 LYS 52 43.781 29.289 -12.266 425 H GLY 53 HN GLY 53 43.188 26.692 -13.891 426 1HA GLY 53 HA2 GLY 53 42.286 26.915 -16.040 427 2HA GLY 53 HA1 GLY 53 43.807 27.722 -16.416 428 H ASN 54 HN ASN 54 43.567 24.309 -15.456 429 HA ASN 54 HA ASN 54 44.650 23.575 -18.149 430 1HB ASN 54 HB2 ASN 54 45.657 23.176 -15.657 431 2HB ASN 54 HB1 ASN 54 44.741 21.684 -15.861 432 1HD2 ASN 54 HD21 ASN 54 45.711 20.059 -17.125 433 2HD2 ASN 54 HD22 ASN 54 47.081 20.296 -18.097 434 H TYR 55 HN TYR 55 42.767 21.873 -15.605 435 HA TYR 55 HA TYR 55 40.756 21.079 -17.671 436 1HB TYR 55 HB2 TYR 55 42.762 19.450 -17.267 437 2HB TYR 55 HB1 TYR 55 41.953 19.091 -15.742 438 HD1 TYR 55 HD1 TYR 55 39.818 17.920 -15.685 439 HD2 TYR 55 HD2 TYR 55 41.704 18.896 -19.422 440 HE1 TYR 55 HE1 TYR 55 38.268 16.392 -16.867 441 HE2 TYR 55 HE2 TYR 55 40.150 17.367 -20.603 442 HH TYR 55 HH TYR 55 38.641 15.056 -19.479 443 H HIS 56 HN HIS 56 38.685 21.030 -16.829 444 HA HIS 56 HA HIS 56 38.397 21.358 -13.857 445 1HB HIS 56 HB2 HIS 56 37.098 22.561 -16.275 446 2HB HIS 56 HB1 HIS 56 36.118 22.372 -14.824 447 HD1 HIS 56 HD1 HIS 56 36.058 24.915 -14.348 448 HD2 HIS 56 HD2 HIS 56 39.913 23.341 -14.452 449 HE1 HIS 56 HE1 HIS 56 37.590 26.707 -13.422 450 H SER 57 HN SER 57 37.417 19.633 -12.874 451 HA SER 57 HA SER 57 35.715 17.807 -14.548 452 1HB SER 57 HB2 SER 57 37.383 17.475 -12.044 453 2HB SER 57 HB1 SER 57 36.221 16.254 -12.553 454 HG SER 57 HG SER 57 38.637 16.390 -13.347 455 H VAL 58 HN VAL 58 33.515 18.115 -14.187 456 HA VAL 58 HA VAL 58 32.714 19.036 -11.444 457 HB VAL 58 HB VAL 58 31.202 20.558 -12.425 458 1HG1 VAL 58 HG11 VAL 58 33.081 20.811 -14.682 459 2HG1 VAL 58 HG12 VAL 58 33.855 20.699 -13.103 460 3HG1 VAL 58 HG13 VAL 58 32.677 21.968 -13.416 461 1HG2 VAL 58 HG21 VAL 58 31.383 18.725 -14.794 462 2HG2 VAL 58 HG22 VAL 58 30.920 20.407 -15.053 463 3HG2 VAL 58 HG23 VAL 58 29.954 19.378 -13.996 464 H SER 59 HN SER 59 30.718 18.222 -10.627 465 HA SER 59 HA SER 59 29.643 15.818 -12.076 466 1HB SER 59 HB2 SER 59 30.997 15.579 -9.885 467 2HB SER 59 HB1 SER 59 29.606 16.310 -9.091 468 HG SER 59 HG SER 59 29.518 14.002 -9.149 469 H ILE 60 HN ILE 60 27.749 16.611 -13.005 470 HA ILE 60 HA ILE 60 26.074 18.519 -11.471 471 HB ILE 60 HB ILE 60 26.422 19.081 -13.775 472 1HG1 ILE 60 HG12 ILE 60 24.140 19.017 -14.708 473 2HG1 ILE 60 HG11 ILE 60 23.694 17.768 -13.549 474 1HG2 ILE 60 HG21 ILE 60 25.507 17.327 -15.520 475 2HG2 ILE 60 HG22 ILE 60 25.850 16.171 -14.234 476 3HG2 ILE 60 HG23 ILE 60 27.145 17.172 -14.890 477 1HD1 ILE 60 HD11 ILE 60 23.203 20.347 -13.070 478 2HD1 ILE 60 HD12 ILE 60 24.862 20.297 -12.477 479 3HD1 ILE 60 HD13 ILE 60 23.642 19.239 -11.771 480 H THR 61 HN THR 61 24.301 17.953 -10.375 481 HA THR 61 HA THR 61 23.428 15.116 -10.345 482 HB THR 61 HB THR 61 22.585 17.635 -8.862 483 HG1 THR 61 HG1 THR 61 24.288 17.138 -7.766 484 1HG2 THR 61 HG21 THR 61 21.669 14.767 -8.619 485 2HG2 THR 61 HG22 THR 61 20.680 16.218 -8.794 486 3HG2 THR 61 HG23 THR 61 21.531 15.909 -7.281 487 H ILE 62 HN ILE 62 21.834 14.426 -11.773 488 HA ILE 62 HA ILE 62 19.837 16.469 -12.711 489 HB ILE 62 HB ILE 62 21.203 14.233 -14.249 490 1HG1 ILE 62 HG12 ILE 62 21.416 17.256 -14.469 491 2HG1 ILE 62 HG11 ILE 62 22.645 16.197 -13.784 492 1HG2 ILE 62 HG21 ILE 62 20.031 15.261 -16.212 493 2HG2 ILE 62 HG22 ILE 62 19.139 16.292 -15.094 494 3HG2 ILE 62 HG23 ILE 62 18.921 14.543 -15.047 495 1HD1 ILE 62 HD11 ILE 62 23.313 16.621 -16.042 496 2HD1 ILE 62 HD12 ILE 62 21.689 16.303 -16.652 497 3HD1 ILE 62 HD13 ILE 62 22.668 14.980 -16.020 498 H ASN 63 HN ASN 63 17.944 15.867 -11.708 499 HA ASN 63 HA ASN 63 17.299 12.999 -11.302 500 1HB ASN 63 HB2 ASN 63 16.973 14.891 -9.610 501 2HB ASN 63 HB1 ASN 63 15.667 15.467 -10.643 502 1HD2 ASN 63 HD21 ASN 63 13.779 13.985 -10.949 503 2HD2 ASN 63 HD22 ASN 63 13.453 12.795 -9.787 504 H ALA 64 HN ALA 64 16.886 12.295 -13.472 505 HA ALA 64 HA ALA 64 14.536 13.589 -14.824 506 1HB ALA 64 HB1 ALA 64 15.612 12.598 -16.891 507 2HB ALA 64 HB2 ALA 64 16.972 12.121 -15.876 508 3HB ALA 64 HB3 ALA 64 16.585 13.829 -16.087 509 H THR 65 HN THR 65 12.811 12.258 -15.359 510 HA THR 65 HA THR 65 12.637 9.620 -14.139 511 HB THR 65 HB THR 65 10.382 9.676 -15.295 512 HG1 THR 65 HG1 THR 65 10.453 10.911 -16.999 513 1HG2 THR 65 HG21 THR 65 10.270 10.542 -13.141 514 2HG2 THR 65 HG22 THR 65 9.735 11.927 -14.090 515 3HG2 THR 65 HG23 THR 65 11.394 11.853 -13.498 516 H HIS 66 HN HIS 66 13.822 10.737 -17.168 517 HA HIS 66 HA HIS 66 13.707 7.950 -18.274 518 1HB HIS 66 HB2 HIS 66 12.284 10.062 -19.206 519 2HB HIS 66 HB1 HIS 66 13.780 10.294 -20.110 520 HD1 HIS 66 HD1 HIS 66 10.661 8.655 -20.453 521 HD2 HIS 66 HD2 HIS 66 14.588 7.522 -21.271 522 HE1 HIS 66 HE1 HIS 66 10.527 6.726 -22.089 523 H ILE 67 HN ILE 67 15.608 7.281 -19.383 524 HA ILE 67 HA ILE 67 18.095 8.555 -18.592 525 HB ILE 67 HB ILE 67 17.617 6.085 -18.947 526 1HG1 ILE 67 HG12 ILE 67 19.895 6.377 -20.705 527 2HG1 ILE 67 HG11 ILE 67 19.955 7.607 -19.442 528 1HG2 ILE 67 HG21 ILE 67 18.038 6.746 -21.871 529 2HG2 ILE 67 HG22 ILE 67 16.438 6.512 -21.167 530 3HG2 ILE 67 HG23 ILE 67 17.603 5.189 -21.166 531 1HD1 ILE 67 HD11 ILE 67 19.558 5.798 -17.747 532 2HD1 ILE 67 HD12 ILE 67 21.079 5.621 -18.623 533 3HD1 ILE 67 HD13 ILE 67 19.695 4.613 -19.047 534 H GLU 68 HN GLU 68 16.010 8.855 -21.389 535 HA GLU 68 HA GLU 68 18.037 9.869 -23.215 536 1HB GLU 68 HB2 GLU 68 16.144 10.252 -24.656 537 2HB GLU 68 HB1 GLU 68 15.828 8.757 -23.782 538 1HG GLU 68 HG2 GLU 68 13.840 9.688 -23.228 539 2HG GLU 68 HG1 GLU 68 14.757 10.687 -22.103 540 H GLN 69 HN GLN 69 16.051 11.303 -20.698 541 HA GLN 69 HA GLN 69 16.174 14.042 -21.629 542 1HB GLN 69 HB2 GLN 69 14.628 12.855 -19.904 543 2HB GLN 69 HB1 GLN 69 15.936 13.143 -18.756 544 1HG GLN 69 HG2 GLN 69 15.630 15.585 -20.088 545 2HG GLN 69 HG1 GLN 69 13.981 15.019 -19.825 546 1HE2 GLN 69 HE21 GLN 69 13.276 14.682 -17.576 547 2HE2 GLN 69 HE22 GLN 69 14.143 15.358 -16.283 548 H VAL 70 HN VAL 70 18.027 12.261 -19.112 549 HA VAL 70 HA VAL 70 19.832 14.424 -18.526 550 HB VAL 70 HB VAL 70 19.297 12.386 -17.128 551 1HG1 VAL 70 HG11 VAL 70 19.470 10.695 -18.909 552 2HG1 VAL 70 HG12 VAL 70 20.580 10.324 -17.590 553 3HG1 VAL 70 HG13 VAL 70 21.191 11.040 -19.080 554 1HG2 VAL 70 HG21 VAL 70 22.083 12.035 -16.985 555 2HG2 VAL 70 HG22 VAL 70 21.111 13.170 -16.050 556 3HG2 VAL 70 HG23 VAL 70 21.854 13.685 -17.565 557 H GLU 71 HN GLU 71 19.883 11.851 -20.969 558 HA GLU 71 HA GLU 71 22.635 12.123 -21.779 559 1HB GLU 71 HB2 GLU 71 20.353 10.602 -22.433 560 2HB GLU 71 HB1 GLU 71 20.778 11.447 -23.921 561 1HG GLU 71 HG2 GLU 71 22.759 9.882 -22.241 562 2HG GLU 71 HG1 GLU 71 21.930 9.225 -23.653 563 H THR 72 HN THR 72 19.605 13.573 -23.019 564 HA THR 72 HA THR 72 20.781 15.209 -25.057 565 HB THR 72 HB THR 72 18.279 15.576 -23.366 566 HG1 THR 72 HG1 THR 72 17.601 13.945 -24.467 567 1HG2 THR 72 HG21 THR 72 19.352 16.952 -25.788 568 2HG2 THR 72 HG22 THR 72 18.382 17.598 -24.465 569 3HG2 THR 72 HG23 THR 72 17.618 16.633 -25.728 570 H LEU 73 HN LEU 73 20.251 15.706 -21.579 571 HA LEU 73 HA LEU 73 20.859 18.499 -21.430 572 1HB LEU 73 HB2 LEU 73 20.629 16.143 -19.664 573 2HB LEU 73 HB1 LEU 73 21.723 17.383 -19.054 574 HG LEU 73 HG LEU 73 20.024 19.038 -19.039 575 1HD1 LEU 73 HD11 LEU 73 17.843 18.753 -20.098 576 2HD1 LEU 73 HD12 LEU 73 18.256 17.113 -20.583 577 3HD1 LEU 73 HD13 LEU 73 19.104 18.485 -21.296 578 1HD2 LEU 73 HD21 LEU 73 18.329 18.096 -17.612 579 2HD2 LEU 73 HD22 LEU 73 19.815 17.198 -17.301 580 3HD2 LEU 73 HD23 LEU 73 18.552 16.492 -18.309 581 H TYR 74 HN TYR 74 22.945 15.597 -21.276 582 HA TYR 74 HA TYR 74 25.416 16.977 -20.751 583 1HB TYR 74 HB2 TYR 74 25.415 14.654 -20.377 584 2HB TYR 74 HB1 TYR 74 24.569 14.314 -21.885 585 HD1 TYR 74 HD1 TYR 74 25.913 13.061 -23.310 586 HD2 TYR 74 HD2 TYR 74 27.684 16.259 -21.056 587 HE1 TYR 74 HE1 TYR 74 28.077 12.666 -24.452 588 HE2 TYR 74 HE2 TYR 74 29.850 15.864 -22.198 589 HH TYR 74 HH TYR 74 30.774 13.325 -23.558 590 H GLU 75 HN GLU 75 23.751 16.046 -23.780 591 HA GLU 75 HA GLU 75 25.787 16.858 -25.623 592 1HB GLU 75 HB2 GLU 75 22.871 16.298 -25.605 593 2HB GLU 75 HB1 GLU 75 23.438 17.295 -26.943 594 1HG GLU 75 HG2 GLU 75 23.897 15.278 -27.909 595 2HG GLU 75 HG1 GLU 75 25.359 15.369 -26.927 596 H GLU 76 HN GLU 76 23.148 18.687 -24.070 597 HA GLU 76 HA GLU 76 23.572 21.142 -25.539 598 1HB GLU 76 HB2 GLU 76 22.002 20.117 -23.261 599 2HB GLU 76 HB1 GLU 76 22.346 21.847 -23.200 600 1HG GLU 76 HG2 GLU 76 20.511 22.010 -24.543 601 2HG GLU 76 HG1 GLU 76 21.643 21.567 -25.820 602 H LEU 77 HN LEU 77 24.488 20.162 -22.195 603 HA LEU 77 HA LEU 77 26.030 22.571 -21.716 604 1HB LEU 77 HB2 LEU 77 26.064 21.744 -19.597 605 2HB LEU 77 HB1 LEU 77 24.925 20.557 -20.217 606 HG LEU 77 HG LEU 77 27.148 19.277 -20.919 607 1HD1 LEU 77 HD11 LEU 77 28.180 21.517 -19.551 608 2HD1 LEU 77 HD12 LEU 77 29.070 20.084 -20.066 609 3HD1 LEU 77 HD13 LEU 77 28.374 20.155 -18.447 610 1HD2 LEU 77 HD21 LEU 77 26.427 19.332 -17.987 611 2HD2 LEU 77 HD22 LEU 77 26.943 17.955 -18.961 612 3HD2 LEU 77 HD23 LEU 77 25.339 18.650 -19.196 613 H GLY 78 HN GLY 78 26.787 19.422 -23.100 614 1HA GLY 78 HA2 GLY 78 29.690 20.082 -23.099 615 2HA GLY 78 HA1 GLY 78 29.007 18.493 -23.442 616 H LYS 79 HN LYS 79 27.924 21.585 -24.806 617 HA LYS 79 HA LYS 79 28.531 20.509 -27.530 618 1HB LYS 79 HB2 LYS 79 26.228 21.490 -26.371 619 2HB LYS 79 HB1 LYS 79 26.833 22.899 -27.241 620 1HG LYS 79 HG2 LYS 79 26.758 21.800 -29.324 621 2HG LYS 79 HG1 LYS 79 26.710 20.201 -28.579 622 1HD LYS 79 HD2 LYS 79 24.460 21.472 -27.541 623 2HD LYS 79 HD1 LYS 79 24.506 22.013 -29.219 624 1HE LYS 79 HE2 LYS 79 24.237 19.856 -30.065 625 2HE LYS 79 HE1 LYS 79 24.946 19.096 -28.627 626 1HZ LYS 79 HZ1 LYS 79 22.364 20.572 -28.671 627 2HZ LYS 79 HZ2 LYS 79 23.041 19.768 -27.335 628 3HZ LYS 79 HZ3 LYS 79 22.508 18.882 -28.683 629 H ILE 80 HN ILE 80 29.981 22.516 -25.327 630 HA ILE 80 HA ILE 80 30.538 24.900 -26.841 631 HB ILE 80 HB ILE 80 32.290 23.577 -24.753 632 1HG1 ILE 80 HG12 ILE 80 30.526 25.557 -23.644 633 2HG1 ILE 80 HG11 ILE 80 29.558 24.344 -24.482 634 1HG2 ILE 80 HG21 ILE 80 33.442 25.463 -25.445 635 2HG2 ILE 80 HG22 ILE 80 32.428 26.169 -24.190 636 3HG2 ILE 80 HG23 ILE 80 31.971 26.330 -25.886 637 1HD1 ILE 80 HD11 ILE 80 30.889 22.570 -23.283 638 2HD1 ILE 80 HD12 ILE 80 29.893 23.570 -22.222 639 3HD1 ILE 80 HD13 ILE 80 31.630 23.858 -22.332 640 H ASP 81 HN ASP 81 32.564 25.426 -27.956 641 HA ASP 81 HA ASP 81 33.543 23.415 -29.747 642 1HB ASP 81 HB2 ASP 81 33.545 25.940 -29.999 643 2HB ASP 81 HB1 ASP 81 34.900 25.986 -28.873 644 H ILE 82 HN ILE 82 34.517 24.358 -26.514 645 HA ILE 82 HA ILE 82 37.173 23.182 -26.554 646 HB ILE 82 HB ILE 82 35.275 23.835 -24.269 647 1HG1 ILE 82 HG12 ILE 82 35.652 25.788 -25.731 648 2HG1 ILE 82 HG11 ILE 82 36.466 26.005 -24.184 649 1HG2 ILE 82 HG21 ILE 82 37.539 24.211 -23.093 650 2HG2 ILE 82 HG22 ILE 82 38.237 23.284 -24.421 651 3HG2 ILE 82 HG23 ILE 82 37.034 22.542 -23.364 652 1HD1 ILE 82 HD11 ILE 82 38.073 24.693 -26.308 653 2HD1 ILE 82 HD12 ILE 82 38.552 25.899 -25.114 654 3HD1 ILE 82 HD13 ILE 82 37.692 26.394 -26.572 655 H VAL 83 HN VAL 83 37.732 21.246 -25.183 656 HA VAL 83 HA VAL 83 36.082 18.963 -25.854 657 HB VAL 83 HB VAL 83 38.481 19.350 -24.032 658 1HG1 VAL 83 HG11 VAL 83 37.159 16.829 -25.077 659 2HG1 VAL 83 HG12 VAL 83 37.360 17.300 -23.389 660 3HG1 VAL 83 HG13 VAL 83 38.769 16.868 -24.357 661 1HG2 VAL 83 HG21 VAL 83 38.112 18.596 -26.935 662 2HG2 VAL 83 HG22 VAL 83 39.583 18.179 -26.058 663 3HG2 VAL 83 HG23 VAL 83 39.124 19.870 -26.257 664 H ARG 84 HN ARG 84 34.105 18.791 -24.822 665 HA ARG 84 HA ARG 84 34.081 18.947 -21.821 666 1HB ARG 84 HB2 ARG 84 32.839 20.689 -23.355 667 2HB ARG 84 HB1 ARG 84 31.665 19.388 -23.562 668 1HG ARG 84 HG2 ARG 84 30.878 20.632 -21.691 669 2HG ARG 84 HG1 ARG 84 31.653 19.208 -20.998 670 1HD ARG 84 HD2 ARG 84 33.606 21.324 -21.384 671 2HD ARG 84 HD1 ARG 84 32.252 21.891 -20.387 672 HE ARG 84 HE ARG 84 33.385 19.224 -19.738 673 1HH1 ARG 84 HH21 ARG 84 35.381 21.279 -18.952 674 2HH1 ARG 84 HH22 ARG 84 34.875 21.709 -17.353 675 1HH2 ARG 84 HH11 ARG 84 31.704 20.337 -17.695 676 2HH2 ARG 84 HH12 ARG 84 32.792 21.176 -16.642 677 H MET 85 HN MET 85 33.946 16.850 -21.076 678 HA MET 85 HA MET 85 32.188 14.920 -22.574 679 1HB MET 85 HB2 MET 85 34.931 14.832 -21.496 680 2HB MET 85 HB1 MET 85 33.956 13.424 -21.074 681 1HG MET 85 HG2 MET 85 34.196 12.609 -23.159 682 2HG MET 85 HG1 MET 85 33.471 14.073 -23.824 683 1HE MET 85 HE1 MET 85 35.874 15.475 -25.854 684 2HE MET 85 HE2 MET 85 34.270 14.848 -25.495 685 3HE MET 85 HE3 MET 85 35.501 13.774 -26.157 686 H VAL 86 HN VAL 86 31.369 13.116 -21.041 687 HA VAL 86 HA VAL 86 30.919 14.124 -18.261 688 HB VAL 86 HB VAL 86 29.080 14.700 -19.964 689 1HG1 VAL 86 HG11 VAL 86 29.119 12.515 -21.142 690 2HG1 VAL 86 HG12 VAL 86 27.515 12.886 -20.511 691 3HG1 VAL 86 HG13 VAL 86 28.545 11.725 -19.674 692 1HG2 VAL 86 HG21 VAL 86 28.994 14.096 -17.281 693 2HG2 VAL 86 HG22 VAL 86 27.747 13.033 -17.933 694 3HG2 VAL 86 HG23 VAL 86 27.651 14.773 -18.201 695 H LEU 87 HN LEU 87 30.364 12.436 -16.741 696 HA LEU 87 HA LEU 87 30.670 10.307 -15.787 697 1HB LEU 87 HB2 LEU 87 28.845 10.254 -17.881 698 2HB LEU 87 HB1 LEU 87 29.906 8.901 -18.258 699 HG LEU 87 HG LEU 87 28.072 8.125 -16.846 700 1HD1 LEU 87 HD11 LEU 87 29.369 7.129 -15.022 701 2HD1 LEU 87 HD12 LEU 87 30.639 8.333 -15.242 702 3HD1 LEU 87 HD13 LEU 87 30.327 7.139 -16.503 703 1HD2 LEU 87 HD21 LEU 87 28.666 9.365 -14.351 704 2HD2 LEU 87 HD22 LEU 87 27.188 9.509 -15.303 705 3HD2 LEU 87 HD23 LEU 87 28.508 10.653 -15.545 Start of MODEL 7 1 1H MET 1 HT1 MET 1 17.124 17.719 -25.277 2 2H MET 1 HT2 MET 1 18.219 18.606 -26.226 3 3H MET 1 HT3 MET 1 16.789 18.002 -26.916 4 HA MET 1 HA MET 1 16.916 20.083 -24.787 5 1HB MET 1 HB2 MET 1 16.969 20.054 -27.757 6 2HB MET 1 HB1 MET 1 15.872 21.227 -27.029 7 1HG MET 1 HG2 MET 1 17.806 21.969 -25.562 8 2HG MET 1 HG1 MET 1 18.852 20.967 -26.568 9 1HE MET 1 HE1 MET 1 20.321 22.195 -27.711 10 2HE MET 1 HE2 MET 1 20.052 23.673 -26.794 11 3HE MET 1 HE3 MET 1 20.112 23.735 -28.553 12 H LYS 2 HN LYS 2 15.207 19.081 -23.577 13 HA LYS 2 HA LYS 2 12.515 19.560 -24.642 14 1HB LYS 2 HB2 LYS 2 13.731 17.099 -25.146 15 2HB LYS 2 HB1 LYS 2 12.724 16.777 -23.734 16 1HG LYS 2 HG2 LYS 2 11.061 18.315 -25.323 17 2HG LYS 2 HG1 LYS 2 11.929 17.336 -26.505 18 1HD LYS 2 HD2 LYS 2 11.327 15.292 -25.249 19 2HD LYS 2 HD1 LYS 2 10.441 16.276 -24.082 20 1HE LYS 2 HE2 LYS 2 8.928 17.067 -25.869 21 2HE LYS 2 HE1 LYS 2 9.818 16.095 -27.058 22 1HZ LYS 2 HZ1 LYS 2 8.053 14.733 -26.348 23 2HZ LYS 2 HZ2 LYS 2 8.265 15.148 -24.712 24 3HZ LYS 2 HZ3 LYS 2 9.404 14.158 -25.496 25 H THR 3 HN THR 3 10.976 18.252 -22.828 26 HA THR 3 HA THR 3 11.994 19.258 -20.191 27 HB THR 3 HB THR 3 9.179 18.850 -21.262 28 HG1 THR 3 HG1 THR 3 9.419 20.769 -22.039 29 1HG2 THR 3 HG21 THR 3 10.232 20.045 -18.686 30 2HG2 THR 3 HG22 THR 3 9.160 18.655 -18.861 31 3HG2 THR 3 HG23 THR 3 8.582 20.272 -19.262 32 H LYS 4 HN LYS 4 9.848 16.719 -21.558 33 HA LYS 4 HA LYS 4 11.001 14.769 -19.622 34 1HB LYS 4 HB2 LYS 4 8.668 16.147 -19.115 35 2HB LYS 4 HB1 LYS 4 8.061 14.686 -19.892 36 1HG LYS 4 HG2 LYS 4 8.160 14.039 -17.646 37 2HG LYS 4 HG1 LYS 4 9.702 13.449 -18.266 38 1HD LYS 4 HD2 LYS 4 10.762 15.591 -17.497 39 2HD LYS 4 HD1 LYS 4 9.227 16.033 -16.751 40 1HE LYS 4 HE2 LYS 4 9.533 14.597 -15.001 41 2HE LYS 4 HE1 LYS 4 10.189 13.323 -16.046 42 1HZ LYS 4 HZ1 LYS 4 11.636 15.809 -15.290 43 2HZ LYS 4 HZ2 LYS 4 12.253 14.527 -16.220 44 3HZ LYS 4 HZ3 LYS 4 11.891 14.292 -14.577 45 H LEU 5 HN LEU 5 10.524 12.529 -20.261 46 HA LEU 5 HA LEU 5 10.059 12.278 -23.200 47 1HB LEU 5 HB2 LEU 5 11.797 11.102 -21.187 48 2HB LEU 5 HB1 LEU 5 10.943 9.847 -22.081 49 HG LEU 5 HG LEU 5 13.083 10.437 -23.173 50 1HD1 LEU 5 HD11 LEU 5 10.726 9.990 -24.388 51 2HD1 LEU 5 HD12 LEU 5 12.209 10.294 -25.293 52 3HD1 LEU 5 HD13 LEU 5 11.057 11.602 -25.021 53 1HD2 LEU 5 HD21 LEU 5 13.680 12.588 -23.744 54 2HD2 LEU 5 HD22 LEU 5 12.659 12.962 -22.357 55 3HD2 LEU 5 HD23 LEU 5 12.010 13.100 -23.991 56 H ASN 6 HN ASN 6 8.066 12.298 -20.683 57 HA ASN 6 HA ASN 6 5.970 11.362 -20.223 58 1HB ASN 6 HB2 ASN 6 6.557 10.615 -23.067 59 2HB ASN 6 HB1 ASN 6 5.140 9.911 -22.287 60 1HD2 ASN 6 HD21 ASN 6 6.551 12.932 -23.464 61 2HD2 ASN 6 HD22 ASN 6 5.153 13.871 -23.261 62 H GLU 7 HN GLU 7 7.184 8.607 -22.148 63 HA GLU 7 HA GLU 7 7.648 6.377 -21.544 64 1HB GLU 7 HB2 GLU 7 8.050 7.579 -18.784 65 2HB GLU 7 HB1 GLU 7 8.717 6.063 -19.377 66 1HG GLU 7 HG2 GLU 7 10.433 7.102 -20.420 67 2HG GLU 7 HG1 GLU 7 9.379 8.337 -21.105 68 H LEU 8 HN LEU 8 6.902 4.633 -19.835 69 HA LEU 8 HA LEU 8 3.974 5.016 -19.422 70 1HB LEU 8 HB2 LEU 8 5.791 2.875 -20.173 71 2HB LEU 8 HB1 LEU 8 4.772 2.376 -18.823 72 HG LEU 8 HG LEU 8 3.043 3.750 -20.557 73 1HD1 LEU 8 HD11 LEU 8 5.252 2.959 -22.068 74 2HD1 LEU 8 HD12 LEU 8 3.654 3.364 -22.694 75 3HD1 LEU 8 HD13 LEU 8 4.065 1.686 -22.345 76 1HD2 LEU 8 HD21 LEU 8 3.571 0.809 -20.057 77 2HD2 LEU 8 HD22 LEU 8 2.181 1.395 -20.971 78 3HD2 LEU 8 HD23 LEU 8 2.368 1.833 -19.274 79 H LEU 9 HN LEU 9 6.973 4.319 -17.652 80 HA LEU 9 HA LEU 9 5.486 4.113 -15.075 81 1HB LEU 9 HB2 LEU 9 8.429 3.775 -15.753 82 2HB LEU 9 HB1 LEU 9 7.656 3.329 -14.233 83 HG LEU 9 HG LEU 9 6.091 1.998 -16.057 84 1HD1 LEU 9 HD11 LEU 9 8.587 2.661 -17.366 85 2HD1 LEU 9 HD12 LEU 9 7.186 1.815 -18.019 86 3HD1 LEU 9 HD13 LEU 9 8.445 0.914 -17.177 87 1HD2 LEU 9 HD21 LEU 9 8.507 0.521 -15.202 88 2HD2 LEU 9 HD22 LEU 9 6.807 0.184 -14.877 89 3HD2 LEU 9 HD23 LEU 9 7.670 1.378 -13.907 90 H GLU 10 HN GLU 10 8.048 6.026 -16.662 91 HA GLU 10 HA GLU 10 8.886 8.181 -16.214 92 1HB GLU 10 HB2 GLU 10 6.391 8.563 -16.442 93 2HB GLU 10 HB1 GLU 10 6.282 8.469 -14.685 94 1HG GLU 10 HG2 GLU 10 6.689 10.697 -14.701 95 2HG GLU 10 HG1 GLU 10 8.357 10.260 -15.069 96 H PHE 11 HN PHE 11 10.178 6.498 -14.672 97 HA PHE 11 HA PHE 11 9.840 7.199 -11.801 98 1HB PHE 11 HB2 PHE 11 10.134 4.845 -12.525 99 2HB PHE 11 HB1 PHE 11 11.680 5.268 -13.260 100 HD1 PHE 11 HD1 PHE 11 9.837 5.078 -10.034 101 HD2 PHE 11 HD2 PHE 11 13.664 5.489 -11.944 102 HE1 PHE 11 HE1 PHE 11 10.964 4.761 -7.848 103 HE2 PHE 11 HE2 PHE 11 14.789 5.172 -9.759 104 HZ PHE 11 HZ PHE 11 13.439 4.809 -7.711 105 HA PRO 12 HA PRO 12 12.979 10.323 -12.621 106 1HB PRO 12 HB2 PRO 12 12.856 11.473 -10.144 107 2HB PRO 12 HB1 PRO 12 11.680 11.810 -11.429 108 1HG PRO 12 HG2 PRO 12 11.447 9.996 -9.079 109 2HG PRO 12 HG1 PRO 12 10.237 11.069 -9.800 110 1HD PRO 12 HD2 PRO 12 10.285 8.384 -10.224 111 2HD PRO 12 HD1 PRO 12 9.655 9.547 -11.411 112 H THR 13 HN THR 13 15.059 9.585 -12.609 113 HA THR 13 HA THR 13 16.118 8.380 -10.068 114 HB THR 13 HB THR 13 15.827 6.818 -11.997 115 HG1 THR 13 HG1 THR 13 17.468 5.973 -11.031 116 1HG2 THR 13 HG21 THR 13 18.104 7.987 -13.471 117 2HG2 THR 13 HG22 THR 13 16.607 8.913 -13.562 118 3HG2 THR 13 HG23 THR 13 16.635 7.230 -14.083 119 HA PRO 14 HA PRO 14 18.962 11.752 -10.095 120 1HB PRO 14 HB2 PRO 14 20.868 10.715 -8.427 121 2HB PRO 14 HB1 PRO 14 19.298 11.315 -7.855 122 1HG PRO 14 HG2 PRO 14 20.195 8.519 -8.333 123 2HG PRO 14 HG1 PRO 14 19.173 9.173 -7.044 124 1HD PRO 14 HD2 PRO 14 18.196 7.831 -9.207 125 2HD PRO 14 HD1 PRO 14 17.274 9.057 -8.311 126 H PHE 15 HN PHE 15 20.388 12.249 -11.704 127 HA PHE 15 HA PHE 15 22.179 10.101 -12.785 128 1HB PHE 15 HB2 PHE 15 20.799 12.534 -13.901 129 2HB PHE 15 HB1 PHE 15 22.202 11.863 -14.724 130 HD1 PHE 15 HD1 PHE 15 18.754 11.823 -14.723 131 HD2 PHE 15 HD2 PHE 15 22.080 9.106 -14.776 132 HE1 PHE 15 HE1 PHE 15 17.320 10.090 -15.760 133 HE2 PHE 15 HE2 PHE 15 20.645 7.371 -15.812 134 HZ PHE 15 HZ PHE 15 18.264 7.862 -16.307 135 H THR 16 HN THR 16 24.047 10.388 -11.484 136 HA THR 16 HA THR 16 25.134 13.059 -10.923 137 HB THR 16 HB THR 16 26.425 10.316 -10.677 138 HG1 THR 16 HG1 THR 16 25.077 9.949 -9.130 139 1HG2 THR 16 HG21 THR 16 28.120 11.415 -9.694 140 2HG2 THR 16 HG22 THR 16 27.006 12.197 -8.573 141 3HG2 THR 16 HG23 THR 16 27.346 12.936 -10.138 142 H TYR 17 HN TYR 17 25.483 13.963 -13.040 143 HA TYR 17 HA TYR 17 27.271 12.457 -14.886 144 1HB TYR 17 HB2 TYR 17 25.217 14.606 -15.038 145 2HB TYR 17 HB1 TYR 17 26.520 14.690 -16.223 146 HD1 TYR 17 HD1 TYR 17 24.701 11.806 -14.624 147 HD2 TYR 17 HD2 TYR 17 25.787 13.824 -18.259 148 HE1 TYR 17 HE1 TYR 17 23.648 9.997 -15.946 149 HE2 TYR 17 HE2 TYR 17 24.732 12.013 -19.581 150 HH TYR 17 HH TYR 17 23.206 9.206 -17.983 151 H LYS 18 HN LYS 18 29.397 12.782 -14.374 152 HA LYS 18 HA LYS 18 30.350 15.377 -13.341 153 1HB LYS 18 HB2 LYS 18 31.477 12.624 -13.838 154 2HB LYS 18 HB1 LYS 18 32.560 13.973 -13.496 155 1HG LYS 18 HG2 LYS 18 32.176 13.539 -11.310 156 2HG LYS 18 HG1 LYS 18 30.586 14.252 -11.569 157 1HD LYS 18 HD2 LYS 18 29.693 12.261 -11.022 158 2HD LYS 18 HD1 LYS 18 30.357 11.622 -12.526 159 1HE LYS 18 HE2 LYS 18 32.470 11.765 -10.567 160 2HE LYS 18 HE1 LYS 18 31.090 10.885 -9.881 161 1HZ LYS 18 HZ1 LYS 18 30.963 9.600 -11.955 162 2HZ LYS 18 HZ2 LYS 18 32.450 9.380 -11.166 163 3HZ LYS 18 HZ3 LYS 18 32.352 10.388 -12.529 164 H VAL 19 HN VAL 19 30.009 16.746 -15.218 165 HA VAL 19 HA VAL 19 31.273 16.016 -17.770 166 HB VAL 19 HB VAL 19 30.553 18.466 -18.298 167 1HG1 VAL 19 HG11 VAL 19 29.088 15.982 -18.074 168 2HG1 VAL 19 HG12 VAL 19 28.975 17.234 -19.311 169 3HG1 VAL 19 HG13 VAL 19 28.011 17.358 -17.839 170 1HG2 VAL 19 HG21 VAL 19 29.278 19.640 -16.789 171 2HG2 VAL 19 HG22 VAL 19 30.244 18.727 -15.632 172 3HG2 VAL 19 HG23 VAL 19 28.621 18.180 -16.048 173 H MET 20 HN MET 20 33.453 16.093 -17.863 174 HA MET 20 HA MET 20 34.907 18.288 -16.425 175 1HB MET 20 HB2 MET 20 35.872 15.628 -17.534 176 2HB MET 20 HB1 MET 20 36.797 16.724 -16.508 177 1HG MET 20 HG2 MET 20 35.103 16.434 -14.709 178 2HG MET 20 HG1 MET 20 34.237 15.290 -15.732 179 1HE MET 20 HE1 MET 20 35.964 13.747 -12.631 180 2HE MET 20 HE2 MET 20 34.826 12.925 -13.694 181 3HE MET 20 HE3 MET 20 34.568 14.617 -13.279 182 H GLY 21 HN GLY 21 36.694 19.326 -17.601 183 1HA GLY 21 HA2 GLY 21 37.478 18.877 -20.250 184 2HA GLY 21 HA1 GLY 21 36.053 19.909 -20.363 185 H GLN 22 HN GLN 22 37.663 21.461 -21.309 186 HA GLN 22 HA GLN 22 39.761 22.608 -19.674 187 1HB GLN 22 HB2 GLN 22 38.378 23.117 -22.252 188 2HB GLN 22 HB1 GLN 22 39.146 24.522 -21.512 189 1HG GLN 22 HG2 GLN 22 41.190 22.925 -21.191 190 2HG GLN 22 HG1 GLN 22 40.407 21.951 -22.436 191 1HE2 GLN 22 HE21 GLN 22 41.674 25.252 -21.811 192 2HE2 GLN 22 HE22 GLN 22 41.956 25.616 -23.444 193 H ALA 23 HN ALA 23 39.723 24.624 -18.529 194 HA ALA 23 HA ALA 23 37.495 25.208 -16.908 195 1HB ALA 23 HB1 ALA 23 38.780 27.117 -16.245 196 2HB ALA 23 HB2 ALA 23 39.572 27.216 -17.816 197 3HB ALA 23 HB3 ALA 23 39.958 25.893 -16.716 198 H LEU 24 HN LEU 24 35.502 25.791 -17.673 199 HA LEU 24 HA LEU 24 35.350 28.006 -19.690 200 1HB LEU 24 HB2 LEU 24 34.195 25.255 -19.623 201 2HB LEU 24 HB1 LEU 24 33.161 26.534 -20.258 202 HG LEU 24 HG LEU 24 35.989 26.417 -21.221 203 1HD1 LEU 24 HD11 LEU 24 35.439 24.754 -22.908 204 2HD1 LEU 24 HD12 LEU 24 33.787 24.633 -22.303 205 3HD1 LEU 24 HD13 LEU 24 35.132 24.062 -21.316 206 1HD2 LEU 24 HD21 LEU 24 34.464 28.229 -21.915 207 2HD2 LEU 24 HD22 LEU 24 33.314 27.036 -22.520 208 3HD2 LEU 24 HD23 LEU 24 34.890 27.213 -23.292 209 HA PRO 25 HA PRO 25 32.739 29.642 -16.461 210 1HB PRO 25 HB2 PRO 25 31.986 31.920 -17.774 211 2HB PRO 25 HB1 PRO 25 33.575 31.722 -17.011 212 1HG PRO 25 HG2 PRO 25 32.812 31.513 -19.876 213 2HG PRO 25 HG1 PRO 25 34.280 32.177 -19.141 214 1HD PRO 25 HD2 PRO 25 34.132 29.702 -20.307 215 2HD PRO 25 HD1 PRO 25 35.305 30.141 -19.046 216 H GLU 26 HN GLU 26 31.731 28.955 -19.755 217 HA GLU 26 HA GLU 26 28.880 29.462 -19.291 218 1HB GLU 26 HB2 GLU 26 30.601 29.212 -21.460 219 2HB GLU 26 HB1 GLU 26 29.641 27.735 -21.538 220 1HG GLU 26 HG2 GLU 26 28.155 30.259 -21.001 221 2HG GLU 26 HG1 GLU 26 28.813 30.061 -22.624 222 H LEU 27 HN LEU 27 30.943 26.950 -18.306 223 HA LEU 27 HA LEU 27 29.402 24.600 -18.820 224 1HB LEU 27 HB2 LEU 27 31.764 25.358 -17.484 225 2HB LEU 27 HB1 LEU 27 30.768 24.598 -16.246 226 HG LEU 27 HG LEU 27 32.158 22.913 -17.356 227 1HD1 LEU 27 HD11 LEU 27 30.115 21.597 -18.459 228 2HD1 LEU 27 HD12 LEU 27 29.189 22.884 -17.690 229 3HD1 LEU 27 HD13 LEU 27 30.220 21.839 -16.716 230 1HD2 LEU 27 HD21 LEU 27 31.166 24.320 -19.763 231 2HD2 LEU 27 HD22 LEU 27 31.198 22.561 -19.893 232 3HD2 LEU 27 HD23 LEU 27 32.676 23.444 -19.512 233 H VAL 28 HN VAL 28 29.546 26.516 -15.776 234 HA VAL 28 HA VAL 28 27.343 25.208 -14.498 235 HB VAL 28 HB VAL 28 27.414 27.207 -13.011 236 1HG1 VAL 28 HG11 VAL 28 29.296 25.283 -13.286 237 2HG1 VAL 28 HG12 VAL 28 29.388 26.549 -12.061 238 3HG1 VAL 28 HG13 VAL 28 30.289 26.712 -13.568 239 1HG2 VAL 28 HG21 VAL 28 28.831 28.326 -15.373 240 2HG2 VAL 28 HG22 VAL 28 29.513 28.739 -13.802 241 3HG2 VAL 28 HG23 VAL 28 27.836 29.139 -14.166 242 H ASP 29 HN ASP 29 27.421 27.901 -16.807 243 HA ASP 29 HA ASP 29 24.719 28.828 -16.344 244 1HB ASP 29 HB2 ASP 29 26.608 30.072 -17.446 245 2HB ASP 29 HB1 ASP 29 26.449 28.998 -18.835 246 H GLN 30 HN GLN 30 26.106 26.783 -18.966 247 HA GLN 30 HA GLN 30 23.532 26.107 -20.109 248 1HB GLN 30 HB2 GLN 30 26.015 26.025 -21.014 249 2HB GLN 30 HB1 GLN 30 25.981 24.388 -20.358 250 1HG GLN 30 HG2 GLN 30 24.924 23.733 -22.236 251 2HG GLN 30 HG1 GLN 30 23.539 24.692 -21.722 252 1HE2 GLN 30 HE21 GLN 30 23.069 26.596 -22.912 253 2HE2 GLN 30 HE22 GLN 30 24.041 27.176 -24.178 254 H VAL 31 HN VAL 31 25.621 24.552 -17.686 255 HA VAL 31 HA VAL 31 24.254 22.049 -17.527 256 HB VAL 31 HB VAL 31 25.991 23.726 -15.731 257 1HG1 VAL 31 HG11 VAL 31 24.317 21.375 -14.946 258 2HG1 VAL 31 HG12 VAL 31 24.797 22.777 -13.991 259 3HG1 VAL 31 HG13 VAL 31 25.953 21.484 -14.300 260 1HG2 VAL 31 HG21 VAL 31 27.075 22.469 -17.506 261 2HG2 VAL 31 HG22 VAL 31 26.221 20.999 -17.041 262 3HG2 VAL 31 HG23 VAL 31 27.444 21.684 -15.971 263 H VAL 32 HN VAL 32 23.822 25.005 -15.503 264 HA VAL 32 HA VAL 32 21.594 23.946 -14.018 265 HB VAL 32 HB VAL 32 23.173 25.875 -13.464 266 1HG1 VAL 32 HG11 VAL 32 21.229 27.438 -15.187 267 2HG1 VAL 32 HG12 VAL 32 22.879 27.039 -15.662 268 3HG1 VAL 32 HG13 VAL 32 22.591 28.088 -14.275 269 1HG2 VAL 32 HG21 VAL 32 21.585 26.878 -12.041 270 2HG2 VAL 32 HG22 VAL 32 20.896 25.286 -12.358 271 3HG2 VAL 32 HG23 VAL 32 20.283 26.698 -13.217 272 H GLU 33 HN GLU 33 21.766 25.742 -17.092 273 HA GLU 33 HA GLU 33 18.897 26.264 -17.233 274 1HB GLU 33 HB2 GLU 33 21.345 26.702 -18.797 275 2HB GLU 33 HB1 GLU 33 19.938 26.376 -19.806 276 1HG GLU 33 HG2 GLU 33 19.342 28.529 -19.515 277 2HG GLU 33 HG1 GLU 33 18.995 28.128 -17.833 278 H VAL 34 HN VAL 34 21.061 23.955 -18.935 279 HA VAL 34 HA VAL 34 18.930 22.575 -20.294 280 HB VAL 34 HB VAL 34 21.397 22.687 -20.870 281 1HG1 VAL 34 HG11 VAL 34 21.824 20.350 -19.050 282 2HG1 VAL 34 HG12 VAL 34 21.935 21.974 -18.375 283 3HG1 VAL 34 HG13 VAL 34 22.996 21.496 -19.698 284 1HG2 VAL 34 HG21 VAL 34 19.782 20.163 -20.800 285 2HG2 VAL 34 HG22 VAL 34 21.447 20.091 -21.376 286 3HG2 VAL 34 HG23 VAL 34 20.281 21.136 -22.183 287 H VAL 35 HN VAL 35 20.403 22.129 -17.083 288 HA VAL 35 HA VAL 35 19.190 19.510 -16.654 289 HB VAL 35 HB VAL 35 21.299 20.599 -15.586 290 1HG1 VAL 35 HG11 VAL 35 19.189 21.577 -13.646 291 2HG1 VAL 35 HG12 VAL 35 20.034 22.622 -14.788 292 3HG1 VAL 35 HG13 VAL 35 20.934 21.795 -13.518 293 1HG2 VAL 35 HG21 VAL 35 20.968 19.248 -13.533 294 2HG2 VAL 35 HG22 VAL 35 20.434 18.389 -14.975 295 3HG2 VAL 35 HG23 VAL 35 19.248 19.129 -13.903 296 H GLN 36 HN GLN 36 18.322 22.874 -15.780 297 HA GLN 36 HA GLN 36 16.005 22.069 -14.205 298 1HB GLN 36 HB2 GLN 36 15.632 24.418 -14.022 299 2HB GLN 36 HB1 GLN 36 17.382 24.234 -14.088 300 1HG GLN 36 HG2 GLN 36 17.441 24.876 -16.407 301 2HG GLN 36 HG1 GLN 36 15.683 24.811 -16.530 302 1HE2 GLN 36 HE21 GLN 36 18.389 26.705 -15.210 303 2HE2 GLN 36 HE22 GLN 36 17.471 28.088 -14.860 304 H ARG 37 HN ARG 37 16.630 22.557 -17.611 305 HA ARG 37 HA ARG 37 13.923 23.057 -18.490 306 1HB ARG 37 HB2 ARG 37 16.578 22.468 -19.580 307 2HB ARG 37 HB1 ARG 37 15.287 21.735 -20.531 308 1HG ARG 37 HG2 ARG 37 14.232 23.835 -20.914 309 2HG ARG 37 HG1 ARG 37 15.194 24.630 -19.667 310 1HD ARG 37 HD2 ARG 37 16.090 25.226 -21.873 311 2HD ARG 37 HD1 ARG 37 17.254 24.168 -21.052 312 HE ARG 37 HE ARG 37 15.303 23.202 -23.114 313 1HH1 ARG 37 HH11 ARG 37 18.379 23.696 -23.442 314 2HH1 ARG 37 HH12 ARG 37 18.943 22.059 -23.411 315 1HH2 ARG 37 HH21 ARG 37 15.966 20.771 -22.167 316 2HH2 ARG 37 HH22 ARG 37 17.576 20.400 -22.686 317 H HIS 38 HN HIS 38 15.885 20.045 -18.357 318 HA HIS 38 HA HIS 38 13.563 18.381 -19.071 319 1HB HIS 38 HB2 HIS 38 16.474 18.180 -18.844 320 2HB HIS 38 HB1 HIS 38 15.655 16.751 -18.213 321 HD1 HIS 38 HD1 HIS 38 13.642 15.856 -19.943 322 HD2 HIS 38 HD2 HIS 38 16.767 18.072 -21.584 323 HE1 HIS 38 HE1 HIS 38 13.642 15.364 -22.425 324 H ALA 39 HN ALA 39 15.644 18.837 -16.183 325 HA ALA 39 HA ALA 39 14.059 17.023 -14.531 326 1HB ALA 39 HB1 ALA 39 15.687 17.514 -12.909 327 2HB ALA 39 HB2 ALA 39 15.921 19.157 -13.506 328 3HB ALA 39 HB3 ALA 39 16.570 17.789 -14.411 329 HA PRO 40 HA PRO 40 10.932 19.830 -13.240 330 1HB PRO 40 HB2 PRO 40 10.471 18.953 -10.683 331 2HB PRO 40 HB1 PRO 40 9.936 18.072 -12.128 332 1HG PRO 40 HG2 PRO 40 12.314 17.597 -10.396 333 2HG PRO 40 HG1 PRO 40 11.209 16.430 -11.139 334 1HD PRO 40 HD2 PRO 40 13.664 16.978 -12.150 335 2HD PRO 40 HD1 PRO 40 12.286 16.497 -13.167 336 H GLY 41 HN GLY 41 13.719 19.438 -11.040 337 1HA GLY 41 HA2 GLY 41 13.251 22.222 -10.052 338 2HA GLY 41 HA1 GLY 41 14.177 20.999 -9.183 339 H ASP 42 HN ASP 42 15.596 23.155 -9.346 340 HA ASP 42 HA ASP 42 17.192 23.208 -11.861 341 1HB ASP 42 HB2 ASP 42 16.402 25.048 -9.752 342 2HB ASP 42 HB1 ASP 42 18.152 25.075 -9.974 343 H TYR 43 HN TYR 43 19.467 22.775 -11.818 344 HA TYR 43 HA TYR 43 20.548 21.619 -9.270 345 1HB TYR 43 HB2 TYR 43 20.604 20.461 -12.071 346 2HB TYR 43 HB1 TYR 43 21.509 19.798 -10.710 347 HD1 TYR 43 HD1 TYR 43 18.233 20.138 -12.274 348 HD2 TYR 43 HD2 TYR 43 20.303 18.891 -8.724 349 HE1 TYR 43 HE1 TYR 43 16.209 18.926 -11.521 350 HE2 TYR 43 HE2 TYR 43 18.280 17.677 -7.972 351 HH TYR 43 HH TYR 43 15.414 18.188 -8.824 352 H THR 44 HN THR 44 23.005 21.244 -9.523 353 HA THR 44 HA THR 44 24.299 23.259 -11.309 354 HB THR 44 HB THR 44 25.354 23.182 -8.556 355 HG1 THR 44 HG1 THR 44 23.639 23.935 -7.537 356 1HG2 THR 44 HG21 THR 44 25.412 24.887 -10.735 357 2HG2 THR 44 HG22 THR 44 25.958 25.286 -9.108 358 3HG2 THR 44 HG23 THR 44 24.324 25.707 -9.618 359 HA PRO 45 HA PRO 45 27.426 20.102 -11.357 360 1HB PRO 45 HB2 PRO 45 29.291 21.497 -12.778 361 2HB PRO 45 HB1 PRO 45 27.794 20.888 -13.505 362 1HG PRO 45 HG2 PRO 45 28.577 23.628 -12.911 363 2HG PRO 45 HG1 PRO 45 27.269 23.032 -13.939 364 1HD PRO 45 HD2 PRO 45 27.131 24.033 -11.221 365 2HD PRO 45 HD1 PRO 45 25.803 23.618 -12.328 366 H THR 46 HN THR 46 28.764 19.581 -9.613 367 HA THR 46 HA THR 46 30.026 21.668 -7.976 368 HB THR 46 HB THR 46 30.233 18.633 -7.928 369 HG1 THR 46 HG1 THR 46 28.272 18.754 -7.232 370 1HG2 THR 46 HG21 THR 46 30.735 19.102 -5.476 371 2HG2 THR 46 HG22 THR 46 30.942 20.793 -5.933 372 3HG2 THR 46 HG23 THR 46 32.003 19.560 -6.612 373 H VAL 47 HN VAL 47 31.717 22.666 -9.121 374 HA VAL 47 HA VAL 47 33.556 21.175 -10.816 375 HB VAL 47 HB VAL 47 32.901 23.526 -11.199 376 1HG1 VAL 47 HG11 VAL 47 32.775 24.906 -9.424 377 2HG1 VAL 47 HG12 VAL 47 34.536 24.949 -9.410 378 3HG1 VAL 47 HG13 VAL 47 33.676 23.778 -8.414 379 1HG2 VAL 47 HG21 VAL 47 35.093 22.672 -12.029 380 2HG2 VAL 47 HG22 VAL 47 35.854 23.255 -10.548 381 3HG2 VAL 47 HG23 VAL 47 35.135 24.400 -11.680 382 H LYS 48 HN LYS 48 35.620 20.481 -10.370 383 HA LYS 48 HA LYS 48 36.825 21.065 -7.709 384 1HB LYS 48 HB2 LYS 48 37.182 18.672 -7.321 385 2HB LYS 48 HB1 LYS 48 35.465 18.966 -7.584 386 1HG LYS 48 HG2 LYS 48 36.242 18.497 -10.137 387 2HG LYS 48 HG1 LYS 48 37.419 17.504 -9.280 388 1HD LYS 48 HD2 LYS 48 35.749 16.178 -8.270 389 2HD LYS 48 HD1 LYS 48 34.485 17.366 -8.592 390 1HE LYS 48 HE2 LYS 48 35.615 16.649 -11.114 391 2HE LYS 48 HE1 LYS 48 35.276 15.146 -10.236 392 1HZ LYS 48 HZ1 LYS 48 33.289 15.896 -11.364 393 2HZ LYS 48 HZ2 LYS 48 33.395 17.420 -10.620 394 3HZ LYS 48 HZ3 LYS 48 33.072 16.035 -9.688 395 HA PRO 49 HA PRO 49 40.428 21.341 -10.235 396 1HB PRO 49 HB2 PRO 49 42.358 21.099 -8.312 397 2HB PRO 49 HB1 PRO 49 41.371 22.559 -8.513 398 1HG PRO 49 HG2 PRO 49 41.144 20.384 -6.510 399 2HG PRO 49 HG1 PRO 49 40.829 22.116 -6.340 400 1HD PRO 49 HD2 PRO 49 38.882 20.183 -6.636 401 2HD PRO 49 HD1 PRO 49 38.667 21.908 -7.006 402 H SER 50 HN SER 50 40.116 19.284 -11.363 403 HA SER 50 HA SER 50 41.332 16.853 -10.166 404 1HB SER 50 HB2 SER 50 39.584 17.552 -12.502 405 2HB SER 50 HB1 SER 50 40.482 16.036 -12.546 406 HG SER 50 HG SER 50 38.555 15.612 -11.546 407 H SER 51 HN SER 51 41.733 18.956 -13.035 408 HA SER 51 HA SER 51 44.452 17.759 -13.461 409 1HB SER 51 HB2 SER 51 42.253 18.075 -15.146 410 2HB SER 51 HB1 SER 51 43.314 19.404 -15.599 411 HG SER 51 HG SER 51 43.801 17.476 -16.739 412 H LYS 52 HN LYS 52 46.139 19.332 -14.165 413 HA LYS 52 HA LYS 52 45.852 21.929 -12.737 414 1HB LYS 52 HB2 LYS 52 48.004 20.052 -13.532 415 2HB LYS 52 HB1 LYS 52 48.440 21.759 -13.600 416 1HG LYS 52 HG2 LYS 52 48.926 21.335 -11.382 417 2HG LYS 52 HG1 LYS 52 47.230 21.794 -11.224 418 1HD LYS 52 HD2 LYS 52 47.338 19.007 -11.870 419 2HD LYS 52 HD1 LYS 52 48.449 19.303 -10.533 420 1HE LYS 52 HE2 LYS 52 46.753 19.810 -9.075 421 2HE LYS 52 HE1 LYS 52 45.819 20.672 -10.313 422 1HZ LYS 52 HZ1 LYS 52 44.692 18.636 -9.816 423 2HZ LYS 52 HZ2 LYS 52 46.110 17.726 -10.025 424 3HZ LYS 52 HZ3 LYS 52 45.376 18.483 -11.359 425 H GLY 53 HN GLY 53 46.566 23.920 -13.808 426 1HA GLY 53 HA2 GLY 53 47.117 25.238 -15.745 427 2HA GLY 53 HA1 GLY 53 46.757 23.845 -16.766 428 H ASN 54 HN ASN 54 45.171 24.669 -18.105 429 HA ASN 54 HA ASN 54 42.878 26.144 -16.898 430 1HB ASN 54 HB2 ASN 54 44.341 26.724 -19.032 431 2HB ASN 54 HB1 ASN 54 43.251 25.591 -19.830 432 1HD2 ASN 54 HD21 ASN 54 40.965 26.189 -19.990 433 2HD2 ASN 54 HD22 ASN 54 40.446 27.774 -19.678 434 H TYR 55 HN TYR 55 42.403 23.828 -15.918 435 HA TYR 55 HA TYR 55 40.392 22.524 -17.692 436 1HB TYR 55 HB2 TYR 55 42.774 21.463 -17.706 437 2HB TYR 55 HB1 TYR 55 42.371 20.910 -16.082 438 HD1 TYR 55 HD1 TYR 55 41.762 20.481 -19.651 439 HD2 TYR 55 HD2 TYR 55 40.410 19.403 -15.718 440 HE1 TYR 55 HE1 TYR 55 40.463 18.603 -20.613 441 HE2 TYR 55 HE2 TYR 55 39.109 17.524 -16.680 442 HH TYR 55 HH TYR 55 38.056 17.151 -19.275 443 H HIS 56 HN HIS 56 38.589 21.847 -16.534 444 HA HIS 56 HA HIS 56 38.765 21.672 -13.563 445 1HB HIS 56 HB2 HIS 56 37.035 23.286 -13.264 446 2HB HIS 56 HB1 HIS 56 38.126 24.001 -14.445 447 HD1 HIS 56 HD1 HIS 56 34.738 23.967 -13.941 448 HD2 HIS 56 HD2 HIS 56 37.007 22.783 -17.229 449 HE1 HIS 56 HE1 HIS 56 33.189 24.036 -15.943 450 H SER 57 HN SER 57 37.223 20.238 -12.655 451 HA SER 57 HA SER 57 35.555 18.713 -14.645 452 1HB SER 57 HB2 SER 57 37.138 17.892 -12.197 453 2HB SER 57 HB1 SER 57 35.950 16.830 -12.949 454 HG SER 57 HG SER 57 38.066 16.497 -13.770 455 H VAL 58 HN VAL 58 33.413 19.265 -14.291 456 HA VAL 58 HA VAL 58 32.568 19.752 -11.456 457 HB VAL 58 HB VAL 58 30.977 21.306 -12.320 458 1HG1 VAL 58 HG11 VAL 58 32.421 22.920 -13.035 459 2HG1 VAL 58 HG12 VAL 58 33.076 21.910 -14.323 460 3HG1 VAL 58 HG13 VAL 58 33.637 21.699 -12.665 461 1HG2 VAL 58 HG21 VAL 58 30.110 19.974 -14.177 462 2HG2 VAL 58 HG22 VAL 58 31.625 20.169 -15.057 463 3HG2 VAL 58 HG23 VAL 58 30.587 21.564 -14.768 464 H SER 59 HN SER 59 30.691 18.749 -10.690 465 HA SER 59 HA SER 59 29.619 16.506 -12.368 466 1HB SER 59 HB2 SER 59 30.883 15.882 -10.329 467 2HB SER 59 HB1 SER 59 29.811 16.886 -9.357 468 HG SER 59 HG SER 59 28.796 15.015 -9.219 469 H ILE 60 HN ILE 60 27.661 17.175 -13.207 470 HA ILE 60 HA ILE 60 25.970 19.051 -11.655 471 HB ILE 60 HB ILE 60 26.243 19.585 -13.975 472 1HG1 ILE 60 HG12 ILE 60 23.950 19.441 -14.854 473 2HG1 ILE 60 HG11 ILE 60 23.566 18.178 -13.689 474 1HG2 ILE 60 HG21 ILE 60 25.351 17.764 -15.670 475 2HG2 ILE 60 HG22 ILE 60 25.775 16.648 -14.373 476 3HG2 ILE 60 HG23 ILE 60 27.010 17.689 -15.080 477 1HD1 ILE 60 HD11 ILE 60 23.394 19.653 -11.946 478 2HD1 ILE 60 HD12 ILE 60 23.057 20.799 -13.243 479 3HD1 ILE 60 HD13 ILE 60 24.680 20.689 -12.563 480 H THR 61 HN THR 61 24.245 18.438 -10.500 481 HA THR 61 HA THR 61 23.481 15.584 -10.367 482 HB THR 61 HB THR 61 22.348 18.074 -9.033 483 HG1 THR 61 HG1 THR 61 24.312 16.209 -8.183 484 1HG2 THR 61 HG21 THR 61 22.159 15.154 -8.240 485 2HG2 THR 61 HG22 THR 61 20.858 16.082 -8.984 486 3HG2 THR 61 HG23 THR 61 21.446 16.517 -7.380 487 H ILE 62 HN ILE 62 21.605 14.711 -11.324 488 HA ILE 62 HA ILE 62 19.709 16.629 -12.634 489 HB ILE 62 HB ILE 62 21.311 14.354 -13.798 490 1HG1 ILE 62 HG12 ILE 62 20.755 16.668 -15.464 491 2HG1 ILE 62 HG11 ILE 62 21.420 17.159 -13.909 492 1HG2 ILE 62 HG21 ILE 62 19.127 13.729 -14.510 493 2HG2 ILE 62 HG22 ILE 62 19.786 14.663 -15.851 494 3HG2 ILE 62 HG23 ILE 62 18.636 15.406 -14.741 495 1HD1 ILE 62 HD11 ILE 62 22.701 14.874 -15.346 496 2HD1 ILE 62 HD12 ILE 62 23.422 16.062 -14.261 497 3HD1 ILE 62 HD13 ILE 62 23.017 16.512 -15.915 498 H ASN 63 HN ASN 63 17.571 16.013 -12.519 499 HA ASN 63 HA ASN 63 16.958 13.339 -11.294 500 1HB ASN 63 HB2 ASN 63 16.597 15.505 -9.965 501 2HB ASN 63 HB1 ASN 63 15.319 15.884 -11.120 502 1HD2 ASN 63 HD21 ASN 63 13.458 14.319 -11.232 503 2HD2 ASN 63 HD22 ASN 63 13.096 13.365 -9.877 504 H ALA 64 HN ALA 64 17.054 12.830 -13.771 505 HA ALA 64 HA ALA 64 14.582 13.666 -15.211 506 1HB ALA 64 HB1 ALA 64 17.050 13.680 -16.082 507 2HB ALA 64 HB2 ALA 64 15.783 13.079 -17.149 508 3HB ALA 64 HB3 ALA 64 16.814 11.944 -16.280 509 H THR 65 HN THR 65 12.923 12.217 -15.580 510 HA THR 65 HA THR 65 12.881 9.679 -14.166 511 HB THR 65 HB THR 65 10.634 9.516 -15.266 512 HG1 THR 65 HG1 THR 65 10.235 10.691 -16.945 513 1HG2 THR 65 HG21 THR 65 9.730 11.649 -14.282 514 2HG2 THR 65 HG22 THR 65 11.394 12.170 -14.020 515 3HG2 THR 65 HG23 THR 65 10.775 10.743 -13.190 516 H HIS 66 HN HIS 66 14.041 10.600 -17.271 517 HA HIS 66 HA HIS 66 14.078 7.726 -18.130 518 1HB HIS 66 HB2 HIS 66 12.500 9.546 -19.248 519 2HB HIS 66 HB1 HIS 66 13.982 9.999 -20.085 520 HD1 HIS 66 HD1 HIS 66 12.620 6.550 -19.165 521 HD2 HIS 66 HD2 HIS 66 13.831 8.708 -22.518 522 HE1 HIS 66 HE1 HIS 66 12.501 4.953 -21.126 523 H ILE 67 HN ILE 67 15.936 7.155 -19.464 524 HA ILE 67 HA ILE 67 18.416 8.451 -18.663 525 HB ILE 67 HB ILE 67 18.005 5.986 -19.091 526 1HG1 ILE 67 HG12 ILE 67 20.190 6.235 -20.885 527 2HG1 ILE 67 HG11 ILE 67 20.270 7.627 -19.804 528 1HG2 ILE 67 HG21 ILE 67 16.714 6.452 -21.240 529 2HG2 ILE 67 HG22 ILE 67 17.915 5.164 -21.338 530 3HG2 ILE 67 HG23 ILE 67 18.274 6.756 -22.006 531 1HD1 ILE 67 HD11 ILE 67 21.168 6.275 -18.247 532 2HD1 ILE 67 HD12 ILE 67 20.876 4.852 -19.246 533 3HD1 ILE 67 HD13 ILE 67 19.620 5.439 -18.157 534 H GLU 68 HN GLU 68 16.275 8.701 -21.438 535 HA GLU 68 HA GLU 68 18.172 9.872 -23.289 536 1HB GLU 68 HB2 GLU 68 15.621 8.862 -23.368 537 2HB GLU 68 HB1 GLU 68 15.308 10.593 -23.488 538 1HG GLU 68 HG2 GLU 68 17.408 9.266 -25.201 539 2HG GLU 68 HG1 GLU 68 15.714 9.293 -25.690 540 H GLN 69 HN GLN 69 16.063 11.169 -20.754 541 HA GLN 69 HA GLN 69 16.149 13.941 -21.469 542 1HB GLN 69 HB2 GLN 69 15.828 12.406 -18.878 543 2HB GLN 69 HB1 GLN 69 15.676 14.161 -18.952 544 1HG GLN 69 HG2 GLN 69 13.959 13.794 -20.813 545 2HG GLN 69 HG1 GLN 69 13.974 12.092 -20.355 546 1HE2 GLN 69 HE21 GLN 69 12.309 11.610 -18.922 547 2HE2 GLN 69 HE22 GLN 69 11.702 12.663 -17.738 548 H VAL 70 HN VAL 70 18.158 12.117 -19.100 549 HA VAL 70 HA VAL 70 19.970 14.322 -18.618 550 HB VAL 70 HB VAL 70 19.484 12.348 -17.118 551 1HG1 VAL 70 HG11 VAL 70 19.555 10.555 -18.766 552 2HG1 VAL 70 HG12 VAL 70 20.811 10.275 -17.561 553 3HG1 VAL 70 HG13 VAL 70 21.239 10.923 -19.143 554 1HG2 VAL 70 HG21 VAL 70 21.941 12.027 -16.497 555 2HG2 VAL 70 HG22 VAL 70 21.374 13.693 -16.560 556 3HG2 VAL 70 HG23 VAL 70 22.326 13.034 -17.890 557 H GLU 71 HN GLU 71 19.840 11.763 -21.038 558 HA GLU 71 HA GLU 71 22.562 11.803 -21.931 559 1HB GLU 71 HB2 GLU 71 20.882 10.101 -22.538 560 2HB GLU 71 HB1 GLU 71 19.943 11.317 -23.401 561 1HG GLU 71 HG2 GLU 71 22.649 11.409 -24.354 562 2HG GLU 71 HG1 GLU 71 22.089 9.737 -24.401 563 H THR 72 HN THR 72 19.684 13.574 -23.174 564 HA THR 72 HA THR 72 21.131 15.217 -25.040 565 HB THR 72 HB THR 72 19.007 16.657 -24.762 566 HG1 THR 72 HG1 THR 72 17.973 16.238 -22.999 567 1HG2 THR 72 HG21 THR 72 18.972 13.729 -25.472 568 2HG2 THR 72 HG22 THR 72 19.024 15.120 -26.555 569 3HG2 THR 72 HG23 THR 72 17.544 14.742 -25.674 570 H LEU 73 HN LEU 73 20.317 15.584 -21.594 571 HA LEU 73 HA LEU 73 21.058 18.301 -21.198 572 1HB LEU 73 HB2 LEU 73 20.651 15.843 -19.643 573 2HB LEU 73 HB1 LEU 73 21.835 16.922 -18.909 574 HG LEU 73 HG LEU 73 20.234 18.780 -18.993 575 1HD1 LEU 73 HD11 LEU 73 18.071 16.885 -19.862 576 2HD1 LEU 73 HD12 LEU 73 19.077 17.662 -21.083 577 3HD1 LEU 73 HD13 LEU 73 18.121 18.643 -19.975 578 1HD2 LEU 73 HD21 LEU 73 18.423 17.691 -17.502 579 2HD2 LEU 73 HD22 LEU 73 20.096 17.563 -16.962 580 3HD2 LEU 73 HD23 LEU 73 19.314 16.187 -17.742 581 H TYR 74 HN TYR 74 23.050 15.331 -21.167 582 HA TYR 74 HA TYR 74 25.548 16.594 -20.487 583 1HB TYR 74 HB2 TYR 74 25.822 14.342 -20.272 584 2HB TYR 74 HB1 TYR 74 24.498 13.998 -21.378 585 HD1 TYR 74 HD1 TYR 74 27.957 15.478 -21.565 586 HD2 TYR 74 HD2 TYR 74 25.062 12.815 -23.293 587 HE1 TYR 74 HE1 TYR 74 29.583 14.855 -23.329 588 HE2 TYR 74 HE2 TYR 74 26.689 12.192 -25.057 589 HH TYR 74 HH TYR 74 29.715 12.447 -24.942 590 H GLU 75 HN GLU 75 24.025 15.768 -23.625 591 HA GLU 75 HA GLU 75 26.160 16.726 -25.301 592 1HB GLU 75 HB2 GLU 75 23.261 16.029 -25.541 593 2HB GLU 75 HB1 GLU 75 23.990 16.936 -26.865 594 1HG GLU 75 HG2 GLU 75 25.201 15.155 -27.571 595 2HG GLU 75 HG1 GLU 75 25.659 14.706 -25.928 596 H GLU 76 HN GLU 76 23.356 18.343 -23.829 597 HA GLU 76 HA GLU 76 23.575 20.810 -25.316 598 1HB GLU 76 HB2 GLU 76 22.080 19.666 -23.063 599 2HB GLU 76 HB1 GLU 76 22.340 21.405 -22.925 600 1HG GLU 76 HG2 GLU 76 20.593 21.655 -24.333 601 2HG GLU 76 HG1 GLU 76 21.656 21.053 -25.603 602 H LEU 77 HN LEU 77 24.527 20.016 -21.926 603 HA LEU 77 HA LEU 77 25.970 22.521 -21.592 604 1HB LEU 77 HB2 LEU 77 26.292 21.754 -19.408 605 2HB LEU 77 HB1 LEU 77 24.850 20.859 -19.878 606 HG LEU 77 HG LEU 77 26.616 19.059 -20.698 607 1HD1 LEU 77 HD11 LEU 77 28.261 19.710 -18.395 608 2HD1 LEU 77 HD12 LEU 77 28.312 21.008 -19.586 609 3HD1 LEU 77 HD13 LEU 77 28.757 19.367 -20.051 610 1HD2 LEU 77 HD21 LEU 77 25.051 19.423 -18.386 611 2HD2 LEU 77 HD22 LEU 77 26.632 18.910 -17.798 612 3HD2 LEU 77 HD23 LEU 77 25.756 17.909 -18.955 613 H GLY 78 HN GLY 78 26.805 19.346 -22.823 614 1HA GLY 78 HA2 GLY 78 29.700 20.055 -22.814 615 2HA GLY 78 HA1 GLY 78 29.054 18.432 -23.051 616 H LYS 79 HN LYS 79 28.072 21.483 -24.619 617 HA LYS 79 HA LYS 79 28.540 20.179 -27.272 618 1HB LYS 79 HB2 LYS 79 26.335 21.373 -26.175 619 2HB LYS 79 HB1 LYS 79 27.041 22.723 -27.064 620 1HG LYS 79 HG2 LYS 79 26.885 21.606 -29.132 621 2HG LYS 79 HG1 LYS 79 26.723 20.025 -28.368 622 1HD LYS 79 HD2 LYS 79 24.562 21.370 -27.328 623 2HD LYS 79 HD1 LYS 79 24.658 22.044 -28.957 624 1HE LYS 79 HE2 LYS 79 24.086 20.053 -29.951 625 2HE LYS 79 HE1 LYS 79 24.977 19.088 -28.759 626 1HZ LYS 79 HZ1 LYS 79 22.570 18.865 -28.471 627 2HZ LYS 79 HZ2 LYS 79 22.433 20.541 -28.236 628 3HZ LYS 79 HZ3 LYS 79 23.288 19.590 -27.116 629 H ILE 80 HN ILE 80 30.194 22.206 -25.246 630 HA ILE 80 HA ILE 80 30.895 24.452 -26.886 631 HB ILE 80 HB ILE 80 32.566 23.034 -24.784 632 1HG1 ILE 80 HG12 ILE 80 31.151 25.263 -23.706 633 2HG1 ILE 80 HG11 ILE 80 29.971 24.251 -24.541 634 1HG2 ILE 80 HG21 ILE 80 33.987 24.736 -25.169 635 2HG2 ILE 80 HG22 ILE 80 32.745 25.841 -24.584 636 3HG2 ILE 80 HG23 ILE 80 32.862 25.480 -26.306 637 1HD1 ILE 80 HD11 ILE 80 30.343 22.433 -23.160 638 2HD1 ILE 80 HD12 ILE 80 30.670 23.744 -22.025 639 3HD1 ILE 80 HD13 ILE 80 32.006 22.905 -22.813 640 H ASP 81 HN ASP 81 32.624 24.723 -28.355 641 HA ASP 81 HA ASP 81 33.534 22.424 -29.843 642 1HB ASP 81 HB2 ASP 81 33.980 25.373 -29.764 643 2HB ASP 81 HB1 ASP 81 35.202 24.412 -30.598 644 H ILE 82 HN ILE 82 34.749 24.030 -26.994 645 HA ILE 82 HA ILE 82 37.527 23.235 -27.186 646 HB ILE 82 HB ILE 82 35.780 23.863 -24.775 647 1HG1 ILE 82 HG12 ILE 82 35.620 25.681 -26.390 648 2HG1 ILE 82 HG11 ILE 82 36.671 26.190 -25.071 649 1HG2 ILE 82 HG21 ILE 82 38.766 23.816 -25.230 650 2HG2 ILE 82 HG22 ILE 82 37.838 22.979 -23.985 651 3HG2 ILE 82 HG23 ILE 82 38.037 24.730 -23.909 652 1HD1 ILE 82 HD11 ILE 82 38.622 25.351 -26.532 653 2HD1 ILE 82 HD12 ILE 82 37.827 26.841 -27.040 654 3HD1 ILE 82 HD13 ILE 82 37.457 25.322 -27.856 655 H VAL 83 HN VAL 83 38.467 21.651 -25.488 656 HA VAL 83 HA VAL 83 37.425 19.019 -25.877 657 HB VAL 83 HB VAL 83 39.347 20.201 -23.842 658 1HG1 VAL 83 HG11 VAL 83 40.119 17.952 -23.413 659 2HG1 VAL 83 HG12 VAL 83 39.047 17.294 -24.649 660 3HG1 VAL 83 HG13 VAL 83 38.373 17.968 -23.166 661 1HG2 VAL 83 HG21 VAL 83 40.484 18.510 -25.899 662 2HG2 VAL 83 HG22 VAL 83 40.849 20.194 -25.526 663 3HG2 VAL 83 HG23 VAL 83 39.534 19.800 -26.634 664 H ARG 84 HN ARG 84 35.491 18.347 -25.056 665 HA ARG 84 HA ARG 84 34.803 19.059 -22.221 666 1HB ARG 84 HB2 ARG 84 32.524 19.220 -22.920 667 2HB ARG 84 HB1 ARG 84 33.446 20.052 -24.168 668 1HG ARG 84 HG2 ARG 84 32.229 18.715 -25.570 669 2HG ARG 84 HG1 ARG 84 33.470 17.527 -25.171 670 1HD ARG 84 HD2 ARG 84 32.007 16.763 -23.246 671 2HD ARG 84 HD1 ARG 84 30.733 17.813 -23.889 672 HE ARG 84 HE ARG 84 30.485 16.329 -25.726 673 1HH1 ARG 84 HH21 ARG 84 31.494 14.280 -23.641 674 2HH1 ARG 84 HH22 ARG 84 32.672 13.428 -24.582 675 1HH2 ARG 84 HH11 ARG 84 32.816 15.842 -27.079 676 2HH2 ARG 84 HH12 ARG 84 33.423 14.314 -26.533 677 H MET 85 HN MET 85 33.517 17.353 -21.104 678 HA MET 85 HA MET 85 33.481 14.635 -22.252 679 1HB MET 85 HB2 MET 85 35.785 15.484 -21.057 680 2HB MET 85 HB1 MET 85 34.924 14.825 -19.664 681 1HG MET 85 HG2 MET 85 34.463 12.787 -21.235 682 2HG MET 85 HG1 MET 85 35.818 13.422 -22.168 683 1HE MET 85 HE1 MET 85 34.322 12.239 -19.139 684 2HE MET 85 HE2 MET 85 35.569 11.872 -17.950 685 3HE MET 85 HE3 MET 85 35.261 10.746 -19.270 686 H VAL 86 HN VAL 86 32.307 13.128 -20.776 687 HA VAL 86 HA VAL 86 30.791 14.509 -18.590 688 HB VAL 86 HB VAL 86 29.531 14.421 -20.753 689 1HG1 VAL 86 HG11 VAL 86 29.805 11.430 -20.337 690 2HG1 VAL 86 HG12 VAL 86 30.425 12.368 -21.694 691 3HG1 VAL 86 HG13 VAL 86 28.686 12.175 -21.477 692 1HG2 VAL 86 HG21 VAL 86 28.478 12.719 -18.475 693 2HG2 VAL 86 HG22 VAL 86 27.482 13.342 -19.789 694 3HG2 VAL 86 HG23 VAL 86 28.269 14.459 -18.677 695 H LEU 87 HN LEU 87 30.251 13.183 -16.829 696 HA LEU 87 HA LEU 87 30.551 11.417 -15.304 697 1HB LEU 87 HB2 LEU 87 30.141 10.006 -17.958 698 2HB LEU 87 HB1 LEU 87 30.149 9.157 -16.413 699 HG LEU 87 HG LEU 87 28.365 11.549 -16.836 700 1HD1 LEU 87 HD11 LEU 87 28.003 8.735 -17.820 701 2HD1 LEU 87 HD12 LEU 87 27.564 10.253 -18.601 702 3HD1 LEU 87 HD13 LEU 87 26.598 9.641 -17.258 703 1HD2 LEU 87 HD21 LEU 87 28.297 9.097 -15.047 704 2HD2 LEU 87 HD22 LEU 87 27.015 10.307 -15.119 705 3HD2 LEU 87 HD23 LEU 87 28.622 10.758 -14.549 Start of MODEL 8 1 1H MET 1 HT1 MET 1 20.850 13.716 -29.818 2 2H MET 1 HT2 MET 1 19.757 14.292 -28.653 3 3H MET 1 HT3 MET 1 19.520 14.653 -30.295 4 HA MET 1 HA MET 1 19.023 12.381 -30.815 5 1HB MET 1 HB2 MET 1 19.271 10.662 -29.100 6 2HB MET 1 HB1 MET 1 20.781 11.559 -29.233 7 1HG MET 1 HG2 MET 1 19.990 12.998 -27.303 8 2HG MET 1 HG1 MET 1 18.643 11.877 -27.108 9 1HE MET 1 HE1 MET 1 18.797 10.300 -25.200 10 2HE MET 1 HE2 MET 1 19.868 8.916 -25.404 11 3HE MET 1 HE3 MET 1 18.831 9.422 -26.735 12 H LYS 2 HN LYS 2 17.281 10.946 -29.147 13 HA LYS 2 HA LYS 2 14.987 12.813 -28.950 14 1HB LYS 2 HB2 LYS 2 15.489 10.105 -29.666 15 2HB LYS 2 HB1 LYS 2 14.452 10.070 -28.242 16 1HG LYS 2 HG2 LYS 2 12.673 10.890 -29.370 17 2HG LYS 2 HG1 LYS 2 13.650 12.085 -30.228 18 1HD LYS 2 HD2 LYS 2 13.696 10.787 -32.064 19 2HD LYS 2 HD1 LYS 2 14.350 9.438 -31.133 20 1HE LYS 2 HE2 LYS 2 11.828 9.235 -30.290 21 2HE LYS 2 HE1 LYS 2 11.503 10.039 -31.842 22 1HZ LYS 2 HZ1 LYS 2 11.608 7.658 -32.170 23 2HZ LYS 2 HZ2 LYS 2 13.142 7.586 -31.438 24 3HZ LYS 2 HZ3 LYS 2 12.943 8.385 -32.922 25 H THR 3 HN THR 3 13.473 12.419 -27.014 26 HA THR 3 HA THR 3 15.030 11.910 -24.499 27 HB THR 3 HB THR 3 13.625 13.803 -23.545 28 HG1 THR 3 HG1 THR 3 12.172 14.624 -24.786 29 1HG2 THR 3 HG21 THR 3 15.445 15.060 -23.921 30 2HG2 THR 3 HG22 THR 3 15.019 15.243 -25.623 31 3HG2 THR 3 HG23 THR 3 15.977 13.858 -25.097 32 H LYS 4 HN LYS 4 11.686 12.337 -25.752 33 HA LYS 4 HA LYS 4 9.647 11.466 -24.891 34 1HB LYS 4 HB2 LYS 4 9.678 8.973 -25.282 35 2HB LYS 4 HB1 LYS 4 10.334 9.920 -26.613 36 1HG LYS 4 HG2 LYS 4 12.582 9.371 -26.029 37 2HG LYS 4 HG1 LYS 4 12.097 8.736 -24.457 38 1HD LYS 4 HD2 LYS 4 10.927 7.497 -26.922 39 2HD LYS 4 HD1 LYS 4 12.587 7.094 -26.482 40 1HE LYS 4 HE2 LYS 4 11.367 6.829 -24.055 41 2HE LYS 4 HE1 LYS 4 10.053 6.340 -25.141 42 1HZ LYS 4 HZ1 LYS 4 12.846 5.325 -25.283 43 2HZ LYS 4 HZ2 LYS 4 11.546 4.835 -26.264 44 3HZ LYS 4 HZ3 LYS 4 11.542 4.480 -24.603 45 H LEU 5 HN LEU 5 10.313 12.392 -22.660 46 HA LEU 5 HA LEU 5 11.311 10.642 -20.597 47 1HB LEU 5 HB2 LEU 5 9.916 13.286 -20.805 48 2HB LEU 5 HB1 LEU 5 10.024 12.522 -19.219 49 HG LEU 5 HG LEU 5 12.587 12.231 -20.321 50 1HD1 LEU 5 HD11 LEU 5 11.514 15.034 -20.779 51 2HD1 LEU 5 HD12 LEU 5 11.982 13.896 -22.044 52 3HD1 LEU 5 HD13 LEU 5 13.199 14.538 -20.942 53 1HD2 LEU 5 HD21 LEU 5 11.243 13.658 -18.127 54 2HD2 LEU 5 HD22 LEU 5 12.747 14.420 -18.641 55 3HD2 LEU 5 HD23 LEU 5 12.748 12.738 -18.113 56 H ASN 6 HN ASN 6 10.138 9.594 -18.913 57 HA ASN 6 HA ASN 6 8.418 8.228 -18.069 58 1HB ASN 6 HB2 ASN 6 7.643 10.902 -18.263 59 2HB ASN 6 HB1 ASN 6 6.272 10.016 -18.931 60 1HD2 ASN 6 HD21 ASN 6 8.348 10.273 -16.020 61 2HD2 ASN 6 HD22 ASN 6 7.226 9.556 -14.967 62 H GLU 7 HN GLU 7 9.093 7.024 -20.302 63 HA GLU 7 HA GLU 7 6.526 6.526 -21.779 64 1HB GLU 7 HB2 GLU 7 9.012 7.571 -22.702 65 2HB GLU 7 HB1 GLU 7 8.863 5.942 -23.361 66 1HG GLU 7 HG2 GLU 7 7.774 7.312 -24.955 67 2HG GLU 7 HG1 GLU 7 6.456 6.623 -24.006 68 H LEU 8 HN LEU 8 9.795 5.120 -21.304 69 HA LEU 8 HA LEU 8 8.536 2.406 -21.143 70 1HB LEU 8 HB2 LEU 8 10.851 3.579 -22.456 71 2HB LEU 8 HB1 LEU 8 11.334 2.222 -21.440 72 HG LEU 8 HG LEU 8 10.776 1.461 -23.718 73 1HD1 LEU 8 HD11 LEU 8 8.458 0.257 -22.542 74 2HD1 LEU 8 HD12 LEU 8 9.668 0.481 -21.279 75 3HD1 LEU 8 HD13 LEU 8 10.071 -0.430 -22.733 76 1HD2 LEU 8 HD21 LEU 8 8.624 3.323 -23.397 77 2HD2 LEU 8 HD22 LEU 8 7.929 1.725 -23.668 78 3HD2 LEU 8 HD23 LEU 8 9.063 2.403 -24.835 79 H LEU 9 HN LEU 9 10.845 4.613 -19.559 80 HA LEU 9 HA LEU 9 11.254 2.681 -17.335 81 1HB LEU 9 HB2 LEU 9 12.444 5.376 -18.067 82 2HB LEU 9 HB1 LEU 9 12.928 4.442 -16.652 83 HG LEU 9 HG LEU 9 13.087 2.560 -18.658 84 1HD1 LEU 9 HD11 LEU 9 12.777 4.022 -20.497 85 2HD1 LEU 9 HD12 LEU 9 14.527 3.834 -20.387 86 3HD1 LEU 9 HD13 LEU 9 13.755 5.292 -19.762 87 1HD2 LEU 9 HD21 LEU 9 15.635 3.444 -18.587 88 2HD2 LEU 9 HD22 LEU 9 14.901 2.567 -17.244 89 3HD2 LEU 9 HD23 LEU 9 14.995 4.327 -17.200 90 H GLU 10 HN GLU 10 10.400 6.158 -17.671 91 HA GLU 10 HA GLU 10 9.072 7.561 -16.318 92 1HB GLU 10 HB2 GLU 10 7.737 4.871 -15.844 93 2HB GLU 10 HB1 GLU 10 7.009 6.436 -15.483 94 1HG GLU 10 HG2 GLU 10 6.498 6.828 -17.656 95 2HG GLU 10 HG1 GLU 10 8.064 6.247 -18.219 96 H PHE 11 HN PHE 11 11.493 6.364 -15.093 97 HA PHE 11 HA PHE 11 10.623 6.322 -12.220 98 1HB PHE 11 HB2 PHE 11 11.494 4.170 -13.174 99 2HB PHE 11 HB1 PHE 11 13.014 4.988 -13.534 100 HD1 PHE 11 HD1 PHE 11 10.727 3.972 -10.781 101 HD2 PHE 11 HD2 PHE 11 14.638 5.407 -11.831 102 HE1 PHE 11 HE1 PHE 11 11.500 3.567 -8.460 103 HE2 PHE 11 HE2 PHE 11 15.410 5.000 -9.509 104 HZ PHE 11 HZ PHE 11 13.841 4.081 -7.825 105 HA PRO 12 HA PRO 12 13.114 10.070 -12.390 106 1HB PRO 12 HB2 PRO 12 12.536 10.884 -9.840 107 2HB PRO 12 HB1 PRO 12 11.434 11.131 -11.208 108 1HG PRO 12 HG2 PRO 12 11.373 9.045 -9.083 109 2HG PRO 12 HG1 PRO 12 10.037 9.941 -9.824 110 1HD PRO 12 HD2 PRO 12 10.663 7.386 -10.501 111 2HD PRO 12 HD1 PRO 12 9.924 8.538 -11.636 112 H THR 13 HN THR 13 15.266 9.498 -12.318 113 HA THR 13 HA THR 13 16.354 8.575 -9.675 114 HB THR 13 HB THR 13 16.194 6.723 -11.288 115 HG1 THR 13 HG1 THR 13 18.017 6.141 -10.479 116 1HG2 THR 13 HG21 THR 13 16.850 8.721 -13.174 117 2HG2 THR 13 HG22 THR 13 16.564 7.010 -13.486 118 3HG2 THR 13 HG23 THR 13 18.201 7.587 -13.175 119 HA PRO 14 HA PRO 14 19.064 12.026 -10.194 120 1HB PRO 14 HB2 PRO 14 20.976 11.320 -8.365 121 2HB PRO 14 HB1 PRO 14 19.383 11.952 -7.904 122 1HG PRO 14 HG2 PRO 14 20.369 9.145 -7.932 123 2HG PRO 14 HG1 PRO 14 19.306 9.958 -6.773 124 1HD PRO 14 HD2 PRO 14 18.409 8.265 -8.716 125 2HD PRO 14 HD1 PRO 14 17.432 9.580 -8.027 126 H PHE 15 HN PHE 15 20.597 12.347 -11.759 127 HA PHE 15 HA PHE 15 22.309 10.032 -12.586 128 1HB PHE 15 HB2 PHE 15 21.112 12.439 -13.946 129 2HB PHE 15 HB1 PHE 15 22.483 11.603 -14.669 130 HD1 PHE 15 HD1 PHE 15 22.230 8.931 -14.715 131 HD2 PHE 15 HD2 PHE 15 18.974 11.728 -14.528 132 HE1 PHE 15 HE1 PHE 15 20.697 7.212 -15.636 133 HE2 PHE 15 HE2 PHE 15 17.444 10.009 -15.446 134 HZ PHE 15 HZ PHE 15 18.304 7.751 -16.000 135 H THR 16 HN THR 16 24.174 10.295 -11.309 136 HA THR 16 HA THR 16 25.396 12.899 -10.805 137 HB THR 16 HB THR 16 26.656 10.139 -10.638 138 HG1 THR 16 HG1 THR 16 25.330 9.700 -9.087 139 1HG2 THR 16 HG21 THR 16 27.082 12.230 -8.579 140 2HG2 THR 16 HG22 THR 16 27.765 12.567 -10.170 141 3HG2 THR 16 HG23 THR 16 28.233 11.106 -9.300 142 H TYR 17 HN TYR 17 25.732 13.819 -12.920 143 HA TYR 17 HA TYR 17 27.481 12.282 -14.788 144 1HB TYR 17 HB2 TYR 17 25.428 14.438 -14.949 145 2HB TYR 17 HB1 TYR 17 26.708 14.469 -16.161 146 HD1 TYR 17 HD1 TYR 17 24.981 11.600 -14.453 147 HD2 TYR 17 HD2 TYR 17 25.823 13.614 -18.155 148 HE1 TYR 17 HE1 TYR 17 23.863 9.776 -15.702 149 HE2 TYR 17 HE2 TYR 17 24.704 11.787 -19.401 150 HH TYR 17 HH TYR 17 24.268 9.122 -18.757 151 H LYS 18 HN LYS 18 29.601 12.633 -14.178 152 HA LYS 18 HA LYS 18 30.542 15.219 -13.181 153 1HB LYS 18 HB2 LYS 18 31.590 12.479 -13.711 154 2HB LYS 18 HB1 LYS 18 32.774 13.786 -13.730 155 1HG LYS 18 HG2 LYS 18 32.822 13.513 -11.477 156 2HG LYS 18 HG1 LYS 18 31.299 14.403 -11.493 157 1HD LYS 18 HD2 LYS 18 30.335 12.584 -10.574 158 2HD LYS 18 HD1 LYS 18 30.580 11.768 -12.118 159 1HE LYS 18 HE2 LYS 18 33.016 11.344 -11.176 160 2HE LYS 18 HE1 LYS 18 32.220 11.590 -9.607 161 1HZ LYS 18 HZ1 LYS 18 31.997 9.296 -10.188 162 2HZ LYS 18 HZ2 LYS 18 31.421 9.681 -11.740 163 3HZ LYS 18 HZ3 LYS 18 30.473 10.021 -10.369 164 H VAL 19 HN VAL 19 30.142 16.723 -14.899 165 HA VAL 19 HA VAL 19 31.068 16.194 -17.621 166 HB VAL 19 HB VAL 19 30.223 18.789 -16.282 167 1HG1 VAL 19 HG11 VAL 19 31.361 18.745 -18.620 168 2HG1 VAL 19 HG12 VAL 19 29.846 19.630 -18.449 169 3HG1 VAL 19 HG13 VAL 19 29.852 18.022 -19.173 170 1HG2 VAL 19 HG21 VAL 19 28.028 18.177 -16.472 171 2HG2 VAL 19 HG22 VAL 19 28.679 16.540 -16.401 172 3HG2 VAL 19 HG23 VAL 19 28.305 17.273 -17.960 173 H MET 20 HN MET 20 33.310 15.827 -17.508 174 HA MET 20 HA MET 20 35.053 17.872 -16.224 175 1HB MET 20 HB2 MET 20 35.531 15.135 -17.450 176 2HB MET 20 HB1 MET 20 36.790 16.115 -16.695 177 1HG MET 20 HG2 MET 20 35.360 16.160 -14.603 178 2HG MET 20 HG1 MET 20 34.319 14.964 -15.374 179 1HE MET 20 HE1 MET 20 36.053 12.677 -12.886 180 2HE MET 20 HE2 MET 20 34.565 13.010 -13.767 181 3HE MET 20 HE3 MET 20 35.271 14.257 -12.744 182 H GLY 21 HN GLY 21 36.757 18.892 -17.442 183 1HA GLY 21 HA2 GLY 21 37.434 18.527 -20.123 184 2HA GLY 21 HA1 GLY 21 36.036 19.602 -20.154 185 H GLN 22 HN GLN 22 37.326 21.354 -20.942 186 HA GLN 22 HA GLN 22 39.661 22.296 -19.446 187 1HB GLN 22 HB2 GLN 22 38.090 22.999 -21.861 188 2HB GLN 22 HB1 GLN 22 38.913 24.348 -21.082 189 1HG GLN 22 HG2 GLN 22 40.950 22.658 -21.025 190 2HG GLN 22 HG1 GLN 22 40.081 21.903 -22.362 191 1HE2 GLN 22 HE21 GLN 22 40.456 22.812 -24.403 192 2HE2 GLN 22 HE22 GLN 22 41.106 24.357 -24.667 193 H ALA 23 HN ALA 23 39.656 24.664 -18.651 194 HA ALA 23 HA ALA 23 37.510 25.008 -16.692 195 1HB ALA 23 HB1 ALA 23 40.047 26.440 -17.476 196 2HB ALA 23 HB2 ALA 23 39.672 25.612 -15.965 197 3HB ALA 23 HB3 ALA 23 38.933 27.173 -16.323 198 H LEU 24 HN LEU 24 35.561 25.570 -17.693 199 HA LEU 24 HA LEU 24 35.564 28.103 -19.304 200 1HB LEU 24 HB2 LEU 24 35.143 25.592 -20.270 201 2HB LEU 24 HB1 LEU 24 33.497 26.034 -19.817 202 HG LEU 24 HG LEU 24 34.091 28.290 -21.057 203 1HD1 LEU 24 HD11 LEU 24 35.545 26.976 -23.101 204 2HD1 LEU 24 HD12 LEU 24 36.387 26.623 -21.592 205 3HD1 LEU 24 HD13 LEU 24 36.100 28.296 -22.073 206 1HD2 LEU 24 HD21 LEU 24 33.492 25.665 -22.459 207 2HD2 LEU 24 HD22 LEU 24 33.240 27.258 -23.172 208 3HD2 LEU 24 HD23 LEU 24 32.312 26.770 -21.754 209 HA PRO 25 HA PRO 25 32.584 29.283 -16.219 210 1HB PRO 25 HB2 PRO 25 31.715 31.582 -17.423 211 2HB PRO 25 HB1 PRO 25 33.272 31.459 -16.579 212 1HG PRO 25 HG2 PRO 25 32.688 31.382 -19.493 213 2HG PRO 25 HG1 PRO 25 34.046 32.122 -18.633 214 1HD PRO 25 HD2 PRO 25 34.200 29.733 -19.953 215 2HD PRO 25 HD1 PRO 25 35.240 30.176 -18.582 216 H GLU 26 HN GLU 26 31.839 28.716 -19.594 217 HA GLU 26 HA GLU 26 28.965 29.059 -19.447 218 1HB GLU 26 HB2 GLU 26 30.884 28.723 -21.391 219 2HB GLU 26 HB1 GLU 26 30.085 27.152 -21.404 220 1HG GLU 26 HG2 GLU 26 28.458 29.687 -21.408 221 2HG GLU 26 HG1 GLU 26 29.120 29.047 -22.912 222 H LEU 27 HN LEU 27 31.069 26.571 -18.278 223 HA LEU 27 HA LEU 27 29.541 24.211 -18.610 224 1HB LEU 27 HB2 LEU 27 31.567 25.281 -16.694 225 2HB LEU 27 HB1 LEU 27 30.698 23.824 -16.210 226 HG LEU 27 HG LEU 27 31.908 24.025 -18.960 227 1HD1 LEU 27 HD11 LEU 27 33.325 23.903 -16.398 228 2HD1 LEU 27 HD12 LEU 27 33.960 24.183 -18.018 229 3HD1 LEU 27 HD13 LEU 27 33.698 22.536 -17.447 230 1HD2 LEU 27 HD21 LEU 27 32.150 21.472 -18.272 231 2HD2 LEU 27 HD22 LEU 27 30.603 22.104 -18.837 232 3HD2 LEU 27 HD23 LEU 27 30.892 21.893 -17.110 233 H VAL 28 HN VAL 28 29.605 26.190 -15.602 234 HA VAL 28 HA VAL 28 27.295 24.996 -14.424 235 HB VAL 28 HB VAL 28 29.108 26.379 -13.340 236 1HG1 VAL 28 HG11 VAL 28 27.494 28.736 -14.351 237 2HG1 VAL 28 HG12 VAL 28 29.013 28.213 -15.077 238 3HG1 VAL 28 HG13 VAL 28 28.985 28.786 -13.410 239 1HG2 VAL 28 HG21 VAL 28 27.615 27.386 -11.685 240 2HG2 VAL 28 HG22 VAL 28 26.956 25.835 -12.204 241 3HG2 VAL 28 HG23 VAL 28 26.274 27.336 -12.829 242 H ASP 29 HN ASP 29 27.588 27.681 -16.721 243 HA ASP 29 HA ASP 29 24.955 28.778 -16.427 244 1HB ASP 29 HB2 ASP 29 26.943 29.791 -17.581 245 2HB ASP 29 HB1 ASP 29 26.732 28.625 -18.887 246 H GLN 30 HN GLN 30 26.147 26.663 -19.088 247 HA GLN 30 HA GLN 30 23.533 26.010 -20.082 248 1HB GLN 30 HB2 GLN 30 26.083 25.745 -20.940 249 2HB GLN 30 HB1 GLN 30 25.782 24.092 -20.408 250 1HG GLN 30 HG2 GLN 30 25.135 24.241 -22.732 251 2HG GLN 30 HG1 GLN 30 23.660 24.124 -21.774 252 1HE2 GLN 30 HE21 GLN 30 22.199 25.914 -21.823 253 2HE2 GLN 30 HE22 GLN 30 22.477 27.313 -22.745 254 H VAL 31 HN VAL 31 25.571 24.487 -17.604 255 HA VAL 31 HA VAL 31 24.218 21.994 -17.376 256 HB VAL 31 HB VAL 31 25.896 23.766 -15.641 257 1HG1 VAL 31 HG11 VAL 31 24.685 23.105 -13.809 258 2HG1 VAL 31 HG12 VAL 31 25.643 21.635 -13.995 259 3HG1 VAL 31 HG13 VAL 31 24.002 21.705 -14.635 260 1HG2 VAL 31 HG21 VAL 31 27.195 22.350 -16.966 261 2HG2 VAL 31 HG22 VAL 31 26.026 21.034 -16.883 262 3HG2 VAL 31 HG23 VAL 31 27.048 21.394 -15.493 263 H VAL 32 HN VAL 32 23.688 24.953 -15.381 264 HA VAL 32 HA VAL 32 21.324 23.909 -14.109 265 HB VAL 32 HB VAL 32 22.918 25.723 -13.321 266 1HG1 VAL 32 HG11 VAL 32 22.033 26.972 -15.733 267 2HG1 VAL 32 HG12 VAL 32 23.190 27.579 -14.554 268 3HG1 VAL 32 HG13 VAL 32 21.477 27.954 -14.381 269 1HG2 VAL 32 HG21 VAL 32 20.057 25.500 -13.032 270 2HG2 VAL 32 HG22 VAL 32 20.536 27.191 -12.892 271 3HG2 VAL 32 HG23 VAL 32 21.255 25.980 -11.831 272 H GLU 33 HN GLU 33 21.790 25.702 -17.129 273 HA GLU 33 HA GLU 33 18.992 26.474 -17.422 274 1HB GLU 33 HB2 GLU 33 21.541 26.587 -18.935 275 2HB GLU 33 HB1 GLU 33 20.080 26.576 -19.921 276 1HG GLU 33 HG2 GLU 33 19.478 28.665 -19.269 277 2HG GLU 33 HG1 GLU 33 19.924 28.368 -17.589 278 H VAL 34 HN VAL 34 21.016 24.065 -19.160 279 HA VAL 34 HA VAL 34 18.808 22.847 -20.541 280 HB VAL 34 HB VAL 34 21.311 22.846 -21.067 281 1HG1 VAL 34 HG11 VAL 34 22.777 21.447 -19.957 282 2HG1 VAL 34 HG12 VAL 34 21.504 20.342 -19.441 283 3HG1 VAL 34 HG13 VAL 34 21.714 21.889 -18.621 284 1HG2 VAL 34 HG21 VAL 34 20.202 21.489 -22.549 285 2HG2 VAL 34 HG22 VAL 34 19.425 20.550 -21.277 286 3HG2 VAL 34 HG23 VAL 34 21.108 20.240 -21.697 287 H VAL 35 HN VAL 35 20.142 22.305 -17.309 288 HA VAL 35 HA VAL 35 18.812 19.706 -16.998 289 HB VAL 35 HB VAL 35 21.009 20.598 -15.932 290 1HG1 VAL 35 HG11 VAL 35 19.047 21.598 -13.857 291 2HG1 VAL 35 HG12 VAL 35 19.821 22.663 -15.031 292 3HG1 VAL 35 HG13 VAL 35 20.801 21.779 -13.862 293 1HG2 VAL 35 HG21 VAL 35 18.879 19.193 -14.293 294 2HG2 VAL 35 HG22 VAL 35 20.599 19.205 -13.905 295 3HG2 VAL 35 HG23 VAL 35 20.033 18.428 -15.383 296 H GLN 36 HN GLN 36 18.145 23.087 -16.048 297 HA GLN 36 HA GLN 36 15.844 22.353 -14.398 298 1HB GLN 36 HB2 GLN 36 15.642 24.697 -14.080 299 2HB GLN 36 HB1 GLN 36 17.372 24.435 -14.279 300 1HG GLN 36 HG2 GLN 36 17.229 25.098 -16.634 301 2HG GLN 36 HG1 GLN 36 15.482 25.292 -16.495 302 1HE2 GLN 36 HE21 GLN 36 14.717 27.019 -14.927 303 2HE2 GLN 36 HE22 GLN 36 15.716 28.365 -14.652 304 H ARG 37 HN ARG 37 16.375 23.066 -17.804 305 HA ARG 37 HA ARG 37 13.582 23.608 -18.451 306 1HB ARG 37 HB2 ARG 37 16.188 23.193 -19.849 307 2HB ARG 37 HB1 ARG 37 14.722 22.951 -20.801 308 1HG ARG 37 HG2 ARG 37 13.917 25.191 -20.110 309 2HG ARG 37 HG1 ARG 37 15.410 25.437 -19.207 310 1HD ARG 37 HD2 ARG 37 15.665 24.653 -22.086 311 2HD ARG 37 HD1 ARG 37 15.174 26.319 -21.720 312 HE ARG 37 HE ARG 37 17.719 25.046 -20.830 313 1HH1 ARG 37 HH21 ARG 37 16.727 26.982 -18.797 314 2HH1 ARG 37 HH22 ARG 37 17.424 28.476 -19.329 315 1HH2 ARG 37 HH11 ARG 37 18.152 27.302 -22.519 316 2HH2 ARG 37 HH12 ARG 37 18.237 28.656 -21.443 317 H HIS 38 HN HIS 38 15.701 20.728 -18.619 318 HA HIS 38 HA HIS 38 13.499 19.065 -19.698 319 1HB HIS 38 HB2 HIS 38 16.398 19.038 -19.519 320 2HB HIS 38 HB1 HIS 38 15.727 17.495 -18.994 321 HD1 HIS 38 HD1 HIS 38 13.460 16.944 -20.803 322 HD2 HIS 38 HD2 HIS 38 16.917 18.804 -22.205 323 HE1 HIS 38 HE1 HIS 38 13.503 16.579 -23.308 324 H ALA 39 HN ALA 39 15.524 19.197 -16.742 325 HA ALA 39 HA ALA 39 13.715 17.234 -15.417 326 1HB ALA 39 HB1 ALA 39 16.494 17.801 -15.429 327 2HB ALA 39 HB2 ALA 39 15.659 16.588 -14.460 328 3HB ALA 39 HB3 ALA 39 15.916 18.208 -13.814 329 HA PRO 40 HA PRO 40 11.689 20.414 -13.132 330 1HB PRO 40 HB2 PRO 40 10.988 19.021 -10.883 331 2HB PRO 40 HB1 PRO 40 10.175 18.809 -12.447 332 1HG PRO 40 HG2 PRO 40 12.262 17.126 -11.157 333 2HG PRO 40 HG1 PRO 40 10.840 16.646 -12.093 334 1HD PRO 40 HD2 PRO 40 13.362 16.677 -13.119 335 2HD PRO 40 HD1 PRO 40 11.903 16.920 -14.103 336 H GLY 41 HN GLY 41 12.303 21.976 -11.640 337 1HA GLY 41 HA2 GLY 41 13.465 22.951 -9.817 338 2HA GLY 41 HA1 GLY 41 14.135 21.364 -9.436 339 H ASP 42 HN ASP 42 15.781 23.623 -9.400 340 HA ASP 42 HA ASP 42 17.312 23.558 -11.962 341 1HB ASP 42 HB2 ASP 42 16.928 25.403 -9.657 342 2HB ASP 42 HB1 ASP 42 18.527 25.415 -10.400 343 H TYR 43 HN TYR 43 19.383 22.689 -12.051 344 HA TYR 43 HA TYR 43 20.456 21.471 -9.522 345 1HB TYR 43 HB2 TYR 43 20.518 20.569 -12.416 346 2HB TYR 43 HB1 TYR 43 21.418 19.773 -11.127 347 HD1 TYR 43 HD1 TYR 43 18.179 20.198 -12.702 348 HD2 TYR 43 HD2 TYR 43 20.164 18.794 -9.160 349 HE1 TYR 43 HE1 TYR 43 16.149 18.928 -12.067 350 HE2 TYR 43 HE2 TYR 43 18.131 17.524 -8.526 351 HH TYR 43 HH TYR 43 15.289 18.036 -9.433 352 H THR 44 HN THR 44 22.919 21.107 -9.691 353 HA THR 44 HA THR 44 24.285 23.226 -11.299 354 HB THR 44 HB THR 44 25.087 22.897 -8.441 355 HG1 THR 44 HG1 THR 44 23.291 23.623 -7.639 356 1HG2 THR 44 HG21 THR 44 25.503 25.258 -8.603 357 2HG2 THR 44 HG22 THR 44 24.569 25.379 -10.094 358 3HG2 THR 44 HG23 THR 44 26.108 24.522 -10.083 359 HA PRO 45 HA PRO 45 27.420 20.052 -11.398 360 1HB PRO 45 HB2 PRO 45 29.258 21.471 -12.834 361 2HB PRO 45 HB1 PRO 45 27.761 20.849 -13.549 362 1HG PRO 45 HG2 PRO 45 28.520 23.594 -12.977 363 2HG PRO 45 HG1 PRO 45 27.189 22.982 -13.964 364 1HD PRO 45 HD2 PRO 45 27.137 23.964 -11.227 365 2HD PRO 45 HD1 PRO 45 25.776 23.597 -12.310 366 H THR 46 HN THR 46 28.756 19.561 -9.639 367 HA THR 46 HA THR 46 29.996 21.658 -8.012 368 HB THR 46 HB THR 46 30.298 18.632 -7.980 369 HG1 THR 46 HG1 THR 46 28.366 18.627 -7.202 370 1HG2 THR 46 HG21 THR 46 31.690 18.966 -6.250 371 2HG2 THR 46 HG22 THR 46 30.422 19.851 -5.402 372 3HG2 THR 46 HG23 THR 46 31.540 20.711 -6.461 373 H VAL 47 HN VAL 47 31.597 22.702 -9.273 374 HA VAL 47 HA VAL 47 33.513 21.239 -10.908 375 HB VAL 47 HB VAL 47 32.676 23.559 -11.323 376 1HG1 VAL 47 HG11 VAL 47 32.887 24.124 -8.783 377 2HG1 VAL 47 HG12 VAL 47 33.257 25.382 -9.962 378 3HG1 VAL 47 HG13 VAL 47 34.566 24.500 -9.174 379 1HG2 VAL 47 HG21 VAL 47 34.759 24.404 -12.136 380 2HG2 VAL 47 HG22 VAL 47 34.912 22.648 -12.177 381 3HG2 VAL 47 HG23 VAL 47 35.671 23.568 -10.878 382 H LYS 48 HN LYS 48 35.587 20.618 -10.409 383 HA LYS 48 HA LYS 48 36.787 21.452 -7.812 384 1HB LYS 48 HB2 LYS 48 37.148 19.162 -7.154 385 2HB LYS 48 HB1 LYS 48 35.452 19.291 -7.613 386 1HG LYS 48 HG2 LYS 48 36.429 18.614 -10.005 387 2HG LYS 48 HG1 LYS 48 37.697 17.897 -9.012 388 1HD LYS 48 HD2 LYS 48 36.119 16.531 -7.825 389 2HD LYS 48 HD1 LYS 48 34.752 17.401 -8.523 390 1HE LYS 48 HE2 LYS 48 36.240 16.509 -10.740 391 2HE LYS 48 HE1 LYS 48 36.203 15.138 -9.616 392 1HZ LYS 48 HZ1 LYS 48 34.206 15.181 -10.983 393 2HZ LYS 48 HZ2 LYS 48 33.852 16.757 -10.457 394 3HZ LYS 48 HZ3 LYS 48 33.816 15.460 -9.357 395 HA PRO 49 HA PRO 49 40.393 21.587 -10.342 396 1HB PRO 49 HB2 PRO 49 42.330 21.487 -8.414 397 2HB PRO 49 HB1 PRO 49 41.322 22.920 -8.697 398 1HG PRO 49 HG2 PRO 49 41.149 20.880 -6.558 399 2HG PRO 49 HG1 PRO 49 40.777 22.608 -6.508 400 1HD PRO 49 HD2 PRO 49 38.905 20.572 -6.684 401 2HD PRO 49 HD1 PRO 49 38.617 22.272 -7.111 402 H SER 50 HN SER 50 39.913 19.371 -11.219 403 HA SER 50 HA SER 50 41.291 17.091 -9.921 404 1HB SER 50 HB2 SER 50 39.111 17.551 -11.749 405 2HB SER 50 HB1 SER 50 40.262 16.447 -12.494 406 HG SER 50 HG SER 50 38.615 15.480 -11.098 407 H SER 51 HN SER 51 41.449 18.891 -13.020 408 HA SER 51 HA SER 51 44.092 17.614 -13.586 409 1HB SER 51 HB2 SER 51 41.789 18.231 -15.092 410 2HB SER 51 HB1 SER 51 43.016 19.371 -15.632 411 HG SER 51 HG SER 51 43.215 17.481 -16.810 412 H LYS 52 HN LYS 52 45.770 19.128 -14.534 413 HA LYS 52 HA LYS 52 45.833 21.677 -12.978 414 1HB LYS 52 HB2 LYS 52 47.716 19.607 -13.854 415 2HB LYS 52 HB1 LYS 52 48.314 21.239 -14.157 416 1HG LYS 52 HG2 LYS 52 49.021 20.932 -11.967 417 2HG LYS 52 HG1 LYS 52 47.443 21.673 -11.697 418 1HD LYS 52 HD2 LYS 52 46.802 18.998 -11.931 419 2HD LYS 52 HD1 LYS 52 48.353 18.942 -11.094 420 1HE LYS 52 HE2 LYS 52 47.362 19.594 -9.166 421 2HE LYS 52 HE1 LYS 52 46.732 21.051 -9.957 422 1HZ LYS 52 HZ1 LYS 52 44.931 19.749 -10.886 423 2HZ LYS 52 HZ2 LYS 52 44.936 19.594 -9.195 424 3HZ LYS 52 HZ3 LYS 52 45.534 18.336 -10.166 425 H GLY 53 HN GLY 53 46.682 23.617 -14.074 426 1HA GLY 53 HA2 GLY 53 47.102 24.992 -15.977 427 2HA GLY 53 HA1 GLY 53 46.690 23.632 -17.023 428 H ASN 54 HN ASN 54 45.052 24.451 -18.282 429 HA ASN 54 HA ASN 54 42.837 25.963 -16.976 430 1HB ASN 54 HB2 ASN 54 44.205 26.595 -19.127 431 2HB ASN 54 HB1 ASN 54 43.155 25.425 -19.926 432 1HD2 ASN 54 HD21 ASN 54 40.964 26.042 -20.330 433 2HD2 ASN 54 HD22 ASN 54 40.334 27.557 -19.897 434 H TYR 55 HN TYR 55 42.425 23.590 -16.028 435 HA TYR 55 HA TYR 55 40.346 22.331 -17.773 436 1HB TYR 55 HB2 TYR 55 42.807 21.159 -16.525 437 2HB TYR 55 HB1 TYR 55 41.367 20.148 -16.635 438 HD1 TYR 55 HD1 TYR 55 43.954 21.948 -18.539 439 HD2 TYR 55 HD2 TYR 55 40.445 19.485 -18.803 440 HE1 TYR 55 HE1 TYR 55 44.427 21.532 -20.937 441 HE2 TYR 55 HE2 TYR 55 40.917 19.068 -21.201 442 HH TYR 55 HH TYR 55 42.551 20.741 -23.070 443 H HIS 56 HN HIS 56 38.511 21.722 -16.632 444 HA HIS 56 HA HIS 56 38.625 21.730 -13.638 445 1HB HIS 56 HB2 HIS 56 37.293 23.569 -15.492 446 2HB HIS 56 HB1 HIS 56 36.177 22.867 -14.321 447 HD1 HIS 56 HD1 HIS 56 37.356 25.892 -14.373 448 HD2 HIS 56 HD2 HIS 56 38.500 22.804 -11.817 449 HE1 HIS 56 HE1 HIS 56 38.357 26.991 -12.323 450 H SER 57 HN SER 57 37.262 20.203 -12.686 451 HA SER 57 HA SER 57 35.637 18.501 -14.557 452 1HB SER 57 HB2 SER 57 37.322 17.932 -12.115 453 2HB SER 57 HB1 SER 57 36.113 16.779 -12.674 454 HG SER 57 HG SER 57 38.495 17.634 -13.876 455 H VAL 58 HN VAL 58 33.520 19.194 -14.252 456 HA VAL 58 HA VAL 58 32.626 19.762 -11.454 457 HB VAL 58 HB VAL 58 30.982 21.186 -12.441 458 1HG1 VAL 58 HG11 VAL 58 33.689 21.555 -12.940 459 2HG1 VAL 58 HG12 VAL 58 32.432 22.778 -13.112 460 3HG1 VAL 58 HG13 VAL 58 32.941 21.835 -14.511 461 1HG2 VAL 58 HG21 VAL 58 31.114 21.134 -15.161 462 2HG2 VAL 58 HG22 VAL 58 29.934 20.216 -14.227 463 3HG2 VAL 58 HG23 VAL 58 31.407 19.435 -14.795 464 H SER 59 HN SER 59 30.693 18.783 -10.669 465 HA SER 59 HA SER 59 29.758 16.385 -12.215 466 1HB SER 59 HB2 SER 59 31.023 16.109 -10.006 467 2HB SER 59 HB1 SER 59 29.642 16.871 -9.223 468 HG SER 59 HG SER 59 29.290 14.684 -9.184 469 H ILE 60 HN ILE 60 27.818 16.981 -13.163 470 HA ILE 60 HA ILE 60 26.056 18.918 -11.782 471 HB ILE 60 HB ILE 60 26.526 19.200 -14.160 472 1HG1 ILE 60 HG12 ILE 60 23.694 18.235 -13.638 473 2HG1 ILE 60 HG11 ILE 60 24.298 19.871 -13.385 474 1HG2 ILE 60 HG21 ILE 60 25.782 16.312 -14.242 475 2HG2 ILE 60 HG22 ILE 60 27.001 17.185 -15.165 476 3HG2 ILE 60 HG23 ILE 60 25.303 17.299 -15.621 477 1HD1 ILE 60 HD11 ILE 60 24.293 18.465 -16.072 478 2HD1 ILE 60 HD12 ILE 60 24.699 20.152 -15.763 479 3HD1 ILE 60 HD13 ILE 60 23.042 19.589 -15.543 480 H THR 61 HN THR 61 24.268 18.374 -10.674 481 HA THR 61 HA THR 61 23.500 15.517 -10.431 482 HB THR 61 HB THR 61 22.427 18.075 -9.177 483 HG1 THR 61 HG1 THR 61 24.270 16.130 -8.241 484 1HG2 THR 61 HG21 THR 61 21.156 16.763 -7.730 485 2HG2 THR 61 HG22 THR 61 22.146 15.328 -7.998 486 3HG2 THR 61 HG23 THR 61 21.010 15.861 -9.237 487 H ILE 62 HN ILE 62 21.776 14.637 -11.605 488 HA ILE 62 HA ILE 62 19.767 16.532 -12.764 489 HB ILE 62 HB ILE 62 21.304 14.359 -14.232 490 1HG1 ILE 62 HG12 ILE 62 21.355 17.388 -14.475 491 2HG1 ILE 62 HG11 ILE 62 22.640 16.391 -13.801 492 1HG2 ILE 62 HG21 ILE 62 19.030 14.515 -15.084 493 2HG2 ILE 62 HG22 ILE 62 20.113 15.293 -16.237 494 3HG2 ILE 62 HG23 ILE 62 19.135 16.275 -15.146 495 1HD1 ILE 62 HD11 ILE 62 22.025 16.970 -16.591 496 2HD1 ILE 62 HD12 ILE 62 22.143 15.238 -16.286 497 3HD1 ILE 62 HD13 ILE 62 23.493 16.298 -15.886 498 H ASN 63 HN ASN 63 18.054 15.762 -11.468 499 HA ASN 63 HA ASN 63 17.548 12.866 -11.206 500 1HB ASN 63 HB2 ASN 63 17.141 14.668 -9.440 501 2HB ASN 63 HB1 ASN 63 15.794 15.220 -10.436 502 1HD2 ASN 63 HD21 ASN 63 13.975 13.667 -10.775 503 2HD2 ASN 63 HD22 ASN 63 13.724 12.407 -9.667 504 H ALA 64 HN ALA 64 17.036 12.097 -13.294 505 HA ALA 64 HA ALA 64 14.698 13.395 -14.660 506 1HB ALA 64 HB1 ALA 64 16.403 13.635 -16.183 507 2HB ALA 64 HB2 ALA 64 15.943 11.986 -16.603 508 3HB ALA 64 HB3 ALA 64 17.314 12.274 -15.532 509 H THR 65 HN THR 65 12.961 12.095 -15.180 510 HA THR 65 HA THR 65 12.739 9.444 -14.000 511 HB THR 65 HB THR 65 10.492 9.552 -15.157 512 HG1 THR 65 HG1 THR 65 10.524 10.805 -16.838 513 1HG2 THR 65 HG21 THR 65 11.557 11.251 -13.090 514 2HG2 THR 65 HG22 THR 65 9.936 10.570 -13.234 515 3HG2 THR 65 HG23 THR 65 10.312 12.121 -13.984 516 H HIS 66 HN HIS 66 14.052 10.569 -16.943 517 HA HIS 66 HA HIS 66 13.846 7.830 -18.144 518 1HB HIS 66 HB2 HIS 66 12.518 9.974 -19.063 519 2HB HIS 66 HB1 HIS 66 14.065 10.274 -19.853 520 HD1 HIS 66 HD1 HIS 66 11.507 7.469 -19.493 521 HD2 HIS 66 HD2 HIS 66 14.463 8.754 -22.133 522 HE1 HIS 66 HE1 HIS 66 11.377 5.951 -21.516 523 H ILE 67 HN ILE 67 15.712 7.245 -19.473 524 HA ILE 67 HA ILE 67 18.240 8.332 -18.446 525 HB ILE 67 HB ILE 67 17.698 5.899 -18.849 526 1HG1 ILE 67 HG12 ILE 67 19.960 5.802 -20.460 527 2HG1 ILE 67 HG11 ILE 67 20.101 7.372 -19.670 528 1HG2 ILE 67 HG21 ILE 67 17.670 5.028 -21.082 529 2HG2 ILE 67 HG22 ILE 67 18.142 6.584 -21.766 530 3HG2 ILE 67 HG23 ILE 67 16.537 6.379 -21.062 531 1HD1 ILE 67 HD11 ILE 67 20.961 6.221 -17.920 532 2HD1 ILE 67 HD12 ILE 67 20.358 4.680 -18.529 533 3HD1 ILE 67 HD13 ILE 67 19.297 5.736 -17.595 534 H GLU 68 HN GLU 68 16.288 8.758 -21.330 535 HA GLU 68 HA GLU 68 18.450 9.748 -23.023 536 1HB GLU 68 HB2 GLU 68 15.429 9.767 -23.122 537 2HB GLU 68 HB1 GLU 68 16.409 10.504 -24.387 538 1HG GLU 68 HG2 GLU 68 17.576 8.340 -24.724 539 2HG GLU 68 HG1 GLU 68 16.542 7.607 -23.497 540 H GLN 69 HN GLN 69 16.133 11.217 -20.773 541 HA GLN 69 HA GLN 69 16.361 13.940 -21.611 542 1HB GLN 69 HB2 GLN 69 14.728 12.861 -19.980 543 2HB GLN 69 HB1 GLN 69 16.022 12.906 -18.781 544 1HG GLN 69 HG2 GLN 69 15.829 15.482 -20.051 545 2HG GLN 69 HG1 GLN 69 14.235 15.002 -19.474 546 1HE2 GLN 69 HE21 GLN 69 13.861 15.082 -17.212 547 2HE2 GLN 69 HE22 GLN 69 15.061 15.452 -16.073 548 H VAL 70 HN VAL 70 18.270 12.076 -19.210 549 HA VAL 70 HA VAL 70 20.005 14.306 -18.548 550 HB VAL 70 HB VAL 70 19.479 12.267 -17.143 551 1HG1 VAL 70 HG11 VAL 70 20.901 10.252 -17.574 552 2HG1 VAL 70 HG12 VAL 70 21.378 10.961 -19.116 553 3HG1 VAL 70 HG13 VAL 70 19.694 10.527 -18.828 554 1HG2 VAL 70 HG21 VAL 70 22.431 12.264 -17.383 555 2HG2 VAL 70 HG22 VAL 70 21.414 12.598 -15.984 556 3HG2 VAL 70 HG23 VAL 70 21.687 13.849 -17.193 557 H GLU 71 HN GLU 71 20.072 11.773 -21.015 558 HA GLU 71 HA GLU 71 22.840 12.020 -21.784 559 1HB GLU 71 HB2 GLU 71 20.392 10.713 -22.644 560 2HB GLU 71 HB1 GLU 71 21.265 11.350 -24.036 561 1HG GLU 71 HG2 GLU 71 22.514 9.464 -23.896 562 2HG GLU 71 HG1 GLU 71 23.295 10.250 -22.524 563 H THR 72 HN THR 72 19.843 13.534 -23.047 564 HA THR 72 HA THR 72 21.141 15.196 -25.008 565 HB THR 72 HB THR 72 18.927 16.474 -24.786 566 HG1 THR 72 HG1 THR 72 17.763 16.048 -23.115 567 1HG2 THR 72 HG21 THR 72 17.628 14.652 -25.771 568 2HG2 THR 72 HG22 THR 72 18.768 13.468 -25.130 569 3HG2 THR 72 HG23 THR 72 19.284 14.605 -26.377 570 H LEU 73 HN LEU 73 20.371 15.631 -21.566 571 HA LEU 73 HA LEU 73 20.955 18.426 -21.349 572 1HB LEU 73 HB2 LEU 73 20.609 16.059 -19.629 573 2HB LEU 73 HB1 LEU 73 21.681 17.275 -18.938 574 HG LEU 73 HG LEU 73 19.987 18.988 -19.150 575 1HD1 LEU 73 HD11 LEU 73 17.658 17.638 -19.934 576 2HD1 LEU 73 HD12 LEU 73 18.883 17.115 -21.084 577 3HD1 LEU 73 HD13 LEU 73 18.544 18.832 -20.879 578 1HD2 LEU 73 HD21 LEU 73 18.992 16.373 -17.998 579 2HD2 LEU 73 HD22 LEU 73 18.100 17.884 -17.813 580 3HD2 LEU 73 HD23 LEU 73 19.724 17.729 -17.139 581 H TYR 74 HN TYR 74 23.044 15.541 -21.219 582 HA TYR 74 HA TYR 74 25.461 16.910 -20.436 583 1HB TYR 74 HB2 TYR 74 25.572 14.616 -20.116 584 2HB TYR 74 HB1 TYR 74 24.638 14.265 -21.568 585 HD1 TYR 74 HD1 TYR 74 25.875 13.001 -23.081 586 HD2 TYR 74 HD2 TYR 74 27.831 16.155 -20.915 587 HE1 TYR 74 HE1 TYR 74 27.970 12.564 -24.333 588 HE2 TYR 74 HE2 TYR 74 29.925 15.715 -22.168 589 HH TYR 74 HH TYR 74 30.795 13.280 -23.499 590 H GLU 75 HN GLU 75 24.330 15.753 -23.660 591 HA GLU 75 HA GLU 75 26.481 16.925 -25.150 592 1HB GLU 75 HB2 GLU 75 25.013 16.492 -27.076 593 2HB GLU 75 HB1 GLU 75 24.943 15.142 -25.945 594 1HG GLU 75 HG2 GLU 75 22.839 15.939 -25.039 595 2HG GLU 75 HG1 GLU 75 22.933 17.411 -26.003 596 H GLU 76 HN GLU 76 23.473 18.311 -23.914 597 HA GLU 76 HA GLU 76 23.479 20.690 -25.572 598 1HB GLU 76 HB2 GLU 76 21.994 19.511 -23.357 599 2HB GLU 76 HB1 GLU 76 22.176 21.253 -23.164 600 1HG GLU 76 HG2 GLU 76 20.422 21.437 -24.582 601 2HG GLU 76 HG1 GLU 76 21.566 21.004 -25.852 602 H LEU 77 HN LEU 77 24.558 20.051 -22.205 603 HA LEU 77 HA LEU 77 25.688 22.726 -21.897 604 1HB LEU 77 HB2 LEU 77 25.824 22.090 -19.703 605 2HB LEU 77 HB1 LEU 77 24.799 20.759 -20.223 606 HG LEU 77 HG LEU 77 27.148 19.644 -20.820 607 1HD1 LEU 77 HD11 LEU 77 27.975 22.042 -19.649 608 2HD1 LEU 77 HD12 LEU 77 28.977 20.618 -19.923 609 3HD1 LEU 77 HD13 LEU 77 28.176 20.846 -18.368 610 1HD2 LEU 77 HD21 LEU 77 27.187 18.894 -18.305 611 2HD2 LEU 77 HD22 LEU 77 25.798 18.482 -19.309 612 3HD2 LEU 77 HD23 LEU 77 25.706 19.842 -18.191 613 H GLY 78 HN GLY 78 26.883 19.585 -22.953 614 1HA GLY 78 HA2 GLY 78 29.667 20.641 -23.018 615 2HA GLY 78 HA1 GLY 78 29.227 18.938 -23.130 616 H LYS 79 HN LYS 79 27.930 21.748 -24.906 617 HA LYS 79 HA LYS 79 28.490 20.301 -27.461 618 1HB LYS 79 HB2 LYS 79 26.227 21.446 -26.449 619 2HB LYS 79 HB1 LYS 79 26.867 22.781 -27.408 620 1HG LYS 79 HG2 LYS 79 26.794 21.539 -29.411 621 2HG LYS 79 HG1 LYS 79 26.689 19.999 -28.556 622 1HD LYS 79 HD2 LYS 79 24.457 21.251 -27.611 623 2HD LYS 79 HD1 LYS 79 24.549 21.928 -29.237 624 1HE LYS 79 HE2 LYS 79 23.890 19.970 -30.178 625 2HE LYS 79 HE1 LYS 79 25.067 19.044 -29.225 626 1HZ LYS 79 HZ1 LYS 79 22.495 20.122 -28.190 627 2HZ LYS 79 HZ2 LYS 79 23.622 19.206 -27.307 628 3HZ LYS 79 HZ3 LYS 79 22.776 18.501 -28.600 629 H ILE 80 HN ILE 80 30.045 22.546 -25.593 630 HA ILE 80 HA ILE 80 30.660 24.618 -27.533 631 HB ILE 80 HB ILE 80 32.273 23.790 -25.104 632 1HG1 ILE 80 HG12 ILE 80 30.497 25.873 -24.402 633 2HG1 ILE 80 HG11 ILE 80 29.510 24.664 -25.223 634 1HG2 ILE 80 HG21 ILE 80 31.961 26.263 -26.772 635 2HG2 ILE 80 HG22 ILE 80 33.429 25.524 -26.134 636 3HG2 ILE 80 HG23 ILE 80 32.364 26.431 -25.063 637 1HD1 ILE 80 HD11 ILE 80 29.897 24.399 -22.665 638 2HD1 ILE 80 HD12 ILE 80 31.507 23.844 -23.124 639 3HD1 ILE 80 HD13 ILE 80 30.080 22.974 -23.689 640 H ASP 81 HN ASP 81 32.730 24.892 -28.620 641 HA ASP 81 HA ASP 81 33.811 22.511 -29.825 642 1HB ASP 81 HB2 ASP 81 33.753 25.147 -30.414 643 2HB ASP 81 HB1 ASP 81 35.387 25.044 -29.756 644 H ILE 82 HN ILE 82 34.573 24.177 -26.862 645 HA ILE 82 HA ILE 82 37.325 23.334 -26.560 646 HB ILE 82 HB ILE 82 35.189 24.075 -24.521 647 1HG1 ILE 82 HG12 ILE 82 35.456 25.825 -26.228 648 2HG1 ILE 82 HG11 ILE 82 36.152 26.360 -24.703 649 1HG2 ILE 82 HG21 ILE 82 37.009 23.150 -23.318 650 2HG2 ILE 82 HG22 ILE 82 37.282 24.891 -23.265 651 3HG2 ILE 82 HG23 ILE 82 38.201 23.889 -24.389 652 1HD1 ILE 82 HD11 ILE 82 38.174 24.962 -26.187 653 2HD1 ILE 82 HD12 ILE 82 38.149 26.654 -25.691 654 3HD1 ILE 82 HD13 ILE 82 37.439 26.176 -27.234 655 H VAL 83 HN VAL 83 37.948 21.773 -24.712 656 HA VAL 83 HA VAL 83 36.912 19.154 -25.201 657 HB VAL 83 HB VAL 83 38.524 20.326 -22.907 658 1HG1 VAL 83 HG11 VAL 83 39.308 17.860 -22.763 659 2HG1 VAL 83 HG12 VAL 83 37.833 17.484 -23.655 660 3HG1 VAL 83 HG13 VAL 83 37.734 18.260 -22.074 661 1HG2 VAL 83 HG21 VAL 83 40.100 20.484 -24.525 662 2HG2 VAL 83 HG22 VAL 83 39.108 19.589 -25.676 663 3HG2 VAL 83 HG23 VAL 83 40.133 18.720 -24.533 664 H ARG 84 HN ARG 84 34.756 18.785 -24.779 665 HA ARG 84 HA ARG 84 33.727 19.387 -22.018 666 1HB ARG 84 HB2 ARG 84 32.776 19.973 -24.713 667 2HB ARG 84 HB1 ARG 84 31.572 19.073 -23.791 668 1HG ARG 84 HG2 ARG 84 31.185 21.403 -23.354 669 2HG ARG 84 HG1 ARG 84 31.924 20.727 -21.903 670 1HD ARG 84 HD2 ARG 84 34.165 21.484 -23.226 671 2HD ARG 84 HD1 ARG 84 33.026 22.696 -23.841 672 HE ARG 84 HE ARG 84 32.457 23.189 -21.436 673 1HH1 ARG 84 HH11 ARG 84 35.244 24.125 -21.924 674 2HH1 ARG 84 HH12 ARG 84 36.112 23.412 -20.607 675 1HH2 ARG 84 HH21 ARG 84 33.613 21.115 -19.859 676 2HH2 ARG 84 HH22 ARG 84 35.185 21.702 -19.433 677 H MET 85 HN MET 85 33.685 17.419 -20.939 678 HA MET 85 HA MET 85 32.518 15.053 -22.374 679 1HB MET 85 HB2 MET 85 35.145 15.450 -21.019 680 2HB MET 85 HB1 MET 85 34.351 13.897 -20.763 681 1HG MET 85 HG2 MET 85 34.799 13.215 -22.868 682 2HG MET 85 HG1 MET 85 34.246 14.740 -23.559 683 1HE MET 85 HE1 MET 85 35.747 16.074 -24.918 684 2HE MET 85 HE2 MET 85 36.033 14.397 -25.376 685 3HE MET 85 HE3 MET 85 37.395 15.507 -25.222 686 H VAL 86 HN VAL 86 31.760 13.356 -20.757 687 HA VAL 86 HA VAL 86 31.120 14.488 -18.066 688 HB VAL 86 HB VAL 86 29.313 14.839 -19.853 689 1HG1 VAL 86 HG11 VAL 86 29.542 12.625 -20.936 690 2HG1 VAL 86 HG12 VAL 86 27.898 12.881 -20.349 691 3HG1 VAL 86 HG13 VAL 86 29.003 11.845 -19.449 692 1HG2 VAL 86 HG21 VAL 86 27.643 14.659 -18.241 693 2HG2 VAL 86 HG22 VAL 86 29.089 14.632 -17.233 694 3HG2 VAL 86 HG23 VAL 86 28.259 13.126 -17.624 695 H LEU 87 HN LEU 87 30.574 12.831 -16.483 696 HA LEU 87 HA LEU 87 30.995 10.787 -15.398 697 1HB LEU 87 HB2 LEU 87 29.308 10.469 -17.579 698 2HB LEU 87 HB1 LEU 87 30.503 9.202 -17.833 699 HG LEU 87 HG LEU 87 28.651 8.340 -16.484 700 1HD1 LEU 87 HD11 LEU 87 31.388 8.609 -15.368 701 2HD1 LEU 87 HD12 LEU 87 30.450 7.158 -15.721 702 3HD1 LEU 87 HD13 LEU 87 30.148 8.064 -14.240 703 1HD2 LEU 87 HD21 LEU 87 28.249 9.302 -14.208 704 2HD2 LEU 87 HD22 LEU 87 27.850 10.426 -15.507 705 3HD2 LEU 87 HD23 LEU 87 29.354 10.618 -14.604 Start of MODEL 9 1 1H MET 1 HT1 MET 1 26.120 10.592 -20.701 2 2H MET 1 HT2 MET 1 26.081 9.253 -19.654 3 3H MET 1 HT3 MET 1 24.664 9.763 -20.438 4 HA MET 1 HA MET 1 25.736 9.230 -22.611 5 1HB MET 1 HB2 MET 1 27.968 9.305 -21.006 6 2HB MET 1 HB1 MET 1 27.731 7.569 -21.202 7 1HG MET 1 HG2 MET 1 28.920 7.924 -23.126 8 2HG MET 1 HG1 MET 1 27.333 8.366 -23.751 9 1HE MET 1 HE1 MET 1 27.315 9.831 -25.254 10 2HE MET 1 HE2 MET 1 29.019 9.883 -25.691 11 3HE MET 1 HE3 MET 1 28.140 11.385 -25.414 12 H LYS 2 HN LYS 2 26.027 6.734 -23.241 13 HA LYS 2 HA LYS 2 25.113 4.568 -23.260 14 1HB LYS 2 HB2 LYS 2 26.136 4.761 -20.874 15 2HB LYS 2 HB1 LYS 2 24.464 4.940 -20.337 16 1HG LYS 2 HG2 LYS 2 24.813 2.744 -22.248 17 2HG LYS 2 HG1 LYS 2 25.758 2.525 -20.776 18 1HD LYS 2 HD2 LYS 2 23.658 3.040 -19.459 19 2HD LYS 2 HD1 LYS 2 22.770 2.985 -20.982 20 1HE LYS 2 HE2 LYS 2 24.032 0.638 -21.226 21 2HE LYS 2 HE1 LYS 2 24.047 0.748 -19.457 22 1HZ LYS 2 HZ1 LYS 2 21.988 -0.248 -20.109 23 2HZ LYS 2 HZ2 LYS 2 21.679 0.983 -21.235 24 3HZ LYS 2 HZ3 LYS 2 21.650 1.325 -19.571 25 H THR 3 HN THR 3 23.258 4.676 -24.458 26 HA THR 3 HA THR 3 20.804 5.895 -23.288 27 HB THR 3 HB THR 3 21.475 4.849 -26.063 28 HG1 THR 3 HG1 THR 3 22.338 6.725 -26.357 29 1HG2 THR 3 HG21 THR 3 19.014 5.863 -24.822 30 2HG2 THR 3 HG22 THR 3 19.226 4.955 -26.317 31 3HG2 THR 3 HG23 THR 3 19.453 6.704 -26.307 32 H LYS 4 HN LYS 4 18.997 4.648 -22.796 33 HA LYS 4 HA LYS 4 19.059 1.740 -23.479 34 1HB LYS 4 HB2 LYS 4 18.396 1.283 -21.107 35 2HB LYS 4 HB1 LYS 4 19.999 1.996 -21.244 36 1HG LYS 4 HG2 LYS 4 19.381 3.746 -19.976 37 2HG LYS 4 HG1 LYS 4 18.025 4.093 -21.048 38 1HD LYS 4 HD2 LYS 4 16.579 2.608 -19.865 39 2HD LYS 4 HD1 LYS 4 17.925 1.891 -18.981 40 1HE LYS 4 HE2 LYS 4 17.226 3.357 -17.341 41 2HE LYS 4 HE1 LYS 4 18.227 4.499 -18.257 42 1HZ LYS 4 HZ1 LYS 4 15.992 5.373 -17.964 43 2HZ LYS 4 HZ2 LYS 4 15.329 3.989 -18.692 44 3HZ LYS 4 HZ3 LYS 4 16.289 5.056 -19.603 45 H LEU 5 HN LEU 5 17.140 1.105 -24.304 46 HA LEU 5 HA LEU 5 14.874 1.108 -24.931 47 1HB LEU 5 HB2 LEU 5 14.922 2.161 -22.107 48 2HB LEU 5 HB1 LEU 5 13.394 2.018 -22.972 49 HG LEU 5 HG LEU 5 14.867 -0.392 -23.400 50 1HD1 LEU 5 HD11 LEU 5 14.400 -0.048 -20.464 51 2HD1 LEU 5 HD12 LEU 5 15.895 0.582 -21.155 52 3HD1 LEU 5 HD13 LEU 5 15.508 -1.132 -21.303 53 1HD2 LEU 5 HD21 LEU 5 12.439 0.173 -21.669 54 2HD2 LEU 5 HD22 LEU 5 12.892 -1.391 -22.344 55 3HD2 LEU 5 HD23 LEU 5 12.397 -0.080 -23.412 56 H ASN 6 HN ASN 6 12.819 2.836 -24.758 57 HA ASN 6 HA ASN 6 13.863 5.525 -25.551 58 1HB ASN 6 HB2 ASN 6 13.023 3.511 -27.282 59 2HB ASN 6 HB1 ASN 6 11.600 4.541 -27.135 60 1HD2 ASN 6 HD21 ASN 6 14.965 4.456 -28.237 61 2HD2 ASN 6 HD22 ASN 6 14.917 5.945 -29.051 62 H GLU 7 HN GLU 7 13.023 5.995 -23.317 63 HA GLU 7 HA GLU 7 11.380 6.837 -21.852 64 1HB GLU 7 HB2 GLU 7 10.592 7.530 -24.654 65 2HB GLU 7 HB1 GLU 7 9.433 7.877 -23.371 66 1HG GLU 7 HG2 GLU 7 10.803 9.841 -23.642 67 2HG GLU 7 HG1 GLU 7 11.291 9.066 -22.135 68 H LEU 8 HN LEU 8 11.137 4.180 -21.750 69 HA LEU 8 HA LEU 8 8.248 3.550 -22.257 70 1HB LEU 8 HB2 LEU 8 10.823 2.029 -22.346 71 2HB LEU 8 HB1 LEU 8 9.370 1.147 -21.873 72 HG LEU 8 HG LEU 8 9.177 2.931 -24.259 73 1HD1 LEU 8 HD11 LEU 8 9.990 0.968 -25.664 74 2HD1 LEU 8 HD12 LEU 8 10.672 0.301 -24.181 75 3HD1 LEU 8 HD13 LEU 8 11.243 1.851 -24.794 76 1HD2 LEU 8 HD21 LEU 8 8.166 0.115 -23.785 77 2HD2 LEU 8 HD22 LEU 8 7.574 1.289 -24.960 78 3HD2 LEU 8 HD23 LEU 8 7.294 1.546 -23.238 79 H LEU 9 HN LEU 9 10.903 3.127 -19.884 80 HA LEU 9 HA LEU 9 9.086 2.154 -17.788 81 1HB LEU 9 HB2 LEU 9 11.967 3.118 -17.672 82 2HB LEU 9 HB1 LEU 9 11.150 2.135 -16.459 83 HG LEU 9 HG LEU 9 10.791 0.781 -18.911 84 1HD1 LEU 9 HD11 LEU 9 12.792 2.380 -19.513 85 2HD1 LEU 9 HD12 LEU 9 12.873 0.676 -19.956 86 3HD1 LEU 9 HD13 LEU 9 13.733 1.258 -18.532 87 1HD2 LEU 9 HD21 LEU 9 11.179 -0.035 -16.494 88 2HD2 LEU 9 HD22 LEU 9 12.899 0.145 -16.840 89 3HD2 LEU 9 HD23 LEU 9 11.923 -0.979 -17.785 90 H GLU 10 HN GLU 10 11.017 5.112 -18.347 91 HA GLU 10 HA GLU 10 10.764 7.307 -17.555 92 1HB GLU 10 HB2 GLU 10 8.200 6.195 -18.118 93 2HB GLU 10 HB1 GLU 10 8.037 7.163 -16.654 94 1HG GLU 10 HG2 GLU 10 7.665 8.635 -18.526 95 2HG GLU 10 HG1 GLU 10 9.248 9.029 -17.857 96 H PHE 11 HN PHE 11 11.977 5.664 -15.714 97 HA PHE 11 HA PHE 11 10.609 6.066 -13.095 98 1HB PHE 11 HB2 PHE 11 12.778 4.364 -14.236 99 2HB PHE 11 HB1 PHE 11 12.941 4.804 -12.535 100 HD1 PHE 11 HD1 PHE 11 10.727 3.170 -15.025 101 HD2 PHE 11 HD2 PHE 11 11.482 3.896 -10.860 102 HE1 PHE 11 HE1 PHE 11 9.033 1.462 -14.421 103 HE2 PHE 11 HE2 PHE 11 9.789 2.188 -10.255 104 HZ PHE 11 HZ PHE 11 8.564 0.972 -12.036 105 HA PRO 12 HA PRO 12 13.046 9.827 -12.882 106 1HB PRO 12 HB2 PRO 12 12.127 10.626 -10.430 107 2HB PRO 12 HB1 PRO 12 11.212 10.851 -11.933 108 1HG PRO 12 HG2 PRO 12 10.925 8.746 -9.839 109 2HG PRO 12 HG1 PRO 12 9.673 9.631 -10.727 110 1HD PRO 12 HD2 PRO 12 10.393 7.102 -11.360 111 2HD PRO 12 HD1 PRO 12 9.834 8.272 -12.576 112 H THR 13 HN THR 13 15.166 9.241 -12.595 113 HA THR 13 HA THR 13 15.999 8.442 -9.819 114 HB THR 13 HB THR 13 16.039 6.519 -11.337 115 HG1 THR 13 HG1 THR 13 17.845 6.000 -10.447 116 1HG2 THR 13 HG21 THR 13 16.159 7.488 -13.502 117 2HG2 THR 13 HG22 THR 13 17.694 6.645 -13.299 118 3HG2 THR 13 HG23 THR 13 17.618 8.394 -13.103 119 HA PRO 14 HA PRO 14 18.744 11.881 -10.177 120 1HB PRO 14 HB2 PRO 14 20.572 11.187 -8.261 121 2HB PRO 14 HB1 PRO 14 18.949 11.793 -7.875 122 1HG PRO 14 HG2 PRO 14 19.976 9.002 -7.871 123 2HG PRO 14 HG1 PRO 14 18.843 9.790 -6.764 124 1HD PRO 14 HD2 PRO 14 18.078 8.097 -8.766 125 2HD PRO 14 HD1 PRO 14 17.043 9.384 -8.112 126 H PHE 15 HN PHE 15 20.220 12.150 -11.804 127 HA PHE 15 HA PHE 15 22.076 9.904 -12.480 128 1HB PHE 15 HB2 PHE 15 20.808 12.216 -13.925 129 2HB PHE 15 HB1 PHE 15 22.272 11.486 -14.578 130 HD1 PHE 15 HD1 PHE 15 18.809 11.389 -14.756 131 HD2 PHE 15 HD2 PHE 15 22.187 8.753 -14.454 132 HE1 PHE 15 HE1 PHE 15 17.461 9.552 -15.728 133 HE2 PHE 15 HE2 PHE 15 20.837 6.915 -15.424 134 HZ PHE 15 HZ PHE 15 18.474 7.313 -16.062 135 H THR 16 HN THR 16 23.870 10.274 -11.108 136 HA THR 16 HA THR 16 25.004 12.943 -10.698 137 HB THR 16 HB THR 16 26.254 10.205 -10.259 138 HG1 THR 16 HG1 THR 16 24.913 9.936 -8.676 139 1HG2 THR 16 HG21 THR 16 26.612 12.628 -8.522 140 2HG2 THR 16 HG22 THR 16 27.530 12.487 -10.021 141 3HG2 THR 16 HG23 THR 16 27.700 11.262 -8.765 142 H TYR 17 HN TYR 17 25.462 13.739 -12.833 143 HA TYR 17 HA TYR 17 27.272 12.086 -14.536 144 1HB TYR 17 HB2 TYR 17 25.263 14.254 -14.888 145 2HB TYR 17 HB1 TYR 17 26.595 14.224 -16.041 146 HD1 TYR 17 HD1 TYR 17 24.895 11.360 -14.308 147 HD2 TYR 17 HD2 TYR 17 25.652 13.380 -18.025 148 HE1 TYR 17 HE1 TYR 17 23.807 9.508 -15.540 149 HE2 TYR 17 HE2 TYR 17 24.563 11.526 -19.253 150 HH TYR 17 HH TYR 17 24.148 8.656 -18.258 151 H LYS 18 HN LYS 18 29.406 12.443 -14.058 152 HA LYS 18 HA LYS 18 30.370 15.049 -13.103 153 1HB LYS 18 HB2 LYS 18 31.125 12.488 -12.699 154 2HB LYS 18 HB1 LYS 18 32.210 12.890 -14.029 155 1HG LYS 18 HG2 LYS 18 32.682 15.060 -12.632 156 2HG LYS 18 HG1 LYS 18 32.047 14.112 -11.288 157 1HD LYS 18 HD2 LYS 18 34.049 12.764 -13.026 158 2HD LYS 18 HD1 LYS 18 34.650 14.066 -11.999 159 1HE LYS 18 HE2 LYS 18 34.445 12.801 -10.122 160 2HE LYS 18 HE1 LYS 18 32.816 12.263 -10.575 161 1HZ LYS 18 HZ1 LYS 18 33.801 10.751 -12.187 162 2HZ LYS 18 HZ2 LYS 18 34.385 10.418 -10.626 163 3HZ LYS 18 HZ3 LYS 18 35.359 11.253 -11.740 164 H VAL 19 HN VAL 19 29.917 16.453 -14.892 165 HA VAL 19 HA VAL 19 30.868 15.846 -17.589 166 HB VAL 19 HB VAL 19 29.903 18.441 -16.332 167 1HG1 VAL 19 HG11 VAL 19 29.071 18.361 -18.963 168 2HG1 VAL 19 HG12 VAL 19 30.670 17.624 -19.050 169 3HG1 VAL 19 HG13 VAL 19 30.480 19.242 -18.372 170 1HG2 VAL 19 HG21 VAL 19 28.494 16.048 -16.562 171 2HG2 VAL 19 HG22 VAL 19 28.017 16.946 -18.002 172 3HG2 VAL 19 HG23 VAL 19 27.781 17.652 -16.403 173 H MET 20 HN MET 20 33.140 15.606 -17.515 174 HA MET 20 HA MET 20 34.767 17.842 -16.381 175 1HB MET 20 HB2 MET 20 35.532 15.083 -17.402 176 2HB MET 20 HB1 MET 20 36.589 16.194 -16.530 177 1HG MET 20 HG2 MET 20 35.142 16.063 -14.555 178 2HG MET 20 HG1 MET 20 34.020 15.017 -15.423 179 1HE MET 20 HE1 MET 20 35.638 11.685 -15.772 180 2HE MET 20 HE2 MET 20 35.098 12.960 -16.861 181 3HE MET 20 HE3 MET 20 34.127 12.547 -15.450 182 H GLY 21 HN GLY 21 36.288 18.952 -17.724 183 1HA GLY 21 HA2 GLY 21 37.113 18.338 -20.314 184 2HA GLY 21 HA1 GLY 21 35.565 19.154 -20.528 185 H GLN 22 HN GLN 22 36.323 21.086 -21.410 186 HA GLN 22 HA GLN 22 38.611 22.551 -20.459 187 1HB GLN 22 HB2 GLN 22 37.296 22.665 -22.679 188 2HB GLN 22 HB1 GLN 22 36.167 23.707 -21.814 189 1HG GLN 22 HG2 GLN 22 38.880 24.562 -21.300 190 2HG GLN 22 HG1 GLN 22 38.598 24.471 -23.038 191 1HE2 GLN 22 HE21 GLN 22 36.429 25.556 -23.763 192 2HE2 GLN 22 HE22 GLN 22 35.995 26.989 -22.964 193 H ALA 23 HN ALA 23 38.642 24.510 -19.180 194 HA ALA 23 HA ALA 23 36.528 24.592 -17.087 195 1HB ALA 23 HB1 ALA 23 39.286 24.667 -17.067 196 2HB ALA 23 HB2 ALA 23 38.261 25.195 -15.735 197 3HB ALA 23 HB3 ALA 23 38.871 26.372 -16.896 198 H LEU 24 HN LEU 24 34.828 25.808 -18.000 199 HA LEU 24 HA LEU 24 35.507 28.635 -18.746 200 1HB LEU 24 HB2 LEU 24 33.656 28.440 -20.422 201 2HB LEU 24 HB1 LEU 24 34.984 27.328 -20.742 202 HG LEU 24 HG LEU 24 32.949 26.177 -18.970 203 1HD1 LEU 24 HD11 LEU 24 32.120 27.565 -21.430 204 2HD1 LEU 24 HD12 LEU 24 31.143 26.979 -20.086 205 3HD1 LEU 24 HD13 LEU 24 31.627 25.872 -21.369 206 1HD2 LEU 24 HD21 LEU 24 33.178 24.310 -20.568 207 2HD2 LEU 24 HD22 LEU 24 34.764 24.910 -20.083 208 3HD2 LEU 24 HD23 LEU 24 34.100 25.349 -21.656 209 HA PRO 25 HA PRO 25 32.488 29.793 -15.765 210 1HB PRO 25 HB2 PRO 25 31.593 32.153 -16.822 211 2HB PRO 25 HB1 PRO 25 33.189 31.971 -16.066 212 1HG PRO 25 HG2 PRO 25 32.455 32.023 -18.949 213 2HG PRO 25 HG1 PRO 25 33.863 32.715 -18.128 214 1HD PRO 25 HD2 PRO 25 33.933 30.385 -19.549 215 2HD PRO 25 HD1 PRO 25 35.035 30.755 -18.205 216 H GLU 26 HN GLU 26 31.513 29.516 -19.144 217 HA GLU 26 HA GLU 26 28.651 29.785 -18.682 218 1HB GLU 26 HB2 GLU 26 30.367 29.828 -20.826 219 2HB GLU 26 HB1 GLU 26 29.611 28.246 -21.014 220 1HG GLU 26 HG2 GLU 26 27.797 30.515 -20.364 221 2HG GLU 26 HG1 GLU 26 28.501 30.504 -21.981 222 H LEU 27 HN LEU 27 30.821 27.298 -17.862 223 HA LEU 27 HA LEU 27 29.390 24.922 -18.525 224 1HB LEU 27 HB2 LEU 27 31.732 25.651 -17.233 225 2HB LEU 27 HB1 LEU 27 30.779 24.944 -15.930 226 HG LEU 27 HG LEU 27 30.918 23.519 -18.565 227 1HD1 LEU 27 HD11 LEU 27 33.212 23.652 -18.336 228 2HD1 LEU 27 HD12 LEU 27 32.901 22.267 -17.290 229 3HD1 LEU 27 HD13 LEU 27 33.132 23.868 -16.589 230 1HD2 LEU 27 HD21 LEU 27 30.028 21.811 -17.363 231 2HD2 LEU 27 HD22 LEU 27 29.680 23.035 -16.142 232 3HD2 LEU 27 HD23 LEU 27 31.145 22.061 -16.022 233 H VAL 28 HN VAL 28 29.394 26.727 -15.410 234 HA VAL 28 HA VAL 28 27.226 25.217 -14.253 235 HB VAL 28 HB VAL 28 27.234 27.090 -12.597 236 1HG1 VAL 28 HG11 VAL 28 29.855 25.905 -13.514 237 2HG1 VAL 28 HG12 VAL 28 28.833 25.394 -12.171 238 3HG1 VAL 28 HG13 VAL 28 29.742 26.902 -12.063 239 1HG2 VAL 28 HG21 VAL 28 27.752 29.134 -13.429 240 2HG2 VAL 28 HG22 VAL 28 28.561 28.449 -14.837 241 3HG2 VAL 28 HG23 VAL 28 29.435 28.621 -13.315 242 H ASP 29 HN ASP 29 27.316 28.091 -16.316 243 HA ASP 29 HA ASP 29 24.625 29.003 -15.851 244 1HB ASP 29 HB2 ASP 29 26.483 30.300 -16.892 245 2HB ASP 29 HB1 ASP 29 26.410 29.240 -18.299 246 H GLN 30 HN GLN 30 25.986 27.035 -18.549 247 HA GLN 30 HA GLN 30 23.405 26.448 -19.712 248 1HB GLN 30 HB2 GLN 30 25.866 26.324 -20.637 249 2HB GLN 30 HB1 GLN 30 25.820 24.681 -19.995 250 1HG GLN 30 HG2 GLN 30 24.735 24.053 -21.868 251 2HG GLN 30 HG1 GLN 30 23.367 25.024 -21.331 252 1HE2 GLN 30 HE21 GLN 30 22.868 26.879 -22.559 253 2HE2 GLN 30 HE22 GLN 30 23.850 27.484 -23.805 254 H VAL 31 HN VAL 31 25.419 24.797 -17.287 255 HA VAL 31 HA VAL 31 24.085 22.292 -17.208 256 HB VAL 31 HB VAL 31 25.651 24.003 -15.299 257 1HG1 VAL 31 HG11 VAL 31 23.848 21.751 -14.559 258 2HG1 VAL 31 HG12 VAL 31 24.408 23.111 -13.587 259 3HG1 VAL 31 HG13 VAL 31 25.466 21.726 -13.858 260 1HG2 VAL 31 HG21 VAL 31 27.339 22.634 -15.935 261 2HG2 VAL 31 HG22 VAL 31 26.253 22.064 -17.202 262 3HG2 VAL 31 HG23 VAL 31 26.365 21.188 -15.676 263 H VAL 32 HN VAL 32 23.461 25.154 -15.101 264 HA VAL 32 HA VAL 32 21.082 24.044 -13.921 265 HB VAL 32 HB VAL 32 22.596 25.890 -13.062 266 1HG1 VAL 32 HG11 VAL 32 22.659 27.180 -15.199 267 2HG1 VAL 32 HG12 VAL 32 22.184 28.168 -13.819 268 3HG1 VAL 32 HG13 VAL 32 20.964 27.603 -14.961 269 1HG2 VAL 32 HG21 VAL 32 20.767 27.105 -11.975 270 2HG2 VAL 32 HG22 VAL 32 20.363 25.393 -12.086 271 3HG2 VAL 32 HG23 VAL 32 19.638 26.544 -13.207 272 H GLU 33 HN GLU 33 21.581 26.031 -16.835 273 HA GLU 33 HA GLU 33 18.769 26.654 -17.226 274 1HB GLU 33 HB2 GLU 33 21.363 27.054 -18.534 275 2HB GLU 33 HB1 GLU 33 20.053 26.816 -19.688 276 1HG GLU 33 HG2 GLU 33 19.363 28.926 -19.334 277 2HG GLU 33 HG1 GLU 33 19.080 28.541 -17.636 278 H VAL 34 HN VAL 34 20.962 24.377 -18.950 279 HA VAL 34 HA VAL 34 18.864 23.144 -20.477 280 HB VAL 34 HB VAL 34 21.367 23.213 -20.918 281 1HG1 VAL 34 HG11 VAL 34 21.629 20.698 -19.327 282 2HG1 VAL 34 HG12 VAL 34 21.723 22.231 -18.462 283 3HG1 VAL 34 HG13 VAL 34 22.857 21.885 -19.766 284 1HG2 VAL 34 HG21 VAL 34 20.393 21.821 -22.448 285 2HG2 VAL 34 HG22 VAL 34 19.558 20.876 -21.216 286 3HG2 VAL 34 HG23 VAL 34 21.265 20.585 -21.543 287 H VAL 35 HN VAL 35 20.138 22.456 -17.232 288 HA VAL 35 HA VAL 35 18.823 19.851 -17.042 289 HB VAL 35 HB VAL 35 20.921 20.784 -15.817 290 1HG1 VAL 35 HG11 VAL 35 19.564 22.787 -14.967 291 2HG1 VAL 35 HG12 VAL 35 20.563 21.953 -13.780 292 3HG1 VAL 35 HG13 VAL 35 18.824 21.663 -13.828 293 1HG2 VAL 35 HG21 VAL 35 20.306 18.619 -15.212 294 2HG2 VAL 35 HG22 VAL 35 18.705 19.116 -14.668 295 3HG2 VAL 35 HG23 VAL 35 20.121 19.470 -13.680 296 H GLN 36 HN GLN 36 17.981 23.194 -16.226 297 HA GLN 36 HA GLN 36 15.660 22.521 -14.601 298 1HB GLN 36 HB2 GLN 36 16.774 24.649 -14.353 299 2HB GLN 36 HB1 GLN 36 16.608 24.999 -16.073 300 1HG GLN 36 HG2 GLN 36 14.235 25.245 -15.891 301 2HG GLN 36 HG1 GLN 36 14.224 24.574 -14.261 302 1HE2 GLN 36 HE21 GLN 36 13.402 26.453 -13.174 303 2HE2 GLN 36 HE22 GLN 36 14.257 27.917 -13.098 304 H ARG 37 HN ARG 37 16.184 23.317 -18.041 305 HA ARG 37 HA ARG 37 13.414 23.457 -18.811 306 1HB ARG 37 HB2 ARG 37 16.088 23.446 -19.993 307 2HB ARG 37 HB1 ARG 37 14.912 22.624 -21.016 308 1HG ARG 37 HG2 ARG 37 14.179 24.631 -21.697 309 2HG ARG 37 HG1 ARG 37 13.613 24.939 -20.057 310 1HD ARG 37 HD2 ARG 37 16.355 25.408 -19.884 311 2HD ARG 37 HD1 ARG 37 15.910 26.092 -21.458 312 HE ARG 37 HE ARG 37 13.928 27.135 -20.057 313 1HH1 ARG 37 HH11 ARG 37 15.254 26.193 -17.484 314 2HH1 ARG 37 HH12 ARG 37 16.095 27.626 -16.995 315 1HH2 ARG 37 HH21 ARG 37 15.844 29.152 -20.111 316 2HH2 ARG 37 HH22 ARG 37 16.432 29.309 -18.489 317 H HIS 38 HN HIS 38 15.596 20.732 -18.303 318 HA HIS 38 HA HIS 38 13.642 18.869 -19.590 319 1HB HIS 38 HB2 HIS 38 16.538 19.028 -19.188 320 2HB HIS 38 HB1 HIS 38 15.891 17.447 -18.756 321 HD1 HIS 38 HD1 HIS 38 14.621 16.121 -20.646 322 HD2 HIS 38 HD2 HIS 38 16.479 19.618 -21.944 323 HE1 HIS 38 HE1 HIS 38 14.655 16.015 -23.177 324 H ALA 39 HN ALA 39 15.474 19.291 -16.533 325 HA ALA 39 HA ALA 39 13.612 17.353 -15.214 326 1HB ALA 39 HB1 ALA 39 15.415 17.188 -13.548 327 2HB ALA 39 HB2 ALA 39 16.297 18.485 -14.354 328 3HB ALA 39 HB3 ALA 39 16.068 16.936 -15.166 329 HA PRO 40 HA PRO 40 11.744 20.699 -13.030 330 1HB PRO 40 HB2 PRO 40 10.882 19.379 -10.792 331 2HB PRO 40 HB1 PRO 40 10.103 19.210 -12.378 332 1HG PRO 40 HG2 PRO 40 12.027 17.396 -11.013 333 2HG PRO 40 HG1 PRO 40 10.605 17.007 -11.990 334 1HD PRO 40 HD2 PRO 40 13.156 16.856 -12.932 335 2HD PRO 40 HD1 PRO 40 11.747 17.184 -13.967 336 H GLY 41 HN GLY 41 12.375 22.218 -11.490 337 1HA GLY 41 HA2 GLY 41 13.513 23.097 -9.601 338 2HA GLY 41 HA1 GLY 41 14.146 21.485 -9.265 339 H ASP 42 HN ASP 42 15.700 23.928 -9.267 340 HA ASP 42 HA ASP 42 17.308 23.871 -11.751 341 1HB ASP 42 HB2 ASP 42 17.129 25.528 -9.246 342 2HB ASP 42 HB1 ASP 42 18.568 25.645 -10.260 343 H TYR 43 HN TYR 43 19.373 22.988 -11.876 344 HA TYR 43 HA TYR 43 20.421 21.613 -9.418 345 1HB TYR 43 HB2 TYR 43 20.363 20.822 -12.340 346 2HB TYR 43 HB1 TYR 43 21.340 19.979 -11.142 347 HD1 TYR 43 HD1 TYR 43 18.114 20.222 -12.648 348 HD2 TYR 43 HD2 TYR 43 20.105 19.143 -8.998 349 HE1 TYR 43 HE1 TYR 43 16.125 18.919 -11.950 350 HE2 TYR 43 HE2 TYR 43 18.116 17.840 -8.300 351 HH TYR 43 HH TYR 43 16.181 16.722 -9.354 352 H THR 44 HN THR 44 22.868 21.223 -9.595 353 HA THR 44 HA THR 44 24.268 23.331 -11.187 354 HB THR 44 HB THR 44 24.882 22.885 -8.267 355 HG1 THR 44 HG1 THR 44 23.119 23.850 -7.718 356 1HG2 THR 44 HG21 THR 44 25.449 25.377 -8.542 357 2HG2 THR 44 HG22 THR 44 25.280 25.101 -10.276 358 3HG2 THR 44 HG23 THR 44 26.505 24.223 -9.358 359 HA PRO 45 HA PRO 45 27.331 20.098 -11.363 360 1HB PRO 45 HB2 PRO 45 29.180 21.500 -12.801 361 2HB PRO 45 HB1 PRO 45 27.661 20.918 -13.507 362 1HG PRO 45 HG2 PRO 45 28.481 23.641 -12.891 363 2HG PRO 45 HG1 PRO 45 27.140 23.073 -13.890 364 1HD PRO 45 HD2 PRO 45 27.092 24.023 -11.147 365 2HD PRO 45 HD1 PRO 45 25.730 23.666 -12.230 366 H THR 46 HN THR 46 28.778 19.530 -9.721 367 HA THR 46 HA THR 46 30.065 21.599 -8.063 368 HB THR 46 HB THR 46 30.281 18.564 -8.056 369 HG1 THR 46 HG1 THR 46 28.360 18.617 -7.256 370 1HG2 THR 46 HG21 THR 46 32.023 19.318 -6.691 371 2HG2 THR 46 HG22 THR 46 30.698 19.152 -5.538 372 3HG2 THR 46 HG23 THR 46 31.125 20.743 -6.167 373 H VAL 47 HN VAL 47 31.610 22.596 -9.457 374 HA VAL 47 HA VAL 47 33.473 21.052 -11.078 375 HB VAL 47 HB VAL 47 32.637 23.334 -11.605 376 1HG1 VAL 47 HG11 VAL 47 32.708 24.993 -10.088 377 2HG1 VAL 47 HG12 VAL 47 34.456 24.827 -9.937 378 3HG1 VAL 47 HG13 VAL 47 33.387 23.857 -8.925 379 1HG2 VAL 47 HG21 VAL 47 34.512 23.607 -12.824 380 2HG2 VAL 47 HG22 VAL 47 35.265 22.342 -11.855 381 3HG2 VAL 47 HG23 VAL 47 35.440 24.033 -11.387 382 H LYS 48 HN LYS 48 35.593 20.519 -10.650 383 HA LYS 48 HA LYS 48 36.843 21.412 -8.097 384 1HB LYS 48 HB2 LYS 48 37.298 19.125 -7.446 385 2HB LYS 48 HB1 LYS 48 35.579 19.232 -7.813 386 1HG LYS 48 HG2 LYS 48 36.369 18.528 -10.238 387 2HG LYS 48 HG1 LYS 48 37.772 17.905 -9.373 388 1HD LYS 48 HD2 LYS 48 36.204 16.097 -9.482 389 2HD LYS 48 HD1 LYS 48 36.136 16.709 -7.829 390 1HE LYS 48 HE2 LYS 48 33.896 16.944 -8.120 391 2HE LYS 48 HE1 LYS 48 34.259 18.258 -9.256 392 1HZ LYS 48 HZ1 LYS 48 32.981 16.543 -10.363 393 2HZ LYS 48 HZ2 LYS 48 34.114 15.360 -9.915 394 3HZ LYS 48 HZ3 LYS 48 34.550 16.588 -11.006 395 HA PRO 49 HA PRO 49 40.354 21.659 -10.757 396 1HB PRO 49 HB2 PRO 49 42.351 21.672 -8.887 397 2HB PRO 49 HB1 PRO 49 41.286 23.062 -9.173 398 1HG PRO 49 HG2 PRO 49 41.218 21.043 -6.999 399 2HG PRO 49 HG1 PRO 49 40.842 22.771 -6.950 400 1HD PRO 49 HD2 PRO 49 38.959 20.766 -7.021 401 2HD PRO 49 HD1 PRO 49 38.672 22.438 -7.548 402 H SER 50 HN SER 50 40.004 19.451 -11.631 403 HA SER 50 HA SER 50 41.429 17.213 -10.307 404 1HB SER 50 HB2 SER 50 39.130 17.457 -11.794 405 2HB SER 50 HB1 SER 50 40.269 16.883 -13.008 406 HG SER 50 HG SER 50 39.093 15.281 -11.625 407 H SER 51 HN SER 51 41.540 19.001 -13.411 408 HA SER 51 HA SER 51 44.282 17.887 -13.897 409 1HB SER 51 HB2 SER 51 42.031 18.904 -15.631 410 2HB SER 51 HB1 SER 51 43.667 18.767 -16.268 411 HG SER 51 HG SER 51 42.113 16.884 -16.411 412 H LYS 52 HN LYS 52 45.834 19.456 -14.901 413 HA LYS 52 HA LYS 52 45.583 22.142 -13.640 414 1HB LYS 52 HB2 LYS 52 47.733 20.295 -14.537 415 2HB LYS 52 HB1 LYS 52 48.081 22.017 -14.701 416 1HG LYS 52 HG2 LYS 52 48.781 21.680 -12.521 417 2HG LYS 52 HG1 LYS 52 47.093 22.104 -12.237 418 1HD LYS 52 HD2 LYS 52 47.114 19.327 -12.760 419 2HD LYS 52 HD1 LYS 52 48.457 19.623 -11.657 420 1HE LYS 52 HE2 LYS 52 47.074 20.257 -9.929 421 2HE LYS 52 HE1 LYS 52 45.893 21.009 -11.018 422 1HZ LYS 52 HZ1 LYS 52 45.005 18.957 -10.121 423 2HZ LYS 52 HZ2 LYS 52 46.351 18.089 -10.687 424 3HZ LYS 52 HZ3 LYS 52 45.265 18.790 -11.789 425 H GLY 53 HN GLY 53 46.135 24.064 -14.929 426 1HA GLY 53 HA2 GLY 53 46.430 25.239 -17.007 427 2HA GLY 53 HA1 GLY 53 46.018 23.760 -17.875 428 H ASN 54 HN ASN 54 44.242 24.349 -19.075 429 HA ASN 54 HA ASN 54 42.032 25.845 -17.728 430 1HB ASN 54 HB2 ASN 54 43.223 26.483 -19.963 431 2HB ASN 54 HB1 ASN 54 42.263 25.183 -20.664 432 1HD2 ASN 54 HD21 ASN 54 41.509 27.441 -21.794 433 2HD2 ASN 54 HD22 ASN 54 40.124 28.129 -21.096 434 H TYR 55 HN TYR 55 41.988 23.357 -16.746 435 HA TYR 55 HA TYR 55 39.784 21.999 -18.254 436 1HB TYR 55 HB2 TYR 55 42.172 21.018 -18.472 437 2HB TYR 55 HB1 TYR 55 41.987 20.542 -16.784 438 HD1 TYR 55 HD1 TYR 55 41.182 19.752 -20.208 439 HD2 TYR 55 HD2 TYR 55 39.965 19.107 -16.139 440 HE1 TYR 55 HE1 TYR 55 39.873 17.770 -20.914 441 HE2 TYR 55 HE2 TYR 55 38.655 17.124 -16.845 442 HH TYR 55 HH TYR 55 39.022 15.447 -19.267 443 H HIS 56 HN HIS 56 38.048 21.602 -16.933 444 HA HIS 56 HA HIS 56 38.503 21.449 -13.972 445 1HB HIS 56 HB2 HIS 56 37.063 23.394 -15.588 446 2HB HIS 56 HB1 HIS 56 35.985 22.620 -14.429 447 HD1 HIS 56 HD1 HIS 56 36.825 25.590 -14.088 448 HD2 HIS 56 HD2 HIS 56 38.766 22.395 -12.244 449 HE1 HIS 56 HE1 HIS 56 38.008 26.544 -12.062 450 H SER 57 HN SER 57 37.286 19.873 -12.936 451 HA SER 57 HA SER 57 35.520 18.174 -14.668 452 1HB SER 57 HB2 SER 57 37.200 17.697 -12.195 453 2HB SER 57 HB1 SER 57 36.017 16.520 -12.755 454 HG SER 57 HG SER 57 38.021 16.059 -13.662 455 H VAL 58 HN VAL 58 33.396 18.863 -14.348 456 HA VAL 58 HA VAL 58 32.586 19.559 -11.551 457 HB VAL 58 HB VAL 58 30.950 20.991 -12.526 458 1HG1 VAL 58 HG11 VAL 58 33.561 21.432 -12.963 459 2HG1 VAL 58 HG12 VAL 58 32.311 22.539 -13.533 460 3HG1 VAL 58 HG13 VAL 58 33.017 21.360 -14.639 461 1HG2 VAL 58 HG21 VAL 58 30.470 19.107 -14.359 462 2HG2 VAL 58 HG22 VAL 58 31.513 20.136 -15.337 463 3HG2 VAL 58 HG23 VAL 58 30.033 20.789 -14.641 464 H SER 59 HN SER 59 30.597 18.705 -10.733 465 HA SER 59 HA SER 59 29.622 16.238 -12.138 466 1HB SER 59 HB2 SER 59 30.910 16.258 -9.818 467 2HB SER 59 HB1 SER 59 29.341 16.745 -9.185 468 HG SER 59 HG SER 59 29.572 14.475 -9.204 469 H ILE 60 HN ILE 60 27.667 16.796 -13.075 470 HA ILE 60 HA ILE 60 25.981 18.865 -11.796 471 HB ILE 60 HB ILE 60 26.497 18.841 -14.238 472 1HG1 ILE 60 HG12 ILE 60 23.577 18.414 -13.519 473 2HG1 ILE 60 HG11 ILE 60 24.454 19.940 -13.415 474 1HG2 ILE 60 HG21 ILE 60 26.128 17.039 -15.568 475 2HG2 ILE 60 HG22 ILE 60 24.560 16.708 -14.834 476 3HG2 ILE 60 HG23 ILE 60 26.034 16.124 -14.065 477 1HD1 ILE 60 HD11 ILE 60 23.504 20.208 -15.502 478 2HD1 ILE 60 HD12 ILE 60 23.476 18.476 -15.827 479 3HD1 ILE 60 HD13 ILE 60 24.985 19.377 -15.975 480 H THR 61 HN THR 61 24.283 18.412 -10.538 481 HA THR 61 HA THR 61 23.389 15.591 -10.209 482 HB THR 61 HB THR 61 22.731 18.208 -8.804 483 HG1 THR 61 HG1 THR 61 24.343 15.989 -8.070 484 1HG2 THR 61 HG21 THR 61 20.968 17.092 -7.949 485 2HG2 THR 61 HG22 THR 61 22.136 16.075 -7.106 486 3HG2 THR 61 HG23 THR 61 21.494 15.570 -8.668 487 H ILE 62 HN ILE 62 21.302 14.894 -10.855 488 HA ILE 62 HA ILE 62 19.259 16.828 -11.703 489 HB ILE 62 HB ILE 62 20.762 16.872 -13.620 490 1HG1 ILE 62 HG12 ILE 62 18.347 15.118 -14.178 491 2HG1 ILE 62 HG11 ILE 62 18.334 16.878 -14.090 492 1HG2 ILE 62 HG21 ILE 62 20.406 14.014 -14.307 493 2HG2 ILE 62 HG22 ILE 62 21.451 14.324 -12.922 494 3HG2 ILE 62 HG23 ILE 62 21.824 15.047 -14.486 495 1HD1 ILE 62 HD11 ILE 62 19.662 15.117 -16.150 496 2HD1 ILE 62 HD12 ILE 62 20.144 16.800 -15.928 497 3HD1 ILE 62 HD13 ILE 62 18.491 16.410 -16.405 498 H ASN 63 HN ASN 63 17.218 15.874 -11.732 499 HA ASN 63 HA ASN 63 17.106 12.937 -11.141 500 1HB ASN 63 HB2 ASN 63 16.263 14.618 -9.458 501 2HB ASN 63 HB1 ASN 63 15.059 15.127 -10.643 502 1HD2 ASN 63 HD21 ASN 63 13.339 13.579 -11.201 503 2HD2 ASN 63 HD22 ASN 63 13.020 12.237 -10.214 504 H ALA 64 HN ALA 64 17.175 12.353 -13.423 505 HA ALA 64 HA ALA 64 14.839 13.251 -15.063 506 1HB ALA 64 HB1 ALA 64 17.362 13.421 -15.723 507 2HB ALA 64 HB2 ALA 64 16.221 12.820 -16.925 508 3HB ALA 64 HB3 ALA 64 17.232 11.689 -16.027 509 H THR 65 HN THR 65 13.297 11.764 -15.685 510 HA THR 65 HA THR 65 13.114 9.199 -14.398 511 HB THR 65 HB THR 65 11.159 8.959 -15.973 512 HG1 THR 65 HG1 THR 65 11.351 10.058 -17.737 513 1HG2 THR 65 HG21 THR 65 11.540 10.728 -13.844 514 2HG2 THR 65 HG22 THR 65 9.991 10.217 -14.514 515 3HG2 THR 65 HG23 THR 65 10.754 11.701 -15.086 516 H HIS 66 HN HIS 66 14.560 10.220 -17.411 517 HA HIS 66 HA HIS 66 15.204 7.357 -18.018 518 1HB HIS 66 HB2 HIS 66 13.503 9.054 -19.444 519 2HB HIS 66 HB1 HIS 66 15.015 9.102 -20.353 520 HD1 HIS 66 HD1 HIS 66 12.528 6.589 -18.956 521 HD2 HIS 66 HD2 HIS 66 15.542 6.799 -21.825 522 HE1 HIS 66 HE1 HIS 66 12.466 4.397 -20.223 523 H ILE 67 HN ILE 67 17.239 7.084 -19.200 524 HA ILE 67 HA ILE 67 19.322 8.930 -18.333 525 HB ILE 67 HB ILE 67 19.433 6.395 -18.553 526 1HG1 ILE 67 HG12 ILE 67 21.662 7.438 -20.215 527 2HG1 ILE 67 HG11 ILE 67 21.392 8.275 -18.688 528 1HG2 ILE 67 HG21 ILE 67 18.369 6.267 -20.789 529 2HG2 ILE 67 HG22 ILE 67 19.955 5.494 -20.776 530 3HG2 ILE 67 HG23 ILE 67 19.761 7.096 -21.487 531 1HD1 ILE 67 HD11 ILE 67 21.810 6.361 -17.412 532 2HD1 ILE 67 HD12 ILE 67 22.966 6.181 -18.732 533 3HD1 ILE 67 HD13 ILE 67 21.457 5.270 -18.752 534 H GLU 68 HN GLU 68 17.352 8.644 -21.192 535 HA GLU 68 HA GLU 68 19.128 9.845 -23.118 536 1HB GLU 68 HB2 GLU 68 16.214 9.276 -22.793 537 2HB GLU 68 HB1 GLU 68 16.664 10.452 -24.027 538 1HG GLU 68 HG2 GLU 68 17.138 8.723 -25.389 539 2HG GLU 68 HG1 GLU 68 18.498 8.345 -24.332 540 H GLN 69 HN GLN 69 16.825 11.199 -20.761 541 HA GLN 69 HA GLN 69 16.849 13.913 -21.706 542 1HB GLN 69 HB2 GLN 69 16.240 12.485 -19.123 543 2HB GLN 69 HB1 GLN 69 16.210 14.248 -19.179 544 1HG GLN 69 HG2 GLN 69 14.282 14.291 -20.378 545 2HG GLN 69 HG1 GLN 69 14.800 12.972 -21.426 546 1HE2 GLN 69 HE21 GLN 69 13.759 13.465 -17.992 547 2HE2 GLN 69 HE22 GLN 69 12.887 12.011 -17.904 548 H VAL 70 HN VAL 70 18.747 12.318 -19.100 549 HA VAL 70 HA VAL 70 20.348 14.661 -18.531 550 HB VAL 70 HB VAL 70 19.861 12.720 -17.004 551 1HG1 VAL 70 HG11 VAL 70 21.807 11.324 -18.861 552 2HG1 VAL 70 HG12 VAL 70 20.142 10.858 -18.515 553 3HG1 VAL 70 HG13 VAL 70 21.373 10.722 -17.261 554 1HG2 VAL 70 HG21 VAL 70 22.123 12.661 -16.018 555 2HG2 VAL 70 HG22 VAL 70 21.703 14.292 -16.539 556 3HG2 VAL 70 HG23 VAL 70 22.793 13.308 -17.514 557 H GLU 71 HN GLU 71 20.603 12.076 -20.908 558 HA GLU 71 HA GLU 71 23.417 12.365 -21.517 559 1HB GLU 71 HB2 GLU 71 20.969 11.134 -22.709 560 2HB GLU 71 HB1 GLU 71 22.335 11.399 -23.793 561 1HG GLU 71 HG2 GLU 71 23.810 10.195 -22.199 562 2HG GLU 71 HG1 GLU 71 22.413 9.880 -21.169 563 H THR 72 HN THR 72 20.457 13.647 -23.105 564 HA THR 72 HA THR 72 21.799 15.270 -25.050 565 HB THR 72 HB THR 72 19.551 16.496 -25.004 566 HG1 THR 72 HG1 THR 72 18.459 16.233 -23.252 567 1HG2 THR 72 HG21 THR 72 20.015 14.510 -26.433 568 2HG2 THR 72 HG22 THR 72 18.329 14.598 -25.922 569 3HG2 THR 72 HG23 THR 72 19.431 13.472 -25.131 570 H LEU 73 HN LEU 73 20.712 15.921 -21.714 571 HA LEU 73 HA LEU 73 21.322 18.706 -21.587 572 1HB LEU 73 HB2 LEU 73 20.800 16.436 -19.789 573 2HB LEU 73 HB1 LEU 73 21.835 17.667 -19.068 574 HG LEU 73 HG LEU 73 20.198 19.389 -19.463 575 1HD1 LEU 73 HD11 LEU 73 18.594 17.266 -20.927 576 2HD1 LEU 73 HD12 LEU 73 19.437 18.617 -21.685 577 3HD1 LEU 73 HD13 LEU 73 18.069 18.920 -20.617 578 1HD2 LEU 73 HD21 LEU 73 18.922 16.841 -18.428 579 2HD2 LEU 73 HD22 LEU 73 18.219 18.447 -18.235 580 3HD2 LEU 73 HD23 LEU 73 19.765 18.063 -17.476 581 H TYR 74 HN TYR 74 23.361 15.821 -21.066 582 HA TYR 74 HA TYR 74 25.726 17.142 -20.146 583 1HB TYR 74 HB2 TYR 74 25.927 14.865 -19.915 584 2HB TYR 74 HB1 TYR 74 24.918 14.537 -21.320 585 HD1 TYR 74 HD1 TYR 74 28.231 16.205 -20.656 586 HD2 TYR 74 HD2 TYR 74 25.994 13.433 -23.060 587 HE1 TYR 74 HE1 TYR 74 30.254 15.749 -22.012 588 HE2 TYR 74 HE2 TYR 74 28.020 12.979 -24.414 589 HH TYR 74 HH TYR 74 30.478 14.780 -24.710 590 H GLU 75 HN GLU 75 24.619 16.294 -23.450 591 HA GLU 75 HA GLU 75 26.909 17.424 -24.811 592 1HB GLU 75 HB2 GLU 75 24.897 15.776 -25.481 593 2HB GLU 75 HB1 GLU 75 24.211 17.282 -26.091 594 1HG GLU 75 HG2 GLU 75 25.492 16.220 -27.870 595 2HG GLU 75 HG1 GLU 75 26.328 17.686 -27.356 596 H GLU 76 HN GLU 76 23.787 18.754 -23.758 597 HA GLU 76 HA GLU 76 23.886 21.223 -25.221 598 1HB GLU 76 HB2 GLU 76 22.395 19.975 -23.022 599 2HB GLU 76 HB1 GLU 76 22.515 21.728 -22.873 600 1HG GLU 76 HG2 GLU 76 20.741 21.758 -24.296 601 2HG GLU 76 HG1 GLU 76 21.949 21.451 -25.543 602 H LEU 77 HN LEU 77 24.860 20.454 -21.845 603 HA LEU 77 HA LEU 77 26.075 23.089 -21.463 604 1HB LEU 77 HB2 LEU 77 26.226 22.410 -19.259 605 2HB LEU 77 HB1 LEU 77 24.995 21.277 -19.805 606 HG LEU 77 HG LEU 77 27.186 19.842 -20.442 607 1HD1 LEU 77 HD11 LEU 77 28.064 21.938 -18.542 608 2HD1 LEU 77 HD12 LEU 77 29.013 20.980 -19.680 609 3HD1 LEU 77 HD13 LEU 77 28.546 20.294 -18.124 610 1HD2 LEU 77 HD21 LEU 77 26.946 18.764 -18.173 611 2HD2 LEU 77 HD22 LEU 77 25.422 18.989 -19.029 612 3HD2 LEU 77 HD23 LEU 77 25.869 20.087 -17.724 613 H GLY 78 HN GLY 78 27.133 19.917 -22.539 614 1HA GLY 78 HA2 GLY 78 29.979 20.816 -22.517 615 2HA GLY 78 HA1 GLY 78 29.452 19.135 -22.621 616 H LYS 79 HN LYS 79 28.696 22.131 -24.424 617 HA LYS 79 HA LYS 79 28.946 20.581 -26.971 618 1HB LYS 79 HB2 LYS 79 26.890 22.016 -26.051 619 2HB LYS 79 HB1 LYS 79 27.802 23.340 -26.777 620 1HG LYS 79 HG2 LYS 79 27.594 22.490 -28.929 621 2HG LYS 79 HG1 LYS 79 27.403 20.830 -28.364 622 1HD LYS 79 HD2 LYS 79 25.243 22.342 -27.285 623 2HD LYS 79 HD1 LYS 79 25.358 22.735 -29.002 624 1HE LYS 79 HE2 LYS 79 25.028 20.495 -29.668 625 2HE LYS 79 HE1 LYS 79 25.481 19.861 -28.074 626 1HZ LYS 79 HZ1 LYS 79 23.109 21.569 -28.613 627 2HZ LYS 79 HZ2 LYS 79 23.538 20.887 -27.117 628 3HZ LYS 79 HZ3 LYS 79 23.061 19.887 -28.404 629 H ILE 80 HN ILE 80 30.882 22.462 -25.083 630 HA ILE 80 HA ILE 80 31.911 24.513 -26.763 631 HB ILE 80 HB ILE 80 33.467 22.832 -24.770 632 1HG1 ILE 80 HG12 ILE 80 32.435 25.130 -23.494 633 2HG1 ILE 80 HG11 ILE 80 31.071 24.422 -24.359 634 1HG2 ILE 80 HG21 ILE 80 33.629 25.719 -25.680 635 2HG2 ILE 80 HG22 ILE 80 34.833 24.459 -25.932 636 3HG2 ILE 80 HG23 ILE 80 34.528 25.071 -24.309 637 1HD1 ILE 80 HD11 ILE 80 32.918 22.933 -22.471 638 2HD1 ILE 80 HD12 ILE 80 31.544 22.234 -23.327 639 3HD1 ILE 80 HD13 ILE 80 31.280 23.464 -22.093 640 H ASP 81 HN ASP 81 33.866 24.505 -28.088 641 HA ASP 81 HA ASP 81 34.166 22.068 -29.688 642 1HB ASP 81 HB2 ASP 81 34.932 24.927 -29.768 643 2HB ASP 81 HB1 ASP 81 36.041 23.833 -30.595 644 H ILE 82 HN ILE 82 35.605 23.045 -26.784 645 HA ILE 82 HA ILE 82 38.313 22.059 -27.377 646 HB ILE 82 HB ILE 82 36.966 22.860 -24.769 647 1HG1 ILE 82 HG12 ILE 82 36.887 24.720 -26.337 648 2HG1 ILE 82 HG11 ILE 82 38.155 25.040 -25.155 649 1HG2 ILE 82 HG21 ILE 82 38.925 21.741 -24.134 650 2HG2 ILE 82 HG22 ILE 82 39.482 23.408 -24.271 651 3HG2 ILE 82 HG23 ILE 82 39.804 22.261 -25.571 652 1HD1 ILE 82 HD11 ILE 82 39.681 23.814 -26.947 653 2HD1 ILE 82 HD12 ILE 82 39.287 25.524 -27.123 654 3HD1 ILE 82 HD13 ILE 82 38.401 24.315 -28.053 655 H VAL 83 HN VAL 83 37.108 21.036 -24.294 656 HA VAL 83 HA VAL 83 36.886 18.217 -25.302 657 HB VAL 83 HB VAL 83 38.153 19.322 -22.769 658 1HG1 VAL 83 HG11 VAL 83 36.962 17.042 -22.626 659 2HG1 VAL 83 HG12 VAL 83 38.657 17.085 -22.143 660 3HG1 VAL 83 HG13 VAL 83 38.207 16.455 -23.727 661 1HG2 VAL 83 HG21 VAL 83 39.266 18.113 -25.315 662 2HG2 VAL 83 HG22 VAL 83 40.213 18.242 -23.834 663 3HG2 VAL 83 HG23 VAL 83 39.619 19.699 -24.628 664 H ARG 84 HN ARG 84 34.823 17.484 -24.956 665 HA ARG 84 HA ARG 84 33.377 18.429 -22.496 666 1HB ARG 84 HB2 ARG 84 31.911 17.478 -24.932 667 2HB ARG 84 HB1 ARG 84 31.435 18.691 -23.750 668 1HG ARG 84 HG2 ARG 84 32.035 20.219 -25.305 669 2HG ARG 84 HG1 ARG 84 33.701 19.804 -24.906 670 1HD ARG 84 HD2 ARG 84 33.684 19.431 -27.225 671 2HD ARG 84 HD1 ARG 84 33.274 17.814 -26.623 672 HE ARG 84 HE ARG 84 30.830 19.187 -26.800 673 1HH1 ARG 84 HH21 ARG 84 31.816 20.565 -29.175 674 2HH1 ARG 84 HH22 ARG 84 31.515 19.436 -30.454 675 1HH2 ARG 84 HH11 ARG 84 31.119 16.721 -28.315 676 2HH2 ARG 84 HH12 ARG 84 31.118 17.250 -29.965 677 H MET 85 HN MET 85 33.332 16.713 -21.090 678 HA MET 85 HA MET 85 32.556 14.024 -22.154 679 1HB MET 85 HB2 MET 85 35.101 14.906 -21.051 680 2HB MET 85 HB1 MET 85 34.414 13.605 -20.080 681 1HG MET 85 HG2 MET 85 34.096 12.259 -22.146 682 2HG MET 85 HG1 MET 85 34.862 13.546 -23.079 683 1HE MET 85 HE1 MET 85 37.166 14.652 -22.029 684 2HE MET 85 HE2 MET 85 37.243 13.728 -23.527 685 3HE MET 85 HE3 MET 85 38.485 13.505 -22.298 686 H VAL 86 HN VAL 86 31.572 12.649 -20.482 687 HA VAL 86 HA VAL 86 30.882 14.022 -17.923 688 HB VAL 86 HB VAL 86 29.174 14.453 -19.727 689 1HG1 VAL 86 HG11 VAL 86 28.643 11.481 -19.435 690 2HG1 VAL 86 HG12 VAL 86 29.381 12.240 -20.847 691 3HG1 VAL 86 HG13 VAL 86 27.713 12.615 -20.415 692 1HG2 VAL 86 HG21 VAL 86 27.401 14.314 -18.227 693 2HG2 VAL 86 HG22 VAL 86 28.778 14.172 -17.135 694 3HG2 VAL 86 HG23 VAL 86 27.895 12.729 -17.632 695 H LEU 87 HN LEU 87 30.267 12.564 -16.232 696 HA LEU 87 HA LEU 87 30.351 10.564 -15.003 697 1HB LEU 87 HB2 LEU 87 28.804 10.164 -17.208 698 2HB LEU 87 HB1 LEU 87 30.023 8.917 -17.460 699 HG LEU 87 HG LEU 87 28.157 7.995 -16.176 700 1HD1 LEU 87 HD11 LEU 87 29.397 7.073 -14.329 701 2HD1 LEU 87 HD12 LEU 87 30.487 8.459 -14.296 702 3HD1 LEU 87 HD13 LEU 87 30.541 7.328 -15.647 703 1HD2 LEU 87 HD21 LEU 87 28.330 9.223 -13.669 704 2HD2 LEU 87 HD22 LEU 87 27.028 9.425 -14.839 705 3HD2 LEU 87 HD23 LEU 87 28.371 10.566 -14.811 Start of MODEL 10 1 1H MET 1 HT1 MET 1 22.074 2.613 -23.499 2 2H MET 1 HT2 MET 1 20.497 2.843 -22.912 3 3H MET 1 HT3 MET 1 21.789 2.647 -21.827 4 HA MET 1 HA MET 1 21.162 4.979 -21.934 5 1HB MET 1 HB2 MET 1 23.739 3.786 -22.691 6 2HB MET 1 HB1 MET 1 23.594 5.476 -23.174 7 1HG MET 1 HG2 MET 1 22.879 6.036 -20.847 8 2HG MET 1 HG1 MET 1 23.170 4.358 -20.387 9 1HE MET 1 HE1 MET 1 24.981 7.146 -19.079 10 2HE MET 1 HE2 MET 1 24.104 7.622 -20.531 11 3HE MET 1 HE3 MET 1 25.857 7.803 -20.468 12 H LYS 2 HN LYS 2 19.856 6.193 -23.231 13 HA LYS 2 HA LYS 2 20.272 6.104 -26.200 14 1HB LYS 2 HB2 LYS 2 17.931 6.584 -24.358 15 2HB LYS 2 HB1 LYS 2 17.868 7.116 -26.038 16 1HG LYS 2 HG2 LYS 2 17.779 4.977 -26.858 17 2HG LYS 2 HG1 LYS 2 18.797 4.329 -25.572 18 1HD LYS 2 HD2 LYS 2 16.310 5.326 -24.471 19 2HD LYS 2 HD1 LYS 2 15.987 4.163 -25.757 20 1HE LYS 2 HE2 LYS 2 16.300 2.624 -24.077 21 2HE LYS 2 HE1 LYS 2 18.019 2.896 -24.417 22 1HZ LYS 2 HZ1 LYS 2 16.406 4.508 -22.510 23 2HZ LYS 2 HZ2 LYS 2 18.077 4.635 -22.787 24 3HZ LYS 2 HZ3 LYS 2 17.438 3.244 -22.052 25 H THR 3 HN THR 3 21.216 7.931 -27.049 26 HA THR 3 HA THR 3 21.739 10.296 -25.459 27 HB THR 3 HB THR 3 22.475 11.148 -27.772 28 HG1 THR 3 HG1 THR 3 21.809 10.029 -29.398 29 1HG2 THR 3 HG21 THR 3 23.547 8.456 -26.887 30 2HG2 THR 3 HG22 THR 3 23.967 9.997 -26.136 31 3HG2 THR 3 HG23 THR 3 24.417 9.680 -27.812 32 H LYS 4 HN LYS 4 19.591 9.724 -28.273 33 HA LYS 4 HA LYS 4 17.801 11.900 -27.267 34 1HB LYS 4 HB2 LYS 4 19.304 11.642 -29.838 35 2HB LYS 4 HB1 LYS 4 17.671 12.304 -29.925 36 1HG LYS 4 HG2 LYS 4 18.601 14.287 -29.366 37 2HG LYS 4 HG1 LYS 4 18.767 13.620 -27.742 38 1HD LYS 4 HD2 LYS 4 20.984 12.592 -28.625 39 2HD LYS 4 HD1 LYS 4 20.829 13.761 -29.936 40 1HE LYS 4 HE2 LYS 4 21.615 15.405 -28.592 41 2HE LYS 4 HE1 LYS 4 20.331 15.085 -27.412 42 1HZ LYS 4 HZ1 LYS 4 22.842 13.515 -27.685 43 2HZ LYS 4 HZ2 LYS 4 21.609 13.235 -26.550 44 3HZ LYS 4 HZ3 LYS 4 22.532 14.658 -26.471 45 H LEU 5 HN LEU 5 17.637 8.888 -27.265 46 HA LEU 5 HA LEU 5 15.304 8.487 -29.108 47 1HB LEU 5 HB2 LEU 5 17.606 6.881 -28.196 48 2HB LEU 5 HB1 LEU 5 16.072 6.011 -28.166 49 HG LEU 5 HG LEU 5 15.940 7.333 -30.581 50 1HD1 LEU 5 HD11 LEU 5 18.258 8.082 -30.429 51 2HD1 LEU 5 HD12 LEU 5 18.126 6.846 -31.681 52 3HD1 LEU 5 HD13 LEU 5 18.797 6.435 -30.103 53 1HD2 LEU 5 HD21 LEU 5 15.342 4.989 -30.176 54 2HD2 LEU 5 HD22 LEU 5 17.044 4.570 -29.987 55 3HD2 LEU 5 HD23 LEU 5 16.437 5.098 -31.555 56 H ASN 6 HN ASN 6 13.340 7.812 -28.220 57 HA ASN 6 HA ASN 6 12.859 8.329 -25.408 58 1HB ASN 6 HB2 ASN 6 10.570 7.819 -26.000 59 2HB ASN 6 HB1 ASN 6 11.286 8.676 -27.364 60 1HD2 ASN 6 HD21 ASN 6 9.999 5.573 -26.300 61 2HD2 ASN 6 HD22 ASN 6 10.081 4.809 -27.814 62 H GLU 7 HN GLU 7 11.871 6.685 -23.922 63 HA GLU 7 HA GLU 7 12.666 3.862 -24.486 64 1HB GLU 7 HB2 GLU 7 13.917 3.767 -22.405 65 2HB GLU 7 HB1 GLU 7 14.507 5.143 -23.336 66 1HG GLU 7 HG2 GLU 7 12.642 6.451 -21.982 67 2HG GLU 7 HG1 GLU 7 12.836 5.118 -20.846 68 H LEU 8 HN LEU 8 11.810 2.407 -22.623 69 HA LEU 8 HA LEU 8 9.123 3.423 -21.753 70 1HB LEU 8 HB2 LEU 8 10.025 1.113 -23.214 71 2HB LEU 8 HB1 LEU 8 9.294 0.570 -21.705 72 HG LEU 8 HG LEU 8 7.595 0.735 -23.472 73 1HD1 LEU 8 HD11 LEU 8 7.112 1.362 -21.038 74 2HD1 LEU 8 HD12 LEU 8 5.968 1.964 -22.237 75 3HD1 LEU 8 HD13 LEU 8 7.188 3.044 -21.562 76 1HD2 LEU 8 HD21 LEU 8 8.631 2.450 -24.866 77 2HD2 LEU 8 HD22 LEU 8 8.452 3.645 -23.581 78 3HD2 LEU 8 HD23 LEU 8 7.024 2.992 -24.385 79 H LEU 9 HN LEU 9 11.019 4.167 -20.009 80 HA LEU 9 HA LEU 9 11.040 2.082 -17.846 81 1HB LEU 9 HB2 LEU 9 12.917 4.323 -18.629 82 2HB LEU 9 HB1 LEU 9 13.004 3.555 -17.044 83 HG LEU 9 HG LEU 9 12.876 1.386 -18.750 84 1HD1 LEU 9 HD11 LEU 9 15.072 2.505 -20.131 85 2HD1 LEU 9 HD12 LEU 9 13.765 3.681 -20.262 86 3HD1 LEU 9 HD13 LEU 9 13.517 2.024 -20.809 87 1HD2 LEU 9 HD21 LEU 9 15.602 2.386 -18.198 88 2HD2 LEU 9 HD22 LEU 9 14.838 0.871 -17.712 89 3HD2 LEU 9 HD23 LEU 9 14.539 2.346 -16.791 90 H GLU 10 HN GLU 10 11.116 5.647 -18.242 91 HA GLU 10 HA GLU 10 10.059 7.363 -17.013 92 1HB GLU 10 HB2 GLU 10 8.120 5.041 -16.861 93 2HB GLU 10 HB1 GLU 10 7.728 6.622 -16.189 94 1HG GLU 10 HG2 GLU 10 6.867 6.829 -18.342 95 2HG GLU 10 HG1 GLU 10 8.484 7.494 -18.559 96 H PHE 11 HN PHE 11 12.062 5.831 -15.596 97 HA PHE 11 HA PHE 11 10.941 5.688 -12.820 98 1HB PHE 11 HB2 PHE 11 12.003 3.658 -13.831 99 2HB PHE 11 HB1 PHE 11 13.504 4.567 -14.004 100 HD1 PHE 11 HD1 PHE 11 11.052 3.254 -11.532 101 HD2 PHE 11 HD2 PHE 11 14.962 4.926 -12.146 102 HE1 PHE 11 HE1 PHE 11 11.652 2.713 -9.188 103 HE2 PHE 11 HE2 PHE 11 15.561 4.385 -9.800 104 HZ PHE 11 HZ PHE 11 13.905 3.279 -8.322 105 HA PRO 12 HA PRO 12 13.235 9.519 -12.352 106 1HB PRO 12 HB2 PRO 12 12.526 9.951 -9.744 107 2HB PRO 12 HB1 PRO 12 11.454 10.312 -11.109 108 1HG PRO 12 HG2 PRO 12 11.462 7.961 -9.280 109 2HG PRO 12 HG1 PRO 12 10.094 8.867 -9.947 110 1HD PRO 12 HD2 PRO 12 10.902 6.466 -10.928 111 2HD PRO 12 HD1 PRO 12 10.127 7.715 -11.930 112 H THR 13 HN THR 13 15.422 9.142 -12.230 113 HA THR 13 HA THR 13 16.485 7.994 -9.674 114 HB THR 13 HB THR 13 16.412 6.232 -11.378 115 HG1 THR 13 HG1 THR 13 18.274 5.668 -10.647 116 1HG2 THR 13 HG21 THR 13 18.063 8.129 -13.074 117 2HG2 THR 13 HG22 THR 13 16.378 7.698 -13.367 118 3HG2 THR 13 HG23 THR 13 17.637 6.471 -13.497 119 HA PRO 14 HA PRO 14 19.123 11.530 -9.899 120 1HB PRO 14 HB2 PRO 14 21.093 10.701 -8.185 121 2HB PRO 14 HB1 PRO 14 19.493 11.238 -7.634 122 1HG PRO 14 HG2 PRO 14 20.546 8.475 -7.973 123 2HG PRO 14 HG1 PRO 14 19.506 9.139 -6.703 124 1HD PRO 14 HD2 PRO 14 18.568 7.632 -8.767 125 2HD PRO 14 HD1 PRO 14 17.598 8.873 -7.942 126 H PHE 15 HN PHE 15 20.541 12.012 -11.531 127 HA PHE 15 HA PHE 15 22.337 9.853 -12.568 128 1HB PHE 15 HB2 PHE 15 20.992 12.298 -13.707 129 2HB PHE 15 HB1 PHE 15 22.365 11.573 -14.537 130 HD1 PHE 15 HD1 PHE 15 22.147 8.804 -14.509 131 HD2 PHE 15 HD2 PHE 15 18.924 11.645 -14.523 132 HE1 PHE 15 HE1 PHE 15 20.644 7.098 -15.501 133 HE2 PHE 15 HE2 PHE 15 17.424 9.939 -15.513 134 HZ PHE 15 HZ PHE 15 18.284 7.665 -16.002 135 H THR 16 HN THR 16 24.220 10.114 -11.306 136 HA THR 16 HA THR 16 25.357 12.760 -10.743 137 HB THR 16 HB THR 16 26.627 10.002 -10.551 138 HG1 THR 16 HG1 THR 16 25.281 9.613 -9.005 139 1HG2 THR 16 HG21 THR 16 27.843 12.351 -10.186 140 2HG2 THR 16 HG22 THR 16 28.191 10.963 -9.155 141 3HG2 THR 16 HG23 THR 16 27.082 12.218 -8.600 142 H TYR 17 HN TYR 17 25.695 13.693 -12.840 143 HA TYR 17 HA TYR 17 27.427 12.193 -14.747 144 1HB TYR 17 HB2 TYR 17 25.417 14.395 -14.819 145 2HB TYR 17 HB1 TYR 17 26.684 14.436 -16.044 146 HD1 TYR 17 HD1 TYR 17 24.889 11.558 -14.410 147 HD2 TYR 17 HD2 TYR 17 25.771 13.665 -18.049 148 HE1 TYR 17 HE1 TYR 17 23.707 9.811 -15.711 149 HE2 TYR 17 HE2 TYR 17 24.590 11.918 -19.348 150 HH TYR 17 HH TYR 17 23.968 8.993 -18.353 151 H LYS 18 HN LYS 18 29.575 12.495 -14.193 152 HA LYS 18 HA LYS 18 30.556 15.053 -13.141 153 1HB LYS 18 HB2 LYS 18 31.323 12.554 -12.744 154 2HB LYS 18 HB1 LYS 18 32.288 12.831 -14.195 155 1HG LYS 18 HG2 LYS 18 32.487 15.080 -12.364 156 2HG LYS 18 HG1 LYS 18 32.959 13.577 -11.573 157 1HD LYS 18 HD2 LYS 18 34.021 13.812 -14.296 158 2HD LYS 18 HD1 LYS 18 34.578 15.097 -13.224 159 1HE LYS 18 HE2 LYS 18 35.881 13.667 -12.017 160 2HE LYS 18 HE1 LYS 18 34.611 12.429 -11.965 161 1HZ LYS 18 HZ1 LYS 18 36.431 13.040 -14.232 162 2HZ LYS 18 HZ2 LYS 18 35.073 12.025 -14.365 163 3HZ LYS 18 HZ3 LYS 18 36.357 11.601 -13.336 164 H VAL 19 HN VAL 19 30.113 16.555 -14.850 165 HA VAL 19 HA VAL 19 31.024 16.068 -17.585 166 HB VAL 19 HB VAL 19 30.142 18.634 -16.213 167 1HG1 VAL 19 HG11 VAL 19 29.259 18.376 -18.918 168 2HG1 VAL 19 HG12 VAL 19 30.990 18.041 -18.877 169 3HG1 VAL 19 HG13 VAL 19 30.371 19.565 -18.244 170 1HG2 VAL 19 HG21 VAL 19 27.902 18.060 -16.589 171 2HG2 VAL 19 HG22 VAL 19 28.588 16.511 -16.102 172 3HG2 VAL 19 HG23 VAL 19 28.313 16.855 -17.809 173 H MET 20 HN MET 20 33.275 15.754 -17.526 174 HA MET 20 HA MET 20 34.995 17.867 -16.303 175 1HB MET 20 HB2 MET 20 35.439 15.544 -15.706 176 2HB MET 20 HB1 MET 20 35.492 15.079 -17.404 177 1HG MET 20 HG2 MET 20 37.436 16.707 -17.666 178 2HG MET 20 HG1 MET 20 37.460 16.825 -15.907 179 1HE MET 20 HE1 MET 20 40.483 14.702 -16.082 180 2HE MET 20 HE2 MET 20 39.492 15.423 -14.815 181 3HE MET 20 HE3 MET 20 39.829 16.334 -16.285 182 H GLY 21 HN GLY 21 36.622 18.921 -17.603 183 1HA GLY 21 HA2 GLY 21 37.243 18.430 -20.299 184 2HA GLY 21 HA1 GLY 21 35.840 19.499 -20.321 185 H GLN 22 HN GLN 22 37.454 20.990 -21.375 186 HA GLN 22 HA GLN 22 39.653 22.099 -19.842 187 1HB GLN 22 HB2 GLN 22 38.938 22.075 -22.431 188 2HB GLN 22 HB1 GLN 22 38.259 23.642 -21.986 189 1HG GLN 22 HG2 GLN 22 40.333 24.557 -21.497 190 2HG GLN 22 HG1 GLN 22 41.049 22.992 -21.112 191 1HE2 GLN 22 HE21 GLN 22 41.947 21.742 -22.853 192 2HE2 GLN 22 HE22 GLN 22 42.072 22.345 -24.437 193 H ALA 23 HN ALA 23 39.717 24.226 -18.856 194 HA ALA 23 HA ALA 23 37.675 24.923 -17.079 195 1HB ALA 23 HB1 ALA 23 40.141 26.037 -18.128 196 2HB ALA 23 HB2 ALA 23 39.443 26.218 -16.518 197 3HB ALA 23 HB3 ALA 23 38.974 27.321 -17.812 198 H LEU 24 HN LEU 24 35.568 25.302 -17.683 199 HA LEU 24 HA LEU 24 35.073 27.318 -19.850 200 1HB LEU 24 HB2 LEU 24 34.465 24.548 -19.758 201 2HB LEU 24 HB1 LEU 24 32.935 25.391 -19.528 202 HG LEU 24 HG LEU 24 33.374 24.999 -21.921 203 1HD1 LEU 24 HD11 LEU 24 32.805 27.509 -20.690 204 2HD1 LEU 24 HD12 LEU 24 32.279 26.928 -22.268 205 3HD1 LEU 24 HD13 LEU 24 33.789 27.825 -22.119 206 1HD2 LEU 24 HD21 LEU 24 35.980 25.287 -21.392 207 2HD2 LEU 24 HD22 LEU 24 35.646 26.945 -21.889 208 3HD2 LEU 24 HD23 LEU 24 35.327 25.610 -22.998 209 HA PRO 25 HA PRO 25 32.973 29.084 -16.272 210 1HB PRO 25 HB2 PRO 25 32.431 31.498 -17.447 211 2HB PRO 25 HB1 PRO 25 34.012 31.089 -16.752 212 1HG PRO 25 HG2 PRO 25 33.138 31.090 -19.596 213 2HG PRO 25 HG1 PRO 25 34.686 31.580 -18.889 214 1HD PRO 25 HD2 PRO 25 34.291 29.192 -20.147 215 2HD PRO 25 HD1 PRO 25 35.502 29.443 -18.872 216 H GLU 26 HN GLU 26 31.770 28.824 -19.581 217 HA GLU 26 HA GLU 26 28.999 29.503 -18.900 218 1HB GLU 26 HB2 GLU 26 30.526 29.541 -21.152 219 2HB GLU 26 HB1 GLU 26 29.671 28.016 -21.380 220 1HG GLU 26 HG2 GLU 26 28.071 30.388 -20.515 221 2HG GLU 26 HG1 GLU 26 28.623 30.336 -22.189 222 H LEU 27 HN LEU 27 30.897 26.706 -18.426 223 HA LEU 27 HA LEU 27 29.116 24.589 -19.114 224 1HB LEU 27 HB2 LEU 27 31.628 24.844 -18.072 225 2HB LEU 27 HB1 LEU 27 30.735 24.313 -16.646 226 HG LEU 27 HG LEU 27 29.728 22.636 -18.560 227 1HD1 LEU 27 HD11 LEU 27 32.660 23.098 -19.186 228 2HD1 LEU 27 HD12 LEU 27 31.303 23.450 -20.257 229 3HD1 LEU 27 HD13 LEU 27 31.678 21.780 -19.831 230 1HD2 LEU 27 HD21 LEU 27 30.362 21.600 -16.596 231 2HD2 LEU 27 HD22 LEU 27 31.904 22.452 -16.520 232 3HD2 LEU 27 HD23 LEU 27 31.701 21.092 -17.624 233 H VAL 28 HN VAL 28 29.512 26.283 -15.961 234 HA VAL 28 HA VAL 28 27.361 24.898 -14.638 235 HB VAL 28 HB VAL 28 29.265 26.176 -13.592 236 1HG1 VAL 28 HG11 VAL 28 29.136 28.594 -13.418 237 2HG1 VAL 28 HG12 VAL 28 27.609 28.615 -14.299 238 3HG1 VAL 28 HG13 VAL 28 29.097 28.155 -15.126 239 1HG2 VAL 28 HG21 VAL 28 26.443 26.232 -12.836 240 2HG2 VAL 28 HG22 VAL 28 27.346 27.573 -12.129 241 3HG2 VAL 28 HG23 VAL 28 27.863 25.912 -11.839 242 H ASP 29 HN ASP 29 27.455 27.852 -16.622 243 HA ASP 29 HA ASP 29 24.791 28.778 -16.030 244 1HB ASP 29 HB2 ASP 29 26.660 30.081 -17.076 245 2HB ASP 29 HB1 ASP 29 26.482 29.106 -18.534 246 H GLN 30 HN GLN 30 26.101 26.768 -18.695 247 HA GLN 30 HA GLN 30 23.511 26.291 -19.918 248 1HB GLN 30 HB2 GLN 30 26.011 26.138 -20.787 249 2HB GLN 30 HB1 GLN 30 25.863 24.468 -20.238 250 1HG GLN 30 HG2 GLN 30 25.133 24.366 -22.478 251 2HG GLN 30 HG1 GLN 30 23.631 24.449 -21.561 252 1HE2 GLN 30 HE21 GLN 30 24.383 25.458 -24.387 253 2HE2 GLN 30 HE22 GLN 30 23.888 27.082 -24.384 254 H VAL 31 HN VAL 31 25.418 24.651 -17.435 255 HA VAL 31 HA VAL 31 24.032 22.146 -17.423 256 HB VAL 31 HB VAL 31 25.732 23.773 -15.572 257 1HG1 VAL 31 HG11 VAL 31 24.500 23.028 -13.790 258 2HG1 VAL 31 HG12 VAL 31 25.435 21.558 -14.057 259 3HG1 VAL 31 HG13 VAL 31 23.799 21.689 -14.698 260 1HG2 VAL 31 HG21 VAL 31 25.954 20.850 -16.288 261 2HG2 VAL 31 HG22 VAL 31 27.236 21.967 -15.821 262 3HG2 VAL 31 HG23 VAL 31 26.481 22.106 -17.408 263 H VAL 32 HN VAL 32 23.448 25.154 -15.537 264 HA VAL 32 HA VAL 32 21.106 24.053 -14.201 265 HB VAL 32 HB VAL 32 22.698 25.831 -13.355 266 1HG1 VAL 32 HG11 VAL 32 21.099 27.602 -15.230 267 2HG1 VAL 32 HG12 VAL 32 22.792 27.162 -15.447 268 3HG1 VAL 32 HG13 VAL 32 22.307 28.145 -14.067 269 1HG2 VAL 32 HG21 VAL 32 20.985 26.994 -12.132 270 2HG2 VAL 32 HG22 VAL 32 20.377 25.366 -12.436 271 3HG2 VAL 32 HG23 VAL 32 19.802 26.719 -13.411 272 H GLU 33 HN GLU 33 21.561 26.124 -17.097 273 HA GLU 33 HA GLU 33 18.704 26.679 -17.333 274 1HB GLU 33 HB2 GLU 33 19.354 27.761 -19.418 275 2HB GLU 33 HB1 GLU 33 20.527 28.165 -18.171 276 1HG GLU 33 HG2 GLU 33 22.069 27.525 -19.705 277 2HG GLU 33 HG1 GLU 33 21.625 25.887 -19.239 278 H VAL 34 HN VAL 34 20.911 24.253 -18.743 279 HA VAL 34 HA VAL 34 18.868 23.229 -20.572 280 HB VAL 34 HB VAL 34 21.403 23.180 -20.868 281 1HG1 VAL 34 HG11 VAL 34 22.734 21.660 -19.711 282 2HG1 VAL 34 HG12 VAL 34 21.363 20.656 -19.243 283 3HG1 VAL 34 HG13 VAL 34 21.638 22.201 -18.441 284 1HG2 VAL 34 HG21 VAL 34 21.233 20.616 -21.602 285 2HG2 VAL 34 HG22 VAL 34 20.366 21.886 -22.466 286 3HG2 VAL 34 HG23 VAL 34 19.523 20.898 -21.274 287 H VAL 35 HN VAL 35 20.058 22.402 -17.320 288 HA VAL 35 HA VAL 35 18.558 19.912 -17.144 289 HB VAL 35 HB VAL 35 20.653 20.699 -15.848 290 1HG1 VAL 35 HG11 VAL 35 18.554 21.896 -14.029 291 2HG1 VAL 35 HG12 VAL 35 19.516 22.862 -15.146 292 3HG1 VAL 35 HG13 VAL 35 20.308 21.967 -13.850 293 1HG2 VAL 35 HG21 VAL 35 18.430 19.010 -15.104 294 2HG2 VAL 35 HG22 VAL 35 19.154 19.720 -13.664 295 3HG2 VAL 35 HG23 VAL 35 20.148 18.785 -14.775 296 H GLN 36 HN GLN 36 17.914 23.311 -16.394 297 HA GLN 36 HA GLN 36 15.446 22.796 -14.922 298 1HB GLN 36 HB2 GLN 36 16.751 24.816 -14.564 299 2HB GLN 36 HB1 GLN 36 16.648 25.236 -16.274 300 1HG GLN 36 HG2 GLN 36 14.613 26.178 -16.009 301 2HG GLN 36 HG1 GLN 36 14.012 24.781 -15.116 302 1HE2 GLN 36 HE21 GLN 36 15.600 27.940 -14.752 303 2HE2 GLN 36 HE22 GLN 36 15.404 28.035 -13.069 304 H ARG 37 HN ARG 37 16.317 23.510 -18.299 305 HA ARG 37 HA ARG 37 13.655 23.962 -19.295 306 1HB ARG 37 HB2 ARG 37 16.362 23.275 -20.375 307 2HB ARG 37 HB1 ARG 37 14.975 23.099 -21.453 308 1HG ARG 37 HG2 ARG 37 14.310 25.466 -20.767 309 2HG ARG 37 HG1 ARG 37 15.904 25.600 -20.028 310 1HD ARG 37 HD2 ARG 37 15.524 24.782 -22.925 311 2HD ARG 37 HD1 ARG 37 15.763 26.467 -22.422 312 HE ARG 37 HE ARG 37 17.873 25.510 -21.215 313 1HH1 ARG 37 HH11 ARG 37 17.549 22.730 -22.268 314 2HH1 ARG 37 HH12 ARG 37 18.555 22.749 -23.678 315 1HH2 ARG 37 HH21 ARG 37 18.720 26.218 -23.836 316 2HH2 ARG 37 HH22 ARG 37 19.220 24.731 -24.568 317 H HIS 38 HN HIS 38 15.420 21.016 -18.521 318 HA HIS 38 HA HIS 38 13.346 19.359 -19.900 319 1HB HIS 38 HB2 HIS 38 16.210 19.126 -19.209 320 2HB HIS 38 HB1 HIS 38 15.277 17.646 -18.990 321 HD1 HIS 38 HD1 HIS 38 14.106 16.640 -21.113 322 HD2 HIS 38 HD2 HIS 38 16.539 19.934 -21.893 323 HE1 HIS 38 HE1 HIS 38 14.435 16.708 -23.624 324 H ALA 39 HN ALA 39 15.031 19.661 -16.747 325 HA ALA 39 HA ALA 39 12.991 17.902 -15.479 326 1HB ALA 39 HB1 ALA 39 15.147 17.320 -14.783 327 2HB ALA 39 HB2 ALA 39 14.662 18.423 -13.495 328 3HB ALA 39 HB3 ALA 39 15.710 18.990 -14.794 329 HA PRO 40 HA PRO 40 10.728 21.285 -13.820 330 1HB PRO 40 HB2 PRO 40 9.879 20.225 -11.438 331 2HB PRO 40 HB1 PRO 40 9.203 19.758 -13.011 332 1HG PRO 40 HG2 PRO 40 11.236 18.363 -11.335 333 2HG PRO 40 HG1 PRO 40 9.887 17.690 -12.266 334 1HD PRO 40 HD2 PRO 40 12.449 17.631 -13.145 335 2HD PRO 40 HD1 PRO 40 11.056 17.731 -14.245 336 H GLY 41 HN GLY 41 13.023 19.744 -11.537 337 1HA GLY 41 HA2 GLY 41 13.289 22.311 -10.073 338 2HA GLY 41 HA1 GLY 41 13.967 20.764 -9.567 339 H ASP 42 HN ASP 42 15.277 23.446 -9.963 340 HA ASP 42 HA ASP 42 17.016 23.180 -12.294 341 1HB ASP 42 HB2 ASP 42 17.937 25.242 -11.497 342 2HB ASP 42 HB1 ASP 42 16.221 25.311 -11.099 343 H TYR 43 HN TYR 43 19.379 22.915 -12.093 344 HA TYR 43 HA TYR 43 20.316 21.523 -9.624 345 1HB TYR 43 HB2 TYR 43 20.146 20.470 -12.444 346 2HB TYR 43 HB1 TYR 43 21.328 19.817 -11.313 347 HD1 TYR 43 HD1 TYR 43 18.005 19.524 -12.493 348 HD2 TYR 43 HD2 TYR 43 20.363 19.199 -8.918 349 HE1 TYR 43 HE1 TYR 43 16.249 18.114 -11.468 350 HE2 TYR 43 HE2 TYR 43 18.606 17.789 -7.889 351 HH TYR 43 HH TYR 43 15.870 16.604 -9.733 352 H THR 44 HN THR 44 22.757 21.197 -9.713 353 HA THR 44 HA THR 44 24.160 23.150 -11.495 354 HB THR 44 HB THR 44 24.705 23.031 -8.526 355 HG1 THR 44 HG1 THR 44 22.967 24.124 -8.105 356 1HG2 THR 44 HG21 THR 44 26.328 24.319 -9.614 357 2HG2 THR 44 HG22 THR 44 25.151 25.535 -9.121 358 3HG2 THR 44 HG23 THR 44 25.175 24.957 -10.786 359 HA PRO 45 HA PRO 45 27.300 19.994 -11.240 360 1HB PRO 45 HB2 PRO 45 29.201 21.313 -12.689 361 2HB PRO 45 HB1 PRO 45 27.732 20.644 -13.423 362 1HG PRO 45 HG2 PRO 45 28.474 23.423 -12.999 363 2HG PRO 45 HG1 PRO 45 27.188 22.747 -14.004 364 1HD PRO 45 HD2 PRO 45 27.007 23.914 -11.348 365 2HD PRO 45 HD1 PRO 45 25.699 23.459 -12.463 366 H THR 46 HN THR 46 28.983 19.523 -9.783 367 HA THR 46 HA THR 46 30.045 21.747 -8.111 368 HB THR 46 HB THR 46 30.266 18.722 -7.874 369 HG1 THR 46 HG1 THR 46 28.334 18.830 -7.099 370 1HG2 THR 46 HG21 THR 46 31.983 20.185 -6.671 371 2HG2 THR 46 HG22 THR 46 31.047 19.093 -5.651 372 3HG2 THR 46 HG23 THR 46 30.637 20.807 -5.717 373 H VAL 47 HN VAL 47 31.734 22.678 -9.318 374 HA VAL 47 HA VAL 47 33.607 21.097 -10.887 375 HB VAL 47 HB VAL 47 32.910 23.437 -11.383 376 1HG1 VAL 47 HG11 VAL 47 33.124 23.991 -8.795 377 2HG1 VAL 47 HG12 VAL 47 33.404 25.240 -10.007 378 3HG1 VAL 47 HG13 VAL 47 34.772 24.423 -9.251 379 1HG2 VAL 47 HG21 VAL 47 35.064 24.183 -12.115 380 2HG2 VAL 47 HG22 VAL 47 35.135 22.421 -12.129 381 3HG2 VAL 47 HG23 VAL 47 35.882 23.322 -10.810 382 H LYS 48 HN LYS 48 35.673 20.455 -10.374 383 HA LYS 48 HA LYS 48 36.838 21.226 -7.742 384 1HB LYS 48 HB2 LYS 48 37.189 18.896 -7.155 385 2HB LYS 48 HB1 LYS 48 35.486 19.100 -7.555 386 1HG LYS 48 HG2 LYS 48 36.205 18.395 -9.959 387 2HG LYS 48 HG1 LYS 48 37.657 17.778 -9.173 388 1HD LYS 48 HD2 LYS 48 36.534 16.082 -8.127 389 2HD LYS 48 HD1 LYS 48 35.086 17.057 -7.879 390 1HE LYS 48 HE2 LYS 48 35.680 16.431 -10.716 391 2HE LYS 48 HE1 LYS 48 35.226 15.041 -9.713 392 1HZ LYS 48 HZ1 LYS 48 33.750 17.622 -9.837 393 2HZ LYS 48 HZ2 LYS 48 33.317 16.268 -8.906 394 3HZ LYS 48 HZ3 LYS 48 33.268 16.187 -10.602 395 HA PRO 49 HA PRO 49 40.478 21.409 -10.203 396 1HB PRO 49 HB2 PRO 49 42.391 21.176 -8.262 397 2HB PRO 49 HB1 PRO 49 41.412 22.639 -8.485 398 1HG PRO 49 HG2 PRO 49 41.145 20.474 -6.473 399 2HG PRO 49 HG1 PRO 49 40.860 22.213 -6.309 400 1HD PRO 49 HD2 PRO 49 38.876 20.330 -6.604 401 2HD PRO 49 HD1 PRO 49 38.703 22.050 -7.016 402 H SER 50 HN SER 50 40.077 19.302 -11.266 403 HA SER 50 HA SER 50 41.342 16.899 -10.070 404 1HB SER 50 HB2 SER 50 39.480 17.580 -12.295 405 2HB SER 50 HB1 SER 50 40.480 16.148 -12.523 406 HG SER 50 HG SER 50 38.633 15.522 -11.452 407 H SER 51 HN SER 51 41.640 18.902 -13.026 408 HA SER 51 HA SER 51 44.375 17.760 -13.475 409 1HB SER 51 HB2 SER 51 42.185 18.889 -15.199 410 2HB SER 51 HB1 SER 51 43.845 18.914 -15.786 411 HG SER 51 HG SER 51 42.867 16.990 -16.407 412 H LYS 52 HN LYS 52 46.047 19.325 -14.161 413 HA LYS 52 HA LYS 52 45.717 21.962 -12.810 414 1HB LYS 52 HB2 LYS 52 47.880 20.045 -13.420 415 2HB LYS 52 HB1 LYS 52 48.339 21.737 -13.613 416 1HG LYS 52 HG2 LYS 52 48.772 21.450 -11.352 417 2HG LYS 52 HG1 LYS 52 47.097 21.998 -11.287 418 1HD LYS 52 HD2 LYS 52 46.759 19.302 -11.629 419 2HD LYS 52 HD1 LYS 52 48.233 19.346 -10.663 420 1HE LYS 52 HE2 LYS 52 46.836 19.561 -8.871 421 2HE LYS 52 HE1 LYS 52 46.615 21.235 -9.413 422 1HZ LYS 52 HZ1 LYS 52 45.034 18.910 -10.384 423 2HZ LYS 52 HZ2 LYS 52 44.809 20.535 -10.828 424 3HZ LYS 52 HZ3 LYS 52 44.493 20.034 -9.237 425 H GLY 53 HN GLY 53 46.558 23.904 -13.936 426 1HA GLY 53 HA2 GLY 53 47.136 25.157 -15.899 427 2HA GLY 53 HA1 GLY 53 46.800 23.732 -16.882 428 H ASN 54 HN ASN 54 45.196 24.372 -18.265 429 HA ASN 54 HA ASN 54 42.908 25.970 -17.203 430 1HB ASN 54 HB2 ASN 54 44.474 26.218 -19.430 431 2HB ASN 54 HB1 ASN 54 43.129 25.286 -20.085 432 1HD2 ASN 54 HD21 ASN 54 41.188 26.417 -20.510 433 2HD2 ASN 54 HD22 ASN 54 40.915 28.033 -20.064 434 H TYR 55 HN TYR 55 42.472 23.659 -16.105 435 HA TYR 55 HA TYR 55 40.431 22.309 -17.811 436 1HB TYR 55 HB2 TYR 55 42.947 21.302 -17.567 437 2HB TYR 55 HB1 TYR 55 42.178 20.558 -16.166 438 HD1 TYR 55 HD1 TYR 55 40.473 18.871 -16.411 439 HD2 TYR 55 HD2 TYR 55 42.042 20.910 -19.851 440 HE1 TYR 55 HE1 TYR 55 39.368 17.219 -17.895 441 HE2 TYR 55 HE2 TYR 55 40.938 19.259 -21.334 442 HH TYR 55 HH TYR 55 40.063 16.469 -20.652 443 H HIS 56 HN HIS 56 38.692 21.490 -16.601 444 HA HIS 56 HA HIS 56 38.874 21.510 -13.630 445 1HB HIS 56 HB2 HIS 56 37.077 23.062 -13.400 446 2HB HIS 56 HB1 HIS 56 38.143 23.768 -14.609 447 HD1 HIS 56 HD1 HIS 56 34.801 23.805 -14.160 448 HD2 HIS 56 HD2 HIS 56 37.033 22.211 -17.296 449 HE1 HIS 56 HE1 HIS 56 33.247 23.680 -16.154 450 H SER 57 HN SER 57 37.235 20.196 -12.620 451 HA SER 57 HA SER 57 35.685 18.456 -14.524 452 1HB SER 57 HB2 SER 57 37.839 17.682 -13.129 453 2HB SER 57 HB1 SER 57 36.636 17.476 -11.862 454 HG SER 57 HG SER 57 37.109 15.685 -13.485 455 H VAL 58 HN VAL 58 33.549 19.102 -14.231 456 HA VAL 58 HA VAL 58 32.655 19.675 -11.431 457 HB VAL 58 HB VAL 58 31.051 21.148 -12.374 458 1HG1 VAL 58 HG11 VAL 58 33.142 21.561 -14.461 459 2HG1 VAL 58 HG12 VAL 58 33.649 21.620 -12.774 460 3HG1 VAL 58 HG13 VAL 58 32.406 22.725 -13.360 461 1HG2 VAL 58 HG21 VAL 58 30.295 19.499 -14.142 462 2HG2 VAL 58 HG22 VAL 58 31.656 20.033 -15.127 463 3HG2 VAL 58 HG23 VAL 58 30.384 21.171 -14.692 464 H SER 59 HN SER 59 30.777 18.665 -10.635 465 HA SER 59 HA SER 59 29.798 16.313 -12.222 466 1HB SER 59 HB2 SER 59 31.125 16.237 -9.899 467 2HB SER 59 HB1 SER 59 29.518 16.544 -9.246 468 HG SER 59 HG SER 59 29.843 14.325 -9.446 469 H ILE 60 HN ILE 60 27.772 16.802 -13.030 470 HA ILE 60 HA ILE 60 26.084 18.776 -11.607 471 HB ILE 60 HB ILE 60 26.487 18.826 -14.085 472 1HG1 ILE 60 HG12 ILE 60 23.661 18.441 -13.059 473 2HG1 ILE 60 HG11 ILE 60 24.532 19.959 -13.258 474 1HG2 ILE 60 HG21 ILE 60 24.605 16.482 -14.300 475 2HG2 ILE 60 HG22 ILE 60 26.342 16.220 -14.188 476 3HG2 ILE 60 HG23 ILE 60 25.679 17.153 -15.527 477 1HD1 ILE 60 HD11 ILE 60 23.412 20.059 -15.243 478 2HD1 ILE 60 HD12 ILE 60 23.112 18.322 -15.271 479 3HD1 ILE 60 HD13 ILE 60 24.672 18.956 -15.795 480 H THR 61 HN THR 61 24.453 18.223 -10.300 481 HA THR 61 HA THR 61 23.674 15.352 -10.060 482 HB THR 61 HB THR 61 23.148 17.873 -8.445 483 HG1 THR 61 HG1 THR 61 24.975 17.296 -7.626 484 1HG2 THR 61 HG21 THR 61 22.148 15.047 -8.094 485 2HG2 THR 61 HG22 THR 61 21.224 16.548 -8.062 486 3HG2 THR 61 HG23 THR 61 22.303 16.149 -6.725 487 H ILE 62 HN ILE 62 21.651 14.636 -10.795 488 HA ILE 62 HA ILE 62 19.445 16.526 -11.223 489 HB ILE 62 HB ILE 62 20.728 17.035 -13.185 490 1HG1 ILE 62 HG12 ILE 62 18.602 14.989 -13.905 491 2HG1 ILE 62 HG11 ILE 62 18.323 16.703 -13.600 492 1HG2 ILE 62 HG21 ILE 62 22.171 14.955 -13.009 493 2HG2 ILE 62 HG22 ILE 62 21.696 15.389 -14.650 494 3HG2 ILE 62 HG23 ILE 62 20.872 14.074 -13.812 495 1HD1 ILE 62 HD11 ILE 62 20.261 16.870 -15.493 496 2HD1 ILE 62 HD12 ILE 62 18.538 16.859 -15.869 497 3HD1 ILE 62 HD13 ILE 62 19.474 15.370 -15.985 498 H ASN 63 HN ASN 63 17.711 15.352 -10.560 499 HA ASN 63 HA ASN 63 17.705 12.394 -10.840 500 1HB ASN 63 HB2 ASN 63 17.100 13.672 -8.723 501 2HB ASN 63 HB1 ASN 63 15.668 14.255 -9.572 502 1HD2 ASN 63 HD21 ASN 63 14.027 12.628 -10.205 503 2HD2 ASN 63 HD22 ASN 63 13.978 11.115 -9.438 504 H ALA 64 HN ALA 64 17.212 11.971 -13.019 505 HA ALA 64 HA ALA 64 14.739 13.257 -14.131 506 1HB ALA 64 HB1 ALA 64 17.276 13.327 -15.073 507 2HB ALA 64 HB2 ALA 64 15.866 13.383 -16.132 508 3HB ALA 64 HB3 ALA 64 16.710 11.857 -15.868 509 H THR 65 HN THR 65 13.089 11.928 -14.855 510 HA THR 65 HA THR 65 13.040 9.134 -14.061 511 HB THR 65 HB THR 65 10.797 9.242 -15.186 512 HG1 THR 65 HG1 THR 65 10.241 11.000 -16.303 513 1HG2 THR 65 HG21 THR 65 11.285 10.091 -12.828 514 2HG2 THR 65 HG22 THR 65 9.828 10.723 -13.591 515 3HG2 THR 65 HG23 THR 65 11.286 11.713 -13.516 516 H HIS 66 HN HIS 66 14.390 10.670 -16.771 517 HA HIS 66 HA HIS 66 14.252 8.133 -18.367 518 1HB HIS 66 HB2 HIS 66 13.787 11.013 -19.064 519 2HB HIS 66 HB1 HIS 66 14.484 9.959 -20.291 520 HD1 HIS 66 HD1 HIS 66 11.427 10.204 -18.047 521 HD2 HIS 66 HD2 HIS 66 12.648 8.283 -21.538 522 HE1 HIS 66 HE1 HIS 66 9.376 9.055 -18.984 523 H ILE 67 HN ILE 67 16.248 7.407 -19.086 524 HA ILE 67 HA ILE 67 18.684 8.688 -18.144 525 HB ILE 67 HB ILE 67 18.183 6.201 -18.508 526 1HG1 ILE 67 HG12 ILE 67 20.662 6.617 -20.021 527 2HG1 ILE 67 HG11 ILE 67 20.557 7.637 -18.587 528 1HG2 ILE 67 HG21 ILE 67 18.424 5.287 -20.709 529 2HG2 ILE 67 HG22 ILE 67 18.937 6.839 -21.369 530 3HG2 ILE 67 HG23 ILE 67 17.269 6.610 -20.847 531 1HD1 ILE 67 HD11 ILE 67 21.594 5.503 -17.997 532 2HD1 ILE 67 HD12 ILE 67 20.220 4.625 -18.670 533 3HD1 ILE 67 HD13 ILE 67 20.010 5.622 -17.231 534 H GLU 68 HN GLU 68 16.785 8.839 -21.082 535 HA GLU 68 HA GLU 68 18.866 9.898 -22.812 536 1HB GLU 68 HB2 GLU 68 16.686 8.677 -23.391 537 2HB GLU 68 HB1 GLU 68 15.863 10.199 -23.047 538 1HG GLU 68 HG2 GLU 68 18.128 10.712 -24.745 539 2HG GLU 68 HG1 GLU 68 17.145 9.432 -25.452 540 H GLN 69 HN GLN 69 16.420 11.298 -20.649 541 HA GLN 69 HA GLN 69 16.517 14.008 -21.535 542 1HB GLN 69 HB2 GLN 69 14.926 12.829 -19.912 543 2HB GLN 69 HB1 GLN 69 16.179 13.028 -18.687 544 1HG GLN 69 HG2 GLN 69 15.820 15.535 -20.034 545 2HG GLN 69 HG1 GLN 69 14.238 14.939 -19.527 546 1HE2 GLN 69 HE21 GLN 69 13.705 15.274 -17.350 547 2HE2 GLN 69 HE22 GLN 69 14.819 15.677 -16.135 548 H VAL 70 HN VAL 70 18.408 12.356 -18.967 549 HA VAL 70 HA VAL 70 20.032 14.684 -18.371 550 HB VAL 70 HB VAL 70 19.512 12.784 -16.827 551 1HG1 VAL 70 HG11 VAL 70 19.885 10.659 -17.444 552 2HG1 VAL 70 HG12 VAL 70 21.602 10.998 -17.646 553 3HG1 VAL 70 HG13 VAL 70 20.494 11.231 -18.994 554 1HG2 VAL 70 HG21 VAL 70 21.324 14.109 -16.118 555 2HG2 VAL 70 HG22 VAL 70 22.364 13.548 -17.427 556 3HG2 VAL 70 HG23 VAL 70 21.977 12.473 -16.084 557 H GLU 71 HN GLU 71 20.293 12.042 -20.705 558 HA GLU 71 HA GLU 71 23.110 12.410 -21.325 559 1HB GLU 71 HB2 GLU 71 20.746 10.927 -22.340 560 2HB GLU 71 HB1 GLU 71 21.973 11.292 -23.554 561 1HG GLU 71 HG2 GLU 71 23.699 10.234 -22.202 562 2HG GLU 71 HG1 GLU 71 22.556 9.978 -20.883 563 H THR 72 HN THR 72 20.051 13.554 -22.784 564 HA THR 72 HA THR 72 21.206 15.086 -24.922 565 HB THR 72 HB THR 72 18.629 15.439 -23.341 566 HG1 THR 72 HG1 THR 72 18.091 13.686 -24.328 567 1HG2 THR 72 HG21 THR 72 19.202 16.287 -26.187 568 2HG2 THR 72 HG22 THR 72 19.372 17.379 -24.814 569 3HG2 THR 72 HG23 THR 72 17.797 16.690 -25.200 570 H LEU 73 HN LEU 73 20.431 15.840 -21.531 571 HA LEU 73 HA LEU 73 20.963 18.658 -21.589 572 1HB LEU 73 HB2 LEU 73 20.610 16.461 -19.646 573 2HB LEU 73 HB1 LEU 73 21.620 17.778 -19.053 574 HG LEU 73 HG LEU 73 19.890 19.389 -19.369 575 1HD1 LEU 73 HD11 LEU 73 19.136 17.861 -21.553 576 2HD1 LEU 73 HD12 LEU 73 18.246 19.244 -20.924 577 3HD1 LEU 73 HD13 LEU 73 17.804 17.611 -20.428 578 1HD2 LEU 73 HD21 LEU 73 17.981 18.407 -18.100 579 2HD2 LEU 73 HD22 LEU 73 19.544 17.995 -17.394 580 3HD2 LEU 73 HD23 LEU 73 18.670 16.804 -18.357 581 H TYR 74 HN TYR 74 23.071 15.823 -21.046 582 HA TYR 74 HA TYR 74 25.479 17.204 -20.344 583 1HB TYR 74 HB2 TYR 74 25.621 14.921 -20.001 584 2HB TYR 74 HB1 TYR 74 24.649 14.544 -21.420 585 HD1 TYR 74 HD1 TYR 74 27.891 16.371 -20.829 586 HD2 TYR 74 HD2 TYR 74 25.813 13.296 -22.995 587 HE1 TYR 74 HE1 TYR 74 29.951 15.888 -22.120 588 HE2 TYR 74 HE2 TYR 74 27.875 12.813 -24.285 589 HH TYR 74 HH TYR 74 30.699 13.390 -23.524 590 H GLU 75 HN GLU 75 24.176 16.182 -23.525 591 HA GLU 75 HA GLU 75 26.342 17.162 -25.134 592 1HB GLU 75 HB2 GLU 75 23.896 15.830 -25.444 593 2HB GLU 75 HB1 GLU 75 23.701 17.319 -26.367 594 1HG GLU 75 HG2 GLU 75 26.206 15.671 -26.645 595 2HG GLU 75 HG1 GLU 75 24.755 15.253 -27.555 596 H GLU 76 HN GLU 76 23.413 18.748 -23.878 597 HA GLU 76 HA GLU 76 23.673 21.184 -25.412 598 1HB GLU 76 HB2 GLU 76 22.083 20.070 -23.204 599 2HB GLU 76 HB1 GLU 76 22.315 21.815 -23.093 600 1HG GLU 76 HG2 GLU 76 20.613 21.993 -24.569 601 2HG GLU 76 HG1 GLU 76 21.758 21.423 -25.784 602 H LEU 77 HN LEU 77 24.512 20.432 -21.987 603 HA LEU 77 HA LEU 77 25.801 22.980 -21.529 604 1HB LEU 77 HB2 LEU 77 26.047 22.158 -19.387 605 2HB LEU 77 HB1 LEU 77 24.827 21.028 -19.961 606 HG LEU 77 HG LEU 77 26.968 19.661 -20.765 607 1HD1 LEU 77 HD11 LEU 77 28.303 20.450 -18.317 608 2HD1 LEU 77 HD12 LEU 77 28.147 21.829 -19.405 609 3HD1 LEU 77 HD13 LEU 77 28.951 20.359 -19.955 610 1HD2 LEU 77 HD21 LEU 77 26.379 19.684 -17.807 611 2HD2 LEU 77 HD22 LEU 77 26.729 18.304 -18.848 612 3HD2 LEU 77 HD23 LEU 77 25.174 19.127 -18.969 613 H GLY 78 HN GLY 78 26.914 19.891 -22.817 614 1HA GLY 78 HA2 GLY 78 29.714 20.930 -22.876 615 2HA GLY 78 HA1 GLY 78 29.274 19.225 -22.993 616 H LYS 79 HN LYS 79 27.875 22.011 -24.722 617 HA LYS 79 HA LYS 79 28.332 20.580 -27.290 618 1HB LYS 79 HB2 LYS 79 26.162 21.779 -26.262 619 2HB LYS 79 HB1 LYS 79 26.873 23.176 -27.070 620 1HG LYS 79 HG2 LYS 79 26.765 22.149 -29.196 621 2HG LYS 79 HG1 LYS 79 26.551 20.541 -28.503 622 1HD LYS 79 HD2 LYS 79 24.404 21.927 -27.454 623 2HD LYS 79 HD1 LYS 79 24.545 22.611 -29.075 624 1HE LYS 79 HE2 LYS 79 23.680 20.729 -29.992 625 2HE LYS 79 HE1 LYS 79 24.884 19.725 -29.164 626 1HZ LYS 79 HZ1 LYS 79 23.588 19.796 -27.163 627 2HZ LYS 79 HZ2 LYS 79 22.582 19.272 -28.427 628 3HZ LYS 79 HZ3 LYS 79 22.471 20.868 -27.857 629 H ILE 80 HN ILE 80 30.112 22.682 -25.472 630 HA ILE 80 HA ILE 80 30.814 24.769 -27.336 631 HB ILE 80 HB ILE 80 32.574 23.624 -25.154 632 1HG1 ILE 80 HG12 ILE 80 31.076 25.725 -24.049 633 2HG1 ILE 80 HG11 ILE 80 29.890 24.732 -24.898 634 1HG2 ILE 80 HG21 ILE 80 32.504 26.044 -26.788 635 2HG2 ILE 80 HG22 ILE 80 33.808 25.402 -25.791 636 3HG2 ILE 80 HG23 ILE 80 32.557 26.408 -25.064 637 1HD1 ILE 80 HD11 ILE 80 31.688 22.961 -23.578 638 2HD1 ILE 80 HD12 ILE 80 29.979 23.225 -23.234 639 3HD1 ILE 80 HD13 ILE 80 31.204 24.190 -22.409 640 H ASP 81 HN ASP 81 32.759 24.919 -28.623 641 HA ASP 81 HA ASP 81 33.546 22.498 -29.995 642 1HB ASP 81 HB2 ASP 81 34.945 24.006 -31.253 643 2HB ASP 81 HB1 ASP 81 33.478 24.896 -30.853 644 H ILE 82 HN ILE 82 34.652 24.014 -27.082 645 HA ILE 82 HA ILE 82 37.394 23.088 -27.070 646 HB ILE 82 HB ILE 82 35.472 23.814 -24.825 647 1HG1 ILE 82 HG12 ILE 82 35.649 25.620 -26.479 648 2HG1 ILE 82 HG11 ILE 82 36.506 26.072 -25.008 649 1HG2 ILE 82 HG21 ILE 82 38.463 23.469 -24.961 650 2HG2 ILE 82 HG22 ILE 82 37.329 22.814 -23.779 651 3HG2 ILE 82 HG23 ILE 82 37.729 24.532 -23.762 652 1HD1 ILE 82 HD11 ILE 82 38.490 24.810 -26.426 653 2HD1 ILE 82 HD12 ILE 82 38.227 26.555 -26.412 654 3HD1 ILE 82 HD13 ILE 82 37.560 25.572 -27.717 655 H VAL 83 HN VAL 83 38.123 21.450 -25.320 656 HA VAL 83 HA VAL 83 36.992 18.873 -25.814 657 HB VAL 83 HB VAL 83 38.833 19.965 -23.660 658 1HG1 VAL 83 HG11 VAL 83 39.538 17.507 -23.496 659 2HG1 VAL 83 HG12 VAL 83 38.038 17.125 -24.341 660 3HG1 VAL 83 HG13 VAL 83 37.985 17.918 -22.767 661 1HG2 VAL 83 HG21 VAL 83 40.602 19.070 -25.069 662 2HG2 VAL 83 HG22 VAL 83 39.569 20.097 -26.065 663 3HG2 VAL 83 HG23 VAL 83 39.419 18.342 -26.158 664 H ARG 84 HN ARG 84 35.016 18.220 -25.119 665 HA ARG 84 HA ARG 84 34.109 18.997 -22.361 666 1HB ARG 84 HB2 ARG 84 31.834 18.975 -23.304 667 2HB ARG 84 HB1 ARG 84 32.863 20.060 -24.235 668 1HG ARG 84 HG2 ARG 84 32.053 18.917 -26.030 669 2HG ARG 84 HG1 ARG 84 33.246 17.702 -25.575 670 1HD ARG 84 HD2 ARG 84 31.652 16.294 -24.624 671 2HD ARG 84 HD1 ARG 84 30.548 17.632 -24.247 672 HE ARG 84 HE ARG 84 30.602 17.738 -26.969 673 1HH1 ARG 84 HH21 ARG 84 28.233 16.578 -25.554 674 2HH1 ARG 84 HH22 ARG 84 28.133 14.992 -26.242 675 1HH2 ARG 84 HH11 ARG 84 31.363 15.062 -27.524 676 2HH2 ARG 84 HH12 ARG 84 29.911 14.132 -27.362 677 H MET 85 HN MET 85 33.276 17.302 -21.071 678 HA MET 85 HA MET 85 32.804 14.623 -22.235 679 1HB MET 85 HB2 MET 85 35.352 15.327 -21.461 680 2HB MET 85 HB1 MET 85 34.723 14.581 -19.992 681 1HG MET 85 HG2 MET 85 33.846 12.771 -21.767 682 2HG MET 85 HG1 MET 85 35.245 13.363 -22.662 683 1HE MET 85 HE1 MET 85 34.967 10.839 -18.946 684 2HE MET 85 HE2 MET 85 33.707 11.581 -19.932 685 3HE MET 85 HE3 MET 85 34.515 12.529 -18.684 686 H VAL 86 HN VAL 86 31.837 13.146 -20.620 687 HA VAL 86 HA VAL 86 30.999 14.420 -18.054 688 HB VAL 86 HB VAL 86 29.340 14.788 -19.942 689 1HG1 VAL 86 HG11 VAL 86 27.958 12.884 -20.624 690 2HG1 VAL 86 HG12 VAL 86 28.905 11.805 -19.602 691 3HG1 VAL 86 HG13 VAL 86 29.648 12.561 -21.010 692 1HG2 VAL 86 HG21 VAL 86 28.887 14.522 -17.346 693 2HG2 VAL 86 HG22 VAL 86 28.041 13.064 -17.865 694 3HG2 VAL 86 HG23 VAL 86 27.543 14.640 -18.481 695 H LEU 87 HN LEU 87 30.290 12.848 -16.452 696 HA LEU 87 HA LEU 87 30.550 10.838 -15.259 697 1HB LEU 87 HB2 LEU 87 29.923 9.874 -18.070 698 2HB LEU 87 HB1 LEU 87 29.936 8.813 -16.662 699 HG LEU 87 HG LEU 87 28.274 11.337 -16.746 700 1HD1 LEU 87 HD11 LEU 87 27.400 8.525 -17.475 701 2HD1 LEU 87 HD12 LEU 87 27.641 9.833 -18.632 702 3HD1 LEU 87 HD13 LEU 87 26.372 9.956 -17.415 703 1HD2 LEU 87 HD21 LEU 87 28.177 8.784 -15.103 704 2HD2 LEU 87 HD22 LEU 87 26.992 10.086 -15.000 705 3HD2 LEU 87 HD23 LEU 87 28.666 10.378 -14.530 Start of MODEL 11 1 1H MET 1 HT1 MET 1 26.086 10.634 -20.798 2 2H MET 1 HT2 MET 1 26.045 9.485 -19.550 3 3H MET 1 HT3 MET 1 24.665 9.759 -20.500 4 HA MET 1 HA MET 1 26.034 8.997 -22.479 5 1HB MET 1 HB2 MET 1 27.887 8.966 -20.231 6 2HB MET 1 HB1 MET 1 27.846 7.406 -21.051 7 1HG MET 1 HG2 MET 1 28.133 8.636 -23.233 8 2HG MET 1 HG1 MET 1 28.390 10.110 -22.297 9 1HE MET 1 HE1 MET 1 30.572 8.673 -24.393 10 2HE MET 1 HE2 MET 1 31.925 9.364 -23.498 11 3HE MET 1 HE3 MET 1 30.436 10.289 -23.683 12 H LYS 2 HN LYS 2 26.100 6.585 -22.931 13 HA LYS 2 HA LYS 2 25.189 4.420 -22.804 14 1HB LYS 2 HB2 LYS 2 26.031 5.008 -20.287 15 2HB LYS 2 HB1 LYS 2 24.309 4.763 -19.989 16 1HG LYS 2 HG2 LYS 2 25.077 2.692 -21.742 17 2HG LYS 2 HG1 LYS 2 26.357 2.790 -20.533 18 1HD LYS 2 HD2 LYS 2 25.019 1.697 -19.092 19 2HD LYS 2 HD1 LYS 2 23.919 3.076 -19.126 20 1HE LYS 2 HE2 LYS 2 23.380 1.722 -21.518 21 2HE LYS 2 HE1 LYS 2 23.573 0.435 -20.311 22 1HZ LYS 2 HZ1 LYS 2 22.189 1.973 -18.822 23 2HZ LYS 2 HZ2 LYS 2 21.379 1.104 -20.034 24 3HZ LYS 2 HZ3 LYS 2 21.735 2.749 -20.260 25 H THR 3 HN THR 3 23.328 4.306 -23.974 26 HA THR 3 HA THR 3 20.871 5.685 -22.971 27 HB THR 3 HB THR 3 21.562 4.443 -25.660 28 HG1 THR 3 HG1 THR 3 22.522 6.252 -26.031 29 1HG2 THR 3 HG21 THR 3 19.502 5.071 -26.412 30 2HG2 THR 3 HG22 THR 3 19.466 6.520 -25.409 31 3HG2 THR 3 HG23 THR 3 19.065 4.952 -24.708 32 H LYS 4 HN LYS 4 19.004 4.474 -22.517 33 HA LYS 4 HA LYS 4 19.183 1.501 -22.854 34 1HB LYS 4 HB2 LYS 4 18.119 1.386 -20.557 35 2HB LYS 4 HB1 LYS 4 19.763 2.014 -20.570 36 1HG LYS 4 HG2 LYS 4 19.107 4.012 -19.756 37 2HG LYS 4 HG1 LYS 4 17.792 4.138 -20.924 38 1HD LYS 4 HD2 LYS 4 16.682 2.287 -19.393 39 2HD LYS 4 HD1 LYS 4 17.780 2.940 -18.177 40 1HE LYS 4 HE2 LYS 4 16.788 5.257 -19.176 41 2HE LYS 4 HE1 LYS 4 15.392 4.193 -19.424 42 1HZ LYS 4 HZ1 LYS 4 16.920 4.448 -16.884 43 2HZ LYS 4 HZ2 LYS 4 15.559 3.463 -17.138 44 3HZ LYS 4 HZ3 LYS 4 15.407 5.154 -17.182 45 H LEU 5 HN LEU 5 17.502 0.861 -24.098 46 HA LEU 5 HA LEU 5 15.376 0.773 -25.108 47 1HB LEU 5 HB2 LEU 5 14.981 1.527 -22.236 48 2HB LEU 5 HB1 LEU 5 13.575 1.556 -23.298 49 HG LEU 5 HG LEU 5 14.741 -0.827 -24.002 50 1HD1 LEU 5 HD11 LEU 5 15.431 -0.168 -21.159 51 2HD1 LEU 5 HD12 LEU 5 16.369 -1.057 -22.359 52 3HD1 LEU 5 HD13 LEU 5 14.998 -1.829 -21.562 53 1HD2 LEU 5 HD21 LEU 5 12.679 -0.249 -21.851 54 2HD2 LEU 5 HD22 LEU 5 12.955 -1.843 -22.550 55 3HD2 LEU 5 HD23 LEU 5 12.368 -0.526 -23.565 56 H ASN 6 HN ASN 6 13.150 2.420 -24.962 57 HA ASN 6 HA ASN 6 14.166 5.164 -25.589 58 1HB ASN 6 HB2 ASN 6 13.177 3.122 -27.367 59 2HB ASN 6 HB1 ASN 6 12.061 4.489 -27.381 60 1HD2 ASN 6 HD21 ASN 6 12.843 6.538 -28.203 61 2HD2 ASN 6 HD22 ASN 6 14.338 6.681 -28.994 62 H GLU 7 HN GLU 7 13.232 5.755 -23.505 63 HA GLU 7 HA GLU 7 11.515 6.528 -22.087 64 1HB GLU 7 HB2 GLU 7 10.833 7.085 -24.906 65 2HB GLU 7 HB1 GLU 7 9.461 7.168 -23.803 66 1HG GLU 7 HG2 GLU 7 10.491 9.364 -23.914 67 2HG GLU 7 HG1 GLU 7 10.812 8.674 -22.323 68 H LEU 8 HN LEU 8 11.509 3.899 -21.783 69 HA LEU 8 HA LEU 8 8.687 2.979 -22.229 70 1HB LEU 8 HB2 LEU 8 11.221 1.871 -22.888 71 2HB LEU 8 HB1 LEU 8 10.548 0.869 -21.601 72 HG LEU 8 HG LEU 8 8.411 1.454 -23.375 73 1HD1 LEU 8 HD11 LEU 8 10.319 1.999 -24.978 74 2HD1 LEU 8 HD12 LEU 8 9.206 0.743 -25.520 75 3HD1 LEU 8 HD13 LEU 8 10.781 0.301 -24.862 76 1HD2 LEU 8 HD21 LEU 8 8.812 -0.591 -21.968 77 2HD2 LEU 8 HD22 LEU 8 10.052 -1.084 -23.120 78 3HD2 LEU 8 HD23 LEU 8 8.370 -0.962 -23.635 79 H LEU 9 HN LEU 9 11.454 2.726 -19.954 80 HA LEU 9 HA LEU 9 9.802 1.691 -17.776 81 1HB LEU 9 HB2 LEU 9 12.592 2.899 -17.816 82 2HB LEU 9 HB1 LEU 9 11.911 1.928 -16.513 83 HG LEU 9 HG LEU 9 11.524 0.384 -18.823 84 1HD1 LEU 9 HD11 LEU 9 13.531 2.223 -19.423 85 2HD1 LEU 9 HD12 LEU 9 13.256 0.688 -20.243 86 3HD1 LEU 9 HD13 LEU 9 14.418 0.783 -18.921 87 1HD2 LEU 9 HD21 LEU 9 13.966 -0.124 -17.217 88 2HD2 LEU 9 HD22 LEU 9 12.600 -1.186 -17.553 89 3HD2 LEU 9 HD23 LEU 9 12.471 0.040 -16.293 90 H GLU 10 HN GLU 10 11.464 4.801 -18.391 91 HA GLU 10 HA GLU 10 11.046 6.971 -17.594 92 1HB GLU 10 HB2 GLU 10 8.578 5.654 -18.179 93 2HB GLU 10 HB1 GLU 10 8.327 6.643 -16.741 94 1HG GLU 10 HG2 GLU 10 7.876 8.051 -18.636 95 2HG GLU 10 HG1 GLU 10 9.436 8.555 -17.986 96 H PHE 11 HN PHE 11 12.300 5.336 -15.709 97 HA PHE 11 HA PHE 11 10.852 5.695 -13.130 98 1HB PHE 11 HB2 PHE 11 11.974 3.551 -13.706 99 2HB PHE 11 HB1 PHE 11 13.510 4.403 -13.847 100 HD1 PHE 11 HD1 PHE 11 10.773 3.538 -11.471 101 HD2 PHE 11 HD2 PHE 11 14.811 4.930 -11.926 102 HE1 PHE 11 HE1 PHE 11 11.127 3.311 -9.027 103 HE2 PHE 11 HE2 PHE 11 15.166 4.703 -9.483 104 HZ PHE 11 HZ PHE 11 13.323 3.893 -8.033 105 HA PRO 12 HA PRO 12 13.108 9.559 -12.797 106 1HB PRO 12 HB2 PRO 12 12.153 10.251 -10.327 107 2HB PRO 12 HB1 PRO 12 11.224 10.462 -11.824 108 1HG PRO 12 HG2 PRO 12 11.052 8.299 -9.778 109 2HG PRO 12 HG1 PRO 12 9.754 9.137 -10.645 110 1HD PRO 12 HD2 PRO 12 10.607 6.662 -11.333 111 2HD PRO 12 HD1 PRO 12 9.978 7.826 -12.522 112 H THR 13 HN THR 13 15.257 9.082 -12.517 113 HA THR 13 HA THR 13 16.130 8.281 -9.757 114 HB THR 13 HB THR 13 16.210 6.355 -11.266 115 HG1 THR 13 HG1 THR 13 18.032 5.897 -10.379 116 1HG2 THR 13 HG21 THR 13 17.194 8.372 -13.144 117 2HG2 THR 13 HG22 THR 13 16.450 6.807 -13.465 118 3HG2 THR 13 HG23 THR 13 18.179 6.910 -13.137 119 HA PRO 14 HA PRO 14 18.784 11.790 -10.143 120 1HB PRO 14 HB2 PRO 14 20.645 11.143 -8.242 121 2HB PRO 14 HB1 PRO 14 19.011 11.712 -7.843 122 1HG PRO 14 HG2 PRO 14 20.102 8.946 -7.844 123 2HG PRO 14 HG1 PRO 14 18.962 9.710 -6.726 124 1HD PRO 14 HD2 PRO 14 18.213 7.996 -8.714 125 2HD PRO 14 HD1 PRO 14 17.158 9.266 -8.057 126 H PHE 15 HN PHE 15 20.289 12.129 -11.727 127 HA PHE 15 HA PHE 15 22.165 9.912 -12.446 128 1HB PHE 15 HB2 PHE 15 20.857 12.219 -13.868 129 2HB PHE 15 HB1 PHE 15 22.321 11.502 -14.537 130 HD1 PHE 15 HD1 PHE 15 18.857 11.382 -14.677 131 HD2 PHE 15 HD2 PHE 15 22.255 8.769 -14.431 132 HE1 PHE 15 HE1 PHE 15 17.510 9.543 -15.648 133 HE2 PHE 15 HE2 PHE 15 20.907 6.928 -15.400 134 HZ PHE 15 HZ PHE 15 18.536 7.313 -16.009 135 H THR 16 HN THR 16 23.963 10.304 -11.086 136 HA THR 16 HA THR 16 25.055 12.990 -10.669 137 HB THR 16 HB THR 16 26.348 10.270 -10.252 138 HG1 THR 16 HG1 THR 16 24.982 9.970 -8.704 139 1HG2 THR 16 HG21 THR 16 27.859 12.179 -9.998 140 2HG2 THR 16 HG22 THR 16 27.524 11.465 -8.421 141 3HG2 THR 16 HG23 THR 16 26.719 12.959 -8.901 142 H TYR 17 HN TYR 17 25.475 13.789 -12.817 143 HA TYR 17 HA TYR 17 27.281 12.158 -14.537 144 1HB TYR 17 HB2 TYR 17 25.275 14.334 -14.853 145 2HB TYR 17 HB1 TYR 17 26.598 14.312 -16.018 146 HD1 TYR 17 HD1 TYR 17 24.971 11.405 -14.299 147 HD2 TYR 17 HD2 TYR 17 25.582 13.508 -17.997 148 HE1 TYR 17 HE1 TYR 17 23.877 9.557 -15.533 149 HE2 TYR 17 HE2 TYR 17 24.486 11.659 -19.228 150 HH TYR 17 HH TYR 17 24.149 8.758 -18.269 151 H LYS 18 HN LYS 18 29.411 12.488 -14.069 152 HA LYS 18 HA LYS 18 30.420 15.066 -13.087 153 1HB LYS 18 HB2 LYS 18 31.415 12.297 -13.602 154 2HB LYS 18 HB1 LYS 18 32.617 13.586 -13.611 155 1HG LYS 18 HG2 LYS 18 32.618 13.105 -11.354 156 2HG LYS 18 HG1 LYS 18 31.324 14.303 -11.385 157 1HD LYS 18 HD2 LYS 18 30.371 12.518 -10.180 158 2HD LYS 18 HD1 LYS 18 29.755 12.274 -11.815 159 1HE LYS 18 HE2 LYS 18 32.098 10.877 -11.960 160 2HE LYS 18 HE1 LYS 18 31.660 10.619 -10.261 161 1HZ LYS 18 HZ1 LYS 18 29.838 10.245 -12.580 162 2HZ LYS 18 HZ2 LYS 18 29.438 9.988 -10.949 163 3HZ LYS 18 HZ3 LYS 18 30.582 8.992 -11.714 164 H VAL 19 HN VAL 19 29.951 16.497 -14.860 165 HA VAL 19 HA VAL 19 30.898 15.924 -17.569 166 HB VAL 19 HB VAL 19 29.933 18.506 -16.286 167 1HG1 VAL 19 HG11 VAL 19 29.566 17.713 -19.163 168 2HG1 VAL 19 HG12 VAL 19 31.098 18.414 -18.640 169 3HG1 VAL 19 HG13 VAL 19 29.601 19.324 -18.448 170 1HG2 VAL 19 HG21 VAL 19 27.790 17.754 -16.406 171 2HG2 VAL 19 HG22 VAL 19 28.507 16.145 -16.458 172 3HG2 VAL 19 HG23 VAL 19 28.062 16.960 -17.957 173 H MET 20 HN MET 20 33.162 15.711 -17.537 174 HA MET 20 HA MET 20 34.770 17.964 -16.395 175 1HB MET 20 HB2 MET 20 35.562 15.177 -17.314 176 2HB MET 20 HB1 MET 20 36.593 16.314 -16.447 177 1HG MET 20 HG2 MET 20 35.045 16.253 -14.522 178 2HG MET 20 HG1 MET 20 34.015 15.115 -15.387 179 1HE MET 20 HE1 MET 20 35.612 12.039 -15.837 180 2HE MET 20 HE2 MET 20 34.241 13.141 -15.922 181 3HE MET 20 HE3 MET 20 34.546 12.238 -14.440 182 H GLY 21 HN GLY 21 36.291 19.050 -17.750 183 1HA GLY 21 HA2 GLY 21 37.137 18.332 -20.323 184 2HA GLY 21 HA1 GLY 21 35.622 19.200 -20.556 185 H GLN 22 HN GLN 22 36.431 21.099 -21.456 186 HA GLN 22 HA GLN 22 38.782 22.491 -20.550 187 1HB GLN 22 HB2 GLN 22 37.445 22.631 -22.751 188 2HB GLN 22 HB1 GLN 22 36.352 23.709 -21.883 189 1HG GLN 22 HG2 GLN 22 39.093 24.498 -21.407 190 2HG GLN 22 HG1 GLN 22 38.788 24.398 -23.140 191 1HE2 GLN 22 HE21 GLN 22 36.513 25.458 -23.766 192 2HE2 GLN 22 HE22 GLN 22 36.181 26.941 -23.011 193 H ALA 23 HN ALA 23 38.897 24.471 -19.300 194 HA ALA 23 HA ALA 23 36.870 24.622 -17.138 195 1HB ALA 23 HB1 ALA 23 38.649 26.149 -16.165 196 2HB ALA 23 HB2 ALA 23 39.616 25.819 -17.603 197 3HB ALA 23 HB3 ALA 23 39.196 24.507 -16.502 198 H LEU 24 HN LEU 24 35.111 25.763 -18.032 199 HA LEU 24 HA LEU 24 35.681 28.595 -18.837 200 1HB LEU 24 HB2 LEU 24 33.820 28.313 -20.489 201 2HB LEU 24 HB1 LEU 24 35.183 27.245 -20.811 202 HG LEU 24 HG LEU 24 33.255 26.018 -18.993 203 1HD1 LEU 24 HD11 LEU 24 31.416 26.941 -20.015 204 2HD1 LEU 24 HD12 LEU 24 31.730 25.655 -21.180 205 3HD1 LEU 24 HD13 LEU 24 32.289 27.296 -21.505 206 1HD2 LEU 24 HD21 LEU 24 34.101 24.201 -20.027 207 2HD2 LEU 24 HD22 LEU 24 35.131 25.287 -20.960 208 3HD2 LEU 24 HD23 LEU 24 33.568 24.786 -21.603 209 HA PRO 25 HA PRO 25 32.659 29.648 -15.813 210 1HB PRO 25 HB2 PRO 25 31.736 32.012 -16.833 211 2HB PRO 25 HB1 PRO 25 33.333 31.839 -16.079 212 1HG PRO 25 HG2 PRO 25 32.600 31.935 -18.959 213 2HG PRO 25 HG1 PRO 25 34.002 32.622 -18.127 214 1HD PRO 25 HD2 PRO 25 34.081 30.316 -19.593 215 2HD PRO 25 HD1 PRO 25 35.192 30.679 -18.255 216 H GLU 26 HN GLU 26 31.719 29.260 -19.167 217 HA GLU 26 HA GLU 26 28.853 29.591 -18.769 218 1HB GLU 26 HB2 GLU 26 30.625 29.481 -20.881 219 2HB GLU 26 HB1 GLU 26 29.792 27.932 -21.012 220 1HG GLU 26 HG2 GLU 26 28.150 30.390 -20.527 221 2HG GLU 26 HG1 GLU 26 28.788 30.114 -22.148 222 H LEU 27 HN LEU 27 30.965 27.119 -17.777 223 HA LEU 27 HA LEU 27 29.528 24.727 -18.357 224 1HB LEU 27 HB2 LEU 27 31.618 25.697 -16.520 225 2HB LEU 27 HB1 LEU 27 30.689 24.346 -15.873 226 HG LEU 27 HG LEU 27 31.779 24.275 -18.684 227 1HD1 LEU 27 HD11 LEU 27 33.366 24.463 -16.365 228 2HD1 LEU 27 HD12 LEU 27 33.888 23.938 -17.966 229 3HD1 LEU 27 HD13 LEU 27 33.347 22.749 -16.782 230 1HD2 LEU 27 HD21 LEU 27 30.007 22.651 -17.588 231 2HD2 LEU 27 HD22 LEU 27 31.426 21.953 -16.809 232 3HD2 LEU 27 HD23 LEU 27 31.315 21.988 -18.568 233 H VAL 28 HN VAL 28 29.491 26.581 -15.274 234 HA VAL 28 HA VAL 28 27.222 25.202 -14.176 235 HB VAL 28 HB VAL 28 27.259 27.067 -12.540 236 1HG1 VAL 28 HG11 VAL 28 29.242 25.214 -13.004 237 2HG1 VAL 28 HG12 VAL 28 29.139 26.246 -11.579 238 3HG1 VAL 28 HG13 VAL 28 30.153 26.722 -12.939 239 1HG2 VAL 28 HG21 VAL 28 27.669 29.072 -13.606 240 2HG2 VAL 28 HG22 VAL 28 28.816 28.359 -14.739 241 3HG2 VAL 28 HG23 VAL 28 29.312 28.707 -13.084 242 H ASP 29 HN ASP 29 27.481 28.031 -16.285 243 HA ASP 29 HA ASP 29 24.803 29.031 -15.934 244 1HB ASP 29 HB2 ASP 29 26.830 30.181 -16.935 245 2HB ASP 29 HB1 ASP 29 26.601 29.188 -18.374 246 H GLN 30 HN GLN 30 26.205 27.038 -18.587 247 HA GLN 30 HA GLN 30 23.667 26.486 -19.840 248 1HB GLN 30 HB2 GLN 30 26.194 26.303 -20.619 249 2HB GLN 30 HB1 GLN 30 26.032 24.649 -20.028 250 1HG GLN 30 HG2 GLN 30 25.456 24.679 -22.387 251 2HG GLN 30 HG1 GLN 30 23.984 24.400 -21.457 252 1HE2 GLN 30 HE21 GLN 30 22.309 25.980 -21.596 253 2HE2 GLN 30 HE22 GLN 30 22.434 27.388 -22.536 254 H VAL 31 HN VAL 31 25.549 24.786 -17.342 255 HA VAL 31 HA VAL 31 24.130 22.320 -17.325 256 HB VAL 31 HB VAL 31 25.714 23.953 -15.360 257 1HG1 VAL 31 HG11 VAL 31 23.822 21.760 -14.699 258 2HG1 VAL 31 HG12 VAL 31 24.451 23.051 -13.677 259 3HG1 VAL 31 HG13 VAL 31 25.434 21.623 -13.998 260 1HG2 VAL 31 HG21 VAL 31 26.403 21.150 -15.745 261 2HG2 VAL 31 HG22 VAL 31 27.376 22.588 -16.052 262 3HG2 VAL 31 HG23 VAL 31 26.269 21.993 -17.287 263 H VAL 32 HN VAL 32 23.590 25.146 -15.146 264 HA VAL 32 HA VAL 32 21.161 24.124 -14.017 265 HB VAL 32 HB VAL 32 22.718 25.925 -13.143 266 1HG1 VAL 32 HG11 VAL 32 22.360 28.220 -13.900 267 2HG1 VAL 32 HG12 VAL 32 21.157 27.675 -15.068 268 3HG1 VAL 32 HG13 VAL 32 22.849 27.221 -15.267 269 1HG2 VAL 32 HG21 VAL 32 20.255 25.441 -12.430 270 2HG2 VAL 32 HG22 VAL 32 19.891 26.956 -13.254 271 3HG2 VAL 32 HG23 VAL 32 21.010 26.941 -11.891 272 H GLU 33 HN GLU 33 21.735 26.106 -16.920 273 HA GLU 33 HA GLU 33 18.961 26.838 -17.332 274 1HB GLU 33 HB2 GLU 33 21.569 27.025 -18.699 275 2HB GLU 33 HB1 GLU 33 20.188 26.954 -19.791 276 1HG GLU 33 HG2 GLU 33 19.519 29.041 -19.241 277 2HG GLU 33 HG1 GLU 33 19.714 28.731 -17.517 278 H VAL 34 HN VAL 34 21.033 24.432 -19.026 279 HA VAL 34 HA VAL 34 18.856 23.279 -20.524 280 HB VAL 34 HB VAL 34 21.335 23.257 -21.036 281 1HG1 VAL 34 HG11 VAL 34 21.596 20.797 -19.362 282 2HG1 VAL 34 HG12 VAL 34 21.720 22.356 -18.549 283 3HG1 VAL 34 HG13 VAL 34 22.830 21.956 -19.860 284 1HG2 VAL 34 HG21 VAL 34 20.305 21.821 -22.490 285 2HG2 VAL 34 HG22 VAL 34 19.478 20.943 -21.205 286 3HG2 VAL 34 HG23 VAL 34 21.172 20.604 -21.554 287 H VAL 35 HN VAL 35 20.138 22.598 -17.292 288 HA VAL 35 HA VAL 35 18.786 20.009 -17.079 289 HB VAL 35 HB VAL 35 20.945 20.889 -15.930 290 1HG1 VAL 35 HG11 VAL 35 19.695 22.924 -15.027 291 2HG1 VAL 35 HG12 VAL 35 20.676 22.043 -13.859 292 3HG1 VAL 35 HG13 VAL 35 18.926 21.825 -13.883 293 1HG2 VAL 35 HG21 VAL 35 19.663 19.686 -13.708 294 2HG2 VAL 35 HG22 VAL 35 20.660 18.897 -14.927 295 3HG2 VAL 35 HG23 VAL 35 18.914 19.002 -15.149 296 H GLN 36 HN GLN 36 18.021 23.364 -16.262 297 HA GLN 36 HA GLN 36 15.729 22.671 -14.571 298 1HB GLN 36 HB2 GLN 36 16.981 24.728 -14.223 299 2HB GLN 36 HB1 GLN 36 16.708 25.223 -15.893 300 1HG GLN 36 HG2 GLN 36 14.719 26.130 -15.356 301 2HG GLN 36 HG1 GLN 36 14.183 24.617 -14.627 302 1HE2 GLN 36 HE21 GLN 36 14.280 24.425 -12.321 303 2HE2 GLN 36 HE22 GLN 36 14.768 25.698 -11.310 304 H ARG 37 HN ARG 37 16.209 23.781 -17.939 305 HA ARG 37 HA ARG 37 13.425 24.039 -18.613 306 1HB ARG 37 HB2 ARG 37 16.062 23.960 -19.949 307 2HB ARG 37 HB1 ARG 37 14.699 23.496 -20.968 308 1HG ARG 37 HG2 ARG 37 13.573 25.572 -20.569 309 2HG ARG 37 HG1 ARG 37 14.690 26.000 -19.271 310 1HD ARG 37 HD2 ARG 37 15.735 25.508 -22.058 311 2HD ARG 37 HD1 ARG 37 15.074 27.093 -21.606 312 HE ARG 37 HE ARG 37 16.890 26.122 -19.574 313 1HH1 ARG 37 HH11 ARG 37 18.521 25.760 -22.047 314 2HH1 ARG 37 HH12 ARG 37 19.266 27.312 -22.229 315 1HH2 ARG 37 HH21 ARG 37 17.039 28.913 -20.074 316 2HH2 ARG 37 HH22 ARG 37 18.414 29.116 -21.107 317 H HIS 38 HN HIS 38 15.513 21.226 -18.373 318 HA HIS 38 HA HIS 38 13.490 19.555 -19.812 319 1HB HIS 38 HB2 HIS 38 16.415 19.378 -19.165 320 2HB HIS 38 HB1 HIS 38 15.519 17.890 -19.470 321 HD1 HIS 38 HD1 HIS 38 14.158 17.851 -21.828 322 HD2 HIS 38 HD2 HIS 38 17.137 20.743 -21.469 323 HE1 HIS 38 HE1 HIS 38 14.671 18.644 -24.177 324 H ALA 39 HN ALA 39 15.401 19.625 -16.772 325 HA ALA 39 HA ALA 39 13.496 17.637 -15.594 326 1HB ALA 39 HB1 ALA 39 16.068 18.535 -14.326 327 2HB ALA 39 HB2 ALA 39 16.136 17.474 -15.733 328 3HB ALA 39 HB3 ALA 39 15.297 16.950 -14.273 329 HA PRO 40 HA PRO 40 11.802 20.896 -13.127 330 1HB PRO 40 HB2 PRO 40 10.670 19.377 -11.152 331 2HB PRO 40 HB1 PRO 40 9.981 19.516 -12.782 332 1HG PRO 40 HG2 PRO 40 11.614 17.329 -11.598 333 2HG PRO 40 HG1 PRO 40 10.235 17.239 -12.704 334 1HD PRO 40 HD2 PRO 40 12.829 16.950 -13.500 335 2HD PRO 40 HD1 PRO 40 11.534 17.551 -14.559 336 H GLY 41 HN GLY 41 12.420 22.090 -11.297 337 1HA GLY 41 HA2 GLY 41 13.444 22.442 -9.157 338 2HA GLY 41 HA1 GLY 41 14.132 20.820 -9.243 339 H ASP 42 HN ASP 42 15.465 23.443 -8.718 340 HA ASP 42 HA ASP 42 17.104 24.003 -11.089 341 1HB ASP 42 HB2 ASP 42 16.284 25.502 -9.057 342 2HB ASP 42 HB1 ASP 42 17.757 24.898 -8.298 343 H TYR 43 HN TYR 43 19.090 23.097 -11.525 344 HA TYR 43 HA TYR 43 20.330 21.344 -9.421 345 1HB TYR 43 HB2 TYR 43 19.938 21.013 -12.399 346 2HB TYR 43 HB1 TYR 43 21.087 20.031 -11.498 347 HD1 TYR 43 HD1 TYR 43 17.878 20.004 -12.765 348 HD2 TYR 43 HD2 TYR 43 19.976 19.194 -9.105 349 HE1 TYR 43 HE1 TYR 43 16.034 18.517 -12.037 350 HE2 TYR 43 HE2 TYR 43 18.131 17.708 -8.376 351 HH TYR 43 HH TYR 43 15.267 17.729 -9.334 352 H THR 44 HN THR 44 22.697 21.199 -9.539 353 HA THR 44 HA THR 44 24.041 23.312 -11.172 354 HB THR 44 HB THR 44 24.699 22.960 -8.253 355 HG1 THR 44 HG1 THR 44 22.890 23.825 -7.679 356 1HG2 THR 44 HG21 THR 44 24.836 25.609 -8.829 357 2HG2 THR 44 HG22 THR 44 25.172 24.924 -10.417 358 3HG2 THR 44 HG23 THR 44 26.187 24.496 -9.040 359 HA PRO 45 HA PRO 45 27.187 20.157 -11.274 360 1HB PRO 45 HB2 PRO 45 29.028 21.576 -12.703 361 2HB PRO 45 HB1 PRO 45 27.529 20.959 -13.422 362 1HG PRO 45 HG2 PRO 45 28.288 23.702 -12.817 363 2HG PRO 45 HG1 PRO 45 26.984 23.100 -13.841 364 1HD PRO 45 HD2 PRO 45 26.849 24.082 -11.115 365 2HD PRO 45 HD1 PRO 45 25.519 23.667 -12.219 366 H THR 46 HN THR 46 28.820 19.599 -9.809 367 HA THR 46 HA THR 46 29.972 21.703 -8.066 368 HB THR 46 HB THR 46 30.287 18.677 -8.079 369 HG1 THR 46 HG1 THR 46 28.314 18.715 -7.407 370 1HG2 THR 46 HG21 THR 46 30.549 19.485 -5.496 371 2HG2 THR 46 HG22 THR 46 31.246 20.870 -6.336 372 3HG2 THR 46 HG23 THR 46 31.913 19.257 -6.589 373 H VAL 47 HN VAL 47 31.481 22.752 -9.473 374 HA VAL 47 HA VAL 47 33.382 21.264 -11.098 375 HB VAL 47 HB VAL 47 32.497 23.511 -11.646 376 1HG1 VAL 47 HG11 VAL 47 33.163 24.071 -8.952 377 2HG1 VAL 47 HG12 VAL 47 32.476 25.180 -10.138 378 3HG1 VAL 47 HG13 VAL 47 34.225 25.074 -9.941 379 1HG2 VAL 47 HG21 VAL 47 34.503 24.340 -12.553 380 2HG2 VAL 47 HG22 VAL 47 34.859 22.630 -12.312 381 3HG2 VAL 47 HG23 VAL 47 35.455 23.824 -11.160 382 H LYS 48 HN LYS 48 35.453 20.669 -10.623 383 HA LYS 48 HA LYS 48 36.754 21.682 -8.141 384 1HB LYS 48 HB2 LYS 48 37.237 19.379 -7.436 385 2HB LYS 48 HB1 LYS 48 35.498 19.590 -7.623 386 1HG LYS 48 HG2 LYS 48 36.248 18.785 -10.149 387 2HG LYS 48 HG1 LYS 48 37.352 17.865 -9.127 388 1HD LYS 48 HD2 LYS 48 35.512 16.938 -7.860 389 2HD LYS 48 HD1 LYS 48 34.357 17.987 -8.681 390 1HE LYS 48 HE2 LYS 48 35.711 16.647 -10.754 391 2HE LYS 48 HE1 LYS 48 35.379 15.406 -9.531 392 1HZ LYS 48 HZ1 LYS 48 33.458 17.255 -10.828 393 2HZ LYS 48 HZ2 LYS 48 33.088 16.448 -9.378 394 3HZ LYS 48 HZ3 LYS 48 33.415 15.561 -10.789 395 HA PRO 49 HA PRO 49 40.232 21.691 -10.849 396 1HB PRO 49 HB2 PRO 49 42.251 21.805 -9.007 397 2HB PRO 49 HB1 PRO 49 41.197 23.186 -9.372 398 1HG PRO 49 HG2 PRO 49 41.147 21.328 -7.063 399 2HG PRO 49 HG1 PRO 49 40.766 23.054 -7.134 400 1HD PRO 49 HD2 PRO 49 38.894 21.027 -7.051 401 2HD PRO 49 HD1 PRO 49 38.587 22.670 -7.652 402 H SER 50 HN SER 50 39.860 19.433 -11.574 403 HA SER 50 HA SER 50 41.264 17.276 -10.105 404 1HB SER 50 HB2 SER 50 39.086 17.556 -11.950 405 2HB SER 50 HB1 SER 50 40.276 16.475 -12.666 406 HG SER 50 HG SER 50 38.744 15.420 -11.277 407 H SER 51 HN SER 51 41.433 18.895 -13.297 408 HA SER 51 HA SER 51 44.140 17.685 -13.724 409 1HB SER 51 HB2 SER 51 41.820 18.443 -15.380 410 2HB SER 51 HB1 SER 51 43.372 18.913 -16.066 411 HG SER 51 HG SER 51 42.916 16.820 -16.698 412 H LYS 52 HN LYS 52 45.712 19.209 -14.858 413 HA LYS 52 HA LYS 52 45.622 21.891 -13.547 414 1HB LYS 52 HB2 LYS 52 47.613 19.870 -14.219 415 2HB LYS 52 HB1 LYS 52 48.099 21.467 -14.792 416 1HG LYS 52 HG2 LYS 52 48.903 21.551 -12.618 417 2HG LYS 52 HG1 LYS 52 47.287 22.218 -12.384 418 1HD LYS 52 HD2 LYS 52 47.085 19.370 -12.266 419 2HD LYS 52 HD1 LYS 52 48.407 19.865 -11.209 420 1HE LYS 52 HE2 LYS 52 47.011 21.129 -9.829 421 2HE LYS 52 HE1 LYS 52 45.808 21.381 -11.108 422 1HZ LYS 52 HZ1 LYS 52 45.056 19.709 -9.518 423 2HZ LYS 52 HZ2 LYS 52 46.442 18.776 -9.821 424 3HZ LYS 52 HZ3 LYS 52 45.294 19.020 -11.049 425 H GLY 53 HN GLY 53 46.248 23.780 -14.828 426 1HA GLY 53 HA2 GLY 53 46.592 24.963 -16.885 427 2HA GLY 53 HA1 GLY 53 46.177 23.496 -17.772 428 H ASN 54 HN ASN 54 44.464 24.172 -19.026 429 HA ASN 54 HA ASN 54 42.253 25.699 -17.730 430 1HB ASN 54 HB2 ASN 54 43.538 26.215 -19.980 431 2HB ASN 54 HB1 ASN 54 42.444 25.006 -20.652 432 1HD2 ASN 54 HD21 ASN 54 41.186 26.564 -21.877 433 2HD2 ASN 54 HD22 ASN 54 40.179 27.699 -21.117 434 H TYR 55 HN TYR 55 41.977 23.354 -16.646 435 HA TYR 55 HA TYR 55 39.865 21.952 -18.235 436 1HB TYR 55 HB2 TYR 55 42.228 20.898 -18.249 437 2HB TYR 55 HB1 TYR 55 41.932 20.526 -16.551 438 HD1 TYR 55 HD1 TYR 55 41.289 19.565 -19.970 439 HD2 TYR 55 HD2 TYR 55 39.855 19.171 -15.939 440 HE1 TYR 55 HE1 TYR 55 39.970 17.573 -20.633 441 HE2 TYR 55 HE2 TYR 55 38.536 17.181 -16.603 442 HH TYR 55 HH TYR 55 37.606 16.440 -19.409 443 H HIS 56 HN HIS 56 38.038 21.648 -17.013 444 HA HIS 56 HA HIS 56 38.290 21.716 -14.022 445 1HB HIS 56 HB2 HIS 56 36.847 23.422 -15.922 446 2HB HIS 56 HB1 HIS 56 35.798 22.775 -14.664 447 HD1 HIS 56 HD1 HIS 56 36.418 25.766 -14.639 448 HD2 HIS 56 HD2 HIS 56 38.709 22.959 -12.578 449 HE1 HIS 56 HE1 HIS 56 37.602 27.026 -12.789 450 H SER 57 HN SER 57 37.134 20.121 -12.973 451 HA SER 57 HA SER 57 35.425 18.327 -14.669 452 1HB SER 57 HB2 SER 57 37.209 17.960 -12.264 453 2HB SER 57 HB1 SER 57 35.966 16.770 -12.635 454 HG SER 57 HG SER 57 38.343 17.320 -13.904 455 H VAL 58 HN VAL 58 33.315 19.089 -14.370 456 HA VAL 58 HA VAL 58 32.481 19.743 -11.573 457 HB VAL 58 HB VAL 58 30.857 21.188 -12.544 458 1HG1 VAL 58 HG11 VAL 58 32.239 22.736 -13.502 459 2HG1 VAL 58 HG12 VAL 58 32.896 21.587 -14.667 460 3HG1 VAL 58 HG13 VAL 58 33.486 21.591 -13.005 461 1HG2 VAL 58 HG21 VAL 58 29.725 20.609 -14.403 462 2HG2 VAL 58 HG22 VAL 58 30.816 19.248 -14.642 463 3HG2 VAL 58 HG23 VAL 58 31.187 20.807 -15.367 464 H SER 59 HN SER 59 30.607 18.774 -10.700 465 HA SER 59 HA SER 59 29.609 16.351 -12.162 466 1HB SER 59 HB2 SER 59 30.899 16.162 -9.951 467 2HB SER 59 HB1 SER 59 29.514 16.939 -9.189 468 HG SER 59 HG SER 59 28.976 14.860 -9.070 469 H ILE 60 HN ILE 60 27.635 16.869 -13.076 470 HA ILE 60 HA ILE 60 25.926 18.911 -11.785 471 HB ILE 60 HB ILE 60 26.411 18.922 -14.223 472 1HG1 ILE 60 HG12 ILE 60 23.515 18.371 -13.495 473 2HG1 ILE 60 HG11 ILE 60 24.327 19.933 -13.402 474 1HG2 ILE 60 HG21 ILE 60 24.568 16.723 -14.853 475 2HG2 ILE 60 HG22 ILE 60 26.042 16.181 -14.057 476 3HG2 ILE 60 HG23 ILE 60 26.140 17.106 -15.553 477 1HD1 ILE 60 HD11 ILE 60 24.863 19.300 -15.979 478 2HD1 ILE 60 HD12 ILE 60 23.423 20.194 -15.491 479 3HD1 ILE 60 HD13 ILE 60 23.327 18.458 -15.778 480 H THR 61 HN THR 61 24.265 18.416 -10.488 481 HA THR 61 HA THR 61 23.406 15.578 -10.197 482 HB THR 61 HB THR 61 22.889 18.173 -8.705 483 HG1 THR 61 HG1 THR 61 24.642 17.530 -7.780 484 1HG2 THR 61 HG21 THR 61 21.842 16.588 -6.979 485 2HG2 THR 61 HG22 THR 61 21.735 15.412 -8.289 486 3HG2 THR 61 HG23 THR 61 20.873 16.946 -8.409 487 H ILE 62 HN ILE 62 21.400 14.862 -10.959 488 HA ILE 62 HA ILE 62 19.238 16.750 -11.584 489 HB ILE 62 HB ILE 62 20.651 17.093 -13.516 490 1HG1 ILE 62 HG12 ILE 62 18.438 15.132 -14.211 491 2HG1 ILE 62 HG11 ILE 62 18.226 16.864 -13.963 492 1HG2 ILE 62 HG21 ILE 62 21.587 15.330 -14.835 493 2HG2 ILE 62 HG22 ILE 62 20.610 14.107 -14.020 494 3HG2 ILE 62 HG23 ILE 62 21.925 14.905 -13.158 495 1HD1 ILE 62 HD11 ILE 62 19.984 17.176 -15.813 496 2HD1 ILE 62 HD12 ILE 62 18.395 16.602 -16.318 497 3HD1 ILE 62 HD13 ILE 62 19.737 15.468 -16.176 498 H ASN 63 HN ASN 63 17.318 15.674 -11.317 499 HA ASN 63 HA ASN 63 17.382 12.695 -11.160 500 1HB ASN 63 HB2 ASN 63 16.538 14.117 -9.265 501 2HB ASN 63 HB1 ASN 63 15.254 14.697 -10.327 502 1HD2 ASN 63 HD21 ASN 63 13.619 13.097 -11.051 503 2HD2 ASN 63 HD22 ASN 63 13.396 11.652 -10.193 504 H ALA 64 HN ALA 64 17.178 12.053 -13.337 505 HA ALA 64 HA ALA 64 14.789 13.084 -14.834 506 1HB ALA 64 HB1 ALA 64 16.836 13.580 -15.977 507 2HB ALA 64 HB2 ALA 64 16.159 12.180 -16.808 508 3HB ALA 64 HB3 ALA 64 17.481 11.971 -15.662 509 H THR 65 HN THR 65 13.273 11.582 -15.540 510 HA THR 65 HA THR 65 13.158 8.978 -14.327 511 HB THR 65 HB THR 65 11.204 8.737 -15.921 512 HG1 THR 65 HG1 THR 65 11.411 9.922 -17.634 513 1HG2 THR 65 HG21 THR 65 10.940 9.774 -13.708 514 2HG2 THR 65 HG22 THR 65 9.915 10.579 -14.895 515 3HG2 THR 65 HG23 THR 65 11.421 11.335 -14.373 516 H HIS 66 HN HIS 66 14.585 10.107 -17.306 517 HA HIS 66 HA HIS 66 15.262 7.270 -17.993 518 1HB HIS 66 HB2 HIS 66 13.524 8.940 -19.369 519 2HB HIS 66 HB1 HIS 66 15.037 9.116 -20.260 520 HD1 HIS 66 HD1 HIS 66 12.786 6.348 -18.924 521 HD2 HIS 66 HD2 HIS 66 15.596 6.981 -21.931 522 HE1 HIS 66 HE1 HIS 66 12.820 4.240 -20.327 523 H ILE 67 HN ILE 67 17.294 7.046 -19.174 524 HA ILE 67 HA ILE 67 19.339 8.953 -18.305 525 HB ILE 67 HB ILE 67 19.466 6.394 -18.423 526 1HG1 ILE 67 HG12 ILE 67 21.768 7.445 -19.981 527 2HG1 ILE 67 HG11 ILE 67 21.398 8.296 -18.482 528 1HG2 ILE 67 HG21 ILE 67 20.131 5.445 -20.590 529 2HG2 ILE 67 HG22 ILE 67 19.950 7.024 -21.351 530 3HG2 ILE 67 HG23 ILE 67 18.537 6.188 -20.712 531 1HD1 ILE 67 HD11 ILE 67 21.186 5.610 -17.779 532 2HD1 ILE 67 HD12 ILE 67 22.551 6.668 -17.424 533 3HD1 ILE 67 HD13 ILE 67 22.575 5.651 -18.863 534 H GLU 68 HN GLU 68 17.379 8.549 -21.138 535 HA GLU 68 HA GLU 68 19.180 9.682 -23.100 536 1HB GLU 68 HB2 GLU 68 16.286 9.015 -22.811 537 2HB GLU 68 HB1 GLU 68 16.705 10.176 -24.070 538 1HG GLU 68 HG2 GLU 68 17.319 8.457 -25.385 539 2HG GLU 68 HG1 GLU 68 18.627 8.112 -24.254 540 H GLN 69 HN GLN 69 16.855 11.056 -20.791 541 HA GLN 69 HA GLN 69 16.816 13.738 -21.860 542 1HB GLN 69 HB2 GLN 69 16.074 12.319 -19.333 543 2HB GLN 69 HB1 GLN 69 16.191 14.077 -19.274 544 1HG GLN 69 HG2 GLN 69 14.160 14.224 -20.220 545 2HG GLN 69 HG1 GLN 69 14.795 13.429 -21.661 546 1HE2 GLN 69 HE21 GLN 69 13.204 12.791 -18.524 547 2HE2 GLN 69 HE22 GLN 69 12.629 11.251 -18.947 548 H VAL 70 HN VAL 70 18.668 12.256 -19.160 549 HA VAL 70 HA VAL 70 20.219 14.633 -18.606 550 HB VAL 70 HB VAL 70 19.737 12.698 -17.062 551 1HG1 VAL 70 HG11 VAL 70 21.908 11.305 -18.654 552 2HG1 VAL 70 HG12 VAL 70 20.192 10.919 -18.765 553 3HG1 VAL 70 HG13 VAL 70 21.054 10.669 -17.249 554 1HG2 VAL 70 HG21 VAL 70 21.402 13.998 -16.146 555 2HG2 VAL 70 HG22 VAL 70 22.446 13.847 -17.558 556 3HG2 VAL 70 HG23 VAL 70 22.328 12.519 -16.403 557 H GLU 71 HN GLU 71 20.555 12.017 -20.937 558 HA GLU 71 HA GLU 71 23.373 12.350 -21.510 559 1HB GLU 71 HB2 GLU 71 20.973 11.027 -22.688 560 2HB GLU 71 HB1 GLU 71 22.317 11.330 -23.788 561 1HG GLU 71 HG2 GLU 71 23.851 10.193 -22.214 562 2HG GLU 71 HG1 GLU 71 22.491 9.857 -21.143 563 H THR 72 HN THR 72 20.413 13.531 -23.178 564 HA THR 72 HA THR 72 21.762 15.155 -25.120 565 HB THR 72 HB THR 72 19.474 16.310 -25.160 566 HG1 THR 72 HG1 THR 72 18.259 15.994 -23.502 567 1HG2 THR 72 HG21 THR 72 20.279 13.886 -26.140 568 2HG2 THR 72 HG22 THR 72 18.725 14.639 -26.501 569 3HG2 THR 72 HG23 THR 72 18.844 13.431 -25.221 570 H LEU 73 HN LEU 73 20.614 15.818 -21.813 571 HA LEU 73 HA LEU 73 21.114 18.636 -21.743 572 1HB LEU 73 HB2 LEU 73 20.695 16.377 -19.868 573 2HB LEU 73 HB1 LEU 73 21.562 17.752 -19.186 574 HG LEU 73 HG LEU 73 19.769 19.263 -19.765 575 1HD1 LEU 73 HD11 LEU 73 18.752 18.744 -21.743 576 2HD1 LEU 73 HD12 LEU 73 17.637 17.849 -20.711 577 3HD1 LEU 73 HD13 LEU 73 18.963 17.009 -21.510 578 1HD2 LEU 73 HD21 LEU 73 19.109 18.407 -17.737 579 2HD2 LEU 73 HD22 LEU 73 19.140 16.741 -18.313 580 3HD2 LEU 73 HD23 LEU 73 17.776 17.785 -18.710 581 H TYR 74 HN TYR 74 23.208 15.820 -21.069 582 HA TYR 74 HA TYR 74 25.527 17.215 -20.154 583 1HB TYR 74 HB2 TYR 74 25.813 14.960 -19.867 584 2HB TYR 74 HB1 TYR 74 24.776 14.563 -21.234 585 HD1 TYR 74 HD1 TYR 74 28.082 16.291 -20.698 586 HD2 TYR 74 HD2 TYR 74 25.823 13.430 -22.973 587 HE1 TYR 74 HE1 TYR 74 30.081 15.816 -22.085 588 HE2 TYR 74 HE2 TYR 74 27.823 12.954 -24.358 589 HH TYR 74 HH TYR 74 30.233 14.747 -24.782 590 H GLU 75 HN GLU 75 24.447 16.314 -23.447 591 HA GLU 75 HA GLU 75 26.740 17.402 -24.825 592 1HB GLU 75 HB2 GLU 75 24.805 15.739 -25.506 593 2HB GLU 75 HB1 GLU 75 23.983 17.215 -26.010 594 1HG GLU 75 HG2 GLU 75 25.211 16.320 -27.908 595 2HG GLU 75 HG1 GLU 75 25.994 17.809 -27.377 596 H GLU 76 HN GLU 76 23.617 18.780 -23.821 597 HA GLU 76 HA GLU 76 23.754 21.233 -25.295 598 1HB GLU 76 HB2 GLU 76 22.271 20.044 -23.052 599 2HB GLU 76 HB1 GLU 76 22.410 21.799 -22.952 600 1HG GLU 76 HG2 GLU 76 20.632 21.828 -24.362 601 2HG GLU 76 HG1 GLU 76 21.813 21.436 -25.613 602 H LEU 77 HN LEU 77 24.774 20.467 -21.935 603 HA LEU 77 HA LEU 77 26.001 23.102 -21.571 604 1HB LEU 77 HB2 LEU 77 26.074 22.454 -19.366 605 2HB LEU 77 HB1 LEU 77 24.925 21.242 -19.920 606 HG LEU 77 HG LEU 77 27.153 19.883 -20.466 607 1HD1 LEU 77 HD11 LEU 77 28.288 20.887 -18.000 608 2HD1 LEU 77 HD12 LEU 77 28.169 22.186 -19.186 609 3HD1 LEU 77 HD13 LEU 77 29.052 20.712 -19.579 610 1HD2 LEU 77 HD21 LEU 77 25.444 20.145 -18.078 611 2HD2 LEU 77 HD22 LEU 77 27.005 19.387 -17.766 612 3HD2 LEU 77 HD23 LEU 77 25.918 18.700 -18.970 613 H GLY 78 HN GLY 78 27.077 19.883 -22.539 614 1HA GLY 78 HA2 GLY 78 29.915 20.797 -22.542 615 2HA GLY 78 HA1 GLY 78 29.388 19.116 -22.651 616 H LYS 79 HN LYS 79 28.644 22.116 -24.446 617 HA LYS 79 HA LYS 79 28.887 20.572 -26.997 618 1HB LYS 79 HB2 LYS 79 26.835 21.992 -26.075 619 2HB LYS 79 HB1 LYS 79 27.749 23.336 -26.762 620 1HG LYS 79 HG2 LYS 79 27.661 22.427 -28.949 621 2HG LYS 79 HG1 LYS 79 27.228 20.826 -28.352 622 1HD LYS 79 HD2 LYS 79 25.162 22.293 -27.366 623 2HD LYS 79 HD1 LYS 79 25.512 23.180 -28.848 624 1HE LYS 79 HE2 LYS 79 24.876 21.431 -30.211 625 2HE LYS 79 HE1 LYS 79 25.420 20.200 -29.056 626 1HZ LYS 79 HZ1 LYS 79 22.993 20.341 -29.144 627 2HZ LYS 79 HZ2 LYS 79 23.062 21.978 -28.689 628 3HZ LYS 79 HZ3 LYS 79 23.579 20.771 -27.611 629 H ILE 80 HN ILE 80 30.846 22.442 -25.113 630 HA ILE 80 HA ILE 80 31.875 24.494 -26.796 631 HB ILE 80 HB ILE 80 33.394 22.767 -24.808 632 1HG1 ILE 80 HG12 ILE 80 32.491 25.099 -23.526 633 2HG1 ILE 80 HG11 ILE 80 31.090 24.513 -24.421 634 1HG2 ILE 80 HG21 ILE 80 33.879 25.334 -26.189 635 2HG2 ILE 80 HG22 ILE 80 35.029 24.200 -25.482 636 3HG2 ILE 80 HG23 ILE 80 34.191 25.360 -24.453 637 1HD1 ILE 80 HD11 ILE 80 30.784 23.093 -22.680 638 2HD1 ILE 80 HD12 ILE 80 32.417 23.358 -22.069 639 3HD1 ILE 80 HD13 ILE 80 32.138 22.186 -23.355 640 H ASP 81 HN ASP 81 33.805 24.478 -28.148 641 HA ASP 81 HA ASP 81 34.085 22.040 -29.750 642 1HB ASP 81 HB2 ASP 81 34.356 24.808 -30.080 643 2HB ASP 81 HB1 ASP 81 35.994 24.180 -30.262 644 H ILE 82 HN ILE 82 35.570 23.041 -26.867 645 HA ILE 82 HA ILE 82 38.261 22.030 -27.496 646 HB ILE 82 HB ILE 82 36.972 22.898 -24.883 647 1HG1 ILE 82 HG12 ILE 82 36.890 24.702 -26.548 648 2HG1 ILE 82 HG11 ILE 82 38.103 25.070 -25.325 649 1HG2 ILE 82 HG21 ILE 82 39.728 22.103 -25.695 650 2HG2 ILE 82 HG22 ILE 82 38.910 21.902 -24.146 651 3HG2 ILE 82 HG23 ILE 82 39.580 23.470 -24.591 652 1HD1 ILE 82 HD11 ILE 82 39.008 23.571 -27.743 653 2HD1 ILE 82 HD12 ILE 82 39.864 24.775 -26.783 654 3HD1 ILE 82 HD13 ILE 82 38.634 25.281 -27.940 655 H VAL 83 HN VAL 83 37.073 21.096 -24.371 656 HA VAL 83 HA VAL 83 36.869 18.247 -25.298 657 HB VAL 83 HB VAL 83 38.110 19.437 -22.791 658 1HG1 VAL 83 HG11 VAL 83 36.911 17.049 -22.815 659 2HG1 VAL 83 HG12 VAL 83 38.436 17.303 -21.968 660 3HG1 VAL 83 HG13 VAL 83 38.431 16.569 -23.572 661 1HG2 VAL 83 HG21 VAL 83 39.552 19.772 -24.701 662 2HG2 VAL 83 HG22 VAL 83 39.274 18.125 -25.265 663 3HG2 VAL 83 HG23 VAL 83 40.198 18.408 -23.789 664 H ARG 84 HN ARG 84 34.817 17.510 -24.948 665 HA ARG 84 HA ARG 84 33.331 18.506 -22.533 666 1HB ARG 84 HB2 ARG 84 31.939 17.480 -24.990 667 2HB ARG 84 HB1 ARG 84 31.393 18.679 -23.824 668 1HG ARG 84 HG2 ARG 84 31.949 20.171 -25.451 669 2HG ARG 84 HG1 ARG 84 33.593 19.932 -24.861 670 1HD ARG 84 HD2 ARG 84 33.914 19.458 -27.121 671 2HD ARG 84 HD1 ARG 84 33.480 17.838 -26.544 672 HE ARG 84 HE ARG 84 31.399 19.725 -27.585 673 1HH1 ARG 84 HH11 ARG 84 30.545 17.098 -26.444 674 2HH1 ARG 84 HH12 ARG 84 30.438 16.100 -27.856 675 1HH2 ARG 84 HH21 ARG 84 32.304 18.254 -29.843 676 2HH2 ARG 84 HH22 ARG 84 31.436 16.756 -29.786 677 H MET 85 HN MET 85 33.365 16.810 -21.084 678 HA MET 85 HA MET 85 32.614 14.090 -22.101 679 1HB MET 85 HB2 MET 85 35.160 14.837 -21.423 680 2HB MET 85 HB1 MET 85 34.560 14.242 -19.875 681 1HG MET 85 HG2 MET 85 33.642 12.286 -21.519 682 2HG MET 85 HG1 MET 85 35.102 12.759 -22.387 683 1HE MET 85 HE1 MET 85 33.531 11.845 -19.048 684 2HE MET 85 HE2 MET 85 34.629 10.616 -18.425 685 3HE MET 85 HE3 MET 85 33.776 10.337 -19.941 686 H VAL 86 HN VAL 86 31.553 12.760 -20.472 687 HA VAL 86 HA VAL 86 30.821 14.125 -17.924 688 HB VAL 86 HB VAL 86 29.159 14.592 -19.763 689 1HG1 VAL 86 HG11 VAL 86 28.763 11.593 -19.563 690 2HG1 VAL 86 HG12 VAL 86 29.254 12.505 -20.991 691 3HG1 VAL 86 HG13 VAL 86 27.623 12.687 -20.346 692 1HG2 VAL 86 HG21 VAL 86 27.343 14.452 -18.311 693 2HG2 VAL 86 HG22 VAL 86 28.696 14.313 -17.189 694 3HG2 VAL 86 HG23 VAL 86 27.823 12.869 -17.701 695 H LEU 87 HN LEU 87 30.207 12.666 -16.248 696 HA LEU 87 HA LEU 87 30.224 10.648 -15.043 697 1HB LEU 87 HB2 LEU 87 28.720 10.281 -17.284 698 2HB LEU 87 HB1 LEU 87 29.935 9.030 -17.524 699 HG LEU 87 HG LEU 87 28.035 8.106 -16.294 700 1HD1 LEU 87 HD11 LEU 87 29.242 7.371 -14.211 701 2HD1 LEU 87 HD12 LEU 87 30.512 8.531 -14.600 702 3HD1 LEU 87 HD13 LEU 87 30.185 7.183 -15.690 703 1HD2 LEU 87 HD21 LEU 87 27.185 9.026 -14.293 704 2HD2 LEU 87 HD22 LEU 87 27.479 10.442 -15.300 705 3HD2 LEU 87 HD23 LEU 87 28.622 10.013 -14.030 Start of MODEL 12 1 1H MET 1 HT1 MET 1 20.732 5.283 -9.131 2 2H MET 1 HT2 MET 1 19.268 5.940 -9.692 3 3H MET 1 HT3 MET 1 20.604 6.952 -9.408 4 HA MET 1 HA MET 1 20.396 6.616 -11.774 5 1HB MET 1 HB2 MET 1 22.604 6.288 -10.158 6 2HB MET 1 HB1 MET 1 22.670 4.833 -11.151 7 1HG MET 1 HG2 MET 1 22.063 6.807 -12.998 8 2HG MET 1 HG1 MET 1 23.173 7.624 -11.898 9 1HE MET 1 HE1 MET 1 26.070 7.285 -12.657 10 2HE MET 1 HE2 MET 1 24.666 8.126 -13.308 11 3HE MET 1 HE3 MET 1 25.667 7.141 -14.372 12 H LYS 2 HN LYS 2 19.464 5.307 -13.294 13 HA LYS 2 HA LYS 2 19.224 2.373 -12.699 14 1HB LYS 2 HB2 LYS 2 17.068 2.491 -13.730 15 2HB LYS 2 HB1 LYS 2 17.174 3.926 -12.713 16 1HG LYS 2 HG2 LYS 2 18.009 5.169 -14.790 17 2HG LYS 2 HG1 LYS 2 17.508 3.754 -15.716 18 1HD LYS 2 HD2 LYS 2 15.342 4.354 -14.010 19 2HD LYS 2 HD1 LYS 2 15.879 5.900 -14.663 20 1HE LYS 2 HE2 LYS 2 15.907 3.968 -16.792 21 2HE LYS 2 HE1 LYS 2 14.326 3.915 -15.990 22 1HZ LYS 2 HZ1 LYS 2 14.279 5.665 -17.600 23 2HZ LYS 2 HZ2 LYS 2 15.730 6.327 -17.013 24 3HZ LYS 2 HZ3 LYS 2 14.321 6.381 -16.062 25 H THR 3 HN THR 3 18.562 1.330 -15.082 26 HA THR 3 HA THR 3 20.577 2.288 -17.082 27 HB THR 3 HB THR 3 21.431 0.441 -15.590 28 HG1 THR 3 HG1 THR 3 22.508 0.020 -17.319 29 1HG2 THR 3 HG21 THR 3 19.290 -1.195 -16.978 30 2HG2 THR 3 HG22 THR 3 19.221 -0.678 -15.293 31 3HG2 THR 3 HG23 THR 3 20.481 -1.792 -15.823 32 H LYS 4 HN LYS 4 20.156 1.337 -19.276 33 HA LYS 4 HA LYS 4 18.752 0.785 -21.086 34 1HB LYS 4 HB2 LYS 4 18.284 -1.106 -19.322 35 2HB LYS 4 HB1 LYS 4 16.741 -0.276 -19.110 36 1HG LYS 4 HG2 LYS 4 17.060 -0.394 -21.879 37 2HG LYS 4 HG1 LYS 4 17.648 -1.959 -21.321 38 1HD LYS 4 HD2 LYS 4 15.506 -2.624 -21.126 39 2HD LYS 4 HD1 LYS 4 15.311 -1.452 -19.824 40 1HE LYS 4 HE2 LYS 4 14.917 0.291 -21.707 41 2HE LYS 4 HE1 LYS 4 14.669 -1.114 -22.760 42 1HZ LYS 4 HZ1 LYS 4 13.263 -0.596 -20.190 43 2HZ LYS 4 HZ2 LYS 4 13.052 -1.971 -21.168 44 3HZ LYS 4 HZ3 LYS 4 12.582 -0.441 -21.736 45 H LEU 5 HN LEU 5 17.894 2.590 -22.009 46 HA LEU 5 HA LEU 5 16.213 4.474 -20.571 47 1HB LEU 5 HB2 LEU 5 16.184 5.625 -22.740 48 2HB LEU 5 HB1 LEU 5 17.810 5.044 -22.396 49 HG LEU 5 HG LEU 5 16.605 2.909 -23.737 50 1HD1 LEU 5 HD11 LEU 5 14.755 4.072 -24.597 51 2HD1 LEU 5 HD12 LEU 5 15.940 4.231 -25.893 52 3HD1 LEU 5 HD13 LEU 5 15.663 5.572 -24.782 53 1HD2 LEU 5 HD21 LEU 5 18.049 3.923 -25.688 54 2HD2 LEU 5 HD22 LEU 5 18.847 3.371 -24.215 55 3HD2 LEU 5 HD23 LEU 5 18.544 5.091 -24.462 56 H ASN 6 HN ASN 6 13.989 4.622 -20.547 57 HA ASN 6 HA ASN 6 12.389 2.941 -22.417 58 1HB ASN 6 HB2 ASN 6 11.056 2.295 -20.247 59 2HB ASN 6 HB1 ASN 6 12.547 1.439 -20.622 60 1HD2 ASN 6 HD21 ASN 6 11.363 4.255 -18.698 61 2HD2 ASN 6 HD22 ASN 6 12.533 4.101 -17.480 62 H GLU 7 HN GLU 7 10.490 3.949 -23.015 63 HA GLU 7 HA GLU 7 9.878 6.583 -21.736 64 1HB GLU 7 HB2 GLU 7 9.455 5.320 -24.440 65 2HB GLU 7 HB1 GLU 7 8.511 6.730 -23.962 66 1HG GLU 7 HG2 GLU 7 11.540 6.624 -23.870 67 2HG GLU 7 HG1 GLU 7 10.621 7.296 -25.217 68 H LEU 8 HN LEU 8 8.773 3.387 -21.632 69 HA LEU 8 HA LEU 8 5.890 4.046 -21.480 70 1HB LEU 8 HB2 LEU 8 7.578 1.759 -21.972 71 2HB LEU 8 HB1 LEU 8 6.473 1.385 -20.652 72 HG LEU 8 HG LEU 8 5.480 0.801 -22.833 73 1HD1 LEU 8 HD11 LEU 8 3.352 1.885 -22.504 74 2HD1 LEU 8 HD12 LEU 8 4.112 3.244 -21.676 75 3HD1 LEU 8 HD13 LEU 8 4.078 1.654 -20.914 76 1HD2 LEU 8 HD21 LEU 8 6.720 3.155 -23.691 77 2HD2 LEU 8 HD22 LEU 8 4.999 3.541 -23.721 78 3HD2 LEU 8 HD23 LEU 8 5.610 2.162 -24.634 79 H LEU 9 HN LEU 9 8.562 3.111 -19.320 80 HA LEU 9 HA LEU 9 6.794 3.087 -16.944 81 1HB LEU 9 HB2 LEU 9 9.794 2.754 -17.318 82 2HB LEU 9 HB1 LEU 9 8.921 2.456 -15.817 83 HG LEU 9 HG LEU 9 7.498 0.960 -17.670 84 1HD1 LEU 9 HD11 LEU 9 10.471 0.730 -18.240 85 2HD1 LEU 9 HD12 LEU 9 9.245 1.314 -19.365 86 3HD1 LEU 9 HD13 LEU 9 9.232 -0.370 -18.845 87 1HD2 LEU 9 HD21 LEU 9 7.873 -0.529 -16.021 88 2HD2 LEU 9 HD22 LEU 9 9.044 0.587 -15.317 89 3HD2 LEU 9 HD23 LEU 9 9.575 -0.639 -16.469 90 H GLU 10 HN GLU 10 9.625 4.920 -18.133 91 HA GLU 10 HA GLU 10 10.436 7.061 -17.597 92 1HB GLU 10 HB2 GLU 10 7.768 7.161 -18.273 93 2HB GLU 10 HB1 GLU 10 7.784 8.012 -16.729 94 1HG GLU 10 HG2 GLU 10 8.182 9.659 -18.440 95 2HG GLU 10 HG1 GLU 10 9.717 9.388 -17.617 96 H PHE 11 HN PHE 11 11.300 5.707 -15.630 97 HA PHE 11 HA PHE 11 10.083 6.520 -13.042 98 1HB PHE 11 HB2 PHE 11 10.706 4.191 -13.328 99 2HB PHE 11 HB1 PHE 11 12.324 4.643 -13.861 100 HD1 PHE 11 HD1 PHE 11 14.068 4.987 -12.301 101 HD2 PHE 11 HD2 PHE 11 9.993 4.819 -10.946 102 HE1 PHE 11 HE1 PHE 11 14.851 4.985 -9.949 103 HE2 PHE 11 HE2 PHE 11 10.777 4.817 -8.593 104 HZ PHE 11 HZ PHE 11 13.206 4.900 -8.095 105 HA PRO 12 HA PRO 12 13.033 9.881 -12.945 106 1HB PRO 12 HB2 PRO 12 12.347 10.807 -10.462 107 2HB PRO 12 HB1 PRO 12 11.388 11.137 -11.918 108 1HG PRO 12 HG2 PRO 12 10.938 9.121 -9.772 109 2HG PRO 12 HG1 PRO 12 9.768 10.132 -10.635 110 1HD PRO 12 HD2 PRO 12 10.179 7.507 -11.212 111 2HD PRO 12 HD1 PRO 12 9.645 8.698 -12.419 112 H THR 13 HN THR 13 15.123 9.187 -12.653 113 HA THR 13 HA THR 13 15.851 8.036 -9.974 114 HB THR 13 HB THR 13 15.775 6.460 -11.966 115 HG1 THR 13 HG1 THR 13 17.268 5.434 -10.938 116 1HG2 THR 13 HG21 THR 13 17.457 6.628 -13.672 117 2HG2 THR 13 HG22 THR 13 18.247 7.968 -12.844 118 3HG2 THR 13 HG23 THR 13 16.662 8.200 -13.580 119 HA PRO 14 HA PRO 14 18.741 11.376 -9.808 120 1HB PRO 14 HB2 PRO 14 20.461 10.370 -7.930 121 2HB PRO 14 HB1 PRO 14 18.851 11.002 -7.529 122 1HG PRO 14 HG2 PRO 14 19.760 8.187 -7.821 123 2HG PRO 14 HG1 PRO 14 18.609 8.891 -6.675 124 1HD PRO 14 HD2 PRO 14 17.873 7.482 -8.900 125 2HD PRO 14 HD1 PRO 14 16.857 8.718 -8.129 126 H PHE 15 HN PHE 15 20.218 11.726 -11.415 127 HA PHE 15 HA PHE 15 22.039 9.510 -12.255 128 1HB PHE 15 HB2 PHE 15 20.875 11.993 -13.491 129 2HB PHE 15 HB1 PHE 15 22.331 11.283 -14.183 130 HD1 PHE 15 HD1 PHE 15 18.914 11.359 -14.546 131 HD2 PHE 15 HD2 PHE 15 22.116 8.513 -14.225 132 HE1 PHE 15 HE1 PHE 15 17.531 9.671 -15.721 133 HE2 PHE 15 HE2 PHE 15 20.731 6.824 -15.398 134 HZ PHE 15 HZ PHE 15 18.438 7.404 -16.147 135 H THR 16 HN THR 16 23.815 9.686 -10.820 136 HA THR 16 HA THR 16 25.003 12.258 -10.105 137 HB THR 16 HB THR 16 26.871 10.622 -9.332 138 HG1 THR 16 HG1 THR 16 26.645 8.695 -10.093 139 1HG2 THR 16 HG21 THR 16 25.133 11.538 -7.839 140 2HG2 THR 16 HG22 THR 16 25.520 9.868 -7.423 141 3HG2 THR 16 HG23 THR 16 24.043 10.235 -8.315 142 H TYR 17 HN TYR 17 25.707 13.387 -11.952 143 HA TYR 17 HA TYR 17 27.530 11.896 -13.808 144 1HB TYR 17 HB2 TYR 17 25.412 13.975 -14.108 145 2HB TYR 17 HB1 TYR 17 26.787 14.074 -15.207 146 HD1 TYR 17 HD1 TYR 17 26.294 13.119 -17.271 147 HD2 TYR 17 HD2 TYR 17 24.842 11.217 -13.705 148 HE1 TYR 17 HE1 TYR 17 25.354 11.276 -18.636 149 HE2 TYR 17 HE2 TYR 17 23.905 9.378 -15.068 150 HH TYR 17 HH TYR 17 23.535 8.607 -17.120 151 H LYS 18 HN LYS 18 29.324 13.130 -14.689 152 HA LYS 18 HA LYS 18 30.234 15.451 -13.033 153 1HB LYS 18 HB2 LYS 18 31.240 12.732 -13.139 154 2HB LYS 18 HB1 LYS 18 32.478 13.850 -13.703 155 1HG LYS 18 HG2 LYS 18 32.398 15.107 -11.660 156 2HG LYS 18 HG1 LYS 18 30.936 14.270 -11.133 157 1HD LYS 18 HD2 LYS 18 32.150 12.167 -10.931 158 2HD LYS 18 HD1 LYS 18 33.607 12.904 -11.596 159 1HE LYS 18 HE2 LYS 18 33.142 14.616 -9.540 160 2HE LYS 18 HE1 LYS 18 32.471 13.125 -8.857 161 1HZ LYS 18 HZ1 LYS 18 34.770 13.061 -8.391 162 2HZ LYS 18 HZ2 LYS 18 35.192 13.554 -9.963 163 3HZ LYS 18 HZ3 LYS 18 34.549 12.001 -9.698 164 H VAL 19 HN VAL 19 29.982 16.948 -14.738 165 HA VAL 19 HA VAL 19 30.874 16.348 -17.469 166 HB VAL 19 HB VAL 19 30.185 19.029 -16.234 167 1HG1 VAL 19 HG11 VAL 19 29.403 18.167 -18.985 168 2HG1 VAL 19 HG12 VAL 19 31.092 18.586 -18.694 169 3HG1 VAL 19 HG13 VAL 19 29.824 19.773 -18.390 170 1HG2 VAL 19 HG21 VAL 19 28.512 16.812 -16.149 171 2HG2 VAL 19 HG22 VAL 19 28.006 17.642 -17.619 172 3HG2 VAL 19 HG23 VAL 19 27.989 18.495 -16.076 173 H MET 20 HN MET 20 33.126 15.984 -17.439 174 HA MET 20 HA MET 20 34.857 18.116 -16.246 175 1HB MET 20 HB2 MET 20 35.406 15.262 -17.134 176 2HB MET 20 HB1 MET 20 36.584 16.327 -16.365 177 1HG MET 20 HG2 MET 20 35.113 16.505 -14.380 178 2HG MET 20 HG1 MET 20 33.963 15.409 -15.142 179 1HE MET 20 HE1 MET 20 34.587 13.307 -16.173 180 2HE MET 20 HE2 MET 20 34.126 12.708 -14.580 181 3HE MET 20 HE3 MET 20 35.572 12.080 -15.363 182 H GLY 21 HN GLY 21 36.701 18.864 -17.546 183 1HA GLY 21 HA2 GLY 21 37.389 18.210 -20.150 184 2HA GLY 21 HA1 GLY 21 36.001 19.279 -20.341 185 H GLN 22 HN GLN 22 37.554 20.745 -21.412 186 HA GLN 22 HA GLN 22 39.775 21.932 -19.980 187 1HB GLN 22 HB2 GLN 22 38.680 21.908 -22.562 188 2HB GLN 22 HB1 GLN 22 38.541 23.586 -22.042 189 1HG GLN 22 HG2 GLN 22 40.749 23.909 -22.294 190 2HG GLN 22 HG1 GLN 22 41.115 22.522 -21.268 191 1HE2 GLN 22 HE21 GLN 22 41.411 20.414 -22.326 192 2HE2 GLN 22 HE22 GLN 22 41.664 20.304 -23.999 193 H ALA 23 HN ALA 23 39.846 24.136 -19.129 194 HA ALA 23 HA ALA 23 37.902 24.882 -17.275 195 1HB ALA 23 HB1 ALA 23 38.999 27.136 -17.441 196 2HB ALA 23 HB2 ALA 23 39.807 26.589 -18.910 197 3HB ALA 23 HB3 ALA 23 40.156 25.807 -17.369 198 H LEU 24 HN LEU 24 35.750 25.164 -17.743 199 HA LEU 24 HA LEU 24 35.033 27.045 -19.967 200 1HB LEU 24 HB2 LEU 24 34.576 24.272 -19.787 201 2HB LEU 24 HB1 LEU 24 33.029 25.009 -19.378 202 HG LEU 24 HG LEU 24 33.212 24.615 -21.808 203 1HD1 LEU 24 HD11 LEU 24 32.696 27.156 -20.533 204 2HD1 LEU 24 HD12 LEU 24 31.879 26.421 -21.912 205 3HD1 LEU 24 HD13 LEU 24 33.317 27.411 -22.163 206 1HD2 LEU 24 HD21 LEU 24 34.922 25.535 -23.140 207 2HD2 LEU 24 HD22 LEU 24 35.789 24.994 -21.703 208 3HD2 LEU 24 HD23 LEU 24 35.389 26.700 -21.901 209 HA PRO 25 HA PRO 25 33.122 28.844 -16.290 210 1HB PRO 25 HB2 PRO 25 32.577 31.264 -17.449 211 2HB PRO 25 HB1 PRO 25 34.176 30.832 -16.810 212 1HG PRO 25 HG2 PRO 25 33.202 30.850 -19.620 213 2HG PRO 25 HG1 PRO 25 34.782 31.309 -18.969 214 1HD PRO 25 HD2 PRO 25 34.288 28.929 -20.213 215 2HD PRO 25 HD1 PRO 25 35.562 29.161 -18.996 216 H GLU 26 HN GLU 26 31.807 28.759 -19.590 217 HA GLU 26 HA GLU 26 29.073 29.420 -18.808 218 1HB GLU 26 HB2 GLU 26 30.498 29.484 -21.104 219 2HB GLU 26 HB1 GLU 26 29.682 27.936 -21.318 220 1HG GLU 26 HG2 GLU 26 28.059 30.286 -20.409 221 2HG GLU 26 HG1 GLU 26 28.530 30.196 -22.106 222 H LEU 27 HN LEU 27 30.933 26.576 -18.427 223 HA LEU 27 HA LEU 27 29.115 24.489 -19.063 224 1HB LEU 27 HB2 LEU 27 31.627 24.658 -18.109 225 2HB LEU 27 HB1 LEU 27 30.790 24.304 -16.598 226 HG LEU 27 HG LEU 27 29.633 22.534 -18.400 227 1HD1 LEU 27 HD11 LEU 27 31.139 22.649 -20.156 228 2HD1 LEU 27 HD12 LEU 27 31.921 21.418 -19.165 229 3HD1 LEU 27 HD13 LEU 27 32.489 23.088 -19.108 230 1HD2 LEU 27 HD21 LEU 27 30.107 21.775 -16.235 231 2HD2 LEU 27 HD22 LEU 27 31.779 22.330 -16.300 232 3HD2 LEU 27 HD23 LEU 27 31.290 20.896 -17.202 233 H VAL 28 HN VAL 28 29.602 26.064 -15.860 234 HA VAL 28 HA VAL 28 27.408 24.793 -14.535 235 HB VAL 28 HB VAL 28 29.332 26.025 -13.501 236 1HG1 VAL 28 HG11 VAL 28 27.804 28.536 -14.235 237 2HG1 VAL 28 HG12 VAL 28 29.213 27.965 -15.129 238 3HG1 VAL 28 HG13 VAL 28 29.372 28.430 -13.436 239 1HG2 VAL 28 HG21 VAL 28 27.404 25.558 -12.112 240 2HG2 VAL 28 HG22 VAL 28 26.538 26.948 -12.768 241 3HG2 VAL 28 HG23 VAL 28 27.955 27.193 -11.747 242 H ASP 29 HN ASP 29 27.555 27.747 -16.518 243 HA ASP 29 HA ASP 29 24.941 28.766 -15.919 244 1HB ASP 29 HB2 ASP 29 26.821 28.969 -18.286 245 2HB ASP 29 HB1 ASP 29 25.316 29.882 -18.198 246 H GLN 30 HN GLN 30 26.083 26.701 -18.629 247 HA GLN 30 HA GLN 30 23.426 26.288 -19.720 248 1HB GLN 30 HB2 GLN 30 25.911 26.043 -20.672 249 2HB GLN 30 HB1 GLN 30 25.671 24.369 -20.171 250 1HG GLN 30 HG2 GLN 30 24.941 24.585 -22.476 251 2HG GLN 30 HG1 GLN 30 23.518 24.353 -21.462 252 1HE2 GLN 30 HE21 GLN 30 21.913 25.976 -21.536 253 2HE2 GLN 30 HE22 GLN 30 22.100 27.461 -22.337 254 H VAL 31 HN VAL 31 25.411 24.554 -17.345 255 HA VAL 31 HA VAL 31 23.992 22.086 -17.276 256 HB VAL 31 HB VAL 31 25.581 23.731 -15.308 257 1HG1 VAL 31 HG11 VAL 31 24.236 22.682 -13.727 258 2HG1 VAL 31 HG12 VAL 31 25.486 21.460 -13.954 259 3HG1 VAL 31 HG13 VAL 31 23.929 21.289 -14.762 260 1HG2 VAL 31 HG21 VAL 31 26.134 21.774 -17.307 261 2HG2 VAL 31 HG22 VAL 31 26.500 21.047 -15.743 262 3HG2 VAL 31 HG23 VAL 31 27.275 22.557 -16.216 263 H VAL 32 HN VAL 32 23.485 25.019 -15.244 264 HA VAL 32 HA VAL 32 21.063 23.969 -14.032 265 HB VAL 32 HB VAL 32 22.711 25.665 -13.100 266 1HG1 VAL 32 HG11 VAL 32 22.414 28.007 -13.734 267 2HG1 VAL 32 HG12 VAL 32 21.172 27.560 -14.904 268 3HG1 VAL 32 HG13 VAL 32 22.845 27.062 -15.158 269 1HG2 VAL 32 HG21 VAL 32 20.284 27.173 -12.762 270 2HG2 VAL 32 HG22 VAL 32 21.052 26.058 -11.632 271 3HG2 VAL 32 HG23 VAL 32 19.892 25.454 -12.814 272 H GLU 33 HN GLU 33 21.708 25.986 -16.885 273 HA GLU 33 HA GLU 33 18.958 26.871 -17.230 274 1HB GLU 33 HB2 GLU 33 21.412 27.563 -18.214 275 2HB GLU 33 HB1 GLU 33 20.752 26.669 -19.581 276 1HG GLU 33 HG2 GLU 33 19.178 28.827 -18.164 277 2HG GLU 33 HG1 GLU 33 20.255 29.186 -19.514 278 H VAL 34 HN VAL 34 20.941 24.373 -18.892 279 HA VAL 34 HA VAL 34 18.775 23.369 -20.503 280 HB VAL 34 HB VAL 34 21.280 23.151 -20.861 281 1HG1 VAL 34 HG11 VAL 34 22.572 21.658 -19.648 282 2HG1 VAL 34 HG12 VAL 34 21.182 20.691 -19.154 283 3HG1 VAL 34 HG13 VAL 34 21.491 22.247 -18.386 284 1HG2 VAL 34 HG21 VAL 34 20.124 21.846 -22.370 285 2HG2 VAL 34 HG22 VAL 34 19.289 20.937 -21.111 286 3HG2 VAL 34 HG23 VAL 34 20.973 20.579 -21.487 287 H VAL 35 HN VAL 35 19.921 22.535 -17.233 288 HA VAL 35 HA VAL 35 18.250 20.143 -17.045 289 HB VAL 35 HB VAL 35 20.447 20.783 -15.805 290 1HG1 VAL 35 HG11 VAL 35 20.219 21.983 -13.755 291 2HG1 VAL 35 HG12 VAL 35 18.459 21.980 -13.868 292 3HG1 VAL 35 HG13 VAL 35 19.412 22.962 -14.978 293 1HG2 VAL 35 HG21 VAL 35 18.143 19.701 -14.163 294 2HG2 VAL 35 HG22 VAL 35 19.855 19.324 -13.973 295 3HG2 VAL 35 HG23 VAL 35 18.983 18.768 -15.400 296 H GLN 36 HN GLN 36 17.845 23.576 -16.369 297 HA GLN 36 HA GLN 36 15.459 23.289 -14.720 298 1HB GLN 36 HB2 GLN 36 16.761 25.277 -14.512 299 2HB GLN 36 HB1 GLN 36 16.817 25.516 -16.257 300 1HG GLN 36 HG2 GLN 36 14.484 26.094 -16.335 301 2HG GLN 36 HG1 GLN 36 14.249 25.607 -14.656 302 1HE2 GLN 36 HE21 GLN 36 14.245 27.348 -13.221 303 2HE2 GLN 36 HE22 GLN 36 15.069 28.813 -13.462 304 H ARG 37 HN ARG 37 16.118 23.761 -18.188 305 HA ARG 37 HA ARG 37 13.351 24.177 -18.972 306 1HB ARG 37 HB2 ARG 37 15.936 23.449 -20.362 307 2HB ARG 37 HB1 ARG 37 14.422 23.593 -21.253 308 1HG ARG 37 HG2 ARG 37 14.154 25.907 -20.405 309 2HG ARG 37 HG1 ARG 37 15.697 25.764 -19.561 310 1HD ARG 37 HD2 ARG 37 15.402 25.375 -22.561 311 2HD ARG 37 HD1 ARG 37 15.883 26.909 -21.811 312 HE ARG 37 HE ARG 37 17.717 25.435 -20.665 313 1HH1 ARG 37 HH21 ARG 37 17.043 22.935 -22.145 314 2HH1 ARG 37 HH22 ARG 37 18.132 22.992 -23.490 315 1HH2 ARG 37 HH11 ARG 37 18.843 26.375 -23.109 316 2HH2 ARG 37 HH12 ARG 37 19.154 24.947 -24.039 317 H HIS 38 HN HIS 38 15.355 21.329 -18.431 318 HA HIS 38 HA HIS 38 13.351 19.552 -19.741 319 1HB HIS 38 HB2 HIS 38 16.187 19.357 -18.773 320 2HB HIS 38 HB1 HIS 38 15.251 17.878 -18.991 321 HD1 HIS 38 HD1 HIS 38 14.263 17.465 -21.439 322 HD2 HIS 38 HD2 HIS 38 17.075 20.528 -21.155 323 HE1 HIS 38 HE1 HIS 38 15.017 17.967 -23.804 324 H ALA 39 HN ALA 39 14.964 19.966 -16.563 325 HA ALA 39 HA ALA 39 12.916 18.173 -15.328 326 1HB ALA 39 HB1 ALA 39 15.450 19.342 -14.140 327 2HB ALA 39 HB2 ALA 39 15.427 17.838 -15.061 328 3HB ALA 39 HB3 ALA 39 14.531 17.959 -13.546 329 HA PRO 40 HA PRO 40 10.877 21.630 -13.514 330 1HB PRO 40 HB2 PRO 40 9.911 20.485 -11.216 331 2HB PRO 40 HB1 PRO 40 9.224 20.174 -12.824 332 1HG PRO 40 HG2 PRO 40 11.101 18.514 -11.213 333 2HG PRO 40 HG1 PRO 40 9.733 18.016 -12.222 334 1HD PRO 40 HD2 PRO 40 12.321 17.827 -13.031 335 2HD PRO 40 HD1 PRO 40 10.966 18.071 -14.155 336 H GLY 41 HN GLY 41 12.975 19.745 -11.297 337 1HA GLY 41 HA2 GLY 41 13.413 22.105 -9.588 338 2HA GLY 41 HA1 GLY 41 14.104 20.502 -9.339 339 H ASP 42 HN ASP 42 15.383 23.254 -9.480 340 HA ASP 42 HA ASP 42 17.025 23.208 -11.908 341 1HB ASP 42 HB2 ASP 42 16.599 24.901 -9.501 342 2HB ASP 42 HB1 ASP 42 18.202 24.995 -10.230 343 H TYR 43 HN TYR 43 19.259 22.699 -11.969 344 HA TYR 43 HA TYR 43 20.380 21.292 -9.567 345 1HB TYR 43 HB2 TYR 43 20.113 20.446 -12.448 346 2HB TYR 43 HB1 TYR 43 21.355 19.740 -11.417 347 HD1 TYR 43 HD1 TYR 43 17.928 19.584 -12.403 348 HD2 TYR 43 HD2 TYR 43 20.569 18.805 -9.106 349 HE1 TYR 43 HE1 TYR 43 16.236 18.072 -11.407 350 HE2 TYR 43 HE2 TYR 43 18.877 17.294 -8.109 351 HH TYR 43 HH TYR 43 15.873 17.283 -8.655 352 H THR 44 HN THR 44 22.780 21.172 -9.601 353 HA THR 44 HA THR 44 24.124 23.132 -11.421 354 HB THR 44 HB THR 44 24.553 23.113 -8.424 355 HG1 THR 44 HG1 THR 44 22.781 24.189 -8.162 356 1HG2 THR 44 HG21 THR 44 25.113 25.560 -9.023 357 2HG2 THR 44 HG22 THR 44 25.138 25.005 -10.696 358 3HG2 THR 44 HG23 THR 44 26.261 24.317 -9.522 359 HA PRO 45 HA PRO 45 27.379 20.107 -11.029 360 1HB PRO 45 HB2 PRO 45 29.226 21.432 -12.541 361 2HB PRO 45 HB1 PRO 45 27.789 20.665 -13.241 362 1HG PRO 45 HG2 PRO 45 28.410 23.493 -12.944 363 2HG PRO 45 HG1 PRO 45 27.175 22.713 -13.937 364 1HD PRO 45 HD2 PRO 45 26.882 24.006 -11.359 365 2HD PRO 45 HD1 PRO 45 25.620 23.402 -12.454 366 H THR 46 HN THR 46 29.342 19.807 -9.824 367 HA THR 46 HA THR 46 30.216 22.145 -8.163 368 HB THR 46 HB THR 46 30.577 19.150 -7.764 369 HG1 THR 46 HG1 THR 46 28.652 19.188 -6.968 370 1HG2 THR 46 HG21 THR 46 30.838 20.127 -5.319 371 2HG2 THR 46 HG22 THR 46 31.303 21.590 -6.186 372 3HG2 THR 46 HG23 THR 46 32.214 20.098 -6.422 373 H VAL 47 HN VAL 47 31.804 23.052 -9.562 374 HA VAL 47 HA VAL 47 33.736 21.422 -10.997 375 HB VAL 47 HB VAL 47 32.893 23.659 -11.706 376 1HG1 VAL 47 HG11 VAL 47 33.072 24.534 -9.248 377 2HG1 VAL 47 HG12 VAL 47 33.428 25.642 -10.571 378 3HG1 VAL 47 HG13 VAL 47 34.746 24.888 -9.674 379 1HG2 VAL 47 HG21 VAL 47 34.967 24.404 -12.612 380 2HG2 VAL 47 HG22 VAL 47 35.164 22.666 -12.390 381 3HG2 VAL 47 HG23 VAL 47 35.878 23.788 -11.232 382 H LYS 48 HN LYS 48 35.806 20.891 -10.457 383 HA LYS 48 HA LYS 48 37.035 22.014 -7.986 384 1HB LYS 48 HB2 LYS 48 37.449 19.785 -7.121 385 2HB LYS 48 HB1 LYS 48 35.732 19.899 -7.500 386 1HG LYS 48 HG2 LYS 48 36.565 18.973 -9.862 387 2HG LYS 48 HG1 LYS 48 37.880 18.337 -8.877 388 1HD LYS 48 HD2 LYS 48 36.524 16.860 -7.773 389 2HD LYS 48 HD1 LYS 48 35.144 17.957 -7.790 390 1HE LYS 48 HE2 LYS 48 35.796 17.175 -10.503 391 2HE LYS 48 HE1 LYS 48 35.545 15.738 -9.493 392 1HZ LYS 48 HZ1 LYS 48 33.509 16.739 -8.641 393 2HZ LYS 48 HZ2 LYS 48 33.434 16.575 -10.331 394 3HZ LYS 48 HZ3 LYS 48 33.736 18.096 -9.636 395 HA PRO 49 HA PRO 49 40.613 21.887 -10.557 396 1HB PRO 49 HB2 PRO 49 42.584 21.904 -8.660 397 2HB PRO 49 HB1 PRO 49 41.597 23.328 -9.039 398 1HG PRO 49 HG2 PRO 49 41.415 21.453 -6.749 399 2HG PRO 49 HG1 PRO 49 41.096 23.192 -6.817 400 1HD PRO 49 HD2 PRO 49 39.154 21.225 -6.803 401 2HD PRO 49 HD1 PRO 49 38.918 22.887 -7.387 402 H SER 50 HN SER 50 40.191 19.661 -11.332 403 HA SER 50 HA SER 50 41.406 17.408 -9.852 404 1HB SER 50 HB2 SER 50 39.661 17.853 -12.233 405 2HB SER 50 HB1 SER 50 40.608 16.369 -12.206 406 HG SER 50 HG SER 50 38.787 15.867 -11.116 407 H SER 51 HN SER 51 41.855 18.990 -13.046 408 HA SER 51 HA SER 51 44.574 17.745 -13.219 409 1HB SER 51 HB2 SER 51 42.560 17.638 -14.971 410 2HB SER 51 HB1 SER 51 43.228 19.189 -15.471 411 HG SER 51 HG SER 51 44.116 17.246 -16.510 412 H LYS 52 HN LYS 52 46.309 19.187 -14.115 413 HA LYS 52 HA LYS 52 46.099 21.923 -12.958 414 1HB LYS 52 HB2 LYS 52 48.169 19.893 -13.490 415 2HB LYS 52 HB1 LYS 52 48.684 21.540 -13.852 416 1HG LYS 52 HG2 LYS 52 49.171 21.559 -11.612 417 2HG LYS 52 HG1 LYS 52 47.463 21.977 -11.484 418 1HD LYS 52 HD2 LYS 52 47.423 19.203 -11.634 419 2HD LYS 52 HD1 LYS 52 48.847 19.531 -10.649 420 1HE LYS 52 HE2 LYS 52 47.416 19.784 -8.898 421 2HE LYS 52 HE1 LYS 52 46.905 21.301 -9.660 422 1HZ LYS 52 HZ1 LYS 52 45.807 18.642 -10.406 423 2HZ LYS 52 HZ2 LYS 52 45.239 20.168 -10.894 424 3HZ LYS 52 HZ3 LYS 52 45.067 19.672 -9.279 425 H GLY 53 HN GLY 53 46.741 23.789 -14.213 426 1HA GLY 53 HA2 GLY 53 47.388 24.876 -16.282 427 2HA GLY 53 HA1 GLY 53 46.941 23.412 -17.158 428 H ASN 54 HN ASN 54 45.325 24.060 -18.510 429 HA ASN 54 HA ASN 54 43.131 25.781 -17.433 430 1HB ASN 54 HB2 ASN 54 42.662 26.160 -19.844 431 2HB ASN 54 HB1 ASN 54 44.337 26.534 -19.448 432 1HD2 ASN 54 HD21 ASN 54 42.424 24.864 -21.677 433 2HD2 ASN 54 HD22 ASN 54 43.601 23.800 -22.280 434 H TYR 55 HN TYR 55 42.738 23.417 -16.337 435 HA TYR 55 HA TYR 55 40.617 22.103 -18.002 436 1HB TYR 55 HB2 TYR 55 42.931 20.940 -17.848 437 2HB TYR 55 HB1 TYR 55 42.505 20.618 -16.168 438 HD1 TYR 55 HD1 TYR 55 40.575 19.176 -15.605 439 HD2 TYR 55 HD2 TYR 55 41.791 19.824 -19.675 440 HE1 TYR 55 HE1 TYR 55 39.194 17.246 -16.326 441 HE2 TYR 55 HE2 TYR 55 40.410 17.895 -20.395 442 HH TYR 55 HH TYR 55 38.044 16.683 -18.939 443 H HIS 56 HN HIS 56 38.819 21.354 -16.775 444 HA HIS 56 HA HIS 56 38.890 21.687 -13.817 445 1HB HIS 56 HB2 HIS 56 37.258 23.359 -13.796 446 2HB HIS 56 HB1 HIS 56 38.169 23.791 -15.237 447 HD1 HIS 56 HD1 HIS 56 37.083 22.208 -17.451 448 HD2 HIS 56 HD2 HIS 56 34.586 23.524 -14.385 449 HE1 HIS 56 HE1 HIS 56 34.729 22.180 -18.382 450 H SER 57 HN SER 57 37.352 20.367 -12.735 451 HA SER 57 HA SER 57 35.711 18.558 -14.498 452 1HB SER 57 HB2 SER 57 37.464 18.019 -12.090 453 2HB SER 57 HB1 SER 57 36.238 16.868 -12.618 454 HG SER 57 HG SER 57 38.272 16.444 -13.571 455 H VAL 58 HN VAL 58 33.546 18.968 -14.061 456 HA VAL 58 HA VAL 58 32.854 19.796 -11.265 457 HB VAL 58 HB VAL 58 31.227 21.231 -12.152 458 1HG1 VAL 58 HG11 VAL 58 33.706 21.653 -12.946 459 2HG1 VAL 58 HG12 VAL 58 32.390 22.641 -13.578 460 3HG1 VAL 58 HG13 VAL 58 33.035 21.312 -14.540 461 1HG2 VAL 58 HG21 VAL 58 29.953 19.752 -13.521 462 2HG2 VAL 58 HG22 VAL 58 31.312 19.464 -14.604 463 3HG2 VAL 58 HG23 VAL 58 30.507 21.031 -14.599 464 H SER 59 HN SER 59 31.275 18.699 -10.172 465 HA SER 59 HA SER 59 30.228 16.193 -11.392 466 1HB SER 59 HB2 SER 59 31.425 16.419 -9.110 467 2HB SER 59 HB1 SER 59 29.950 17.198 -8.546 468 HG SER 59 HG SER 59 29.666 15.067 -8.134 469 H ILE 60 HN ILE 60 28.333 16.649 -12.531 470 HA ILE 60 HA ILE 60 26.502 18.746 -11.524 471 HB ILE 60 HB ILE 60 27.157 18.584 -13.919 472 1HG1 ILE 60 HG12 ILE 60 24.221 18.014 -13.386 473 2HG1 ILE 60 HG11 ILE 60 24.990 19.597 -13.285 474 1HG2 ILE 60 HG21 ILE 60 27.068 15.936 -13.708 475 2HG2 ILE 60 HG22 ILE 60 26.733 16.727 -15.246 476 3HG2 ILE 60 HG23 ILE 60 25.402 16.174 -14.231 477 1HD1 ILE 60 HD11 ILE 60 23.761 19.040 -15.479 478 2HD1 ILE 60 HD12 ILE 60 25.099 17.940 -15.811 479 3HD1 ILE 60 HD13 ILE 60 25.402 19.667 -15.623 480 H THR 61 HN THR 61 24.780 18.301 -10.285 481 HA THR 61 HA THR 61 23.925 15.467 -9.909 482 HB THR 61 HB THR 61 23.160 18.086 -8.556 483 HG1 THR 61 HG1 THR 61 24.885 15.970 -7.777 484 1HG2 THR 61 HG21 THR 61 21.361 16.687 -8.066 485 2HG2 THR 61 HG22 THR 61 22.461 16.316 -6.739 486 3HG2 THR 61 HG23 THR 61 22.352 15.227 -8.120 487 H ILE 62 HN ILE 62 21.957 14.726 -10.772 488 HA ILE 62 HA ILE 62 19.879 16.637 -11.613 489 HB ILE 62 HB ILE 62 21.483 16.799 -13.440 490 1HG1 ILE 62 HG12 ILE 62 19.266 14.953 -14.362 491 2HG1 ILE 62 HG11 ILE 62 18.990 16.640 -13.932 492 1HG2 ILE 62 HG21 ILE 62 22.846 15.015 -13.727 493 2HG2 ILE 62 HG22 ILE 62 21.541 14.326 -14.692 494 3HG2 ILE 62 HG23 ILE 62 21.691 13.908 -12.986 495 1HD1 ILE 62 HD11 ILE 62 21.211 16.699 -15.643 496 2HD1 ILE 62 HD12 ILE 62 19.562 17.174 -16.046 497 3HD1 ILE 62 HD13 ILE 62 20.109 15.531 -16.375 498 H ASN 63 HN ASN 63 17.873 15.624 -11.888 499 HA ASN 63 HA ASN 63 17.814 12.642 -11.536 500 1HB ASN 63 HB2 ASN 63 17.113 14.176 -9.594 501 2HB ASN 63 HB1 ASN 63 15.733 14.632 -10.594 502 1HD2 ASN 63 HD21 ASN 63 14.227 12.836 -11.247 503 2HD2 ASN 63 HD22 ASN 63 14.118 11.448 -10.278 504 H ALA 64 HN ALA 64 17.222 11.837 -13.526 505 HA ALA 64 HA ALA 64 15.032 13.254 -15.016 506 1HB ALA 64 HB1 ALA 64 16.746 13.469 -16.508 507 2HB ALA 64 HB2 ALA 64 16.408 11.780 -16.880 508 3HB ALA 64 HB3 ALA 64 17.693 12.193 -15.745 509 H THR 65 HN THR 65 13.327 11.990 -15.747 510 HA THR 65 HA THR 65 12.946 9.345 -14.578 511 HB THR 65 HB THR 65 10.778 9.549 -15.895 512 HG1 THR 65 HG1 THR 65 10.581 11.128 -17.270 513 1HG2 THR 65 HG21 THR 65 10.484 10.322 -13.742 514 2HG2 THR 65 HG22 THR 65 10.217 11.826 -14.624 515 3HG2 THR 65 HG23 THR 65 11.782 11.508 -13.877 516 H HIS 66 HN HIS 66 14.586 10.343 -17.359 517 HA HIS 66 HA HIS 66 14.194 7.660 -18.640 518 1HB HIS 66 HB2 HIS 66 13.022 9.621 -19.744 519 2HB HIS 66 HB1 HIS 66 14.611 10.319 -20.041 520 HD1 HIS 66 HD1 HIS 66 13.168 6.806 -20.531 521 HD2 HIS 66 HD2 HIS 66 15.339 9.691 -22.614 522 HE1 HIS 66 HE1 HIS 66 13.669 5.821 -22.809 523 H ILE 67 HN ILE 67 16.109 6.786 -19.614 524 HA ILE 67 HA ILE 67 18.628 7.544 -18.397 525 HB ILE 67 HB ILE 67 17.679 5.618 -20.512 526 1HG1 ILE 67 HG12 ILE 67 17.377 5.190 -18.039 527 2HG1 ILE 67 HG11 ILE 67 18.304 3.951 -18.881 528 1HG2 ILE 67 HG21 ILE 67 20.104 4.714 -20.398 529 2HG2 ILE 67 HG22 ILE 67 20.528 6.327 -19.824 530 3HG2 ILE 67 HG23 ILE 67 19.799 6.121 -21.416 531 1HD1 ILE 67 HD11 ILE 67 20.408 5.051 -18.130 532 2HD1 ILE 67 HD12 ILE 67 19.412 4.522 -16.775 533 3HD1 ILE 67 HD13 ILE 67 19.448 6.224 -17.230 534 H GLU 68 HN GLU 68 17.382 7.781 -21.759 535 HA GLU 68 HA GLU 68 19.693 9.111 -22.840 536 1HB GLU 68 HB2 GLU 68 17.291 8.017 -23.731 537 2HB GLU 68 HB1 GLU 68 17.130 9.732 -24.110 538 1HG GLU 68 HG2 GLU 68 19.589 8.115 -24.823 539 2HG GLU 68 HG1 GLU 68 18.225 8.322 -25.921 540 H GLN 69 HN GLN 69 17.063 10.304 -20.881 541 HA GLN 69 HA GLN 69 16.894 13.015 -21.725 542 1HB GLN 69 HB2 GLN 69 15.900 11.358 -19.691 543 2HB GLN 69 HB1 GLN 69 16.743 12.647 -18.836 544 1HG GLN 69 HG2 GLN 69 15.499 14.242 -20.474 545 2HG GLN 69 HG1 GLN 69 14.433 12.865 -20.756 546 1HE2 GLN 69 HE21 GLN 69 15.244 15.398 -18.497 547 2HE2 GLN 69 HE22 GLN 69 14.128 14.960 -17.295 548 H VAL 70 HN VAL 70 18.828 11.731 -18.972 549 HA VAL 70 HA VAL 70 20.292 14.122 -18.483 550 HB VAL 70 HB VAL 70 20.030 12.106 -17.004 551 1HG1 VAL 70 HG11 VAL 70 21.966 10.947 -19.016 552 2HG1 VAL 70 HG12 VAL 70 20.435 10.272 -18.459 553 3HG1 VAL 70 HG13 VAL 70 21.825 10.313 -17.377 554 1HG2 VAL 70 HG21 VAL 70 22.293 12.246 -16.053 555 2HG2 VAL 70 HG22 VAL 70 21.732 13.842 -16.553 556 3HG2 VAL 70 HG23 VAL 70 22.887 12.960 -17.552 557 H GLU 71 HN GLU 71 20.787 11.609 -20.914 558 HA GLU 71 HA GLU 71 23.532 12.292 -21.575 559 1HB GLU 71 HB2 GLU 71 21.298 10.640 -22.629 560 2HB GLU 71 HB1 GLU 71 22.487 11.155 -23.823 561 1HG GLU 71 HG2 GLU 71 23.767 9.434 -23.124 562 2HG GLU 71 HG1 GLU 71 24.032 10.352 -21.643 563 H THR 72 HN THR 72 20.354 13.163 -22.984 564 HA THR 72 HA THR 72 21.321 14.848 -25.089 565 HB THR 72 HB THR 72 18.744 14.987 -23.480 566 HG1 THR 72 HG1 THR 72 18.371 13.141 -24.371 567 1HG2 THR 72 HG21 THR 72 17.815 15.904 -25.600 568 2HG2 THR 72 HG22 THR 72 19.439 15.909 -26.283 569 3HG2 THR 72 HG23 THR 72 19.059 16.945 -24.909 570 H LEU 73 HN LEU 73 20.419 15.548 -21.702 571 HA LEU 73 HA LEU 73 20.764 18.399 -21.821 572 1HB LEU 73 HB2 LEU 73 20.505 16.248 -19.790 573 2HB LEU 73 HB1 LEU 73 21.263 17.739 -19.229 574 HG LEU 73 HG LEU 73 19.287 18.955 -20.361 575 1HD1 LEU 73 HD11 LEU 73 18.095 17.461 -21.636 576 2HD1 LEU 73 HD12 LEU 73 17.243 17.212 -20.113 577 3HD1 LEU 73 HD13 LEU 73 18.511 16.093 -20.608 578 1HD2 LEU 73 HD21 LEU 73 19.127 19.119 -18.078 579 2HD2 LEU 73 HD22 LEU 73 19.330 17.385 -17.833 580 3HD2 LEU 73 HD23 LEU 73 17.764 18.028 -18.329 581 H TYR 74 HN TYR 74 23.020 15.722 -21.148 582 HA TYR 74 HA TYR 74 25.256 17.281 -20.273 583 1HB TYR 74 HB2 TYR 74 25.623 15.037 -19.919 584 2HB TYR 74 HB1 TYR 74 24.693 14.561 -21.337 585 HD1 TYR 74 HD1 TYR 74 25.926 13.464 -22.974 586 HD2 TYR 74 HD2 TYR 74 27.819 16.555 -20.667 587 HE1 TYR 74 HE1 TYR 74 28.030 13.125 -24.242 588 HE2 TYR 74 HE2 TYR 74 29.921 16.215 -21.935 589 HH TYR 74 HH TYR 74 30.823 13.831 -23.392 590 H GLU 75 HN GLU 75 24.290 16.158 -23.543 591 HA GLU 75 HA GLU 75 26.485 17.387 -24.948 592 1HB GLU 75 HB2 GLU 75 24.233 15.775 -25.489 593 2HB GLU 75 HB1 GLU 75 24.012 17.224 -26.470 594 1HG GLU 75 HG2 GLU 75 26.607 15.662 -26.389 595 2HG GLU 75 HG1 GLU 75 25.344 15.374 -27.585 596 H GLU 76 HN GLU 76 23.294 18.566 -23.929 597 HA GLU 76 HA GLU 76 23.267 21.009 -25.440 598 1HB GLU 76 HB2 GLU 76 21.944 19.926 -22.969 599 2HB GLU 76 HB1 GLU 76 21.703 21.616 -23.412 600 1HG GLU 76 HG2 GLU 76 20.850 20.978 -25.599 601 2HG GLU 76 HG1 GLU 76 21.218 19.282 -25.286 602 H LEU 77 HN LEU 77 24.434 20.249 -22.132 603 HA LEU 77 HA LEU 77 25.390 22.992 -21.699 604 1HB LEU 77 HB2 LEU 77 25.620 22.285 -19.520 605 2HB LEU 77 HB1 LEU 77 24.554 20.998 -20.070 606 HG LEU 77 HG LEU 77 26.865 19.853 -20.754 607 1HD1 LEU 77 HD11 LEU 77 27.712 22.192 -19.375 608 2HD1 LEU 77 HD12 LEU 77 28.712 20.865 -19.964 609 3HD1 LEU 77 HD13 LEU 77 28.060 20.818 -18.326 610 1HD2 LEU 77 HD21 LEU 77 25.038 19.327 -18.888 611 2HD2 LEU 77 HD22 LEU 77 26.335 19.845 -17.810 612 3HD2 LEU 77 HD23 LEU 77 26.589 18.488 -18.907 613 H GLY 78 HN GLY 78 26.733 19.921 -22.796 614 1HA GLY 78 HA2 GLY 78 29.461 21.123 -22.890 615 2HA GLY 78 HA1 GLY 78 29.116 19.395 -22.957 616 H LYS 79 HN LYS 79 27.928 22.242 -24.770 617 HA LYS 79 HA LYS 79 28.322 20.701 -27.305 618 1HB LYS 79 HB2 LYS 79 26.124 21.906 -26.318 619 2HB LYS 79 HB1 LYS 79 26.827 23.278 -27.173 620 1HG LYS 79 HG2 LYS 79 26.728 22.188 -29.260 621 2HG LYS 79 HG1 LYS 79 26.562 20.595 -28.520 622 1HD LYS 79 HD2 LYS 79 24.390 22.127 -27.558 623 2HD LYS 79 HD1 LYS 79 24.488 22.456 -29.287 624 1HE LYS 79 HE2 LYS 79 24.132 20.213 -29.873 625 2HE LYS 79 HE1 LYS 79 24.691 19.613 -28.300 626 1HZ LYS 79 HZ1 LYS 79 22.388 19.499 -28.122 627 2HZ LYS 79 HZ2 LYS 79 22.141 20.955 -28.961 628 3HZ LYS 79 HZ3 LYS 79 22.744 20.977 -27.372 629 H ILE 80 HN ILE 80 30.032 22.868 -25.496 630 HA ILE 80 HA ILE 80 30.731 24.942 -27.371 631 HB ILE 80 HB ILE 80 32.463 23.828 -25.148 632 1HG1 ILE 80 HG12 ILE 80 30.941 25.943 -24.102 633 2HG1 ILE 80 HG11 ILE 80 29.774 24.936 -24.959 634 1HG2 ILE 80 HG21 ILE 80 32.425 26.623 -25.112 635 2HG2 ILE 80 HG22 ILE 80 32.449 26.209 -26.826 636 3HG2 ILE 80 HG23 ILE 80 33.712 25.603 -25.755 637 1HD1 ILE 80 HD11 ILE 80 29.999 23.215 -23.490 638 2HD1 ILE 80 HD12 ILE 80 30.680 24.436 -22.416 639 3HD1 ILE 80 HD13 ILE 80 31.747 23.416 -23.380 640 H ASP 81 HN ASP 81 32.727 25.114 -28.610 641 HA ASP 81 HA ASP 81 33.534 22.718 -29.997 642 1HB ASP 81 HB2 ASP 81 33.568 25.210 -30.700 643 2HB ASP 81 HB1 ASP 81 35.094 25.304 -29.819 644 H ILE 82 HN ILE 82 34.616 24.216 -27.040 645 HA ILE 82 HA ILE 82 37.303 23.165 -26.937 646 HB ILE 82 HB ILE 82 35.334 23.966 -24.759 647 1HG1 ILE 82 HG12 ILE 82 35.671 25.784 -26.354 648 2HG1 ILE 82 HG11 ILE 82 36.541 26.156 -24.869 649 1HG2 ILE 82 HG21 ILE 82 37.095 22.835 -23.662 650 2HG2 ILE 82 HG22 ILE 82 37.557 24.536 -23.571 651 3HG2 ILE 82 HG23 ILE 82 38.312 23.479 -24.764 652 1HD1 ILE 82 HD11 ILE 82 37.668 25.188 -27.499 653 2HD1 ILE 82 HD12 ILE 82 38.588 25.074 -26.000 654 3HD1 ILE 82 HD13 ILE 82 38.083 26.651 -26.606 655 H VAL 83 HN VAL 83 37.950 21.451 -25.282 656 HA VAL 83 HA VAL 83 36.664 18.952 -25.793 657 HB VAL 83 HB VAL 83 38.615 19.902 -23.669 658 1HG1 VAL 83 HG11 VAL 83 37.205 17.676 -23.287 659 2HG1 VAL 83 HG12 VAL 83 38.933 17.723 -22.941 660 3HG1 VAL 83 HG13 VAL 83 38.356 17.022 -24.452 661 1HG2 VAL 83 HG21 VAL 83 39.422 18.065 -25.850 662 2HG2 VAL 83 HG22 VAL 83 40.259 19.473 -25.198 663 3HG2 VAL 83 HG23 VAL 83 38.960 19.686 -26.370 664 H ARG 84 HN ARG 84 34.658 18.412 -25.068 665 HA ARG 84 HA ARG 84 33.883 19.156 -22.261 666 1HB ARG 84 HB2 ARG 84 31.567 19.241 -23.139 667 2HB ARG 84 HB1 ARG 84 32.615 20.359 -24.008 668 1HG ARG 84 HG2 ARG 84 32.754 17.845 -25.349 669 2HG ARG 84 HG1 ARG 84 31.051 18.206 -25.070 670 1HD ARG 84 HD2 ARG 84 31.225 20.326 -26.199 671 2HD ARG 84 HD1 ARG 84 32.995 20.215 -26.250 672 HE ARG 84 HE ARG 84 32.654 18.152 -27.704 673 1HH1 ARG 84 HH21 ARG 84 32.040 20.608 -29.281 674 2HH1 ARG 84 HH22 ARG 84 30.484 20.246 -29.949 675 1HH2 ARG 84 HH11 ARG 84 29.847 17.641 -27.727 676 2HH2 ARG 84 HH12 ARG 84 29.235 18.556 -29.064 677 H MET 85 HN MET 85 33.210 17.433 -20.970 678 HA MET 85 HA MET 85 32.469 14.841 -22.223 679 1HB MET 85 HB2 MET 85 35.078 15.524 -21.180 680 2HB MET 85 HB1 MET 85 34.367 14.238 -20.203 681 1HG MET 85 HG2 MET 85 34.067 12.826 -22.109 682 2HG MET 85 HG1 MET 85 34.410 14.146 -23.228 683 1HE MET 85 HE1 MET 85 37.387 15.043 -23.548 684 2HE MET 85 HE2 MET 85 36.009 14.306 -24.362 685 3HE MET 85 HE3 MET 85 37.557 13.465 -24.329 686 H VAL 86 HN VAL 86 31.561 13.330 -20.602 687 HA VAL 86 HA VAL 86 30.936 14.529 -17.942 688 HB VAL 86 HB VAL 86 29.178 15.023 -19.737 689 1HG1 VAL 86 HG11 VAL 86 27.639 13.187 -20.285 690 2HG1 VAL 86 HG12 VAL 86 28.632 12.062 -19.360 691 3HG1 VAL 86 HG13 VAL 86 29.269 12.797 -20.831 692 1HG2 VAL 86 HG21 VAL 86 28.221 13.380 -17.380 693 2HG2 VAL 86 HG22 VAL 86 27.357 14.688 -18.190 694 3HG2 VAL 86 HG23 VAL 86 28.803 15.039 -17.240 695 H LEU 87 HN LEU 87 30.304 12.926 -16.365 696 HA LEU 87 HA LEU 87 31.379 10.216 -16.934 697 1HB LEU 87 HB2 LEU 87 32.275 11.173 -14.981 698 2HB LEU 87 HB1 LEU 87 30.742 11.903 -14.525 699 HG LEU 87 HG LEU 87 30.657 8.965 -14.678 700 1HD1 LEU 87 HD11 LEU 87 31.838 8.738 -12.462 701 2HD1 LEU 87 HD12 LEU 87 32.427 10.387 -12.670 702 3HD1 LEU 87 HD13 LEU 87 32.909 9.129 -13.808 703 1HD2 LEU 87 HD21 LEU 87 30.048 10.494 -12.202 704 2HD2 LEU 87 HD22 LEU 87 29.095 9.259 -13.023 705 3HD2 LEU 87 HD23 LEU 87 29.098 10.916 -13.625 Start of MODEL 13 1 1H MET 1 HT1 MET 1 11.698 22.829 -25.771 2 2H MET 1 HT2 MET 1 13.375 23.001 -25.985 3 3H MET 1 HT3 MET 1 12.463 24.282 -25.343 4 HA MET 1 HA MET 1 13.658 23.196 -23.554 5 1HB MET 1 HB2 MET 1 10.784 23.465 -23.885 6 2HB MET 1 HB1 MET 1 11.153 22.196 -22.718 7 1HG MET 1 HG2 MET 1 12.435 23.691 -21.357 8 2HG MET 1 HG1 MET 1 12.444 24.931 -22.612 9 1HE MET 1 HE1 MET 1 10.899 25.989 -19.472 10 2HE MET 1 HE2 MET 1 11.832 24.504 -19.648 11 3HE MET 1 HE3 MET 1 10.151 24.422 -19.134 12 H LYS 2 HN LYS 2 11.133 20.911 -24.687 13 HA LYS 2 HA LYS 2 11.167 18.574 -24.969 14 1HB LYS 2 HB2 LYS 2 13.482 19.554 -26.024 15 2HB LYS 2 HB1 LYS 2 14.125 18.439 -24.818 16 1HG LYS 2 HG2 LYS 2 11.873 17.333 -26.351 17 2HG LYS 2 HG1 LYS 2 13.279 17.719 -27.344 18 1HD LYS 2 HD2 LYS 2 14.693 16.280 -26.107 19 2HD LYS 2 HD1 LYS 2 13.561 16.187 -24.757 20 1HE LYS 2 HE2 LYS 2 12.197 15.283 -27.120 21 2HE LYS 2 HE1 LYS 2 13.742 14.418 -26.991 22 1HZ LYS 2 HZ1 LYS 2 11.709 14.738 -24.846 23 2HZ LYS 2 HZ2 LYS 2 13.240 14.035 -24.624 24 3HZ LYS 2 HZ3 LYS 2 12.106 13.300 -25.652 25 H THR 3 HN THR 3 11.140 16.777 -23.585 26 HA THR 3 HA THR 3 12.675 16.966 -21.025 27 HB THR 3 HB THR 3 9.692 16.583 -21.419 28 HG1 THR 3 HG1 THR 3 9.686 18.597 -20.890 29 1HG2 THR 3 HG21 THR 3 10.043 15.075 -19.693 30 2HG2 THR 3 HG22 THR 3 9.882 16.572 -18.774 31 3HG2 THR 3 HG23 THR 3 11.482 15.915 -19.113 32 H LYS 4 HN LYS 4 10.232 14.800 -22.550 33 HA LYS 4 HA LYS 4 12.224 12.594 -22.558 34 1HB LYS 4 HB2 LYS 4 10.672 11.166 -21.241 35 2HB LYS 4 HB1 LYS 4 11.186 12.582 -20.327 36 1HG LYS 4 HG2 LYS 4 8.993 12.992 -19.972 37 2HG LYS 4 HG1 LYS 4 8.905 13.460 -21.670 38 1HD LYS 4 HD2 LYS 4 8.622 10.908 -22.114 39 2HD LYS 4 HD1 LYS 4 8.200 10.822 -20.404 40 1HE LYS 4 HE2 LYS 4 6.347 12.339 -20.699 41 2HE LYS 4 HE1 LYS 4 6.856 12.722 -22.354 42 1HZ LYS 4 HZ1 LYS 4 6.075 10.026 -21.367 43 2HZ LYS 4 HZ2 LYS 4 6.580 10.394 -22.948 44 3HZ LYS 4 HZ3 LYS 4 5.121 11.027 -22.349 45 H LEU 5 HN LEU 5 11.692 10.931 -24.054 46 HA LEU 5 HA LEU 5 9.735 11.683 -26.129 47 1HB LEU 5 HB2 LEU 5 12.146 10.087 -25.822 48 2HB LEU 5 HB1 LEU 5 10.904 9.180 -26.685 49 HG LEU 5 HG LEU 5 11.255 12.021 -27.490 50 1HD1 LEU 5 HD11 LEU 5 13.288 9.853 -28.093 51 2HD1 LEU 5 HD12 LEU 5 13.586 11.378 -27.260 52 3HD1 LEU 5 HD13 LEU 5 13.174 11.376 -28.975 53 1HD2 LEU 5 HD21 LEU 5 11.161 9.567 -29.241 54 2HD2 LEU 5 HD22 LEU 5 10.583 11.196 -29.591 55 3HD2 LEU 5 HD23 LEU 5 9.697 10.169 -28.465 56 H ASN 6 HN ASN 6 8.841 9.207 -27.033 57 HA ASN 6 HA ASN 6 6.568 8.657 -25.411 58 1HB ASN 6 HB2 ASN 6 7.878 7.666 -27.835 59 2HB ASN 6 HB1 ASN 6 7.040 6.383 -26.961 60 1HD2 ASN 6 HD21 ASN 6 6.583 9.403 -28.742 61 2HD2 ASN 6 HD22 ASN 6 4.888 9.320 -28.803 62 H GLU 7 HN GLU 7 6.577 7.708 -23.421 63 HA GLU 7 HA GLU 7 8.045 5.190 -22.973 64 1HB GLU 7 HB2 GLU 7 9.246 6.181 -20.996 65 2HB GLU 7 HB1 GLU 7 9.761 6.860 -22.538 66 1HG GLU 7 HG2 GLU 7 9.286 8.905 -21.723 67 2HG GLU 7 HG1 GLU 7 7.583 8.451 -21.710 68 H LEU 8 HN LEU 8 7.297 4.089 -21.054 69 HA LEU 8 HA LEU 8 4.813 5.264 -19.840 70 1HB LEU 8 HB2 LEU 8 5.283 2.897 -21.359 71 2HB LEU 8 HB1 LEU 8 4.934 2.387 -19.709 72 HG LEU 8 HG LEU 8 2.861 2.562 -21.028 73 1HD1 LEU 8 HD11 LEU 8 3.426 4.038 -18.586 74 2HD1 LEU 8 HD12 LEU 8 2.009 3.076 -19.006 75 3HD1 LEU 8 HD13 LEU 8 2.096 4.771 -19.482 76 1HD2 LEU 8 HD21 LEU 8 2.143 4.609 -22.026 77 2HD2 LEU 8 HD22 LEU 8 3.824 4.412 -22.518 78 3HD2 LEU 8 HD23 LEU 8 3.411 5.532 -21.220 79 H LEU 9 HN LEU 9 7.501 5.615 -18.760 80 HA LEU 9 HA LEU 9 7.238 4.029 -16.223 81 1HB LEU 9 HB2 LEU 9 9.661 4.766 -17.887 82 2HB LEU 9 HB1 LEU 9 9.797 4.213 -16.219 83 HG LEU 9 HG LEU 9 8.081 2.354 -17.370 84 1HD1 LEU 9 HD11 LEU 9 9.497 3.638 -19.478 85 2HD1 LEU 9 HD12 LEU 9 8.477 2.203 -19.579 86 3HD1 LEU 9 HD13 LEU 9 10.206 2.036 -19.276 87 1HD2 LEU 9 HD21 LEU 9 9.837 0.819 -16.934 88 2HD2 LEU 9 HD22 LEU 9 10.122 2.138 -15.799 89 3HD2 LEU 9 HD23 LEU 9 11.083 2.021 -17.272 90 H GLU 10 HN GLU 10 9.100 6.832 -17.483 91 HA GLU 10 HA GLU 10 9.476 8.968 -16.567 92 1HB GLU 10 HB2 GLU 10 6.840 8.581 -16.847 93 2HB GLU 10 HB1 GLU 10 6.884 8.746 -15.093 94 1HG GLU 10 HG2 GLU 10 6.572 10.959 -15.872 95 2HG GLU 10 HG1 GLU 10 8.297 10.869 -15.513 96 H PHE 11 HN PHE 11 10.851 7.091 -15.134 97 HA PHE 11 HA PHE 11 10.194 7.434 -12.251 98 1HB PHE 11 HB2 PHE 11 10.782 5.214 -13.258 99 2HB PHE 11 HB1 PHE 11 12.375 5.855 -13.661 100 HD1 PHE 11 HD1 PHE 11 10.071 5.096 -10.835 101 HD2 PHE 11 HD2 PHE 11 14.097 6.022 -12.020 102 HE1 PHE 11 HE1 PHE 11 10.868 4.563 -8.548 103 HE2 PHE 11 HE2 PHE 11 14.892 5.489 -9.732 104 HZ PHE 11 HZ PHE 11 13.278 4.759 -7.997 105 HA PRO 12 HA PRO 12 13.099 10.873 -12.457 106 1HB PRO 12 HB2 PRO 12 12.620 11.769 -9.918 107 2HB PRO 12 HB1 PRO 12 11.556 12.132 -11.290 108 1HG PRO 12 HG2 PRO 12 11.246 10.092 -9.143 109 2HG PRO 12 HG1 PRO 12 10.026 11.127 -9.902 110 1HD PRO 12 HD2 PRO 12 10.363 8.505 -10.541 111 2HD PRO 12 HD1 PRO 12 9.749 9.718 -11.686 112 H THR 13 HN THR 13 15.162 10.050 -12.388 113 HA THR 13 HA THR 13 16.146 9.015 -9.746 114 HB THR 13 HB THR 13 15.838 7.174 -11.313 115 HG1 THR 13 HG1 THR 13 17.677 6.446 -10.673 116 1HG2 THR 13 HG21 THR 13 17.423 8.924 -13.205 117 2HG2 THR 13 HG22 THR 13 15.791 8.296 -13.431 118 3HG2 THR 13 HG23 THR 13 17.172 7.200 -13.476 119 HA PRO 14 HA PRO 14 19.171 12.196 -10.229 120 1HB PRO 14 HB2 PRO 14 21.007 11.294 -8.408 121 2HB PRO 14 HB1 PRO 14 19.478 12.067 -7.942 122 1HG PRO 14 HG2 PRO 14 20.200 9.182 -8.000 123 2HG PRO 14 HG1 PRO 14 19.216 10.077 -6.833 124 1HD PRO 14 HD2 PRO 14 18.169 8.495 -8.795 125 2HD PRO 14 HD1 PRO 14 17.317 9.887 -8.092 126 H PHE 15 HN PHE 15 20.737 12.404 -11.779 127 HA PHE 15 HA PHE 15 22.295 9.973 -12.589 128 1HB PHE 15 HB2 PHE 15 21.223 12.405 -14.020 129 2HB PHE 15 HB1 PHE 15 22.519 11.448 -14.726 130 HD1 PHE 15 HD1 PHE 15 19.059 11.858 -14.657 131 HD2 PHE 15 HD2 PHE 15 22.049 8.775 -14.568 132 HE1 PHE 15 HE1 PHE 15 17.399 10.224 -15.504 133 HE2 PHE 15 HE2 PHE 15 20.387 7.141 -15.414 134 HZ PHE 15 HZ PHE 15 18.063 7.865 -15.884 135 H THR 16 HN THR 16 24.187 10.198 -11.336 136 HA THR 16 HA THR 16 25.509 12.760 -10.893 137 HB THR 16 HB THR 16 26.657 9.954 -10.697 138 HG1 THR 16 HG1 THR 16 25.363 9.615 -9.089 139 1HG2 THR 16 HG21 THR 16 27.294 12.638 -9.502 140 2HG2 THR 16 HG22 THR 16 28.381 11.471 -10.254 141 3HG2 THR 16 HG23 THR 16 27.735 11.163 -8.643 142 H TYR 17 HN TYR 17 25.870 13.652 -13.010 143 HA TYR 17 HA TYR 17 27.539 12.032 -14.881 144 1HB TYR 17 HB2 TYR 17 25.543 14.241 -15.050 145 2HB TYR 17 HB1 TYR 17 26.801 14.207 -16.286 146 HD1 TYR 17 HD1 TYR 17 25.050 11.407 -14.486 147 HD2 TYR 17 HD2 TYR 17 25.827 13.353 -18.238 148 HE1 TYR 17 HE1 TYR 17 23.859 9.590 -15.677 149 HE2 TYR 17 HE2 TYR 17 24.635 11.534 -19.427 150 HH TYR 17 HH TYR 17 24.156 8.777 -18.562 151 H LYS 18 HN LYS 18 29.662 12.322 -14.235 152 HA LYS 18 HA LYS 18 30.708 14.893 -13.329 153 1HB LYS 18 HB2 LYS 18 31.516 12.096 -13.582 154 2HB LYS 18 HB1 LYS 18 32.819 13.192 -14.041 155 1HG LYS 18 HG2 LYS 18 31.944 14.444 -11.810 156 2HG LYS 18 HG1 LYS 18 31.540 12.778 -11.393 157 1HD LYS 18 HD2 LYS 18 33.704 12.293 -11.007 158 2HD LYS 18 HD1 LYS 18 34.167 12.890 -12.601 159 1HE LYS 18 HE2 LYS 18 33.542 14.878 -10.424 160 2HE LYS 18 HE1 LYS 18 35.132 14.094 -10.465 161 1HZ LYS 18 HZ1 LYS 18 35.372 14.744 -12.770 162 2HZ LYS 18 HZ2 LYS 18 35.092 16.118 -11.813 163 3HZ LYS 18 HZ3 LYS 18 33.841 15.473 -12.762 164 H VAL 19 HN VAL 19 30.252 16.317 -15.163 165 HA VAL 19 HA VAL 19 31.403 15.631 -17.782 166 HB VAL 19 HB VAL 19 30.666 18.114 -18.215 167 1HG1 VAL 19 HG11 VAL 19 29.466 16.256 -19.154 168 2HG1 VAL 19 HG12 VAL 19 28.279 17.335 -18.421 169 3HG1 VAL 19 HG13 VAL 19 28.757 15.854 -17.590 170 1HG2 VAL 19 HG21 VAL 19 29.256 19.153 -16.686 171 2HG2 VAL 19 HG22 VAL 19 30.390 18.367 -15.591 172 3HG2 VAL 19 HG23 VAL 19 28.816 17.637 -15.902 173 H MET 20 HN MET 20 33.587 15.679 -17.901 174 HA MET 20 HA MET 20 35.080 17.860 -16.487 175 1HB MET 20 HB2 MET 20 35.847 15.130 -17.567 176 2HB MET 20 HB1 MET 20 36.996 16.253 -16.838 177 1HG MET 20 HG2 MET 20 36.312 15.750 -14.743 178 2HG MET 20 HG1 MET 20 34.609 15.858 -15.188 179 1HE MET 20 HE1 MET 20 37.298 12.265 -14.775 180 2HE MET 20 HE2 MET 20 36.918 13.495 -13.573 181 3HE MET 20 HE3 MET 20 37.791 13.945 -15.036 182 H GLY 21 HN GLY 21 36.694 19.042 -17.670 183 1HA GLY 21 HA2 GLY 21 37.435 18.581 -20.372 184 2HA GLY 21 HA1 GLY 21 36.060 19.686 -20.380 185 H GLN 22 HN GLN 22 37.595 21.282 -21.278 186 HA GLN 22 HA GLN 22 39.885 22.211 -19.762 187 1HB GLN 22 HB2 GLN 22 38.173 23.310 -22.000 188 2HB GLN 22 HB1 GLN 22 39.555 24.201 -21.365 189 1HG GLN 22 HG2 GLN 22 40.148 21.381 -21.949 190 2HG GLN 22 HG1 GLN 22 39.687 22.313 -23.372 191 1HE2 GLN 22 HE21 GLN 22 40.889 24.539 -23.543 192 2HE2 GLN 22 HE22 GLN 22 42.524 24.551 -23.085 193 H ALA 23 HN ALA 23 39.838 24.758 -19.223 194 HA ALA 23 HA ALA 23 38.027 25.097 -16.985 195 1HB ALA 23 HB1 ALA 23 39.493 27.404 -18.181 196 2HB ALA 23 HB2 ALA 23 40.467 26.031 -17.657 197 3HB ALA 23 HB3 ALA 23 39.429 26.866 -16.503 198 H LEU 24 HN LEU 24 35.857 25.224 -17.643 199 HA LEU 24 HA LEU 24 35.152 27.466 -19.512 200 1HB LEU 24 HB2 LEU 24 34.642 24.646 -19.591 201 2HB LEU 24 HB1 LEU 24 33.102 25.464 -19.341 202 HG LEU 24 HG LEU 24 33.544 25.224 -21.739 203 1HD1 LEU 24 HD11 LEU 24 32.558 27.391 -20.640 204 2HD1 LEU 24 HD12 LEU 24 32.989 27.412 -22.350 205 3HD1 LEU 24 HD13 LEU 24 34.076 28.127 -21.159 206 1HD2 LEU 24 HD21 LEU 24 35.487 26.229 -22.790 207 2HD2 LEU 24 HD22 LEU 24 36.051 25.172 -21.495 208 3HD2 LEU 24 HD23 LEU 24 36.014 26.919 -21.256 209 HA PRO 25 HA PRO 25 33.221 28.708 -15.606 210 1HB PRO 25 HB2 PRO 25 32.653 31.264 -16.417 211 2HB PRO 25 HB1 PRO 25 34.251 30.761 -15.828 212 1HG PRO 25 HG2 PRO 25 33.296 31.127 -18.628 213 2HG PRO 25 HG1 PRO 25 34.852 31.561 -17.900 214 1HD PRO 25 HD2 PRO 25 34.512 29.356 -19.441 215 2HD PRO 25 HD1 PRO 25 35.699 29.439 -18.122 216 H GLU 26 HN GLU 26 31.913 28.561 -18.826 217 HA GLU 26 HA GLU 26 29.195 29.391 -18.089 218 1HB GLU 26 HB2 GLU 26 30.558 29.484 -20.357 219 2HB GLU 26 HB1 GLU 26 29.912 27.856 -20.565 220 1HG GLU 26 HG2 GLU 26 27.862 29.715 -19.643 221 2HG GLU 26 HG1 GLU 26 28.588 30.246 -21.160 222 H LEU 27 HN LEU 27 30.914 26.567 -17.421 223 HA LEU 27 HA LEU 27 29.131 24.480 -18.152 224 1HB LEU 27 HB2 LEU 27 30.366 23.170 -16.569 225 2HB LEU 27 HB1 LEU 27 31.499 24.350 -17.215 226 HG LEU 27 HG LEU 27 30.711 25.783 -15.125 227 1HD1 LEU 27 HD11 LEU 27 30.272 24.294 -13.174 228 2HD1 LEU 27 HD12 LEU 27 30.170 22.919 -14.273 229 3HD1 LEU 27 HD13 LEU 27 28.978 24.213 -14.367 230 1HD2 LEU 27 HD21 LEU 27 33.009 24.984 -15.516 231 2HD2 LEU 27 HD22 LEU 27 32.564 23.387 -14.917 232 3HD2 LEU 27 HD23 LEU 27 32.565 24.770 -13.823 233 H VAL 28 HN VAL 28 29.017 26.698 -15.364 234 HA VAL 28 HA VAL 28 26.848 25.275 -14.026 235 HB VAL 28 HB VAL 28 28.602 26.796 -12.998 236 1HG1 VAL 28 HG11 VAL 28 28.292 29.194 -13.107 237 2HG1 VAL 28 HG12 VAL 28 26.825 29.008 -14.067 238 3HG1 VAL 28 HG13 VAL 28 28.391 28.583 -14.758 239 1HG2 VAL 28 HG21 VAL 28 26.900 26.334 -11.494 240 2HG2 VAL 28 HG22 VAL 28 25.653 27.029 -12.529 241 3HG2 VAL 28 HG23 VAL 28 26.734 28.085 -11.620 242 H ASP 29 HN ASP 29 27.043 27.939 -16.372 243 HA ASP 29 HA ASP 29 24.327 28.851 -16.172 244 1HB ASP 29 HB2 ASP 29 26.165 30.083 -17.259 245 2HB ASP 29 HB1 ASP 29 26.300 28.822 -18.483 246 H GLN 30 HN GLN 30 25.866 26.505 -18.417 247 HA GLN 30 HA GLN 30 23.365 25.788 -19.705 248 1HB GLN 30 HB2 GLN 30 26.019 25.526 -20.260 249 2HB GLN 30 HB1 GLN 30 25.630 23.887 -19.731 250 1HG GLN 30 HG2 GLN 30 24.845 23.554 -21.829 251 2HG GLN 30 HG1 GLN 30 23.476 24.551 -21.345 252 1HE2 GLN 30 HE21 GLN 30 26.564 24.591 -23.104 253 2HE2 GLN 30 HE22 GLN 30 26.312 26.089 -23.859 254 H VAL 31 HN VAL 31 25.278 24.374 -17.045 255 HA VAL 31 HA VAL 31 23.914 21.904 -16.782 256 HB VAL 31 HB VAL 31 25.386 23.783 -14.950 257 1HG1 VAL 31 HG11 VAL 31 23.696 21.439 -14.162 258 2HG1 VAL 31 HG12 VAL 31 24.018 22.933 -13.282 259 3HG1 VAL 31 HG13 VAL 31 25.242 21.666 -13.345 260 1HG2 VAL 31 HG21 VAL 31 27.084 22.141 -15.064 261 2HG2 VAL 31 HG22 VAL 31 26.416 22.163 -16.695 262 3HG2 VAL 31 HG23 VAL 31 25.957 20.885 -15.572 263 H VAL 32 HN VAL 32 23.131 25.057 -15.219 264 HA VAL 32 HA VAL 32 20.752 23.980 -13.925 265 HB VAL 32 HB VAL 32 22.244 25.891 -13.161 266 1HG1 VAL 32 HG11 VAL 32 21.863 28.099 -14.080 267 2HG1 VAL 32 HG12 VAL 32 20.622 27.481 -15.169 268 3HG1 VAL 32 HG13 VAL 32 22.309 27.024 -15.404 269 1HG2 VAL 32 HG21 VAL 32 19.410 25.539 -12.977 270 2HG2 VAL 32 HG22 VAL 32 19.744 27.268 -13.027 271 3HG2 VAL 32 HG23 VAL 32 20.499 26.260 -11.793 272 H GLU 33 HN GLU 33 21.308 25.885 -16.919 273 HA GLU 33 HA GLU 33 18.456 26.271 -17.398 274 1HB GLU 33 HB2 GLU 33 19.191 27.346 -19.404 275 2HB GLU 33 HB1 GLU 33 20.411 27.711 -18.188 276 1HG GLU 33 HG2 GLU 33 21.863 27.004 -19.793 277 2HG GLU 33 HG1 GLU 33 21.418 25.399 -19.224 278 H VAL 34 HN VAL 34 20.838 23.821 -18.362 279 HA VAL 34 HA VAL 34 19.045 22.601 -20.329 280 HB VAL 34 HB VAL 34 21.604 22.648 -20.337 281 1HG1 VAL 34 HG11 VAL 34 22.841 21.187 -18.993 282 2HG1 VAL 34 HG12 VAL 34 21.430 20.216 -18.575 283 3HG1 VAL 34 HG13 VAL 34 21.642 21.816 -17.865 284 1HG2 VAL 34 HG21 VAL 34 20.654 21.262 -21.950 285 2HG2 VAL 34 HG22 VAL 34 19.918 20.200 -20.752 286 3HG2 VAL 34 HG23 VAL 34 21.655 20.129 -21.043 287 H VAL 35 HN VAL 35 19.913 22.021 -16.915 288 HA VAL 35 HA VAL 35 18.440 19.512 -16.737 289 HB VAL 35 HB VAL 35 20.358 20.313 -15.264 290 1HG1 VAL 35 HG11 VAL 35 19.279 22.613 -14.971 291 2HG1 VAL 35 HG12 VAL 35 19.923 21.864 -13.513 292 3HG1 VAL 35 HG13 VAL 35 18.187 21.843 -13.822 293 1HG2 VAL 35 HG21 VAL 35 18.744 18.425 -14.717 294 2HG2 VAL 35 HG22 VAL 35 17.844 19.581 -13.737 295 3HG2 VAL 35 HG23 VAL 35 19.510 19.179 -13.320 296 H GLN 36 HN GLN 36 17.671 22.936 -16.328 297 HA GLN 36 HA GLN 36 15.074 22.490 -15.066 298 1HB GLN 36 HB2 GLN 36 16.258 24.545 -14.678 299 2HB GLN 36 HB1 GLN 36 16.477 24.819 -16.406 300 1HG GLN 36 HG2 GLN 36 14.089 25.162 -16.708 301 2HG GLN 36 HG1 GLN 36 13.783 24.746 -15.020 302 1HE2 GLN 36 HE21 GLN 36 15.636 27.130 -17.001 303 2HE2 GLN 36 HE22 GLN 36 15.492 28.394 -15.876 304 H ARG 37 HN ARG 37 16.253 23.036 -18.388 305 HA ARG 37 HA ARG 37 13.694 23.383 -19.651 306 1HB ARG 37 HB2 ARG 37 16.504 22.733 -20.418 307 2HB ARG 37 HB1 ARG 37 15.251 22.398 -21.614 308 1HG ARG 37 HG2 ARG 37 14.582 24.654 -21.729 309 2HG ARG 37 HG1 ARG 37 15.350 25.055 -20.193 310 1HD ARG 37 HD2 ARG 37 16.923 25.929 -21.680 311 2HD ARG 37 HD1 ARG 37 17.551 24.278 -21.512 312 HE ARG 37 HE ARG 37 15.720 25.116 -23.736 313 1HH1 ARG 37 HH21 ARG 37 18.733 24.903 -24.141 314 2HH1 ARG 37 HH22 ARG 37 18.873 23.321 -24.833 315 1HH2 ARG 37 HH11 ARG 37 15.679 22.333 -23.875 316 2HH2 ARG 37 HH12 ARG 37 17.137 21.862 -24.683 317 H HIS 38 HN HIS 38 15.458 20.491 -18.644 318 HA HIS 38 HA HIS 38 13.482 18.754 -20.072 319 1HB HIS 38 HB2 HIS 38 16.283 18.495 -19.047 320 2HB HIS 38 HB1 HIS 38 15.304 17.035 -19.174 321 HD1 HIS 38 HD1 HIS 38 14.708 16.193 -21.532 322 HD2 HIS 38 HD2 HIS 38 16.850 19.768 -21.557 323 HE1 HIS 38 HE1 HIS 38 15.399 16.598 -23.935 324 H ALA 39 HN ALA 39 15.009 19.180 -16.856 325 HA ALA 39 HA ALA 39 12.881 17.478 -15.639 326 1HB ALA 39 HB1 ALA 39 15.439 17.248 -15.276 327 2HB ALA 39 HB2 ALA 39 14.415 17.235 -13.841 328 3HB ALA 39 HB3 ALA 39 15.293 18.698 -14.284 329 HA PRO 40 HA PRO 40 10.771 21.033 -14.111 330 1HB PRO 40 HB2 PRO 40 9.624 19.981 -11.855 331 2HB PRO 40 HB1 PRO 40 9.051 19.622 -13.496 332 1HG PRO 40 HG2 PRO 40 10.784 17.997 -11.700 333 2HG PRO 40 HG1 PRO 40 9.482 17.480 -12.784 334 1HD PRO 40 HD2 PRO 40 12.115 17.229 -13.404 335 2HD PRO 40 HD1 PRO 40 10.846 17.455 -14.628 336 H GLY 41 HN GLY 41 12.738 19.208 -11.741 337 1HA GLY 41 HA2 GLY 41 13.017 21.574 -10.013 338 2HA GLY 41 HA1 GLY 41 13.741 19.991 -9.730 339 H ASP 42 HN ASP 42 14.935 22.769 -9.759 340 HA ASP 42 HA ASP 42 16.803 22.684 -12.053 341 1HB ASP 42 HB2 ASP 42 15.993 24.569 -9.882 342 2HB ASP 42 HB1 ASP 42 17.624 24.752 -10.527 343 H TYR 43 HN TYR 43 19.079 22.405 -11.776 344 HA TYR 43 HA TYR 43 19.990 21.415 -9.101 345 1HB TYR 43 HB2 TYR 43 20.117 20.113 -11.819 346 2HB TYR 43 HB1 TYR 43 21.254 19.667 -10.546 347 HD1 TYR 43 HD1 TYR 43 20.420 18.740 -8.382 348 HD2 TYR 43 HD2 TYR 43 17.808 19.449 -11.718 349 HE1 TYR 43 HE1 TYR 43 18.690 17.307 -7.334 350 HE2 TYR 43 HE2 TYR 43 16.080 18.014 -10.671 351 HH TYR 43 HH TYR 43 15.710 17.344 -7.859 352 H THR 44 HN THR 44 22.538 21.053 -9.303 353 HA THR 44 HA THR 44 23.768 23.235 -10.939 354 HB THR 44 HB THR 44 24.665 22.932 -8.111 355 HG1 THR 44 HG1 THR 44 22.823 23.428 -7.269 356 1HG2 THR 44 HG21 THR 44 25.735 24.717 -9.071 357 2HG2 THR 44 HG22 THR 44 24.290 25.563 -8.519 358 3HG2 THR 44 HG23 THR 44 24.418 25.037 -10.198 359 HA PRO 45 HA PRO 45 27.049 20.254 -11.182 360 1HB PRO 45 HB2 PRO 45 28.884 21.863 -12.406 361 2HB PRO 45 HB1 PRO 45 27.439 21.260 -13.234 362 1HG PRO 45 HG2 PRO 45 28.072 23.962 -12.350 363 2HG PRO 45 HG1 PRO 45 26.837 23.412 -13.487 364 1HD PRO 45 HD2 PRO 45 26.537 24.149 -10.706 365 2HD PRO 45 HD1 PRO 45 25.278 23.753 -11.896 366 H THR 46 HN THR 46 29.331 19.915 -10.427 367 HA THR 46 HA THR 46 30.188 21.823 -8.269 368 HB THR 46 HB THR 46 30.325 18.784 -8.267 369 HG1 THR 46 HG1 THR 46 28.322 18.954 -7.701 370 1HG2 THR 46 HG21 THR 46 30.506 20.345 -5.761 371 2HG2 THR 46 HG22 THR 46 31.879 20.516 -6.854 372 3HG2 THR 46 HG23 THR 46 31.413 18.920 -6.269 373 H VAL 47 HN VAL 47 31.717 22.756 -9.796 374 HA VAL 47 HA VAL 47 33.658 21.031 -11.157 375 HB VAL 47 HB VAL 47 32.689 23.133 -12.095 376 1HG1 VAL 47 HG11 VAL 47 33.925 24.247 -9.639 377 2HG1 VAL 47 HG12 VAL 47 32.522 24.802 -10.547 378 3HG1 VAL 47 HG13 VAL 47 34.147 25.197 -11.106 379 1HG2 VAL 47 HG21 VAL 47 34.934 24.107 -12.819 380 2HG2 VAL 47 HG22 VAL 47 34.730 22.377 -13.089 381 3HG2 VAL 47 HG23 VAL 47 35.687 22.948 -11.724 382 H LYS 48 HN LYS 48 35.805 20.744 -10.644 383 HA LYS 48 HA LYS 48 36.944 22.135 -8.270 384 1HB LYS 48 HB2 LYS 48 37.536 20.014 -7.245 385 2HB LYS 48 HB1 LYS 48 35.811 19.975 -7.604 386 1HG LYS 48 HG2 LYS 48 36.625 18.907 -9.883 387 2HG LYS 48 HG1 LYS 48 38.062 18.510 -8.942 388 1HD LYS 48 HD2 LYS 48 36.968 16.755 -8.056 389 2HD LYS 48 HD1 LYS 48 35.823 17.875 -7.317 390 1HE LYS 48 HE2 LYS 48 35.310 17.477 -10.181 391 2HE LYS 48 HE1 LYS 48 35.172 15.981 -9.237 392 1HZ LYS 48 HZ1 LYS 48 33.792 17.171 -7.630 393 2HZ LYS 48 HZ2 LYS 48 33.094 17.210 -9.180 394 3HZ LYS 48 HZ3 LYS 48 33.894 18.581 -8.574 395 HA PRO 49 HA PRO 49 40.513 22.122 -10.856 396 1HB PRO 49 HB2 PRO 49 42.473 22.458 -8.977 397 2HB PRO 49 HB1 PRO 49 41.366 23.758 -9.460 398 1HG PRO 49 HG2 PRO 49 41.331 22.046 -7.036 399 2HG PRO 49 HG1 PRO 49 40.890 23.749 -7.225 400 1HD PRO 49 HD2 PRO 49 39.085 21.677 -7.053 401 2HD PRO 49 HD1 PRO 49 38.745 23.254 -7.796 402 H SER 50 HN SER 50 40.211 19.782 -11.392 403 HA SER 50 HA SER 50 41.681 17.799 -9.763 404 1HB SER 50 HB2 SER 50 39.869 17.823 -12.159 405 2HB SER 50 HB1 SER 50 40.862 16.400 -11.859 406 HG SER 50 HG SER 50 38.869 16.215 -10.800 407 H SER 51 HN SER 51 41.901 19.248 -13.030 408 HA SER 51 HA SER 51 44.605 18.022 -13.378 409 1HB SER 51 HB2 SER 51 42.332 18.805 -15.063 410 2HB SER 51 HB1 SER 51 43.881 19.330 -15.715 411 HG SER 51 HG SER 51 43.545 17.258 -16.423 412 H LYS 52 HN LYS 52 46.269 19.498 -14.410 413 HA LYS 52 HA LYS 52 46.197 22.182 -13.106 414 1HB LYS 52 HB2 LYS 52 48.240 20.187 -13.958 415 2HB LYS 52 HB1 LYS 52 48.716 21.884 -14.037 416 1HG LYS 52 HG2 LYS 52 49.239 21.567 -11.838 417 2HG LYS 52 HG1 LYS 52 47.513 21.839 -11.601 418 1HD LYS 52 HD2 LYS 52 47.991 19.078 -12.318 419 2HD LYS 52 HD1 LYS 52 48.979 19.523 -10.927 420 1HE LYS 52 HE2 LYS 52 47.097 20.091 -9.615 421 2HE LYS 52 HE1 LYS 52 46.046 20.252 -11.036 422 1HZ LYS 52 HZ1 LYS 52 45.555 18.145 -10.162 423 2HZ LYS 52 HZ2 LYS 52 47.189 17.775 -9.876 424 3HZ LYS 52 HZ3 LYS 52 46.590 17.826 -11.467 425 H GLY 53 HN GLY 53 46.845 24.070 -14.347 426 1HA GLY 53 HA2 GLY 53 47.323 25.251 -16.385 427 2HA GLY 53 HA1 GLY 53 46.937 23.790 -17.295 428 H ASN 54 HN ASN 54 45.284 24.454 -18.626 429 HA ASN 54 HA ASN 54 43.025 26.009 -17.443 430 1HB ASN 54 HB2 ASN 54 44.389 26.616 -19.575 431 2HB ASN 54 HB1 ASN 54 43.469 25.330 -20.355 432 1HD2 ASN 54 HD21 ASN 54 41.257 25.755 -20.883 433 2HD2 ASN 54 HD22 ASN 54 40.498 27.239 -20.567 434 H TYR 55 HN TYR 55 42.681 23.649 -16.398 435 HA TYR 55 HA TYR 55 40.604 22.309 -18.077 436 1HB TYR 55 HB2 TYR 55 42.988 21.247 -18.080 437 2HB TYR 55 HB1 TYR 55 42.596 20.748 -16.435 438 HD1 TYR 55 HD1 TYR 55 40.703 19.209 -15.998 439 HD2 TYR 55 HD2 TYR 55 41.879 20.264 -19.993 440 HE1 TYR 55 HE1 TYR 55 39.376 17.315 -16.888 441 HE2 TYR 55 HE2 TYR 55 40.552 18.369 -20.884 442 HH TYR 55 HH TYR 55 39.703 15.891 -19.462 443 H HIS 56 HN HIS 56 38.820 21.674 -16.875 444 HA HIS 56 HA HIS 56 39.025 21.696 -13.892 445 1HB HIS 56 HB2 HIS 56 37.648 23.554 -15.696 446 2HB HIS 56 HB1 HIS 56 36.573 22.870 -14.477 447 HD1 HIS 56 HD1 HIS 56 39.061 25.469 -14.940 448 HD2 HIS 56 HD2 HIS 56 37.748 23.164 -11.725 449 HE1 HIS 56 HE1 HIS 56 39.844 26.654 -12.843 450 H SER 57 HN SER 57 37.824 20.068 -12.947 451 HA SER 57 HA SER 57 36.106 18.395 -14.754 452 1HB SER 57 HB2 SER 57 37.698 17.855 -12.232 453 2HB SER 57 HB1 SER 57 36.577 16.681 -12.916 454 HG SER 57 HG SER 57 38.810 16.488 -13.622 455 H VAL 58 HN VAL 58 33.916 18.679 -14.397 456 HA VAL 58 HA VAL 58 33.054 19.400 -11.619 457 HB VAL 58 HB VAL 58 32.933 21.346 -13.030 458 1HG1 VAL 58 HG11 VAL 58 31.526 19.534 -15.007 459 2HG1 VAL 58 HG12 VAL 58 33.075 20.346 -15.228 460 3HG1 VAL 58 HG13 VAL 58 31.586 21.288 -15.158 461 1HG2 VAL 58 HG21 VAL 58 30.119 20.315 -13.179 462 2HG2 VAL 58 HG22 VAL 58 30.695 21.919 -12.726 463 3HG2 VAL 58 HG23 VAL 58 30.880 20.568 -11.609 464 H SER 59 HN SER 59 31.166 18.421 -10.859 465 HA SER 59 HA SER 59 30.036 16.226 -12.559 466 1HB SER 59 HB2 SER 59 29.502 15.200 -10.337 467 2HB SER 59 HB1 SER 59 31.225 15.488 -10.549 468 HG SER 59 HG SER 59 30.432 16.208 -8.510 469 H ILE 60 HN ILE 60 28.035 16.741 -13.332 470 HA ILE 60 HA ILE 60 26.410 18.809 -11.957 471 HB ILE 60 HB ILE 60 26.809 18.965 -14.376 472 1HG1 ILE 60 HG12 ILE 60 23.954 18.207 -13.670 473 2HG1 ILE 60 HG11 ILE 60 24.669 19.810 -13.528 474 1HG2 ILE 60 HG21 ILE 60 26.846 17.121 -15.669 475 2HG2 ILE 60 HG22 ILE 60 25.140 16.833 -15.327 476 3HG2 ILE 60 HG23 ILE 60 26.377 16.143 -14.279 477 1HD1 ILE 60 HD11 ILE 60 23.809 18.327 -15.972 478 2HD1 ILE 60 HD12 ILE 60 25.217 19.379 -16.110 479 3HD1 ILE 60 HD13 ILE 60 23.668 20.044 -15.594 480 H THR 61 HN THR 61 24.561 18.364 -10.829 481 HA THR 61 HA THR 61 23.773 15.516 -10.474 482 HB THR 61 HB THR 61 22.723 18.088 -9.228 483 HG1 THR 61 HG1 THR 61 24.470 18.049 -8.094 484 1HG2 THR 61 HG21 THR 61 21.377 15.862 -9.133 485 2HG2 THR 61 HG22 THR 61 21.655 16.738 -7.628 486 3HG2 THR 61 HG23 THR 61 22.640 15.330 -8.023 487 H ILE 62 HN ILE 62 22.330 14.728 -12.004 488 HA ILE 62 HA ILE 62 20.218 16.614 -13.014 489 HB ILE 62 HB ILE 62 21.762 14.375 -14.357 490 1HG1 ILE 62 HG12 ILE 62 22.929 16.555 -14.156 491 2HG1 ILE 62 HG11 ILE 62 22.547 16.180 -15.835 492 1HG2 ILE 62 HG21 ILE 62 19.331 15.926 -15.261 493 2HG2 ILE 62 HG22 ILE 62 19.574 14.179 -15.255 494 3HG2 ILE 62 HG23 ILE 62 20.441 15.186 -16.413 495 1HD1 ILE 62 HD11 ILE 62 21.952 18.485 -15.479 496 2HD1 ILE 62 HD12 ILE 62 21.077 18.089 -14.002 497 3HD1 ILE 62 HD13 ILE 62 20.446 17.573 -15.566 498 H ASN 63 HN ASN 63 18.487 15.968 -11.662 499 HA ASN 63 HA ASN 63 17.873 13.082 -11.369 500 1HB ASN 63 HB2 ASN 63 17.675 14.853 -9.540 501 2HB ASN 63 HB1 ASN 63 16.303 15.505 -10.438 502 1HD2 ASN 63 HD21 ASN 63 14.366 14.109 -10.651 503 2HD2 ASN 63 HD22 ASN 63 14.120 12.814 -9.584 504 H ALA 64 HN ALA 64 17.426 12.652 -13.645 505 HA ALA 64 HA ALA 64 15.065 14.050 -14.814 506 1HB ALA 64 HB1 ALA 64 16.129 12.328 -16.704 507 2HB ALA 64 HB2 ALA 64 17.542 12.783 -15.752 508 3HB ALA 64 HB3 ALA 64 16.560 14.028 -16.522 509 H THR 65 HN THR 65 13.178 12.953 -15.273 510 HA THR 65 HA THR 65 12.679 10.385 -13.996 511 HB THR 65 HB THR 65 10.411 10.762 -15.065 512 HG1 THR 65 HG1 THR 65 10.471 12.031 -16.723 513 1HG2 THR 65 HG21 THR 65 10.565 11.629 -12.900 514 2HG2 THR 65 HG22 THR 65 10.119 13.055 -13.837 515 3HG2 THR 65 HG23 THR 65 11.796 12.807 -13.352 516 H HIS 66 HN HIS 66 14.054 11.195 -16.997 517 HA HIS 66 HA HIS 66 13.341 8.500 -18.099 518 1HB HIS 66 HB2 HIS 66 12.347 10.772 -19.077 519 2HB HIS 66 HB1 HIS 66 13.917 10.846 -19.875 520 HD1 HIS 66 HD1 HIS 66 12.501 10.459 -22.133 521 HD2 HIS 66 HD2 HIS 66 12.594 7.234 -19.496 522 HE1 HIS 66 HE1 HIS 66 11.748 8.434 -23.453 523 H ILE 67 HN ILE 67 15.018 7.589 -19.504 524 HA ILE 67 HA ILE 67 17.723 8.038 -18.533 525 HB ILE 67 HB ILE 67 16.353 6.325 -20.606 526 1HG1 ILE 67 HG12 ILE 67 18.046 4.983 -18.686 527 2HG1 ILE 67 HG11 ILE 67 16.970 6.102 -17.848 528 1HG2 ILE 67 HG21 ILE 67 18.668 5.198 -20.813 529 2HG2 ILE 67 HG22 ILE 67 19.317 6.714 -20.190 530 3HG2 ILE 67 HG23 ILE 67 18.414 6.698 -21.705 531 1HD1 ILE 67 HD11 ILE 67 16.260 3.765 -19.606 532 2HD1 ILE 67 HD12 ILE 67 15.119 5.091 -19.388 533 3HD1 ILE 67 HD13 ILE 67 15.664 4.159 -17.993 534 H GLU 68 HN GLU 68 16.087 8.601 -21.672 535 HA GLU 68 HA GLU 68 18.336 9.769 -23.019 536 1HB GLU 68 HB2 GLU 68 16.605 10.532 -24.605 537 2HB GLU 68 HB1 GLU 68 16.300 8.872 -24.104 538 1HG GLU 68 HG2 GLU 68 14.203 9.586 -23.623 539 2HG GLU 68 HG1 GLU 68 14.927 10.323 -22.194 540 H GLN 69 HN GLN 69 16.136 11.092 -20.635 541 HA GLN 69 HA GLN 69 16.272 13.870 -21.256 542 1HB GLN 69 HB2 GLN 69 14.873 12.488 -19.544 543 2HB GLN 69 HB1 GLN 69 16.240 12.738 -18.460 544 1HG GLN 69 HG2 GLN 69 16.004 15.120 -18.563 545 2HG GLN 69 HG1 GLN 69 14.865 15.013 -19.905 546 1HE2 GLN 69 HE21 GLN 69 12.912 13.323 -19.187 547 2HE2 GLN 69 HE22 GLN 69 12.219 13.720 -17.689 548 H VAL 70 HN VAL 70 18.304 11.975 -18.958 549 HA VAL 70 HA VAL 70 20.114 14.175 -18.439 550 HB VAL 70 HB VAL 70 19.654 12.178 -16.970 551 1HG1 VAL 70 HG11 VAL 70 21.381 10.777 -19.032 552 2HG1 VAL 70 HG12 VAL 70 19.694 10.423 -18.667 553 3HG1 VAL 70 HG13 VAL 70 20.940 10.103 -17.464 554 1HG2 VAL 70 HG21 VAL 70 22.224 11.772 -16.557 555 2HG2 VAL 70 HG22 VAL 70 21.531 13.366 -16.268 556 3HG2 VAL 70 HG23 VAL 70 22.417 13.048 -17.758 557 H GLU 71 HN GLU 71 19.989 11.659 -20.913 558 HA GLU 71 HA GLU 71 22.715 11.769 -21.806 559 1HB GLU 71 HB2 GLU 71 20.127 10.708 -22.644 560 2HB GLU 71 HB1 GLU 71 21.071 11.268 -24.025 561 1HG GLU 71 HG2 GLU 71 21.987 9.173 -23.859 562 2HG GLU 71 HG1 GLU 71 23.011 9.972 -22.667 563 H THR 72 HN THR 72 19.790 13.449 -23.054 564 HA THR 72 HA THR 72 21.175 15.125 -24.930 565 HB THR 72 HB THR 72 19.036 16.491 -24.710 566 HG1 THR 72 HG1 THR 72 18.279 16.224 -22.741 567 1HG2 THR 72 HG21 THR 72 18.217 13.630 -24.895 568 2HG2 THR 72 HG22 THR 72 19.451 14.200 -26.017 569 3HG2 THR 72 HG23 THR 72 17.867 14.973 -25.984 570 H LEU 73 HN LEU 73 20.356 15.514 -21.489 571 HA LEU 73 HA LEU 73 21.130 18.251 -21.166 572 1HB LEU 73 HB2 LEU 73 20.578 15.855 -19.531 573 2HB LEU 73 HB1 LEU 73 21.678 17.001 -18.766 574 HG LEU 73 HG LEU 73 20.086 18.756 -18.839 575 1HD1 LEU 73 HD11 LEU 73 19.339 18.486 -21.152 576 2HD1 LEU 73 HD12 LEU 73 17.939 18.548 -20.084 577 3HD1 LEU 73 HD13 LEU 73 18.487 17.002 -20.729 578 1HD2 LEU 73 HD21 LEU 73 18.330 17.914 -17.522 579 2HD2 LEU 73 HD22 LEU 73 19.591 16.701 -17.310 580 3HD2 LEU 73 HD23 LEU 73 18.255 16.400 -18.422 581 H TYR 74 HN TYR 74 23.013 15.217 -20.968 582 HA TYR 74 HA TYR 74 25.489 16.382 -20.091 583 1HB TYR 74 HB2 TYR 74 25.852 14.148 -19.977 584 2HB TYR 74 HB1 TYR 74 24.417 13.840 -20.941 585 HD1 TYR 74 HD1 TYR 74 27.912 15.146 -21.479 586 HD2 TYR 74 HD2 TYR 74 24.734 12.626 -22.897 587 HE1 TYR 74 HE1 TYR 74 29.332 14.423 -23.378 588 HE2 TYR 74 HE2 TYR 74 26.156 11.904 -24.796 589 HH TYR 74 HH TYR 74 28.530 13.364 -25.973 590 H GLU 75 HN GLU 75 24.230 15.647 -23.365 591 HA GLU 75 HA GLU 75 26.531 16.678 -24.779 592 1HB GLU 75 HB2 GLU 75 24.535 15.082 -25.437 593 2HB GLU 75 HB1 GLU 75 23.744 16.588 -25.902 594 1HG GLU 75 HG2 GLU 75 24.865 15.790 -27.861 595 2HG GLU 75 HG1 GLU 75 25.837 17.128 -27.249 596 H GLU 76 HN GLU 76 23.553 18.154 -23.561 597 HA GLU 76 HA GLU 76 23.757 20.612 -25.082 598 1HB GLU 76 HB2 GLU 76 22.247 19.570 -22.711 599 2HB GLU 76 HB1 GLU 76 22.205 21.300 -23.049 600 1HG GLU 76 HG2 GLU 76 21.360 20.897 -25.291 601 2HG GLU 76 HG1 GLU 76 21.544 19.156 -25.089 602 H LEU 77 HN LEU 77 24.545 19.835 -21.645 603 HA LEU 77 HA LEU 77 25.772 22.421 -21.162 604 1HB LEU 77 HB2 LEU 77 26.046 21.613 -19.001 605 2HB LEU 77 HB1 LEU 77 24.743 20.575 -19.571 606 HG LEU 77 HG LEU 77 26.802 19.056 -20.365 607 1HD1 LEU 77 HD11 LEU 77 28.471 20.750 -19.567 608 2HD1 LEU 77 HD12 LEU 77 28.663 19.178 -18.796 609 3HD1 LEU 77 HD13 LEU 77 27.884 20.497 -17.925 610 1HD2 LEU 77 HD21 LEU 77 26.190 17.659 -18.655 611 2HD2 LEU 77 HD22 LEU 77 24.916 18.858 -18.431 612 3HD2 LEU 77 HD23 LEU 77 26.367 18.913 -17.431 613 H GLY 78 HN GLY 78 26.937 19.307 -22.335 614 1HA GLY 78 HA2 GLY 78 29.743 20.307 -22.303 615 2HA GLY 78 HA1 GLY 78 29.266 18.624 -22.514 616 H LYS 79 HN LYS 79 28.083 21.567 -24.161 617 HA LYS 79 HA LYS 79 28.651 20.233 -26.778 618 1HB LYS 79 HB2 LYS 79 26.369 21.296 -25.752 619 2HB LYS 79 HB1 LYS 79 27.014 22.703 -26.597 620 1HG LYS 79 HG2 LYS 79 27.128 21.489 -28.682 621 2HG LYS 79 HG1 LYS 79 26.717 19.974 -27.877 622 1HD LYS 79 HD2 LYS 79 24.627 21.591 -27.119 623 2HD LYS 79 HD1 LYS 79 24.958 22.171 -28.751 624 1HE LYS 79 HE2 LYS 79 23.995 20.323 -29.645 625 2HE LYS 79 HE1 LYS 79 25.051 19.268 -28.688 626 1HZ LYS 79 HZ1 LYS 79 23.625 19.518 -26.800 627 2HZ LYS 79 HZ2 LYS 79 22.660 19.048 -28.117 628 3HZ LYS 79 HZ3 LYS 79 22.662 20.666 -27.598 629 H ILE 80 HN ILE 80 30.174 22.392 -24.789 630 HA ILE 80 HA ILE 80 30.766 24.662 -26.405 631 HB ILE 80 HB ILE 80 32.548 23.237 -24.400 632 1HG1 ILE 80 HG12 ILE 80 31.145 25.416 -23.223 633 2HG1 ILE 80 HG11 ILE 80 29.946 24.423 -24.053 634 1HG2 ILE 80 HG21 ILE 80 33.872 25.066 -24.466 635 2HG2 ILE 80 HG22 ILE 80 32.490 26.159 -24.407 636 3HG2 ILE 80 HG23 ILE 80 33.025 25.498 -25.951 637 1HD1 ILE 80 HD11 ILE 80 32.056 23.164 -22.307 638 2HD1 ILE 80 HD12 ILE 80 30.503 22.499 -22.809 639 3HD1 ILE 80 HD13 ILE 80 30.563 23.792 -21.612 640 H ASP 81 HN ASP 81 32.442 25.045 -27.919 641 HA ASP 81 HA ASP 81 33.322 22.874 -29.573 642 1HB ASP 81 HB2 ASP 81 33.050 25.419 -30.015 643 2HB ASP 81 HB1 ASP 81 34.673 25.566 -29.341 644 H ILE 82 HN ILE 82 34.641 24.229 -26.636 645 HA ILE 82 HA ILE 82 37.394 23.384 -26.982 646 HB ILE 82 HB ILE 82 35.766 23.904 -24.462 647 1HG1 ILE 82 HG12 ILE 82 35.543 25.815 -25.958 648 2HG1 ILE 82 HG11 ILE 82 36.669 26.238 -24.671 649 1HG2 ILE 82 HG21 ILE 82 37.837 22.983 -23.798 650 2HG2 ILE 82 HG22 ILE 82 38.093 24.725 -23.697 651 3HG2 ILE 82 HG23 ILE 82 38.720 23.820 -25.075 652 1HD1 ILE 82 HD11 ILE 82 37.735 26.993 -26.647 653 2HD1 ILE 82 HD12 ILE 82 37.287 25.541 -27.543 654 3HD1 ILE 82 HD13 ILE 82 38.525 25.458 -26.289 655 H VAL 83 HN VAL 83 38.322 21.692 -25.338 656 HA VAL 83 HA VAL 83 37.244 19.106 -25.893 657 HB VAL 83 HB VAL 83 39.174 20.141 -23.790 658 1HG1 VAL 83 HG11 VAL 83 39.983 17.725 -23.800 659 2HG1 VAL 83 HG12 VAL 83 38.486 17.315 -24.636 660 3HG1 VAL 83 HG13 VAL 83 38.430 17.996 -23.010 661 1HG2 VAL 83 HG21 VAL 83 39.328 19.588 -26.649 662 2HG2 VAL 83 HG22 VAL 83 40.502 18.634 -25.743 663 3HG2 VAL 83 HG23 VAL 83 40.499 20.392 -25.605 664 H ARG 84 HN ARG 84 35.312 18.379 -25.119 665 HA ARG 84 HA ARG 84 34.599 18.938 -22.252 666 1HB ARG 84 HB2 ARG 84 32.277 18.991 -23.009 667 2HB ARG 84 HB1 ARG 84 33.226 20.104 -23.993 668 1HG ARG 84 HG2 ARG 84 33.385 17.593 -25.288 669 2HG ARG 84 HG1 ARG 84 31.694 17.802 -24.832 670 1HD ARG 84 HD2 ARG 84 31.662 20.021 -25.918 671 2HD ARG 84 HD1 ARG 84 33.365 19.819 -26.377 672 HE ARG 84 HE ARG 84 32.622 17.765 -27.657 673 1HH1 ARG 84 HH11 ARG 84 31.530 20.367 -28.861 674 2HH1 ARG 84 HH12 ARG 84 29.886 19.920 -29.177 675 1HH2 ARG 84 HH21 ARG 84 29.985 17.096 -27.148 676 2HH2 ARG 84 HH22 ARG 84 29.009 18.062 -28.204 677 H MET 85 HN MET 85 33.522 17.170 -21.135 678 HA MET 85 HA MET 85 33.287 14.537 -22.459 679 1HB MET 85 HB2 MET 85 35.720 15.202 -21.513 680 2HB MET 85 HB1 MET 85 35.000 14.618 -20.011 681 1HG MET 85 HG2 MET 85 34.217 12.609 -21.547 682 2HG MET 85 HG1 MET 85 35.579 13.127 -22.542 683 1HE MET 85 HE1 MET 85 35.446 12.225 -18.178 684 2HE MET 85 HE2 MET 85 34.983 10.795 -19.097 685 3HE MET 85 HE3 MET 85 34.146 12.320 -19.374 686 H VAL 86 HN VAL 86 32.205 12.953 -20.991 687 HA VAL 86 HA VAL 86 30.905 14.223 -18.604 688 HB VAL 86 HB VAL 86 29.505 14.168 -20.725 689 1HG1 VAL 86 HG11 VAL 86 29.460 11.186 -20.173 690 2HG1 VAL 86 HG12 VAL 86 30.355 11.935 -21.494 691 3HG1 VAL 86 HG13 VAL 86 28.596 12.037 -21.453 692 1HG2 VAL 86 HG21 VAL 86 27.617 13.950 -19.452 693 2HG2 VAL 86 HG22 VAL 86 28.778 13.859 -18.130 694 3HG2 VAL 86 HG23 VAL 86 28.104 12.380 -18.814 695 H LEU 87 HN LEU 87 30.422 12.796 -16.886 696 HA LEU 87 HA LEU 87 30.858 10.982 -15.450 697 1HB LEU 87 HB2 LEU 87 30.244 9.661 -18.113 698 2HB LEU 87 HB1 LEU 87 30.319 8.780 -16.588 699 HG LEU 87 HG LEU 87 28.570 11.220 -16.871 700 1HD1 LEU 87 HD11 LEU 87 26.805 9.996 -17.768 701 2HD1 LEU 87 HD12 LEU 87 27.478 8.451 -17.254 702 3HD1 LEU 87 HD13 LEU 87 28.174 9.300 -18.634 703 1HD2 LEU 87 HD21 LEU 87 28.900 10.441 -14.609 704 2HD2 LEU 87 HD22 LEU 87 28.609 8.769 -15.085 705 3HD2 LEU 87 HD23 LEU 87 27.286 9.934 -15.104 Start of MODEL 14 1 1H MET 1 HT1 MET 1 24.198 8.966 -20.282 2 2H MET 1 HT2 MET 1 23.805 7.402 -19.744 3 3H MET 1 HT3 MET 1 22.712 8.270 -20.711 4 HA MET 1 HA MET 1 24.399 8.246 -22.536 5 1HB MET 1 HB2 MET 1 25.911 7.362 -20.298 6 2HB MET 1 HB1 MET 1 25.862 6.016 -21.435 7 1HG MET 1 HG2 MET 1 27.606 7.117 -22.413 8 2HG MET 1 HG1 MET 1 26.323 8.087 -23.141 9 1HE MET 1 HE1 MET 1 27.730 9.585 -23.697 10 2HE MET 1 HE2 MET 1 29.084 10.215 -22.762 11 3HE MET 1 HE3 MET 1 27.577 11.124 -22.840 12 H LYS 2 HN LYS 2 24.107 6.597 -24.125 13 HA LYS 2 HA LYS 2 23.108 4.732 -25.152 14 1HB LYS 2 HB2 LYS 2 24.252 3.771 -22.922 15 2HB LYS 2 HB1 LYS 2 22.566 3.466 -22.501 16 1HG LYS 2 HG2 LYS 2 23.543 2.687 -25.229 17 2HG LYS 2 HG1 LYS 2 23.941 1.658 -23.854 18 1HD LYS 2 HD2 LYS 2 21.124 2.526 -23.929 19 2HD LYS 2 HD1 LYS 2 21.599 1.504 -25.286 20 1HE LYS 2 HE2 LYS 2 21.940 -0.340 -23.949 21 2HE LYS 2 HE1 LYS 2 22.508 0.633 -22.578 22 1HZ LYS 2 HZ1 LYS 2 20.277 -0.265 -22.184 23 2HZ LYS 2 HZ2 LYS 2 19.705 0.541 -23.566 24 3HZ LYS 2 HZ3 LYS 2 20.268 1.430 -22.232 25 H THR 3 HN THR 3 21.190 5.484 -25.946 26 HA THR 3 HA THR 3 18.953 6.281 -24.258 27 HB THR 3 HB THR 3 19.341 5.783 -27.227 28 HG1 THR 3 HG1 THR 3 20.162 7.691 -27.076 29 1HG2 THR 3 HG21 THR 3 17.164 7.473 -26.927 30 2HG2 THR 3 HG22 THR 3 16.901 6.255 -25.681 31 3HG2 THR 3 HG23 THR 3 17.087 5.766 -27.365 32 H LYS 4 HN LYS 4 17.304 4.982 -23.542 33 HA LYS 4 HA LYS 4 16.900 2.316 -24.826 34 1HB LYS 4 HB2 LYS 4 16.838 1.332 -22.522 35 2HB LYS 4 HB1 LYS 4 18.413 1.999 -22.943 36 1HG LYS 4 HG2 LYS 4 18.305 3.239 -21.065 37 2HG LYS 4 HG1 LYS 4 16.986 4.144 -21.806 38 1HD LYS 4 HD2 LYS 4 15.346 2.599 -20.898 39 2HD LYS 4 HD1 LYS 4 16.623 1.564 -20.260 40 1HE LYS 4 HE2 LYS 4 16.908 2.876 -18.423 41 2HE LYS 4 HE1 LYS 4 16.867 4.364 -19.383 42 1HZ LYS 4 HZ1 LYS 4 14.703 4.629 -18.987 43 2HZ LYS 4 HZ2 LYS 4 14.839 3.420 -17.802 44 3HZ LYS 4 HZ3 LYS 4 14.337 3.018 -19.373 45 H LEU 5 HN LEU 5 14.769 1.639 -24.836 46 HA LEU 5 HA LEU 5 12.426 1.805 -24.720 47 1HB LEU 5 HB2 LEU 5 13.540 2.637 -22.090 48 2HB LEU 5 HB1 LEU 5 11.847 3.038 -22.371 49 HG LEU 5 HG LEU 5 12.625 0.305 -23.189 50 1HD1 LEU 5 HD11 LEU 5 12.169 -0.134 -20.526 51 2HD1 LEU 5 HD12 LEU 5 13.141 1.335 -20.468 52 3HD1 LEU 5 HD13 LEU 5 13.770 -0.108 -21.265 53 1HD2 LEU 5 HD21 LEU 5 10.296 1.295 -23.171 54 2HD2 LEU 5 HD22 LEU 5 10.392 1.327 -21.410 55 3HD2 LEU 5 HD23 LEU 5 10.451 -0.213 -22.268 56 H ASN 6 HN ASN 6 10.666 3.693 -23.953 57 HA ASN 6 HA ASN 6 11.608 6.287 -25.109 58 1HB ASN 6 HB2 ASN 6 9.902 4.303 -26.276 59 2HB ASN 6 HB1 ASN 6 8.919 5.724 -25.927 60 1HD2 ASN 6 HD21 ASN 6 9.472 7.746 -27.023 61 2HD2 ASN 6 HD22 ASN 6 10.530 7.769 -28.350 62 H GLU 7 HN GLU 7 11.553 6.448 -22.564 63 HA GLU 7 HA GLU 7 10.545 7.340 -20.635 64 1HB GLU 7 HB2 GLU 7 10.298 9.105 -22.469 65 2HB GLU 7 HB1 GLU 7 8.632 8.554 -22.645 66 1HG GLU 7 HG2 GLU 7 8.648 10.443 -21.125 67 2HG GLU 7 HG1 GLU 7 8.295 8.989 -20.194 68 H LEU 8 HN LEU 8 9.763 4.800 -20.739 69 HA LEU 8 HA LEU 8 6.784 4.672 -20.728 70 1HB LEU 8 HB2 LEU 8 9.053 2.879 -21.224 71 2HB LEU 8 HB1 LEU 8 7.824 2.148 -20.192 72 HG LEU 8 HG LEU 8 6.409 3.497 -22.229 73 1HD1 LEU 8 HD11 LEU 8 7.398 2.967 -24.258 74 2HD1 LEU 8 HD12 LEU 8 8.321 1.628 -23.578 75 3HD1 LEU 8 HD13 LEU 8 8.836 3.288 -23.290 76 1HD2 LEU 8 HD21 LEU 8 6.926 0.575 -22.482 77 2HD2 LEU 8 HD22 LEU 8 5.394 1.446 -22.442 78 3HD2 LEU 8 HD23 LEU 8 6.265 1.128 -20.943 79 H LEU 9 HN LEU 9 9.598 4.175 -18.598 80 HA LEU 9 HA LEU 9 8.016 3.336 -16.290 81 1HB LEU 9 HB2 LEU 9 10.849 4.409 -16.551 82 2HB LEU 9 HB1 LEU 9 10.201 3.558 -15.149 83 HG LEU 9 HG LEU 9 9.628 1.910 -17.366 84 1HD1 LEU 9 HD11 LEU 9 11.401 3.394 -18.494 85 2HD1 LEU 9 HD12 LEU 9 11.681 1.654 -18.541 86 3HD1 LEU 9 HD13 LEU 9 12.557 2.658 -17.386 87 1HD2 LEU 9 HD21 LEU 9 11.843 1.745 -15.298 88 2HD2 LEU 9 HD22 LEU 9 11.224 0.393 -16.245 89 3HD2 LEU 9 HD23 LEU 9 10.184 1.195 -15.068 90 H GLU 10 HN GLU 10 9.692 6.342 -17.244 91 HA GLU 10 HA GLU 10 9.352 8.582 -16.594 92 1HB GLU 10 HB2 GLU 10 6.966 7.694 -17.123 93 2HB GLU 10 HB1 GLU 10 6.752 7.649 -15.374 94 1HG GLU 10 HG2 GLU 10 5.941 9.786 -16.117 95 2HG GLU 10 HG1 GLU 10 7.487 10.076 -15.322 96 H PHE 11 HN PHE 11 10.721 6.712 -14.773 97 HA PHE 11 HA PHE 11 9.895 7.657 -12.067 98 1HB PHE 11 HB2 PHE 11 10.281 5.258 -12.422 99 2HB PHE 11 HB1 PHE 11 11.891 5.590 -13.061 100 HD1 PHE 11 HD1 PHE 11 9.767 5.851 -10.009 101 HD2 PHE 11 HD2 PHE 11 13.752 5.912 -11.614 102 HE1 PHE 11 HE1 PHE 11 10.696 5.800 -7.710 103 HE2 PHE 11 HE2 PHE 11 14.679 5.861 -9.315 104 HZ PHE 11 HZ PHE 11 13.151 5.805 -7.364 105 HA PRO 12 HA PRO 12 13.101 10.749 -12.652 106 1HB PRO 12 HB2 PRO 12 12.755 11.981 -10.232 107 2HB PRO 12 HB1 PRO 12 11.693 12.263 -11.627 108 1HG PRO 12 HG2 PRO 12 11.271 10.514 -9.251 109 2HG PRO 12 HG1 PRO 12 10.123 11.564 -10.098 110 1HD PRO 12 HD2 PRO 12 10.195 8.876 -10.454 111 2HD PRO 12 HD1 PRO 12 9.698 10.007 -11.733 112 H THR 13 HN THR 13 15.082 9.739 -12.523 113 HA THR 13 HA THR 13 15.982 8.791 -9.817 114 HB THR 13 HB THR 13 15.720 7.052 -11.565 115 HG1 THR 13 HG1 THR 13 17.348 6.249 -10.549 116 1HG2 THR 13 HG21 THR 13 17.298 7.089 -13.508 117 2HG2 THR 13 HG22 THR 13 17.747 8.734 -13.063 118 3HG2 THR 13 HG23 THR 13 16.095 8.377 -13.566 119 HA PRO 14 HA PRO 14 19.029 11.979 -10.022 120 1HB PRO 14 HB2 PRO 14 20.785 11.004 -8.162 121 2HB PRO 14 HB1 PRO 14 19.232 11.748 -7.732 122 1HG PRO 14 HG2 PRO 14 19.977 8.874 -7.875 123 2HG PRO 14 HG1 PRO 14 18.924 9.713 -6.727 124 1HD PRO 14 HD2 PRO 14 18.007 8.205 -8.816 125 2HD PRO 14 HD1 PRO 14 17.094 9.542 -8.083 126 H PHE 15 HN PHE 15 20.430 12.142 -11.718 127 HA PHE 15 HA PHE 15 22.127 9.802 -12.470 128 1HB PHE 15 HB2 PHE 15 20.962 12.214 -13.834 129 2HB PHE 15 HB1 PHE 15 22.377 11.438 -14.537 130 HD1 PHE 15 HD1 PHE 15 18.962 11.560 -14.791 131 HD2 PHE 15 HD2 PHE 15 22.106 8.666 -14.354 132 HE1 PHE 15 HE1 PHE 15 17.505 9.828 -15.796 133 HE2 PHE 15 HE2 PHE 15 20.647 6.932 -15.358 134 HZ PHE 15 HZ PHE 15 18.346 7.511 -16.081 135 H THR 16 HN THR 16 23.972 10.033 -11.134 136 HA THR 16 HA THR 16 25.265 12.608 -10.647 137 HB THR 16 HB THR 16 26.459 9.832 -10.385 138 HG1 THR 16 HG1 THR 16 24.661 11.166 -8.636 139 1HG2 THR 16 HG21 THR 16 26.875 11.695 -8.202 140 2HG2 THR 16 HG22 THR 16 27.371 12.409 -9.736 141 3HG2 THR 16 HG23 THR 16 28.068 10.877 -9.211 142 H TYR 17 HN TYR 17 25.811 13.521 -12.709 143 HA TYR 17 HA TYR 17 27.570 11.843 -14.462 144 1HB TYR 17 HB2 TYR 17 25.572 14.035 -14.842 145 2HB TYR 17 HB1 TYR 17 26.888 13.920 -16.009 146 HD1 TYR 17 HD1 TYR 17 24.888 11.342 -14.136 147 HD2 TYR 17 HD2 TYR 17 26.145 12.855 -17.955 148 HE1 TYR 17 HE1 TYR 17 23.739 9.459 -15.259 149 HE2 TYR 17 HE2 TYR 17 24.993 10.968 -19.078 150 HH TYR 17 HH TYR 17 24.167 8.247 -17.718 151 H LYS 18 HN LYS 18 29.707 12.244 -14.143 152 HA LYS 18 HA LYS 18 30.652 14.802 -13.033 153 1HB LYS 18 HB2 LYS 18 31.830 12.145 -13.837 154 2HB LYS 18 HB1 LYS 18 32.892 13.509 -13.488 155 1HG LYS 18 HG2 LYS 18 32.534 13.353 -11.263 156 2HG LYS 18 HG1 LYS 18 30.790 13.193 -11.479 157 1HD LYS 18 HD2 LYS 18 31.953 10.792 -12.448 158 2HD LYS 18 HD1 LYS 18 32.719 11.138 -10.897 159 1HE LYS 18 HE2 LYS 18 30.839 10.552 -9.777 160 2HE LYS 18 HE1 LYS 18 29.855 11.650 -10.765 161 1HZ LYS 18 HZ1 LYS 18 30.828 8.981 -11.648 162 2HZ LYS 18 HZ2 LYS 18 29.826 10.032 -12.532 163 3HZ LYS 18 HZ3 LYS 18 29.252 9.303 -11.108 164 H VAL 19 HN VAL 19 30.133 16.306 -14.734 165 HA VAL 19 HA VAL 19 31.057 15.863 -17.475 166 HB VAL 19 HB VAL 19 30.134 18.434 -16.150 167 1HG1 VAL 19 HG11 VAL 19 30.935 18.819 -18.376 168 2HG1 VAL 19 HG12 VAL 19 29.176 18.775 -18.485 169 3HG1 VAL 19 HG13 VAL 19 30.125 17.376 -18.986 170 1HG2 VAL 19 HG21 VAL 19 28.555 16.050 -17.134 171 2HG2 VAL 19 HG22 VAL 19 27.847 17.662 -17.064 172 3HG2 VAL 19 HG23 VAL 19 28.419 16.888 -15.588 173 H MET 20 HN MET 20 33.335 15.638 -17.391 174 HA MET 20 HA MET 20 34.920 17.851 -16.166 175 1HB MET 20 HB2 MET 20 35.714 15.133 -17.279 176 2HB MET 20 HB1 MET 20 36.773 16.232 -16.394 177 1HG MET 20 HG2 MET 20 35.136 16.104 -14.466 178 2HG MET 20 HG1 MET 20 34.311 14.816 -15.341 179 1HE MET 20 HE1 MET 20 36.250 12.126 -15.892 180 2HE MET 20 HE2 MET 20 34.685 12.874 -15.582 181 3HE MET 20 HE3 MET 20 35.473 11.941 -14.313 182 H GLY 21 HN GLY 21 36.065 19.265 -17.455 183 1HA GLY 21 HA2 GLY 21 36.937 18.665 -20.135 184 2HA GLY 21 HA1 GLY 21 35.482 19.663 -20.174 185 H GLN 22 HN GLN 22 36.809 21.381 -21.119 186 HA GLN 22 HA GLN 22 39.090 22.516 -19.760 187 1HB GLN 22 HB2 GLN 22 37.756 22.794 -22.179 188 2HB GLN 22 HB1 GLN 22 37.453 24.338 -21.381 189 1HG GLN 22 HG2 GLN 22 39.512 24.568 -22.612 190 2HG GLN 22 HG1 GLN 22 39.932 24.475 -20.903 191 1HE2 GLN 22 HE21 GLN 22 41.730 23.152 -20.603 192 2HE2 GLN 22 HE22 GLN 22 42.060 21.739 -21.484 193 H ALA 23 HN ALA 23 39.035 24.833 -18.880 194 HA ALA 23 HA ALA 23 36.879 25.050 -16.861 195 1HB ALA 23 HB1 ALA 23 38.406 26.783 -15.941 196 2HB ALA 23 HB2 ALA 23 39.429 26.623 -17.367 197 3HB ALA 23 HB3 ALA 23 39.259 25.272 -16.247 198 H LEU 24 HN LEU 24 35.053 25.851 -17.976 199 HA LEU 24 HA LEU 24 35.357 28.592 -19.157 200 1HB LEU 24 HB2 LEU 24 33.633 27.871 -20.822 201 2HB LEU 24 HB1 LEU 24 35.117 26.928 -20.929 202 HG LEU 24 HG LEU 24 33.371 25.672 -19.023 203 1HD1 LEU 24 HD11 LEU 24 32.132 26.154 -21.749 204 2HD1 LEU 24 HD12 LEU 24 31.570 26.872 -20.239 205 3HD1 LEU 24 HD13 LEU 24 31.475 25.128 -20.473 206 1HD2 LEU 24 HD21 LEU 24 33.448 24.093 -21.307 207 2HD2 LEU 24 HD22 LEU 24 34.638 24.069 -20.009 208 3HD2 LEU 24 HD23 LEU 24 34.917 25.058 -21.440 209 HA PRO 25 HA PRO 25 32.087 29.727 -16.439 210 1HB PRO 25 HB2 PRO 25 30.966 31.794 -17.836 211 2HB PRO 25 HB1 PRO 25 32.533 31.916 -17.012 212 1HG PRO 25 HG2 PRO 25 31.938 31.501 -19.895 213 2HG PRO 25 HG1 PRO 25 33.215 32.460 -19.131 214 1HD PRO 25 HD2 PRO 25 33.617 29.988 -20.226 215 2HD PRO 25 HD1 PRO 25 34.613 30.667 -18.921 216 H GLU 26 HN GLU 26 31.280 28.955 -19.799 217 HA GLU 26 HA GLU 26 28.408 28.945 -19.517 218 1HB GLU 26 HB2 GLU 26 29.849 29.015 -21.621 219 2HB GLU 26 HB1 GLU 26 30.106 27.285 -21.397 220 1HG GLU 26 HG2 GLU 26 27.309 27.764 -21.131 221 2HG GLU 26 HG1 GLU 26 27.852 28.607 -22.581 222 H LEU 27 HN LEU 27 30.789 26.784 -18.267 223 HA LEU 27 HA LEU 27 29.501 24.257 -18.448 224 1HB LEU 27 HB2 LEU 27 31.668 25.540 -17.020 225 2HB LEU 27 HB1 LEU 27 30.797 24.456 -15.937 226 HG LEU 27 HG LEU 27 31.591 23.565 -18.706 227 1HD1 LEU 27 HD11 LEU 27 33.556 24.453 -17.237 228 2HD1 LEU 27 HD12 LEU 27 33.707 22.856 -17.969 229 3HD1 LEU 27 HD13 LEU 27 33.270 23.007 -16.267 230 1HD2 LEU 27 HD21 LEU 27 31.036 22.144 -16.080 231 2HD2 LEU 27 HD22 LEU 27 31.515 21.340 -17.576 232 3HD2 LEU 27 HD23 LEU 27 29.972 22.188 -17.485 233 H VAL 28 HN VAL 28 29.498 26.370 -15.530 234 HA VAL 28 HA VAL 28 27.284 24.996 -14.300 235 HB VAL 28 HB VAL 28 27.342 26.962 -12.753 236 1HG1 VAL 28 HG11 VAL 28 30.216 26.496 -13.114 237 2HG1 VAL 28 HG12 VAL 28 29.261 25.015 -13.150 238 3HG1 VAL 28 HG13 VAL 28 29.173 26.087 -11.752 239 1HG2 VAL 28 HG21 VAL 28 28.407 28.925 -13.247 240 2HG2 VAL 28 HG22 VAL 28 28.151 28.416 -14.914 241 3HG2 VAL 28 HG23 VAL 28 29.701 28.118 -14.132 242 H ASP 29 HN ASP 29 27.443 27.746 -16.520 243 HA ASP 29 HA ASP 29 24.787 28.765 -16.123 244 1HB ASP 29 HB2 ASP 29 26.587 29.980 -17.265 245 2HB ASP 29 HB1 ASP 29 26.653 28.745 -18.523 246 H GLN 30 HN GLN 30 26.047 26.635 -18.733 247 HA GLN 30 HA GLN 30 23.435 25.973 -19.771 248 1HB GLN 30 HB2 GLN 30 25.989 25.779 -20.634 249 2HB GLN 30 HB1 GLN 30 25.730 24.113 -20.115 250 1HG GLN 30 HG2 GLN 30 25.060 24.233 -22.422 251 2HG GLN 30 HG1 GLN 30 23.583 24.134 -21.464 252 1HE2 GLN 30 HE21 GLN 30 22.072 25.816 -21.733 253 2HE2 GLN 30 HE22 GLN 30 22.386 27.257 -22.573 254 H VAL 31 HN VAL 31 25.500 24.507 -17.288 255 HA VAL 31 HA VAL 31 24.246 21.966 -17.075 256 HB VAL 31 HB VAL 31 25.796 23.819 -15.302 257 1HG1 VAL 31 HG11 VAL 31 24.020 21.622 -14.358 258 2HG1 VAL 31 HG12 VAL 31 24.565 23.069 -13.514 259 3HG1 VAL 31 HG13 VAL 31 25.641 21.682 -13.670 260 1HG2 VAL 31 HG21 VAL 31 26.389 21.732 -17.045 261 2HG2 VAL 31 HG22 VAL 31 26.520 20.985 -15.453 262 3HG2 VAL 31 HG23 VAL 31 27.485 22.408 -15.840 263 H VAL 32 HN VAL 32 23.496 24.972 -15.222 264 HA VAL 32 HA VAL 32 21.154 23.797 -13.967 265 HB VAL 32 HB VAL 32 22.630 25.654 -13.094 266 1HG1 VAL 32 HG11 VAL 32 21.125 27.235 -15.199 267 2HG1 VAL 32 HG12 VAL 32 22.870 27.016 -15.081 268 3HG1 VAL 32 HG13 VAL 32 22.016 27.968 -13.867 269 1HG2 VAL 32 HG21 VAL 32 19.730 26.490 -13.277 270 2HG2 VAL 32 HG22 VAL 32 20.848 26.739 -11.937 271 3HG2 VAL 32 HG23 VAL 32 20.256 25.119 -12.302 272 H GLU 33 HN GLU 33 21.641 25.758 -16.898 273 HA GLU 33 HA GLU 33 18.821 26.350 -17.301 274 1HB GLU 33 HB2 GLU 33 21.418 26.733 -18.634 275 2HB GLU 33 HB1 GLU 33 20.075 26.530 -19.759 276 1HG GLU 33 HG2 GLU 33 19.424 28.644 -19.362 277 2HG GLU 33 HG1 GLU 33 19.188 28.250 -17.661 278 H VAL 34 HN VAL 34 21.062 23.993 -18.824 279 HA VAL 34 HA VAL 34 19.034 22.755 -20.454 280 HB VAL 34 HB VAL 34 21.587 22.798 -20.702 281 1HG1 VAL 34 HG11 VAL 34 22.922 21.289 -19.527 282 2HG1 VAL 34 HG12 VAL 34 21.552 20.280 -19.063 283 3HG1 VAL 34 HG13 VAL 34 21.808 21.837 -18.276 284 1HG2 VAL 34 HG21 VAL 34 19.798 20.431 -21.111 285 2HG2 VAL 34 HG22 VAL 34 21.514 20.275 -21.488 286 3HG2 VAL 34 HG23 VAL 34 20.538 21.497 -22.305 287 H VAL 35 HN VAL 35 20.228 22.062 -17.160 288 HA VAL 35 HA VAL 35 18.802 19.533 -16.955 289 HB VAL 35 HB VAL 35 20.852 20.354 -15.646 290 1HG1 VAL 35 HG11 VAL 35 19.690 22.540 -15.030 291 2HG1 VAL 35 HG12 VAL 35 20.498 21.701 -13.709 292 3HG1 VAL 35 HG13 VAL 35 18.745 21.602 -13.875 293 1HG2 VAL 35 HG21 VAL 35 19.511 18.304 -15.124 294 2HG2 VAL 35 HG22 VAL 35 18.514 19.277 -14.045 295 3HG2 VAL 35 HG23 VAL 35 20.227 19.044 -13.693 296 H GLN 36 HN GLN 36 18.018 22.919 -16.266 297 HA GLN 36 HA GLN 36 15.581 22.348 -14.775 298 1HB GLN 36 HB2 GLN 36 16.468 24.468 -14.375 299 2HB GLN 36 HB1 GLN 36 16.935 24.702 -16.059 300 1HG GLN 36 HG2 GLN 36 14.810 25.377 -16.701 301 2HG GLN 36 HG1 GLN 36 14.020 24.480 -15.405 302 1HE2 GLN 36 HE21 GLN 36 13.493 25.644 -13.524 303 2HE2 GLN 36 HE22 GLN 36 14.032 27.219 -13.191 304 H ARG 37 HN ARG 37 16.386 22.889 -18.194 305 HA ARG 37 HA ARG 37 13.684 23.168 -19.164 306 1HB ARG 37 HB2 ARG 37 16.426 22.723 -20.231 307 2HB ARG 37 HB1 ARG 37 15.089 22.291 -21.300 308 1HG ARG 37 HG2 ARG 37 14.107 24.539 -20.978 309 2HG ARG 37 HG1 ARG 37 15.456 24.974 -19.931 310 1HD ARG 37 HD2 ARG 37 16.569 23.934 -22.347 311 2HD ARG 37 HD1 ARG 37 15.334 25.125 -22.790 312 HE ARG 37 HE ARG 37 16.505 26.562 -20.922 313 1HH1 ARG 37 HH11 ARG 37 18.464 23.992 -21.669 314 2HH1 ARG 37 HH12 ARG 37 19.805 24.921 -22.248 315 1HH2 ARG 37 HH21 ARG 37 18.045 27.921 -22.287 316 2HH2 ARG 37 HH22 ARG 37 19.564 27.156 -22.608 317 H HIS 38 HN HIS 38 15.768 20.321 -18.632 318 HA HIS 38 HA HIS 38 13.671 18.543 -19.796 319 1HB HIS 38 HB2 HIS 38 16.583 18.376 -19.119 320 2HB HIS 38 HB1 HIS 38 15.653 16.879 -19.162 321 HD1 HIS 38 HD1 HIS 38 14.546 16.223 -21.460 322 HD2 HIS 38 HD2 HIS 38 17.047 19.553 -21.638 323 HE1 HIS 38 HE1 HIS 38 14.967 16.672 -23.917 324 H ALA 39 HN ALA 39 15.543 18.945 -16.760 325 HA ALA 39 HA ALA 39 13.632 17.120 -15.367 326 1HB ALA 39 HB1 ALA 39 15.499 16.483 -14.258 327 2HB ALA 39 HB2 ALA 39 15.850 18.147 -13.796 328 3HB ALA 39 HB3 ALA 39 16.422 17.521 -15.342 329 HA PRO 40 HA PRO 40 11.685 20.550 -13.383 330 1HB PRO 40 HB2 PRO 40 10.790 19.328 -11.105 331 2HB PRO 40 HB1 PRO 40 10.048 19.071 -12.697 332 1HG PRO 40 HG2 PRO 40 11.954 17.349 -11.198 333 2HG PRO 40 HG1 PRO 40 10.567 16.899 -12.198 334 1HD PRO 40 HD2 PRO 40 13.156 16.743 -13.049 335 2HD PRO 40 HD1 PRO 40 11.772 16.978 -14.139 336 H GLY 41 HN GLY 41 12.297 22.153 -11.928 337 1HA GLY 41 HA2 GLY 41 13.390 23.143 -10.068 338 2HA GLY 41 HA1 GLY 41 13.986 21.548 -9.606 339 H ASP 42 HN ASP 42 15.706 23.736 -9.540 340 HA ASP 42 HA ASP 42 17.355 23.584 -12.021 341 1HB ASP 42 HB2 ASP 42 17.150 25.394 -9.618 342 2HB ASP 42 HB1 ASP 42 18.585 25.441 -10.642 343 H TYR 43 HN TYR 43 19.492 22.799 -11.965 344 HA TYR 43 HA TYR 43 20.414 21.573 -9.386 345 1HB TYR 43 HB2 TYR 43 20.385 20.457 -12.206 346 2HB TYR 43 HB1 TYR 43 21.264 19.704 -10.876 347 HD1 TYR 43 HD1 TYR 43 18.092 20.002 -12.514 348 HD2 TYR 43 HD2 TYR 43 19.921 19.163 -8.720 349 HE1 TYR 43 HE1 TYR 43 15.999 18.922 -11.744 350 HE2 TYR 43 HE2 TYR 43 17.827 18.083 -7.949 351 HH TYR 43 HH TYR 43 15.033 18.521 -9.024 352 H THR 44 HN THR 44 22.856 21.149 -9.449 353 HA THR 44 HA THR 44 24.297 23.062 -11.243 354 HB THR 44 HB THR 44 25.194 22.993 -8.425 355 HG1 THR 44 HG1 THR 44 23.406 23.626 -7.550 356 1HG2 THR 44 HG21 THR 44 24.795 25.581 -9.031 357 2HG2 THR 44 HG22 THR 44 24.871 24.921 -10.664 358 3HG2 THR 44 HG23 THR 44 26.226 24.695 -9.558 359 HA PRO 45 HA PRO 45 27.403 19.882 -11.102 360 1HB PRO 45 HB2 PRO 45 29.318 21.244 -12.486 361 2HB PRO 45 HB1 PRO 45 27.838 20.640 -13.252 362 1HG PRO 45 HG2 PRO 45 28.626 23.380 -12.680 363 2HG PRO 45 HG1 PRO 45 27.333 22.781 -13.722 364 1HD PRO 45 HD2 PRO 45 27.162 23.806 -11.007 365 2HD PRO 45 HD1 PRO 45 25.851 23.432 -12.146 366 H THR 46 HN THR 46 29.179 19.332 -9.765 367 HA THR 46 HA THR 46 30.197 21.439 -7.918 368 HB THR 46 HB THR 46 30.568 18.418 -7.945 369 HG1 THR 46 HG1 THR 46 28.562 18.431 -7.364 370 1HG2 THR 46 HG21 THR 46 31.536 20.596 -6.238 371 2HG2 THR 46 HG22 THR 46 32.081 18.921 -6.341 372 3HG2 THR 46 HG23 THR 46 30.692 19.335 -5.337 373 H VAL 47 HN VAL 47 31.712 22.522 -9.299 374 HA VAL 47 HA VAL 47 33.663 21.076 -10.898 375 HB VAL 47 HB VAL 47 32.730 23.345 -11.388 376 1HG1 VAL 47 HG11 VAL 47 33.249 25.234 -10.105 377 2HG1 VAL 47 HG12 VAL 47 34.632 24.456 -9.337 378 3HG1 VAL 47 HG13 VAL 47 32.994 24.007 -8.864 379 1HG2 VAL 47 HG21 VAL 47 35.661 23.796 -11.058 380 2HG2 VAL 47 HG22 VAL 47 34.648 23.993 -12.487 381 3HG2 VAL 47 HG23 VAL 47 35.169 22.383 -11.990 382 H LYS 48 HN LYS 48 35.741 20.528 -10.412 383 HA LYS 48 HA LYS 48 36.984 21.502 -7.885 384 1HB LYS 48 HB2 LYS 48 37.477 19.207 -7.210 385 2HB LYS 48 HB1 LYS 48 35.743 19.353 -7.486 386 1HG LYS 48 HG2 LYS 48 36.581 18.637 -9.979 387 2HG LYS 48 HG1 LYS 48 37.770 17.796 -8.985 388 1HD LYS 48 HD2 LYS 48 36.114 16.549 -7.850 389 2HD LYS 48 HD1 LYS 48 34.822 17.636 -8.361 390 1HE LYS 48 HE2 LYS 48 36.006 16.694 -10.751 391 2HE LYS 48 HE1 LYS 48 35.813 15.274 -9.705 392 1HZ LYS 48 HZ1 LYS 48 33.710 17.306 -10.252 393 2HZ LYS 48 HZ2 LYS 48 33.536 15.935 -9.262 394 3HZ LYS 48 HZ3 LYS 48 33.770 15.755 -10.936 395 HA PRO 49 HA PRO 49 40.506 21.651 -10.540 396 1HB PRO 49 HB2 PRO 49 42.505 21.676 -8.672 397 2HB PRO 49 HB1 PRO 49 41.455 23.073 -8.982 398 1HG PRO 49 HG2 PRO 49 41.369 21.094 -6.772 399 2HG PRO 49 HG1 PRO 49 41.010 22.827 -6.753 400 1HD PRO 49 HD2 PRO 49 39.107 20.839 -6.787 401 2HD PRO 49 HD1 PRO 49 38.834 22.505 -7.341 402 H SER 50 HN SER 50 40.113 19.420 -11.357 403 HA SER 50 HA SER 50 41.540 17.208 -9.990 404 1HB SER 50 HB2 SER 50 39.270 17.524 -11.661 405 2HB SER 50 HB1 SER 50 40.433 16.583 -12.587 406 HG SER 50 HG SER 50 39.043 15.339 -11.175 407 H SER 51 HN SER 51 41.605 18.890 -13.158 408 HA SER 51 HA SER 51 44.270 17.661 -13.723 409 1HB SER 51 HB2 SER 51 42.163 17.664 -15.271 410 2HB SER 51 HB1 SER 51 42.602 19.339 -15.592 411 HG SER 51 HG SER 51 43.726 18.240 -17.078 412 H LYS 52 HN LYS 52 45.822 19.235 -14.887 413 HA LYS 52 HA LYS 52 45.926 21.787 -13.340 414 1HB LYS 52 HB2 LYS 52 47.807 19.809 -14.443 415 2HB LYS 52 HB1 LYS 52 48.308 21.480 -14.707 416 1HG LYS 52 HG2 LYS 52 49.144 21.315 -12.595 417 2HG LYS 52 HG1 LYS 52 47.471 21.603 -12.113 418 1HD LYS 52 HD2 LYS 52 47.636 18.844 -12.680 419 2HD LYS 52 HD1 LYS 52 49.081 19.227 -11.744 420 1HE LYS 52 HE2 LYS 52 47.874 19.526 -9.840 421 2HE LYS 52 HE1 LYS 52 46.680 20.537 -10.678 422 1HZ LYS 52 HZ1 LYS 52 46.850 17.572 -10.853 423 2HZ LYS 52 HZ2 LYS 52 45.708 18.551 -11.644 424 3HZ LYS 52 HZ3 LYS 52 45.702 18.434 -9.950 425 H GLY 53 HN GLY 53 46.692 23.739 -14.539 426 1HA GLY 53 HA2 GLY 53 46.875 25.106 -16.483 427 2HA GLY 53 HA1 GLY 53 46.351 23.739 -17.466 428 H ASN 54 HN ASN 54 44.623 24.658 -18.553 429 HA ASN 54 HA ASN 54 42.522 26.068 -16.969 430 1HB ASN 54 HB2 ASN 54 43.689 26.909 -19.139 431 2HB ASN 54 HB1 ASN 54 42.661 25.742 -19.969 432 1HD2 ASN 54 HD21 ASN 54 40.511 26.379 -20.389 433 2HD2 ASN 54 HD22 ASN 54 39.789 27.774 -19.747 434 H TYR 55 HN TYR 55 42.355 23.495 -16.275 435 HA TYR 55 HA TYR 55 40.064 22.420 -17.884 436 1HB TYR 55 HB2 TYR 55 42.370 21.320 -18.214 437 2HB TYR 55 HB1 TYR 55 42.208 20.744 -16.556 438 HD1 TYR 55 HD1 TYR 55 41.168 20.298 -20.005 439 HD2 TYR 55 HD2 TYR 55 40.246 19.282 -15.933 440 HE1 TYR 55 HE1 TYR 55 39.745 18.427 -20.793 441 HE2 TYR 55 HE2 TYR 55 38.823 17.412 -16.722 442 HH TYR 55 HH TYR 55 38.951 15.975 -19.322 443 H HIS 56 HN HIS 56 38.309 21.930 -16.610 444 HA HIS 56 HA HIS 56 38.731 21.583 -13.661 445 1HB HIS 56 HB2 HIS 56 37.345 23.649 -15.175 446 2HB HIS 56 HB1 HIS 56 36.253 22.844 -14.048 447 HD1 HIS 56 HD1 HIS 56 37.850 22.343 -11.615 448 HD2 HIS 56 HD2 HIS 56 38.383 25.824 -13.844 449 HE1 HIS 56 HE1 HIS 56 38.917 24.032 -10.059 450 H SER 57 HN SER 57 37.507 19.942 -12.750 451 HA SER 57 HA SER 57 35.695 18.415 -14.591 452 1HB SER 57 HB2 SER 57 37.307 17.693 -12.126 453 2HB SER 57 HB1 SER 57 36.181 16.581 -12.900 454 HG SER 57 HG SER 57 38.236 16.255 -13.741 455 H VAL 58 HN VAL 58 33.540 18.874 -14.189 456 HA VAL 58 HA VAL 58 32.774 19.498 -11.358 457 HB VAL 58 HB VAL 58 31.193 21.029 -12.208 458 1HG1 VAL 58 HG11 VAL 58 33.756 21.435 -12.805 459 2HG1 VAL 58 HG12 VAL 58 32.502 22.551 -13.345 460 3HG1 VAL 58 HG13 VAL 58 33.140 21.338 -14.454 461 1HG2 VAL 58 HG21 VAL 58 30.399 21.070 -14.510 462 2HG2 VAL 58 HG22 VAL 58 30.197 19.441 -13.867 463 3HG2 VAL 58 HG23 VAL 58 31.533 19.798 -14.959 464 H SER 59 HN SER 59 31.025 18.418 -10.448 465 HA SER 59 HA SER 59 29.960 16.070 -11.972 466 1HB SER 59 HB2 SER 59 30.348 16.770 -9.057 467 2HB SER 59 HB1 SER 59 29.292 15.445 -9.534 468 HG SER 59 HG SER 59 31.438 14.747 -9.158 469 H ILE 60 HN ILE 60 28.053 16.723 -12.974 470 HA ILE 60 HA ILE 60 26.301 18.693 -11.626 471 HB ILE 60 HB ILE 60 26.936 18.809 -14.054 472 1HG1 ILE 60 HG12 ILE 60 23.999 18.470 -13.368 473 2HG1 ILE 60 HG11 ILE 60 24.934 19.963 -13.296 474 1HG2 ILE 60 HG21 ILE 60 24.959 16.625 -14.611 475 2HG2 ILE 60 HG22 ILE 60 26.610 16.174 -14.192 476 3HG2 ILE 60 HG23 ILE 60 26.307 17.192 -15.597 477 1HD1 ILE 60 HD11 ILE 60 23.731 20.071 -15.352 478 2HD1 ILE 60 HD12 ILE 60 24.118 18.398 -15.752 479 3HD1 ILE 60 HD13 ILE 60 25.379 19.629 -15.799 480 H THR 61 HN THR 61 24.458 18.190 -10.580 481 HA THR 61 HA THR 61 23.647 15.337 -10.394 482 HB THR 61 HB THR 61 23.851 16.855 -8.406 483 HG1 THR 61 HG1 THR 61 21.195 16.005 -8.919 484 1HG2 THR 61 HG21 THR 61 22.326 18.658 -8.042 485 2HG2 THR 61 HG22 THR 61 21.361 18.214 -9.448 486 3HG2 THR 61 HG23 THR 61 22.974 18.890 -9.666 487 H ILE 62 HN ILE 62 22.053 14.522 -11.710 488 HA ILE 62 HA ILE 62 20.198 16.476 -13.045 489 HB ILE 62 HB ILE 62 21.329 13.837 -14.030 490 1HG1 ILE 62 HG12 ILE 62 23.024 15.660 -13.874 491 2HG1 ILE 62 HG11 ILE 62 22.699 15.191 -15.541 492 1HG2 ILE 62 HG21 ILE 62 19.908 15.919 -15.686 493 2HG2 ILE 62 HG22 ILE 62 19.013 14.646 -14.857 494 3HG2 ILE 62 HG23 ILE 62 20.216 14.227 -16.074 495 1HD1 ILE 62 HD11 ILE 62 20.897 17.295 -14.623 496 2HD1 ILE 62 HD12 ILE 62 21.917 17.245 -16.060 497 3HD1 ILE 62 HD13 ILE 62 22.588 17.779 -14.518 498 H ASN 63 HN ASN 63 18.072 16.171 -12.513 499 HA ASN 63 HA ASN 63 17.248 13.553 -11.321 500 1HB ASN 63 HB2 ASN 63 16.920 15.809 -10.163 501 2HB ASN 63 HB1 ASN 63 15.745 16.187 -11.422 502 1HD2 ASN 63 HD21 ASN 63 13.764 14.816 -11.522 503 2HD2 ASN 63 HD22 ASN 63 13.270 13.934 -10.159 504 H ALA 64 HN ALA 64 17.504 12.978 -13.835 505 HA ALA 64 HA ALA 64 15.105 13.746 -15.409 506 1HB ALA 64 HB1 ALA 64 16.510 12.108 -17.011 507 2HB ALA 64 HB2 ALA 64 17.793 12.533 -15.879 508 3HB ALA 64 HB3 ALA 64 16.961 13.797 -16.782 509 H THR 65 HN THR 65 13.382 12.383 -15.662 510 HA THR 65 HA THR 65 13.117 9.976 -14.106 511 HB THR 65 HB THR 65 10.975 9.799 -15.425 512 HG1 THR 65 HG1 THR 65 10.979 10.737 -17.284 513 1HG2 THR 65 HG21 THR 65 10.761 12.587 -14.842 514 2HG2 THR 65 HG22 THR 65 11.840 11.864 -13.650 515 3HG2 THR 65 HG23 THR 65 10.212 11.225 -13.867 516 H HIS 66 HN HIS 66 14.314 10.590 -17.318 517 HA HIS 66 HA HIS 66 14.609 7.639 -17.761 518 1HB HIS 66 HB2 HIS 66 12.971 9.421 -19.153 519 2HB HIS 66 HB1 HIS 66 14.397 9.275 -20.180 520 HD1 HIS 66 HD1 HIS 66 11.945 7.005 -18.339 521 HD2 HIS 66 HD2 HIS 66 14.430 6.954 -21.682 522 HE1 HIS 66 HE1 HIS 66 11.514 4.808 -19.518 523 H ILE 67 HN ILE 67 16.487 7.106 -19.155 524 HA ILE 67 HA ILE 67 18.835 8.685 -18.511 525 HB ILE 67 HB ILE 67 18.641 6.170 -18.809 526 1HG1 ILE 67 HG12 ILE 67 20.800 6.666 -20.649 527 2HG1 ILE 67 HG11 ILE 67 20.754 7.960 -19.453 528 1HG2 ILE 67 HG21 ILE 67 17.327 6.285 -20.929 529 2HG2 ILE 67 HG22 ILE 67 18.766 5.277 -21.072 530 3HG2 ILE 67 HG23 ILE 67 18.760 6.905 -21.748 531 1HD1 ILE 67 HD11 ILE 67 20.768 4.994 -18.823 532 2HD1 ILE 67 HD12 ILE 67 20.740 6.298 -17.636 533 3HD1 ILE 67 HD13 ILE 67 22.149 6.077 -18.671 534 H GLU 68 HN GLU 68 16.542 8.813 -21.115 535 HA GLU 68 HA GLU 68 18.264 9.875 -23.186 536 1HB GLU 68 HB2 GLU 68 15.353 9.586 -22.599 537 2HB GLU 68 HB1 GLU 68 15.798 10.791 -23.805 538 1HG GLU 68 HG2 GLU 68 15.865 9.077 -25.279 539 2HG GLU 68 HG1 GLU 68 17.373 8.613 -24.491 540 H GLN 69 HN GLN 69 16.400 11.340 -20.534 541 HA GLN 69 HA GLN 69 16.608 14.082 -21.381 542 1HB GLN 69 HB2 GLN 69 16.062 12.571 -18.846 543 2HB GLN 69 HB1 GLN 69 16.328 14.311 -18.749 544 1HG GLN 69 HG2 GLN 69 14.398 14.813 -19.901 545 2HG GLN 69 HG1 GLN 69 14.454 13.329 -20.854 546 1HE2 GLN 69 HE21 GLN 69 13.199 14.772 -17.926 547 2HE2 GLN 69 HE22 GLN 69 12.384 13.394 -17.363 548 H VAL 70 HN VAL 70 18.591 12.163 -19.072 549 HA VAL 70 HA VAL 70 20.466 14.292 -18.542 550 HB VAL 70 HB VAL 70 19.934 12.213 -17.167 551 1HG1 VAL 70 HG11 VAL 70 20.081 10.528 -18.918 552 2HG1 VAL 70 HG12 VAL 70 21.313 10.200 -17.701 553 3HG1 VAL 70 HG13 VAL 70 21.764 10.951 -19.231 554 1HG2 VAL 70 HG21 VAL 70 22.485 13.535 -17.639 555 2HG2 VAL 70 HG22 VAL 70 22.712 11.892 -17.044 556 3HG2 VAL 70 HG23 VAL 70 21.750 13.038 -16.115 557 H GLU 71 HN GLU 71 20.228 11.893 -21.114 558 HA GLU 71 HA GLU 71 22.967 12.004 -22.031 559 1HB GLU 71 HB2 GLU 71 20.299 11.087 -23.006 560 2HB GLU 71 HB1 GLU 71 21.530 11.362 -24.238 561 1HG GLU 71 HG2 GLU 71 23.076 9.863 -23.077 562 2HG GLU 71 HG1 GLU 71 21.909 9.635 -21.775 563 H THR 72 HN THR 72 19.990 13.658 -23.171 564 HA THR 72 HA THR 72 21.304 15.359 -25.088 565 HB THR 72 HB THR 72 19.128 16.667 -24.825 566 HG1 THR 72 HG1 THR 72 18.193 16.348 -22.984 567 1HG2 THR 72 HG21 THR 72 19.459 14.693 -26.365 568 2HG2 THR 72 HG22 THR 72 17.791 14.951 -25.852 569 3HG2 THR 72 HG23 THR 72 18.756 13.677 -25.106 570 H LEU 73 HN LEU 73 20.588 15.694 -21.626 571 HA LEU 73 HA LEU 73 21.206 18.460 -21.290 572 1HB LEU 73 HB2 LEU 73 20.912 16.005 -19.677 573 2HB LEU 73 HB1 LEU 73 21.975 17.207 -18.951 574 HG LEU 73 HG LEU 73 20.261 18.870 -18.943 575 1HD1 LEU 73 HD11 LEU 73 18.343 17.032 -20.369 576 2HD1 LEU 73 HD12 LEU 73 19.418 18.087 -21.285 577 3HD1 LEU 73 HD13 LEU 73 18.250 18.780 -20.162 578 1HD2 LEU 73 HD21 LEU 73 20.067 16.979 -17.260 579 2HD2 LEU 73 HD22 LEU 73 18.829 16.279 -18.302 580 3HD2 LEU 73 HD23 LEU 73 18.570 17.859 -17.562 581 H TYR 74 HN TYR 74 23.292 15.557 -21.194 582 HA TYR 74 HA TYR 74 25.738 16.905 -20.493 583 1HB TYR 74 HB2 TYR 74 25.740 14.582 -20.208 584 2HB TYR 74 HB1 TYR 74 24.908 14.294 -21.735 585 HD1 TYR 74 HD1 TYR 74 28.034 16.182 -20.819 586 HD2 TYR 74 HD2 TYR 74 26.256 13.061 -23.177 587 HE1 TYR 74 HE1 TYR 74 30.208 15.793 -21.944 588 HE2 TYR 74 HE2 TYR 74 28.431 12.672 -24.300 589 HH TYR 74 HH TYR 74 30.715 14.560 -24.592 590 H GLU 75 HN GLU 75 24.300 15.997 -23.651 591 HA GLU 75 HA GLU 75 26.447 17.032 -25.278 592 1HB GLU 75 HB2 GLU 75 23.892 15.755 -25.551 593 2HB GLU 75 HB1 GLU 75 23.927 17.152 -26.625 594 1HG GLU 75 HG2 GLU 75 24.811 15.211 -27.808 595 2HG GLU 75 HG1 GLU 75 26.117 16.361 -27.523 596 H GLU 76 HN GLU 76 23.443 18.486 -24.028 597 HA GLU 76 HA GLU 76 23.631 20.954 -25.512 598 1HB GLU 76 HB2 GLU 76 22.177 19.924 -23.095 599 2HB GLU 76 HB1 GLU 76 22.084 21.639 -23.497 600 1HG GLU 76 HG2 GLU 76 21.191 21.148 -25.688 601 2HG GLU 76 HG1 GLU 76 21.469 19.421 -25.468 602 H LEU 77 HN LEU 77 24.497 20.148 -22.111 603 HA LEU 77 HA LEU 77 25.689 22.759 -21.626 604 1HB LEU 77 HB2 LEU 77 25.752 22.000 -19.466 605 2HB LEU 77 HB1 LEU 77 24.697 20.741 -20.094 606 HG LEU 77 HG LEU 77 27.001 19.551 -20.669 607 1HD1 LEU 77 HD11 LEU 77 28.843 20.506 -19.794 608 2HD1 LEU 77 HD12 LEU 77 28.112 20.504 -18.190 609 3HD1 LEU 77 HD13 LEU 77 27.856 21.871 -19.274 610 1HD2 LEU 77 HD21 LEU 77 26.917 18.484 -18.407 611 2HD2 LEU 77 HD22 LEU 77 25.330 18.612 -19.164 612 3HD2 LEU 77 HD23 LEU 77 25.795 19.744 -17.893 613 H GLY 78 HN GLY 78 26.883 19.653 -22.791 614 1HA GLY 78 HA2 GLY 78 29.679 20.694 -22.745 615 2HA GLY 78 HA1 GLY 78 29.233 18.996 -22.924 616 H LYS 79 HN LYS 79 28.115 21.942 -24.611 617 HA LYS 79 HA LYS 79 28.631 20.560 -27.215 618 1HB LYS 79 HB2 LYS 79 26.379 21.673 -26.212 619 2HB LYS 79 HB1 LYS 79 27.065 23.084 -27.017 620 1HG LYS 79 HG2 LYS 79 27.044 22.035 -29.134 621 2HG LYS 79 HG1 LYS 79 26.869 20.427 -28.430 622 1HD LYS 79 HD2 LYS 79 24.633 21.555 -27.446 623 2HD LYS 79 HD1 LYS 79 24.804 22.519 -28.914 624 1HE LYS 79 HE2 LYS 79 23.772 20.785 -29.975 625 2HE LYS 79 HE1 LYS 79 25.307 19.916 -29.787 626 1HZ LYS 79 HZ1 LYS 79 23.474 18.682 -28.781 627 2HZ LYS 79 HZ2 LYS 79 23.117 20.003 -27.774 628 3HZ LYS 79 HZ3 LYS 79 24.591 19.173 -27.604 629 H ILE 80 HN ILE 80 30.223 22.675 -25.238 630 HA ILE 80 HA ILE 80 30.905 24.913 -26.870 631 HB ILE 80 HB ILE 80 32.639 23.474 -24.829 632 1HG1 ILE 80 HG12 ILE 80 31.290 25.634 -23.617 633 2HG1 ILE 80 HG11 ILE 80 30.053 24.770 -24.531 634 1HG2 ILE 80 HG21 ILE 80 33.758 25.284 -26.073 635 2HG2 ILE 80 HG22 ILE 80 33.495 25.753 -24.394 636 3HG2 ILE 80 HG23 ILE 80 32.445 26.386 -25.663 637 1HD1 ILE 80 HD11 ILE 80 31.831 22.925 -23.151 638 2HD1 ILE 80 HD12 ILE 80 30.074 23.044 -23.081 639 3HD1 ILE 80 HD13 ILE 80 31.067 24.048 -22.026 640 H ASP 81 HN ASP 81 32.904 25.269 -28.096 641 HA ASP 81 HA ASP 81 33.589 23.037 -29.839 642 1HB ASP 81 HB2 ASP 81 33.501 25.759 -30.022 643 2HB ASP 81 HB1 ASP 81 35.237 25.498 -29.846 644 H ILE 82 HN ILE 82 34.769 23.850 -26.756 645 HA ILE 82 HA ILE 82 37.583 23.157 -27.295 646 HB ILE 82 HB ILE 82 36.212 23.535 -24.618 647 1HG1 ILE 82 HG12 ILE 82 35.595 25.450 -26.046 648 2HG1 ILE 82 HG11 ILE 82 36.762 25.949 -24.826 649 1HG2 ILE 82 HG21 ILE 82 38.791 24.732 -24.805 650 2HG2 ILE 82 HG22 ILE 82 38.913 23.114 -25.496 651 3HG2 ILE 82 HG23 ILE 82 38.315 23.327 -23.852 652 1HD1 ILE 82 HD11 ILE 82 37.048 26.555 -27.438 653 2HD1 ILE 82 HD12 ILE 82 37.881 25.002 -27.417 654 3HD1 ILE 82 HD13 ILE 82 38.426 26.308 -26.365 655 H VAL 83 HN VAL 83 37.083 21.771 -24.350 656 HA VAL 83 HA VAL 83 36.620 19.054 -25.539 657 HB VAL 83 HB VAL 83 38.397 19.999 -23.263 658 1HG1 VAL 83 HG11 VAL 83 37.863 17.851 -22.564 659 2HG1 VAL 83 HG12 VAL 83 39.221 17.504 -23.634 660 3HG1 VAL 83 HG13 VAL 83 37.568 17.277 -24.206 661 1HG2 VAL 83 HG21 VAL 83 39.367 20.559 -25.399 662 2HG2 VAL 83 HG22 VAL 83 38.952 18.978 -26.064 663 3HG2 VAL 83 HG23 VAL 83 40.195 19.113 -24.820 664 H ARG 84 HN ARG 84 34.682 18.248 -24.848 665 HA ARG 84 HA ARG 84 33.782 18.866 -22.048 666 1HB ARG 84 HB2 ARG 84 32.183 18.424 -24.591 667 2HB ARG 84 HB1 ARG 84 31.485 18.714 -23.001 668 1HG ARG 84 HG2 ARG 84 31.487 20.884 -23.775 669 2HG ARG 84 HG1 ARG 84 33.115 20.840 -23.101 670 1HD ARG 84 HD2 ARG 84 33.050 21.776 -25.434 671 2HD ARG 84 HD1 ARG 84 34.045 20.314 -25.322 672 HE ARG 84 HE ARG 84 31.190 20.247 -26.240 673 1HH1 ARG 84 HH21 ARG 84 33.854 20.363 -27.964 674 2HH1 ARG 84 HH22 ARG 84 33.891 18.722 -28.515 675 1HH2 ARG 84 HH11 ARG 84 31.493 17.626 -26.250 676 2HH2 ARG 84 HH12 ARG 84 32.551 17.168 -27.542 677 H MET 85 HN MET 85 33.434 17.071 -20.784 678 HA MET 85 HA MET 85 32.866 14.439 -22.080 679 1HB MET 85 HB2 MET 85 35.393 15.180 -21.293 680 2HB MET 85 HB1 MET 85 34.791 14.397 -19.831 681 1HG MET 85 HG2 MET 85 33.956 12.575 -21.595 682 2HG MET 85 HG1 MET 85 35.295 13.232 -22.536 683 1HE MET 85 HE1 MET 85 33.871 11.539 -19.794 684 2HE MET 85 HE2 MET 85 34.897 12.025 -18.448 685 3HE MET 85 HE3 MET 85 35.104 10.433 -19.175 686 H VAL 86 HN VAL 86 31.913 12.891 -20.506 687 HA VAL 86 HA VAL 86 31.053 14.100 -17.915 688 HB VAL 86 HB VAL 86 29.401 14.510 -19.792 689 1HG1 VAL 86 HG11 VAL 86 29.824 12.218 -20.836 690 2HG1 VAL 86 HG12 VAL 86 28.131 12.686 -20.683 691 3HG1 VAL 86 HG13 VAL 86 28.837 11.546 -19.538 692 1HG2 VAL 86 HG21 VAL 86 28.201 12.691 -17.712 693 2HG2 VAL 86 HG22 VAL 86 27.549 14.187 -18.382 694 3HG2 VAL 86 HG23 VAL 86 28.901 14.243 -17.251 695 H LEU 87 HN LEU 87 30.477 12.543 -16.311 696 HA LEU 87 HA LEU 87 30.688 10.514 -15.149 697 1HB LEU 87 HB2 LEU 87 29.077 10.178 -17.318 698 2HB LEU 87 HB1 LEU 87 30.302 8.958 -17.657 699 HG LEU 87 HG LEU 87 28.513 7.937 -16.363 700 1HD1 LEU 87 HD11 LEU 87 29.793 7.032 -14.524 701 2HD1 LEU 87 HD12 LEU 87 30.858 8.438 -14.509 702 3HD1 LEU 87 HD13 LEU 87 30.902 7.313 -15.866 703 1HD2 LEU 87 HD21 LEU 87 28.557 9.014 -13.835 704 2HD2 LEU 87 HD22 LEU 87 27.349 9.395 -15.061 705 3HD2 LEU 87 HD23 LEU 87 28.741 10.453 -14.837 Start of MODEL 15 1 1H MET 1 HT1 MET 1 16.550 1.087 -18.425 2 2H MET 1 HT2 MET 1 17.116 2.037 -17.136 3 3H MET 1 HT3 MET 1 17.786 2.218 -18.687 4 HA MET 1 HA MET 1 15.020 2.933 -17.849 5 1HB MET 1 HB2 MET 1 17.610 4.250 -17.962 6 2HB MET 1 HB1 MET 1 16.446 5.074 -18.998 7 1HG MET 1 HG2 MET 1 15.923 6.110 -17.010 8 2HG MET 1 HG1 MET 1 14.875 4.700 -16.854 9 1HE MET 1 HE1 MET 1 14.647 3.718 -14.770 10 2HE MET 1 HE2 MET 1 14.920 5.367 -14.212 11 3HE MET 1 HE3 MET 1 15.692 4.023 -13.374 12 H LYS 2 HN LYS 2 17.352 3.342 -20.570 13 HA LYS 2 HA LYS 2 15.142 3.585 -22.490 14 1HB LYS 2 HB2 LYS 2 17.729 4.511 -22.290 15 2HB LYS 2 HB1 LYS 2 17.898 3.223 -23.483 16 1HG LYS 2 HG2 LYS 2 15.563 5.036 -23.815 17 2HG LYS 2 HG1 LYS 2 17.148 5.732 -24.146 18 1HD LYS 2 HD2 LYS 2 17.566 4.281 -25.918 19 2HD LYS 2 HD1 LYS 2 16.464 3.050 -25.302 20 1HE LYS 2 HE2 LYS 2 14.710 5.094 -25.715 21 2HE LYS 2 HE1 LYS 2 15.881 5.404 -27.010 22 1HZ LYS 2 HZ1 LYS 2 14.501 2.834 -26.433 23 2HZ LYS 2 HZ2 LYS 2 15.756 3.011 -27.566 24 3HZ LYS 2 HZ3 LYS 2 14.281 3.820 -27.796 25 H THR 3 HN THR 3 14.228 1.394 -22.069 26 HA THR 3 HA THR 3 15.759 -0.780 -23.473 27 HB THR 3 HB THR 3 14.335 -2.280 -21.985 28 HG1 THR 3 HG1 THR 3 12.932 -1.377 -20.733 29 1HG2 THR 3 HG21 THR 3 16.720 -1.584 -21.496 30 2HG2 THR 3 HG22 THR 3 15.769 -2.033 -20.081 31 3HG2 THR 3 HG23 THR 3 16.060 -0.332 -20.443 32 H LYS 4 HN LYS 4 14.752 -1.634 -25.249 33 HA LYS 4 HA LYS 4 13.136 -2.046 -26.902 34 1HB LYS 4 HB2 LYS 4 11.828 -2.209 -24.273 35 2HB LYS 4 HB1 LYS 4 10.700 -1.879 -25.589 36 1HG LYS 4 HG2 LYS 4 11.363 -3.838 -26.782 37 2HG LYS 4 HG1 LYS 4 12.780 -4.069 -25.760 38 1HD LYS 4 HD2 LYS 4 10.762 -4.088 -23.900 39 2HD LYS 4 HD1 LYS 4 9.970 -4.837 -25.288 40 1HE LYS 4 HE2 LYS 4 11.018 -6.769 -24.725 41 2HE LYS 4 HE1 LYS 4 12.545 -5.996 -25.188 42 1HZ LYS 4 HZ1 LYS 4 12.850 -5.167 -23.018 43 2HZ LYS 4 HZ2 LYS 4 12.411 -6.797 -22.819 44 3HZ LYS 4 HZ3 LYS 4 11.271 -5.569 -22.544 45 H LEU 5 HN LEU 5 11.036 0.134 -25.001 46 HA LEU 5 HA LEU 5 10.819 1.912 -27.374 47 1HB LEU 5 HB2 LEU 5 9.170 1.012 -25.183 48 2HB LEU 5 HB1 LEU 5 9.214 2.774 -25.194 49 HG LEU 5 HG LEU 5 8.962 2.057 -27.891 50 1HD1 LEU 5 HD11 LEU 5 6.969 0.590 -27.881 51 2HD1 LEU 5 HD12 LEU 5 7.121 0.407 -26.133 52 3HD1 LEU 5 HD13 LEU 5 8.375 -0.228 -27.198 53 1HD2 LEU 5 HD21 LEU 5 6.574 2.907 -27.490 54 2HD2 LEU 5 HD22 LEU 5 7.879 3.986 -26.999 55 3HD2 LEU 5 HD23 LEU 5 7.017 3.035 -25.788 56 H ASN 6 HN ASN 6 10.167 4.311 -26.011 57 HA ASN 6 HA ASN 6 12.729 5.509 -25.581 58 1HB ASN 6 HB2 ASN 6 10.440 6.516 -26.231 59 2HB ASN 6 HB1 ASN 6 10.077 6.501 -24.505 60 1HD2 ASN 6 HD21 ASN 6 12.785 7.551 -26.669 61 2HD2 ASN 6 HD22 ASN 6 13.094 8.985 -25.815 62 H GLU 7 HN GLU 7 10.140 4.773 -23.196 63 HA GLU 7 HA GLU 7 12.225 4.174 -21.161 64 1HB GLU 7 HB2 GLU 7 11.668 6.619 -21.096 65 2HB GLU 7 HB1 GLU 7 9.987 6.192 -20.779 66 1HG GLU 7 HG2 GLU 7 11.280 6.730 -18.699 67 2HG GLU 7 HG1 GLU 7 10.599 5.106 -18.694 68 H LEU 8 HN LEU 8 11.620 2.252 -20.281 69 HA LEU 8 HA LEU 8 8.734 1.473 -20.299 70 1HB LEU 8 HB2 LEU 8 11.296 0.190 -20.741 71 2HB LEU 8 HB1 LEU 8 10.414 -0.653 -19.470 72 HG LEU 8 HG LEU 8 9.888 -1.566 -21.713 73 1HD1 LEU 8 HD11 LEU 8 8.094 -1.945 -20.290 74 2HD1 LEU 8 HD12 LEU 8 7.309 -0.996 -21.553 75 3HD1 LEU 8 HD13 LEU 8 7.792 -0.225 -20.042 76 1HD2 LEU 8 HD21 LEU 8 9.975 1.088 -22.516 77 2HD2 LEU 8 HD22 LEU 8 8.250 0.722 -22.545 78 3HD2 LEU 8 HD23 LEU 8 9.375 -0.255 -23.489 79 H LEU 9 HN LEU 9 11.526 1.910 -18.141 80 HA LEU 9 HA LEU 9 10.068 0.987 -15.756 81 1HB LEU 9 HB2 LEU 9 12.736 2.382 -16.168 82 2HB LEU 9 HB1 LEU 9 12.195 1.667 -14.651 83 HG LEU 9 HG LEU 9 11.820 -0.378 -16.500 84 1HD1 LEU 9 HD11 LEU 9 13.070 0.408 -18.283 85 2HD1 LEU 9 HD12 LEU 9 14.344 -0.382 -17.353 86 3HD1 LEU 9 HD13 LEU 9 14.133 1.366 -17.253 87 1HD2 LEU 9 HD21 LEU 9 14.414 -0.139 -15.015 88 2HD2 LEU 9 HD22 LEU 9 13.322 -1.518 -15.141 89 3HD2 LEU 9 HD23 LEU 9 12.913 -0.162 -14.089 90 H GLU 10 HN GLU 10 11.418 4.103 -16.896 91 HA GLU 10 HA GLU 10 10.824 6.326 -16.409 92 1HB GLU 10 HB2 GLU 10 8.619 5.144 -17.163 93 2HB GLU 10 HB1 GLU 10 8.179 5.230 -15.457 94 1HG GLU 10 HG2 GLU 10 7.300 7.203 -16.552 95 2HG GLU 10 HG1 GLU 10 8.649 7.703 -15.531 96 H PHE 11 HN PHE 11 12.238 4.932 -14.366 97 HA PHE 11 HA PHE 11 10.911 5.675 -11.806 98 1HB PHE 11 HB2 PHE 11 11.947 3.457 -12.050 99 2HB PHE 11 HB1 PHE 11 13.481 4.205 -12.494 100 HD1 PHE 11 HD1 PHE 11 14.972 5.069 -10.838 101 HD2 PHE 11 HD2 PHE 11 11.013 3.811 -9.736 102 HE1 PHE 11 HE1 PHE 11 15.579 5.253 -8.442 103 HE2 PHE 11 HE2 PHE 11 11.623 3.995 -7.340 104 HZ PHE 11 HZ PHE 11 13.905 4.716 -6.693 105 HA PRO 12 HA PRO 12 13.221 9.483 -11.858 106 1HB PRO 12 HB2 PRO 12 12.717 10.233 -9.271 107 2HB PRO 12 HB1 PRO 12 11.525 10.395 -10.578 108 1HG PRO 12 HG2 PRO 12 11.755 8.295 -8.477 109 2HG PRO 12 HG1 PRO 12 10.310 9.085 -9.128 110 1HD PRO 12 HD2 PRO 12 11.089 6.598 -9.876 111 2HD PRO 12 HD1 PRO 12 10.214 7.704 -10.959 112 H THR 13 HN THR 13 15.407 9.039 -11.930 113 HA THR 13 HA THR 13 16.719 8.229 -9.352 114 HB THR 13 HB THR 13 16.587 6.357 -10.946 115 HG1 THR 13 HG1 THR 13 18.495 5.893 -10.266 116 1HG2 THR 13 HG21 THR 13 18.170 8.121 -12.836 117 2HG2 THR 13 HG22 THR 13 16.448 7.783 -13.004 118 3HG2 THR 13 HG23 THR 13 17.619 6.473 -13.140 119 HA PRO 14 HA PRO 14 19.141 11.861 -10.047 120 1HB PRO 14 HB2 PRO 14 21.188 11.316 -8.313 121 2HB PRO 14 HB1 PRO 14 19.578 11.835 -7.776 122 1HG PRO 14 HG2 PRO 14 20.768 9.109 -7.832 123 2HG PRO 14 HG1 PRO 14 19.704 9.853 -6.629 124 1HD PRO 14 HD2 PRO 14 18.848 8.076 -8.517 125 2HD PRO 14 HD1 PRO 14 17.807 9.314 -7.782 126 H PHE 15 HN PHE 15 20.474 12.213 -11.778 127 HA PHE 15 HA PHE 15 22.335 10.041 -12.650 128 1HB PHE 15 HB2 PHE 15 20.964 12.393 -13.956 129 2HB PHE 15 HB1 PHE 15 22.316 11.586 -14.743 130 HD1 PHE 15 HD1 PHE 15 18.848 11.662 -14.569 131 HD2 PHE 15 HD2 PHE 15 22.107 8.862 -14.592 132 HE1 PHE 15 HE1 PHE 15 17.320 9.889 -15.385 133 HE2 PHE 15 HE2 PHE 15 20.576 7.090 -15.407 134 HZ PHE 15 HZ PHE 15 18.183 7.603 -15.803 135 H THR 16 HN THR 16 24.218 10.430 -11.417 136 HA THR 16 HA THR 16 25.301 13.135 -11.068 137 HB THR 16 HB THR 16 26.636 10.432 -10.672 138 HG1 THR 16 HG1 THR 16 25.298 10.132 -9.102 139 1HG2 THR 16 HG21 THR 16 28.229 11.543 -9.471 140 2HG2 THR 16 HG22 THR 16 27.076 12.715 -8.831 141 3HG2 THR 16 HG23 THR 16 27.721 12.912 -10.461 142 H TYR 17 HN TYR 17 25.582 13.890 -13.243 143 HA TYR 17 HA TYR 17 27.331 12.293 -15.041 144 1HB TYR 17 HB2 TYR 17 25.334 14.502 -15.252 145 2HB TYR 17 HB1 TYR 17 26.601 14.448 -16.477 146 HD1 TYR 17 HD1 TYR 17 24.871 11.641 -14.666 147 HD2 TYR 17 HD2 TYR 17 25.594 13.608 -18.417 148 HE1 TYR 17 HE1 TYR 17 23.684 9.817 -15.852 149 HE2 TYR 17 HE2 TYR 17 24.406 11.785 -19.602 150 HH TYR 17 HH TYR 17 22.452 9.543 -18.043 151 H LYS 18 HN LYS 18 29.459 12.609 -14.455 152 HA LYS 18 HA LYS 18 30.477 15.179 -13.506 153 1HB LYS 18 HB2 LYS 18 31.352 12.397 -13.867 154 2HB LYS 18 HB1 LYS 18 32.627 13.565 -14.216 155 1HG LYS 18 HG2 LYS 18 32.921 13.416 -11.942 156 2HG LYS 18 HG1 LYS 18 31.684 14.669 -11.967 157 1HD LYS 18 HD2 LYS 18 30.659 13.231 -10.495 158 2HD LYS 18 HD1 LYS 18 30.082 12.509 -11.994 159 1HE LYS 18 HE2 LYS 18 32.748 11.545 -11.144 160 2HE LYS 18 HE1 LYS 18 31.426 11.113 -10.048 161 1HZ LYS 18 HZ1 LYS 18 30.902 9.542 -11.527 162 2HZ LYS 18 HZ2 LYS 18 31.949 10.176 -12.705 163 3HZ LYS 18 HZ3 LYS 18 30.371 10.781 -12.556 164 H VAL 19 HN VAL 19 29.990 16.618 -15.301 165 HA VAL 19 HA VAL 19 31.156 16.023 -17.935 166 HB VAL 19 HB VAL 19 30.330 18.491 -18.305 167 1HG1 VAL 19 HG11 VAL 19 29.281 16.335 -19.105 168 2HG1 VAL 19 HG12 VAL 19 28.146 17.659 -18.843 169 3HG1 VAL 19 HG13 VAL 19 28.281 16.364 -17.653 170 1HG2 VAL 19 HG21 VAL 19 28.414 17.937 -16.094 171 2HG2 VAL 19 HG22 VAL 19 29.002 19.479 -16.713 172 3HG2 VAL 19 HG23 VAL 19 30.005 18.528 -15.622 173 H MET 20 HN MET 20 33.373 16.046 -17.842 174 HA MET 20 HA MET 20 34.725 18.395 -16.560 175 1HB MET 20 HB2 MET 20 35.748 15.645 -17.358 176 2HB MET 20 HB1 MET 20 36.664 16.863 -16.471 177 1HG MET 20 HG2 MET 20 34.870 16.794 -14.694 178 2HG MET 20 HG1 MET 20 34.171 15.415 -15.541 179 1HE MET 20 HE1 MET 20 34.778 12.988 -14.420 180 2HE MET 20 HE2 MET 20 36.332 12.538 -15.120 181 3HE MET 20 HE3 MET 20 35.158 13.423 -16.091 182 H GLY 21 HN GLY 21 36.380 19.490 -17.770 183 1HA GLY 21 HA2 GLY 21 37.242 18.740 -20.392 184 2HA GLY 21 HA1 GLY 21 35.906 19.880 -20.538 185 H GLN 22 HN GLN 22 37.391 21.443 -21.462 186 HA GLN 22 HA GLN 22 39.758 22.379 -20.109 187 1HB GLN 22 HB2 GLN 22 38.456 22.750 -22.536 188 2HB GLN 22 HB1 GLN 22 38.319 24.329 -21.765 189 1HG GLN 22 HG2 GLN 22 40.384 24.432 -22.911 190 2HG GLN 22 HG1 GLN 22 40.840 24.076 -21.245 191 1HE2 GLN 22 HE21 GLN 22 40.656 22.727 -24.508 192 2HE2 GLN 22 HE22 GLN 22 41.498 21.296 -24.158 193 H ALA 23 HN ALA 23 39.939 24.674 -19.222 194 HA ALA 23 HA ALA 23 38.098 25.073 -17.036 195 1HB ALA 23 HB1 ALA 23 39.507 27.014 -16.599 196 2HB ALA 23 HB2 ALA 23 40.117 26.987 -18.252 197 3HB ALA 23 HB3 ALA 23 40.536 25.687 -17.136 198 H LEU 24 HN LEU 24 35.979 25.547 -17.644 199 HA LEU 24 HA LEU 24 35.573 28.015 -19.306 200 1HB LEU 24 HB2 LEU 24 35.103 25.594 -20.255 201 2HB LEU 24 HB1 LEU 24 33.642 25.710 -19.276 202 HG LEU 24 HG LEU 24 33.715 28.169 -20.539 203 1HD1 LEU 24 HD11 LEU 24 34.125 27.709 -22.907 204 2HD1 LEU 24 HD12 LEU 24 34.531 26.034 -22.534 205 3HD1 LEU 24 HD13 LEU 24 35.575 27.341 -21.974 206 1HD2 LEU 24 HD21 LEU 24 31.733 26.756 -20.226 207 2HD2 LEU 24 HD22 LEU 24 32.347 25.602 -21.412 208 3HD2 LEU 24 HD23 LEU 24 31.874 27.222 -21.921 209 HA PRO 25 HA PRO 25 33.417 29.058 -15.510 210 1HB PRO 25 HB2 PRO 25 32.749 31.607 -16.252 211 2HB PRO 25 HB1 PRO 25 34.365 31.155 -15.675 212 1HG PRO 25 HG2 PRO 25 33.402 31.588 -18.457 213 2HG PRO 25 HG1 PRO 25 34.951 32.025 -17.716 214 1HD PRO 25 HD2 PRO 25 34.617 29.862 -19.342 215 2HD PRO 25 HD1 PRO 25 35.854 29.953 -18.069 216 H GLU 26 HN GLU 26 32.140 28.923 -18.737 217 HA GLU 26 HA GLU 26 29.387 29.648 -18.026 218 1HB GLU 26 HB2 GLU 26 30.844 29.704 -20.291 219 2HB GLU 26 HB1 GLU 26 30.072 28.133 -20.502 220 1HG GLU 26 HG2 GLU 26 28.162 30.117 -19.567 221 2HG GLU 26 HG1 GLU 26 28.940 30.638 -21.061 222 H LEU 27 HN LEU 27 31.193 26.888 -17.347 223 HA LEU 27 HA LEU 27 29.523 24.724 -18.101 224 1HB LEU 27 HB2 LEU 27 30.730 23.505 -16.382 225 2HB LEU 27 HB1 LEU 27 31.844 24.637 -17.139 226 HG LEU 27 HG LEU 27 30.954 26.209 -15.137 227 1HD1 LEU 27 HD11 LEU 27 30.669 23.350 -14.175 228 2HD1 LEU 27 HD12 LEU 27 29.456 24.627 -14.117 229 3HD1 LEU 27 HD13 LEU 27 30.877 24.713 -13.078 230 1HD2 LEU 27 HD21 LEU 27 33.240 24.452 -15.586 231 2HD2 LEU 27 HD22 LEU 27 32.929 24.694 -13.867 232 3HD2 LEU 27 HD23 LEU 27 33.200 26.083 -14.917 233 H VAL 28 HN VAL 28 29.257 26.919 -15.296 234 HA VAL 28 HA VAL 28 27.053 25.406 -14.100 235 HB VAL 28 HB VAL 28 28.785 26.829 -12.906 236 1HG1 VAL 28 HG11 VAL 28 28.557 29.215 -12.884 237 2HG1 VAL 28 HG12 VAL 28 27.050 29.145 -13.799 238 3HG1 VAL 28 HG13 VAL 28 28.577 28.738 -14.582 239 1HG2 VAL 28 HG21 VAL 28 27.320 27.232 -11.162 240 2HG2 VAL 28 HG22 VAL 28 26.307 26.183 -12.154 241 3HG2 VAL 28 HG23 VAL 28 26.092 27.933 -12.216 242 H ASP 29 HN ASP 29 27.370 28.170 -16.289 243 HA ASP 29 HA ASP 29 24.659 29.127 -16.106 244 1HB ASP 29 HB2 ASP 29 26.586 30.379 -17.032 245 2HB ASP 29 HB1 ASP 29 26.698 29.224 -18.360 246 H GLN 30 HN GLN 30 26.250 26.965 -18.502 247 HA GLN 30 HA GLN 30 23.812 26.349 -19.925 248 1HB GLN 30 HB2 GLN 30 26.475 26.047 -20.357 249 2HB GLN 30 HB1 GLN 30 26.055 24.400 -19.883 250 1HG GLN 30 HG2 GLN 30 25.111 24.026 -21.890 251 2HG GLN 30 HG1 GLN 30 24.041 25.407 -21.674 252 1HE2 GLN 30 HE21 GLN 30 27.330 24.524 -22.814 253 2HE2 GLN 30 HE22 GLN 30 27.506 25.871 -23.831 254 H VAL 31 HN VAL 31 25.650 24.573 -17.403 255 HA VAL 31 HA VAL 31 24.100 22.224 -17.280 256 HB VAL 31 HB VAL 31 25.739 23.844 -15.360 257 1HG1 VAL 31 HG11 VAL 31 25.389 21.642 -13.874 258 2HG1 VAL 31 HG12 VAL 31 23.803 21.689 -14.639 259 3HG1 VAL 31 HG13 VAL 31 24.362 23.062 -13.685 260 1HG2 VAL 31 HG21 VAL 31 26.882 22.433 -16.982 261 2HG2 VAL 31 HG22 VAL 31 25.900 21.045 -16.518 262 3HG2 VAL 31 HG23 VAL 31 27.068 21.715 -15.382 263 H VAL 32 HN VAL 32 23.594 25.180 -15.265 264 HA VAL 32 HA VAL 32 21.168 24.211 -14.065 265 HB VAL 32 HB VAL 32 22.769 26.043 -13.295 266 1HG1 VAL 32 HG11 VAL 32 21.084 27.781 -15.117 267 2HG1 VAL 32 HG12 VAL 32 22.719 27.255 -15.516 268 3HG1 VAL 32 HG13 VAL 32 22.444 28.284 -14.112 269 1HG2 VAL 32 HG21 VAL 32 21.089 27.079 -12.013 270 2HG2 VAL 32 HG22 VAL 32 20.355 25.539 -12.461 271 3HG2 VAL 32 HG23 VAL 32 19.914 27.011 -13.326 272 H GLU 33 HN GLU 33 21.727 26.159 -17.010 273 HA GLU 33 HA GLU 33 18.917 26.790 -17.415 274 1HB GLU 33 HB2 GLU 33 21.520 27.106 -18.788 275 2HB GLU 33 HB1 GLU 33 20.119 27.051 -19.857 276 1HG GLU 33 HG2 GLU 33 19.435 29.106 -19.219 277 2HG GLU 33 HG1 GLU 33 19.616 28.710 -17.511 278 H VAL 34 HN VAL 34 21.120 24.450 -19.030 279 HA VAL 34 HA VAL 34 19.087 23.254 -20.671 280 HB VAL 34 HB VAL 34 21.615 23.213 -20.934 281 1HG1 VAL 34 HG11 VAL 34 21.609 20.783 -19.173 282 2HG1 VAL 34 HG12 VAL 34 21.812 22.373 -18.442 283 3HG1 VAL 34 HG13 VAL 34 22.959 21.810 -19.655 284 1HG2 VAL 34 HG21 VAL 34 19.787 20.871 -21.224 285 2HG2 VAL 34 HG22 VAL 34 21.506 20.605 -21.512 286 3HG2 VAL 34 HG23 VAL 34 20.626 21.802 -22.463 287 H VAL 35 HN VAL 35 20.176 22.558 -17.358 288 HA VAL 35 HA VAL 35 18.706 20.035 -17.195 289 HB VAL 35 HB VAL 35 20.843 20.883 -15.944 290 1HG1 VAL 35 HG11 VAL 35 20.469 21.980 -13.849 291 2HG1 VAL 35 HG12 VAL 35 18.718 21.819 -14.004 292 3HG1 VAL 35 HG13 VAL 35 19.600 22.918 -15.063 293 1HG2 VAL 35 HG21 VAL 35 20.532 19.190 -14.378 294 2HG2 VAL 35 HG22 VAL 35 19.327 18.757 -15.590 295 3HG2 VAL 35 HG23 VAL 35 18.837 19.597 -14.122 296 H GLN 36 HN GLN 36 18.030 23.425 -16.466 297 HA GLN 36 HA GLN 36 15.671 22.895 -14.834 298 1HB GLN 36 HB2 GLN 36 16.967 24.945 -14.618 299 2HB GLN 36 HB1 GLN 36 16.712 25.328 -16.322 300 1HG GLN 36 HG2 GLN 36 14.537 25.991 -15.995 301 2HG GLN 36 HG1 GLN 36 14.280 24.857 -14.669 302 1HE2 GLN 36 HE21 GLN 36 15.619 28.055 -15.475 303 2HE2 GLN 36 HE22 GLN 36 15.729 28.600 -13.872 304 H ARG 37 HN ARG 37 16.251 23.636 -18.280 305 HA ARG 37 HA ARG 37 13.454 23.906 -19.004 306 1HB ARG 37 HB2 ARG 37 16.115 23.663 -20.335 307 2HB ARG 37 HB1 ARG 37 14.694 23.315 -21.319 308 1HG ARG 37 HG2 ARG 37 13.740 25.494 -20.809 309 2HG ARG 37 HG1 ARG 37 15.051 25.844 -19.681 310 1HD ARG 37 HD2 ARG 37 15.546 25.250 -22.620 311 2HD ARG 37 HD1 ARG 37 15.320 26.894 -21.995 312 HE ARG 37 HE ARG 37 17.348 25.185 -20.652 313 1HH1 ARG 37 HH11 ARG 37 18.402 25.975 -23.307 314 2HH1 ARG 37 HH12 ARG 37 19.143 27.508 -22.990 315 1HH2 ARG 37 HH21 ARG 37 17.502 27.972 -19.958 316 2HH2 ARG 37 HH22 ARG 37 18.629 28.641 -21.085 317 H HIS 38 HN HIS 38 15.587 21.149 -18.575 318 HA HIS 38 HA HIS 38 13.685 19.341 -19.995 319 1HB HIS 38 HB2 HIS 38 16.542 19.318 -19.138 320 2HB HIS 38 HB1 HIS 38 15.719 17.761 -19.230 321 HD1 HIS 38 HD1 HIS 38 14.491 17.267 -21.614 322 HD2 HIS 38 HD2 HIS 38 17.336 20.313 -21.607 323 HE1 HIS 38 HE1 HIS 38 15.087 17.697 -24.038 324 H ALA 39 HN ALA 39 15.276 19.698 -16.802 325 HA ALA 39 HA ALA 39 13.461 17.666 -15.622 326 1HB ALA 39 HB1 ALA 39 15.110 17.492 -14.035 327 2HB ALA 39 HB2 ALA 39 15.341 19.239 -13.948 328 3HB ALA 39 HB3 ALA 39 16.088 18.313 -15.250 329 HA PRO 40 HA PRO 40 10.625 20.645 -14.044 330 1HB PRO 40 HB2 PRO 40 9.882 19.453 -11.686 331 2HB PRO 40 HB1 PRO 40 9.329 18.895 -13.278 332 1HG PRO 40 HG2 PRO 40 11.514 17.824 -11.554 333 2HG PRO 40 HG1 PRO 40 10.305 16.954 -12.512 334 1HD PRO 40 HD2 PRO 40 12.857 17.282 -13.343 335 2HD PRO 40 HD1 PRO 40 11.487 17.199 -14.473 336 H GLY 41 HN GLY 41 13.129 19.492 -11.770 337 1HA GLY 41 HA2 GLY 41 12.979 22.094 -10.324 338 2HA GLY 41 HA1 GLY 41 13.780 20.642 -9.723 339 H ASP 42 HN ASP 42 15.130 23.102 -9.772 340 HA ASP 42 HA ASP 42 16.859 23.149 -12.168 341 1HB ASP 42 HB2 ASP 42 17.666 25.199 -11.219 342 2HB ASP 42 HB1 ASP 42 15.937 25.168 -10.887 343 H TYR 43 HN TYR 43 19.180 22.828 -12.008 344 HA TYR 43 HA TYR 43 20.126 21.393 -9.557 345 1HB TYR 43 HB2 TYR 43 20.214 20.515 -12.454 346 2HB TYR 43 HB1 TYR 43 21.214 19.774 -11.205 347 HD1 TYR 43 HD1 TYR 43 20.084 18.735 -9.176 348 HD2 TYR 43 HD2 TYR 43 17.913 19.948 -12.679 349 HE1 TYR 43 HE1 TYR 43 18.167 17.326 -8.478 350 HE2 TYR 43 HE2 TYR 43 15.999 18.538 -11.981 351 HH TYR 43 HH TYR 43 15.246 17.628 -9.368 352 H THR 44 HN THR 44 22.621 21.075 -9.730 353 HA THR 44 HA THR 44 23.933 23.304 -11.233 354 HB THR 44 HB THR 44 24.450 22.758 -8.300 355 HG1 THR 44 HG1 THR 44 22.684 23.759 -7.819 356 1HG2 THR 44 HG21 THR 44 25.010 25.015 -10.221 357 2HG2 THR 44 HG22 THR 44 26.154 24.106 -9.232 358 3HG2 THR 44 HG23 THR 44 25.055 25.258 -8.475 359 HA PRO 45 HA PRO 45 27.153 20.230 -11.490 360 1HB PRO 45 HB2 PRO 45 28.988 21.781 -12.782 361 2HB PRO 45 HB1 PRO 45 27.517 21.185 -13.572 362 1HG PRO 45 HG2 PRO 45 28.206 23.897 -12.760 363 2HG PRO 45 HG1 PRO 45 26.940 23.341 -13.858 364 1HD PRO 45 HD2 PRO 45 26.712 24.134 -11.083 365 2HD PRO 45 HD1 PRO 45 25.421 23.751 -12.242 366 H THR 46 HN THR 46 28.760 19.611 -10.009 367 HA THR 46 HA THR 46 29.843 21.651 -8.143 368 HB THR 46 HB THR 46 30.225 18.638 -8.266 369 HG1 THR 46 HG1 THR 46 28.336 18.477 -7.377 370 1HG2 THR 46 HG21 THR 46 31.875 19.802 -6.872 371 2HG2 THR 46 HG22 THR 46 30.748 18.898 -5.860 372 3HG2 THR 46 HG23 THR 46 30.579 20.646 -6.023 373 H VAL 47 HN VAL 47 31.441 22.786 -9.296 374 HA VAL 47 HA VAL 47 33.337 21.472 -11.071 375 HB VAL 47 HB VAL 47 32.492 23.809 -11.298 376 1HG1 VAL 47 HG11 VAL 47 32.770 24.126 -8.686 377 2HG1 VAL 47 HG12 VAL 47 32.976 25.498 -9.775 378 3HG1 VAL 47 HG13 VAL 47 34.390 24.660 -9.135 379 1HG2 VAL 47 HG21 VAL 47 34.853 24.856 -11.565 380 2HG2 VAL 47 HG22 VAL 47 34.481 23.415 -12.510 381 3HG2 VAL 47 HG23 VAL 47 35.454 23.282 -11.045 382 H LYS 48 HN LYS 48 35.350 20.709 -10.622 383 HA LYS 48 HA LYS 48 36.666 21.407 -8.045 384 1HB LYS 48 HB2 LYS 48 36.971 19.065 -7.491 385 2HB LYS 48 HB1 LYS 48 35.258 19.317 -7.818 386 1HG LYS 48 HG2 LYS 48 36.225 18.698 -10.320 387 2HG LYS 48 HG1 LYS 48 37.230 17.689 -9.282 388 1HD LYS 48 HD2 LYS 48 35.356 16.573 -8.357 389 2HD LYS 48 HD1 LYS 48 34.233 17.804 -8.937 390 1HE LYS 48 HE2 LYS 48 35.518 16.870 -11.258 391 2HE LYS 48 HE1 LYS 48 35.171 15.416 -10.304 392 1HZ LYS 48 HZ1 LYS 48 33.212 17.593 -10.816 393 2HZ LYS 48 HZ2 LYS 48 32.909 16.118 -10.028 394 3HZ LYS 48 HZ3 LYS 48 33.269 16.140 -11.688 395 HA PRO 49 HA PRO 49 40.169 21.434 -10.726 396 1HB PRO 49 HB2 PRO 49 42.160 21.417 -8.853 397 2HB PRO 49 HB1 PRO 49 41.140 22.835 -9.164 398 1HG PRO 49 HG2 PRO 49 41.069 20.916 -6.921 399 2HG PRO 49 HG1 PRO 49 40.625 22.627 -6.963 400 1HD PRO 49 HD2 PRO 49 38.856 20.459 -7.009 401 2HD PRO 49 HD1 PRO 49 38.461 22.146 -7.400 402 H SER 50 HN SER 50 39.636 19.157 -11.464 403 HA SER 50 HA SER 50 40.959 16.908 -10.113 404 1HB SER 50 HB2 SER 50 39.075 17.412 -12.315 405 2HB SER 50 HB1 SER 50 40.177 16.079 -12.636 406 HG SER 50 HG SER 50 38.525 15.189 -11.511 407 H SER 51 HN SER 51 41.399 18.678 -13.201 408 HA SER 51 HA SER 51 44.096 17.413 -13.491 409 1HB SER 51 HB2 SER 51 42.062 17.548 -15.238 410 2HB SER 51 HB1 SER 51 42.814 19.099 -15.600 411 HG SER 51 HG SER 51 43.671 17.365 -16.854 412 H LYS 52 HN LYS 52 45.906 18.832 -14.045 413 HA LYS 52 HA LYS 52 45.694 21.507 -12.765 414 1HB LYS 52 HB2 LYS 52 47.736 19.446 -13.287 415 2HB LYS 52 HB1 LYS 52 48.320 21.095 -13.513 416 1HG LYS 52 HG2 LYS 52 48.697 20.748 -11.228 417 2HG LYS 52 HG1 LYS 52 47.132 21.561 -11.231 418 1HD LYS 52 HD2 LYS 52 46.572 18.810 -11.550 419 2HD LYS 52 HD1 LYS 52 47.792 18.911 -10.281 420 1HE LYS 52 HE2 LYS 52 46.345 19.893 -8.814 421 2HE LYS 52 HE1 LYS 52 45.651 20.941 -10.064 422 1HZ LYS 52 HZ1 LYS 52 44.486 19.019 -10.973 423 2HZ LYS 52 HZ2 LYS 52 44.042 19.281 -9.356 424 3HZ LYS 52 HZ3 LYS 52 45.123 18.031 -9.750 425 H GLY 53 HN GLY 53 46.319 23.435 -13.868 426 1HA GLY 53 HA2 GLY 53 47.156 24.641 -15.812 427 2HA GLY 53 HA1 GLY 53 46.785 23.231 -16.805 428 H ASN 54 HN ASN 54 45.295 24.034 -18.254 429 HA ASN 54 HA ASN 54 43.035 25.695 -17.241 430 1HB ASN 54 HB2 ASN 54 44.571 26.192 -19.280 431 2HB ASN 54 HB1 ASN 54 43.641 24.941 -20.105 432 1HD2 ASN 54 HD21 ASN 54 43.315 28.109 -18.463 433 2HD2 ASN 54 HD22 ASN 54 41.846 28.520 -19.205 434 H TYR 55 HN TYR 55 42.251 23.581 -16.152 435 HA TYR 55 HA TYR 55 40.357 22.220 -18.005 436 1HB TYR 55 HB2 TYR 55 42.642 21.017 -17.670 437 2HB TYR 55 HB1 TYR 55 42.045 20.657 -16.050 438 HD1 TYR 55 HD1 TYR 55 41.716 19.938 -19.619 439 HD2 TYR 55 HD2 TYR 55 39.988 19.293 -15.738 440 HE1 TYR 55 HE1 TYR 55 40.372 18.062 -20.528 441 HE2 TYR 55 HE2 TYR 55 38.645 17.417 -16.648 442 HH TYR 55 HH TYR 55 37.873 16.939 -19.534 443 H HIS 56 HN HIS 56 38.374 22.130 -17.040 444 HA HIS 56 HA HIS 56 38.221 22.315 -14.043 445 1HB HIS 56 HB2 HIS 56 36.874 23.706 -16.306 446 2HB HIS 56 HB1 HIS 56 35.848 23.294 -14.933 447 HD1 HIS 56 HD1 HIS 56 35.926 26.097 -14.883 448 HD2 HIS 56 HD2 HIS 56 39.291 24.036 -13.547 449 HE1 HIS 56 HE1 HIS 56 37.254 27.728 -13.472 450 H SER 57 HN SER 57 37.264 20.530 -13.119 451 HA SER 57 HA SER 57 35.611 18.749 -14.885 452 1HB SER 57 HB2 SER 57 37.302 18.317 -12.410 453 2HB SER 57 HB1 SER 57 36.219 17.079 -13.039 454 HG SER 57 HG SER 57 38.535 18.201 -14.179 455 H VAL 58 HN VAL 58 33.439 19.235 -14.547 456 HA VAL 58 HA VAL 58 32.589 19.712 -11.709 457 HB VAL 58 HB VAL 58 30.968 21.266 -12.555 458 1HG1 VAL 58 HG11 VAL 58 33.064 22.037 -14.477 459 2HG1 VAL 58 HG12 VAL 58 33.664 21.668 -12.861 460 3HG1 VAL 58 HG13 VAL 58 32.435 22.912 -13.081 461 1HG2 VAL 58 HG21 VAL 58 31.174 19.661 -14.942 462 2HG2 VAL 58 HG22 VAL 58 31.430 21.355 -15.353 463 3HG2 VAL 58 HG23 VAL 58 29.954 20.861 -14.525 464 H SER 59 HN SER 59 30.595 18.755 -11.039 465 HA SER 59 HA SER 59 29.605 16.548 -12.819 466 1HB SER 59 HB2 SER 59 29.142 15.363 -10.680 467 2HB SER 59 HB1 SER 59 30.843 15.787 -10.830 468 HG SER 59 HG SER 59 30.001 16.331 -8.776 469 H ILE 60 HN ILE 60 27.574 17.026 -13.559 470 HA ILE 60 HA ILE 60 25.902 18.971 -12.071 471 HB ILE 60 HB ILE 60 26.216 19.269 -14.474 472 1HG1 ILE 60 HG12 ILE 60 23.425 18.247 -13.849 473 2HG1 ILE 60 HG11 ILE 60 24.016 19.873 -13.514 474 1HG2 ILE 60 HG21 ILE 60 26.703 17.073 -15.271 475 2HG2 ILE 60 HG22 ILE 60 25.170 17.512 -16.022 476 3HG2 ILE 60 HG23 ILE 60 25.192 16.425 -14.635 477 1HD1 ILE 60 HD11 ILE 60 23.467 18.582 -16.180 478 2HD1 ILE 60 HD12 ILE 60 24.576 19.946 -16.056 479 3HD1 ILE 60 HD13 ILE 60 22.893 20.131 -15.564 480 H THR 61 HN THR 61 24.189 18.393 -10.841 481 HA THR 61 HA THR 61 23.491 15.523 -10.571 482 HB THR 61 HB THR 61 22.485 18.057 -9.221 483 HG1 THR 61 HG1 THR 61 24.269 17.898 -8.161 484 1HG2 THR 61 HG21 THR 61 22.164 15.860 -7.519 485 2HG2 THR 61 HG22 THR 61 21.616 15.282 -9.092 486 3HG2 THR 61 HG23 THR 61 20.883 16.717 -8.373 487 H ILE 62 HN ILE 62 21.718 14.609 -11.621 488 HA ILE 62 HA ILE 62 19.546 16.429 -12.584 489 HB ILE 62 HB ILE 62 21.094 14.391 -14.224 490 1HG1 ILE 62 HG12 ILE 62 20.852 17.401 -14.542 491 2HG1 ILE 62 HG11 ILE 62 22.238 16.589 -13.818 492 1HG2 ILE 62 HG21 ILE 62 18.444 15.591 -14.550 493 2HG2 ILE 62 HG22 ILE 62 19.182 14.247 -15.423 494 3HG2 ILE 62 HG23 ILE 62 19.499 15.906 -15.928 495 1HD1 ILE 62 HD11 ILE 62 22.148 15.193 -16.086 496 2HD1 ILE 62 HD12 ILE 62 22.986 16.741 -15.996 497 3HD1 ILE 62 HD13 ILE 62 21.360 16.656 -16.672 498 H ASN 63 HN ASN 63 18.028 15.493 -11.104 499 HA ASN 63 HA ASN 63 17.719 12.568 -10.959 500 1HB ASN 63 HB2 ASN 63 17.360 14.205 -9.056 501 2HB ASN 63 HB1 ASN 63 15.922 14.775 -9.904 502 1HD2 ASN 63 HD21 ASN 63 14.184 13.090 -10.326 503 2HD2 ASN 63 HD22 ASN 63 14.039 11.780 -9.259 504 H ALA 64 HN ALA 64 17.133 11.934 -13.089 505 HA ALA 64 HA ALA 64 14.524 13.020 -14.105 506 1HB ALA 64 HB1 ALA 64 15.742 11.828 -16.243 507 2HB ALA 64 HB2 ALA 64 17.146 12.348 -15.311 508 3HB ALA 64 HB3 ALA 64 15.943 13.530 -15.827 509 H THR 65 HN THR 65 12.909 11.529 -14.568 510 HA THR 65 HA THR 65 13.063 8.870 -13.444 511 HB THR 65 HB THR 65 10.792 8.695 -14.558 512 HG1 THR 65 HG1 THR 65 10.530 9.986 -16.175 513 1HG2 THR 65 HG21 THR 65 9.858 10.709 -13.260 514 2HG2 THR 65 HG22 THR 65 11.532 11.066 -12.838 515 3HG2 THR 65 HG23 THR 65 10.804 9.540 -12.339 516 H HIS 66 HN HIS 66 13.989 10.156 -16.495 517 HA HIS 66 HA HIS 66 14.307 7.388 -17.593 518 1HB HIS 66 HB2 HIS 66 13.930 8.684 -19.858 519 2HB HIS 66 HB1 HIS 66 12.539 8.220 -18.886 520 HD1 HIS 66 HD1 HIS 66 10.914 10.078 -18.626 521 HD2 HIS 66 HD2 HIS 66 14.813 11.516 -18.929 522 HE1 HIS 66 HE1 HIS 66 10.759 12.602 -18.485 523 H ILE 67 HN ILE 67 16.143 7.192 -19.095 524 HA ILE 67 HA ILE 67 18.385 8.965 -18.327 525 HB ILE 67 HB ILE 67 18.378 6.402 -18.385 526 1HG1 ILE 67 HG12 ILE 67 20.600 7.285 -20.148 527 2HG1 ILE 67 HG11 ILE 67 20.393 8.202 -18.655 528 1HG2 ILE 67 HG21 ILE 67 17.264 6.166 -20.577 529 2HG2 ILE 67 HG22 ILE 67 18.841 5.376 -20.576 530 3HG2 ILE 67 HG23 ILE 67 18.641 6.943 -21.359 531 1HD1 ILE 67 HD11 ILE 67 20.209 5.833 -17.542 532 2HD1 ILE 67 HD12 ILE 67 21.800 6.470 -17.960 533 3HD1 ILE 67 HD13 ILE 67 21.021 5.284 -19.008 534 H GLU 68 HN GLU 68 16.074 9.012 -20.775 535 HA GLU 68 HA GLU 68 17.731 9.718 -23.059 536 1HB GLU 68 HB2 GLU 68 14.800 10.077 -22.357 537 2HB GLU 68 HB1 GLU 68 15.472 10.459 -23.941 538 1HG GLU 68 HG2 GLU 68 14.932 8.292 -24.411 539 2HG GLU 68 HG1 GLU 68 16.453 7.942 -23.589 540 H GLN 69 HN GLN 69 15.830 11.598 -20.678 541 HA GLN 69 HA GLN 69 16.370 14.193 -21.796 542 1HB GLN 69 HB2 GLN 69 14.529 13.649 -20.250 543 2HB GLN 69 HB1 GLN 69 15.694 13.292 -18.976 544 1HG GLN 69 HG2 GLN 69 16.338 15.871 -19.981 545 2HG GLN 69 HG1 GLN 69 14.592 15.838 -19.731 546 1HE2 GLN 69 HE21 GLN 69 13.799 15.625 -17.542 547 2HE2 GLN 69 HE22 GLN 69 14.830 15.702 -16.195 548 H VAL 70 HN VAL 70 17.926 12.418 -19.081 549 HA VAL 70 HA VAL 70 19.836 14.443 -18.429 550 HB VAL 70 HB VAL 70 19.141 12.417 -17.088 551 1HG1 VAL 70 HG11 VAL 70 20.337 10.302 -17.518 552 2HG1 VAL 70 HG12 VAL 70 21.064 11.005 -18.962 553 3HG1 VAL 70 HG13 VAL 70 19.322 10.745 -18.890 554 1HG2 VAL 70 HG21 VAL 70 20.955 12.965 -15.881 555 2HG2 VAL 70 HG22 VAL 70 21.688 13.691 -17.311 556 3HG2 VAL 70 HG23 VAL 70 21.964 11.988 -16.946 557 H GLU 71 HN GLU 71 19.873 11.918 -20.925 558 HA GLU 71 HA GLU 71 22.678 12.089 -21.590 559 1HB GLU 71 HB2 GLU 71 20.895 10.326 -22.205 560 2HB GLU 71 HB1 GLU 71 20.385 11.448 -23.466 561 1HG GLU 71 HG2 GLU 71 23.284 10.672 -23.210 562 2HG GLU 71 HG1 GLU 71 22.154 9.614 -24.052 563 H THR 72 HN THR 72 19.757 13.662 -22.946 564 HA THR 72 HA THR 72 21.071 15.259 -24.924 565 HB THR 72 HB THR 72 18.598 16.015 -23.342 566 HG1 THR 72 HG1 THR 72 17.689 14.283 -24.059 567 1HG2 THR 72 HG21 THR 72 18.655 16.232 -26.276 568 2HG2 THR 72 HG22 THR 72 19.851 17.240 -25.462 569 3HG2 THR 72 HG23 THR 72 18.140 17.410 -25.070 570 H LEU 73 HN LEU 73 20.483 15.750 -21.459 571 HA LEU 73 HA LEU 73 21.260 18.516 -21.304 572 1HB LEU 73 HB2 LEU 73 20.735 16.207 -19.537 573 2HB LEU 73 HB1 LEU 73 21.871 17.374 -18.866 574 HG LEU 73 HG LEU 73 20.294 19.143 -18.973 575 1HD1 LEU 73 HD11 LEU 73 18.150 18.974 -20.156 576 2HD1 LEU 73 HD12 LEU 73 18.533 17.325 -20.649 577 3HD1 LEU 73 HD13 LEU 73 19.481 18.676 -21.271 578 1HD2 LEU 73 HD21 LEU 73 18.145 17.315 -18.340 579 2HD2 LEU 73 HD22 LEU 73 19.078 18.343 -17.254 580 3HD2 LEU 73 HD23 LEU 73 19.659 16.728 -17.652 581 H TYR 74 HN TYR 74 23.096 15.463 -21.040 582 HA TYR 74 HA TYR 74 25.613 16.600 -20.271 583 1HB TYR 74 HB2 TYR 74 25.891 14.361 -20.080 584 2HB TYR 74 HB1 TYR 74 24.468 14.059 -21.066 585 HD1 TYR 74 HD1 TYR 74 28.002 15.275 -21.543 586 HD2 TYR 74 HD2 TYR 74 24.792 12.823 -23.006 587 HE1 TYR 74 HE1 TYR 74 29.445 14.493 -23.400 588 HE2 TYR 74 HE2 TYR 74 26.236 12.042 -24.864 589 HH TYR 74 HH TYR 74 29.416 12.211 -24.919 590 H GLU 75 HN GLU 75 24.339 15.724 -23.521 591 HA GLU 75 HA GLU 75 26.648 16.765 -24.935 592 1HB GLU 75 HB2 GLU 75 25.254 16.351 -26.909 593 2HB GLU 75 HB1 GLU 75 25.084 15.014 -25.772 594 1HG GLU 75 HG2 GLU 75 22.977 15.934 -24.950 595 2HG GLU 75 HG1 GLU 75 23.157 17.349 -25.987 596 H GLU 76 HN GLU 76 23.667 18.235 -23.760 597 HA GLU 76 HA GLU 76 23.789 20.599 -25.447 598 1HB GLU 76 HB2 GLU 76 22.306 19.652 -23.023 599 2HB GLU 76 HB1 GLU 76 22.256 21.371 -23.414 600 1HG GLU 76 HG2 GLU 76 21.465 20.847 -25.686 601 2HG GLU 76 HG1 GLU 76 21.533 19.124 -25.321 602 H LEU 77 HN LEU 77 24.653 20.001 -21.998 603 HA LEU 77 HA LEU 77 25.879 22.637 -21.710 604 1HB LEU 77 HB2 LEU 77 26.200 21.973 -19.473 605 2HB LEU 77 HB1 LEU 77 24.762 21.080 -19.951 606 HG LEU 77 HG LEU 77 26.550 19.236 -20.651 607 1HD1 LEU 77 HD11 LEU 77 28.172 21.218 -19.427 608 2HD1 LEU 77 HD12 LEU 77 28.659 19.606 -19.949 609 3HD1 LEU 77 HD13 LEU 77 28.093 19.866 -18.299 610 1HD2 LEU 77 HD21 LEU 77 24.866 18.752 -19.015 611 2HD2 LEU 77 HD22 LEU 77 25.579 19.869 -17.852 612 3HD2 LEU 77 HD23 LEU 77 26.407 18.363 -18.252 613 H GLY 78 HN GLY 78 26.967 19.449 -22.690 614 1HA GLY 78 HA2 GLY 78 29.811 20.332 -22.587 615 2HA GLY 78 HA1 GLY 78 29.268 18.666 -22.796 616 H LYS 79 HN LYS 79 28.109 21.554 -24.524 617 HA LYS 79 HA LYS 79 28.793 20.207 -27.099 618 1HB LYS 79 HB2 LYS 79 26.493 21.324 -26.156 619 2HB LYS 79 HB1 LYS 79 27.185 22.699 -27.015 620 1HG LYS 79 HG2 LYS 79 27.149 21.596 -29.079 621 2HG LYS 79 HG1 LYS 79 27.104 19.999 -28.334 622 1HD LYS 79 HD2 LYS 79 24.797 21.069 -27.356 623 2HD LYS 79 HD1 LYS 79 24.885 21.867 -28.925 624 1HE LYS 79 HE2 LYS 79 24.374 19.946 -30.031 625 2HE LYS 79 HE1 LYS 79 25.533 19.004 -29.074 626 1HZ LYS 79 HZ1 LYS 79 23.996 18.969 -27.241 627 2HZ LYS 79 HZ2 LYS 79 23.207 18.374 -28.622 628 3HZ LYS 79 HZ3 LYS 79 22.896 19.953 -28.077 629 H ILE 80 HN ILE 80 30.283 22.358 -25.079 630 HA ILE 80 HA ILE 80 30.969 24.596 -26.713 631 HB ILE 80 HB ILE 80 32.698 23.228 -24.627 632 1HG1 ILE 80 HG12 ILE 80 31.187 25.343 -23.479 633 2HG1 ILE 80 HG11 ILE 80 30.042 24.323 -24.350 634 1HG2 ILE 80 HG21 ILE 80 33.180 25.731 -24.149 635 2HG2 ILE 80 HG22 ILE 80 32.477 26.023 -25.741 636 3HG2 ILE 80 HG23 ILE 80 33.912 25.011 -25.583 637 1HD1 ILE 80 HD11 ILE 80 32.137 23.169 -22.503 638 2HD1 ILE 80 HD12 ILE 80 30.694 22.379 -23.139 639 3HD1 ILE 80 HD13 ILE 80 30.542 23.652 -21.927 640 H ASP 81 HN ASP 81 32.723 24.920 -28.153 641 HA ASP 81 HA ASP 81 33.628 22.726 -29.747 642 1HB ASP 81 HB2 ASP 81 34.329 25.615 -29.352 643 2HB ASP 81 HB1 ASP 81 35.413 24.622 -30.327 644 H ILE 82 HN ILE 82 34.988 24.240 -26.860 645 HA ILE 82 HA ILE 82 37.646 23.221 -26.971 646 HB ILE 82 HB ILE 82 36.070 24.814 -25.338 647 1HG1 ILE 82 HG12 ILE 82 38.238 24.875 -23.914 648 2HG1 ILE 82 HG11 ILE 82 38.869 23.729 -25.098 649 1HG2 ILE 82 HG21 ILE 82 36.993 22.461 -23.665 650 2HG2 ILE 82 HG22 ILE 82 35.314 22.750 -24.123 651 3HG2 ILE 82 HG23 ILE 82 36.160 23.907 -23.094 652 1HD1 ILE 82 HD11 ILE 82 37.852 26.533 -25.605 653 2HD1 ILE 82 HD12 ILE 82 38.133 25.370 -26.900 654 3HD1 ILE 82 HD13 ILE 82 39.476 25.907 -25.890 655 H VAL 83 HN VAL 83 38.460 21.511 -25.332 656 HA VAL 83 HA VAL 83 37.341 18.944 -25.939 657 HB VAL 83 HB VAL 83 39.269 19.933 -23.813 658 1HG1 VAL 83 HG11 VAL 83 39.999 17.493 -23.782 659 2HG1 VAL 83 HG12 VAL 83 38.502 17.121 -24.638 660 3HG1 VAL 83 HG13 VAL 83 38.443 17.823 -23.021 661 1HG2 VAL 83 HG21 VAL 83 39.817 20.157 -26.309 662 2HG2 VAL 83 HG22 VAL 83 39.839 18.393 -26.358 663 3HG2 VAL 83 HG23 VAL 83 40.985 19.261 -25.337 664 H ARG 84 HN ARG 84 35.449 18.139 -25.135 665 HA ARG 84 HA ARG 84 34.664 18.856 -22.325 666 1HB ARG 84 HB2 ARG 84 32.417 19.001 -23.078 667 2HB ARG 84 HB1 ARG 84 33.349 19.779 -24.355 668 1HG ARG 84 HG2 ARG 84 32.121 18.373 -25.688 669 2HG ARG 84 HG1 ARG 84 33.396 17.231 -25.265 670 1HD ARG 84 HD2 ARG 84 31.970 16.499 -23.296 671 2HD ARG 84 HD1 ARG 84 30.662 17.490 -23.967 672 HE ARG 84 HE ARG 84 30.486 15.968 -25.797 673 1HH1 ARG 84 HH21 ARG 84 31.369 14.044 -23.518 674 2HH1 ARG 84 HH22 ARG 84 32.546 13.095 -24.360 675 1HH2 ARG 84 HH11 ARG 84 32.820 15.309 -27.024 676 2HH2 ARG 84 HH12 ARG 84 33.371 13.812 -26.350 677 H MET 85 HN MET 85 33.476 17.145 -21.179 678 HA MET 85 HA MET 85 33.436 14.418 -22.303 679 1HB MET 85 HB2 MET 85 35.757 15.316 -21.137 680 2HB MET 85 HB1 MET 85 34.930 14.599 -19.753 681 1HG MET 85 HG2 MET 85 34.482 12.667 -21.587 682 2HG MET 85 HG1 MET 85 36.012 13.298 -22.195 683 1HE MET 85 HE1 MET 85 34.212 12.348 -18.779 684 2HE MET 85 HE2 MET 85 35.141 10.884 -18.465 685 3HE MET 85 HE3 MET 85 34.240 11.041 -19.970 686 H VAL 86 HN VAL 86 32.271 12.928 -20.828 687 HA VAL 86 HA VAL 86 30.849 14.293 -18.572 688 HB VAL 86 HB VAL 86 29.555 14.256 -20.749 689 1HG1 VAL 86 HG11 VAL 86 30.376 12.049 -21.535 690 2HG1 VAL 86 HG12 VAL 86 28.615 12.114 -21.488 691 3HG1 VAL 86 HG13 VAL 86 29.499 11.269 -20.218 692 1HG2 VAL 86 HG21 VAL 86 27.664 14.195 -19.507 693 2HG2 VAL 86 HG22 VAL 86 28.713 13.801 -18.148 694 3HG2 VAL 86 HG23 VAL 86 27.921 12.512 -19.052 695 H LEU 87 HN LEU 87 30.297 12.925 -16.841 696 HA LEU 87 HA LEU 87 30.592 11.112 -15.370 697 1HB LEU 87 HB2 LEU 87 30.082 9.773 -18.045 698 2HB LEU 87 HB1 LEU 87 30.077 8.901 -16.513 699 HG LEU 87 HG LEU 87 28.380 11.367 -16.882 700 1HD1 LEU 87 HD11 LEU 87 28.100 9.241 -18.569 701 2HD1 LEU 87 HD12 LEU 87 26.761 10.262 -18.044 702 3HD1 LEU 87 HD13 LEU 87 27.076 8.733 -17.224 703 1HD2 LEU 87 HD21 LEU 87 27.017 10.201 -15.146 704 2HD2 LEU 87 HD22 LEU 87 28.668 10.507 -14.606 705 3HD2 LEU 87 HD23 LEU 87 28.198 8.892 -15.132
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