![]() |
NMR Restraints Grid |
![]() |
Result table
(Save to zip file containing files for each block)
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
![]() |
609560 |
5knw ![]() ![]() |
30126 | cing | 1-original | 5 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 MET 437 HT1 MET 437 129.821 -1.585 -18.612 2 H2 MET 437 HT2 MET 437 130.508 -0.793 -17.253 3 H3 MET 437 HT3 MET 437 129.260 -0.032 -18.152 4 HA MET 437 HA MET 437 128.434 -0.900 -16.107 5 HB2 MET 437 HB2 MET 437 127.465 -1.316 -18.713 6 HB3 MET 437 HB3 MET 437 127.159 -2.819 -17.854 7 HG2 MET 437 HG2 MET 437 126.310 -1.022 -16.028 8 HG3 MET 437 HG3 MET 437 125.943 -0.169 -17.526 9 HE1 MET 437 HE1 MET 437 122.991 -0.440 -17.540 10 HE2 MET 437 HE2 MET 437 123.807 -0.340 -15.980 11 HE3 MET 437 HE3 MET 437 122.573 -1.570 -16.252 12 H HIS 438 H HIS 438 130.200 -1.973 -14.994 13 HA HIS 438 HA HIS 438 131.207 -4.480 -15.432 14 HB2 HIS 438 HB2 HIS 438 131.374 -4.615 -12.877 15 HB3 HIS 438 HB3 HIS 438 132.153 -3.248 -13.664 16 HD1 HIS 438 HD1 HIS 438 128.462 -3.448 -12.884 17 HD2 HIS 438 HD2 HIS 438 131.867 -1.424 -11.630 18 HE1 HIS 438 HE1 HIS 438 127.644 -1.671 -11.304 19 HE2 HIS 438 HE2 HIS 438 129.726 -0.489 -10.520 20 H HIS 439 H HIS 439 130.606 -6.569 -15.024 21 HA HIS 439 HA HIS 439 127.803 -7.119 -14.934 22 HB2 HIS 439 HB2 HIS 439 129.697 -9.340 -14.441 23 HB3 HIS 439 HB3 HIS 439 128.358 -9.231 -15.578 24 HD1 HIS 439 HD1 HIS 439 128.893 -7.774 -17.800 25 HD2 HIS 439 HD2 HIS 439 132.158 -9.030 -15.558 26 HE1 HIS 439 HE1 HIS 439 130.880 -7.563 -19.328 27 HE2 HIS 439 HE2 HIS 439 132.828 -8.423 -17.980 28 H HIS 440 H HIS 440 126.573 -7.297 -13.184 29 HA HIS 440 HA HIS 440 127.387 -6.931 -10.589 30 HB2 HIS 440 HB2 HIS 440 124.960 -7.792 -11.916 31 HB3 HIS 440 HB3 HIS 440 125.166 -8.623 -10.377 32 HD1 HIS 440 HD1 HIS 440 126.240 -6.478 -8.580 33 HD2 HIS 440 HD2 HIS 440 123.261 -5.756 -11.386 34 HE1 HIS 440 HE1 HIS 440 125.040 -4.422 -7.771 35 HE2 HIS 440 HE2 HIS 440 123.302 -3.950 -9.533 36 H HIS 441 H HIS 441 126.465 -10.100 -11.958 37 HA HIS 441 HA HIS 441 128.703 -11.422 -10.793 38 HB2 HIS 441 HB2 HIS 441 126.438 -11.083 -9.116 39 HB3 HIS 441 HB3 HIS 441 126.501 -12.781 -9.577 40 HD1 HIS 441 HD1 HIS 441 128.393 -10.166 -7.680 41 HD2 HIS 441 HD2 HIS 441 128.643 -14.228 -8.516 42 HE1 HIS 441 HE1 HIS 441 130.154 -11.065 -6.127 43 HE2 HIS 441 HE2 HIS 441 130.370 -13.500 -6.734 44 H HIS 442 H HIS 442 128.922 -13.560 -11.489 45 HA HIS 442 HA HIS 442 127.890 -14.196 -13.980 46 HB2 HIS 442 HB2 HIS 442 128.944 -16.308 -13.754 47 HB3 HIS 442 HB3 HIS 442 129.930 -15.183 -12.826 48 HD1 HIS 442 HD1 HIS 442 129.458 -15.240 -10.148 49 HD2 HIS 442 HD2 HIS 442 128.122 -18.494 -12.360 50 HE1 HIS 442 HE1 HIS 442 129.070 -17.077 -8.475 51 HE2 HIS 442 HE2 HIS 442 128.351 -19.064 -9.848 52 H HIS 443 H HIS 443 127.071 -16.891 -13.780 53 HA HIS 443 HA HIS 443 124.271 -16.513 -13.314 54 HB2 HIS 443 HB2 HIS 443 125.839 -19.005 -14.011 55 HB3 HIS 443 HB3 HIS 443 124.083 -18.888 -14.007 56 HD1 HIS 443 HD1 HIS 443 125.095 -19.712 -16.603 57 HD2 HIS 443 HD2 HIS 443 124.992 -15.695 -15.546 58 HE1 HIS 443 HE1 HIS 443 125.129 -18.445 -18.775 59 HE2 HIS 443 HE2 HIS 443 125.122 -16.015 -18.110 60 H SER 444 H SER 444 123.592 -16.371 -11.260 61 HA SER 444 HA SER 444 123.905 -18.669 -9.540 62 HB2 SER 444 HB2 SER 444 124.574 -16.995 -7.617 63 HB3 SER 444 HB3 SER 444 125.812 -17.686 -8.665 64 HG SER 444 HG SER 444 125.839 -15.784 -9.842 65 H ASN 445 H ASN 445 121.614 -18.007 -10.639 66 HA ASN 445 HA ASN 445 119.491 -17.161 -10.360 67 HB2 ASN 445 HB2 ASN 445 120.328 -18.629 -7.940 68 HB3 ASN 445 HB3 ASN 445 118.894 -17.624 -7.746 69 HD21 ASN 445 HD21 ASN 445 120.301 -20.002 -9.967 70 HD22 ASN 445 HD22 ASN 445 118.811 -20.794 -10.335 71 H ALA 446 H ALA 446 120.070 -14.934 -10.703 72 HA ALA 446 HA ALA 446 120.180 -13.315 -8.251 73 HB1 ALA 446 HB1 ALA 446 120.972 -11.483 -9.719 74 HB2 ALA 446 HB2 ALA 446 120.953 -12.606 -11.078 75 HB3 ALA 446 HB3 ALA 446 122.040 -12.886 -9.718 76 H THR 447 H THR 447 119.282 -10.924 -9.055 77 HA THR 447 HA THR 447 116.500 -11.453 -9.877 78 HB THR 447 HB THR 447 115.728 -9.734 -8.434 79 HG1 THR 447 HG1 THR 447 116.962 -8.137 -7.761 80 HG21 THR 447 HG21 THR 447 117.223 -10.420 -6.252 81 HG22 THR 447 HG22 THR 447 117.511 -11.780 -7.338 82 HG23 THR 447 HG23 THR 447 115.862 -11.349 -6.881 83 H GLY 448 H GLY 448 115.796 -8.684 -10.004 84 HA2 GLY 448 HA2 GLY 448 117.317 -7.901 -12.414 85 HA3 GLY 448 HA3 GLY 448 115.590 -7.636 -12.222 86 HA PRO 449 HA PRO 449 116.951 -3.566 -11.000 87 HB2 PRO 449 HB2 PRO 449 114.499 -2.481 -10.680 88 HB3 PRO 449 HB3 PRO 449 115.194 -2.794 -12.275 89 HG2 PRO 449 HG2 PRO 449 113.203 -4.407 -10.727 90 HG3 PRO 449 HG3 PRO 449 113.212 -3.997 -12.453 91 HD2 PRO 449 HD2 PRO 449 114.040 -6.406 -11.492 92 HD3 PRO 449 HD3 PRO 449 114.696 -5.675 -12.971 93 H GLN 450 H GLN 450 117.486 -2.768 -9.056 94 HA GLN 450 HA GLN 450 116.381 -4.025 -6.681 95 HB2 GLN 450 HB2 GLN 450 118.905 -3.067 -7.371 96 HB3 GLN 450 HB3 GLN 450 118.310 -1.909 -6.191 97 HG2 GLN 450 HG2 GLN 450 119.478 -3.522 -4.961 98 HG3 GLN 450 HG3 GLN 450 117.771 -3.885 -4.714 99 HE21 GLN 450 HE21 GLN 450 118.281 -6.016 -4.148 100 HE22 GLN 450 HE22 GLN 450 118.722 -7.190 -5.336 101 H PHE 451 H PHE 451 114.298 -2.826 -7.449 102 HA PHE 451 HA PHE 451 114.164 -0.038 -6.707 103 HB2 PHE 451 HB2 PHE 451 111.805 -0.202 -7.312 104 HB3 PHE 451 HB3 PHE 451 112.808 -0.926 -8.565 105 HD1 PHE 451 HD1 PHE 451 112.899 -3.372 -8.817 106 HD2 PHE 451 HD2 PHE 451 110.253 -1.499 -6.060 107 HE1 PHE 451 HE1 PHE 451 111.595 -5.452 -8.661 108 HE2 PHE 451 HE2 PHE 451 108.945 -3.575 -5.899 109 HZ PHE 451 HZ PHE 451 109.615 -5.556 -7.200 110 H VAL 452 H VAL 452 114.366 0.363 -4.570 111 HA VAL 452 HA VAL 452 113.922 -1.149 -2.394 112 HB VAL 452 HB VAL 452 112.979 1.036 -1.290 113 HG11 VAL 452 HG11 VAL 452 115.201 1.834 -0.977 114 HG12 VAL 452 HG12 VAL 452 115.744 1.092 -2.482 115 HG13 VAL 452 HG13 VAL 452 115.289 0.078 -1.113 116 HG21 VAL 452 HG21 VAL 452 114.213 2.312 -3.699 117 HG22 VAL 452 HG22 VAL 452 113.170 3.023 -2.467 118 HG23 VAL 452 HG23 VAL 452 112.492 1.928 -3.672 119 H SER 453 H SER 453 112.286 -2.616 -2.369 120 HA SER 453 HA SER 453 109.617 -2.008 -3.141 121 HB2 SER 453 HB2 SER 453 109.299 -4.231 -3.033 122 HB3 SER 453 HB3 SER 453 111.043 -4.315 -2.793 123 HG SER 453 HG SER 453 109.055 -4.231 -0.769 124 H GLY 454 H GLY 454 110.887 -0.492 -0.738 125 HA2 GLY 454 HA2 GLY 454 110.309 0.045 1.455 126 HA3 GLY 454 HA3 GLY 454 108.806 0.387 0.617 127 H VAL 455 H VAL 455 110.071 -2.858 1.053 128 HA VAL 455 HA VAL 455 108.985 -4.707 1.877 129 HB VAL 455 HB VAL 455 108.566 -3.269 4.441 130 HG11 VAL 455 HG11 VAL 455 109.604 -5.927 3.536 131 HG12 VAL 455 HG12 VAL 455 108.257 -5.565 4.615 132 HG13 VAL 455 HG13 VAL 455 109.916 -5.345 5.170 133 HG21 VAL 455 HG21 VAL 455 111.070 -3.202 2.916 134 HG22 VAL 455 HG22 VAL 455 111.236 -3.793 4.570 135 HG23 VAL 455 HG23 VAL 455 110.535 -2.203 4.268 136 H ILE 456 H ILE 456 107.029 -5.075 0.964 137 HA ILE 456 HA ILE 456 104.711 -3.493 1.659 138 HB ILE 456 HB ILE 456 104.944 -5.991 -0.025 139 HG12 ILE 456 HG12 ILE 456 106.014 -4.363 -1.276 140 HG13 ILE 456 HG13 ILE 456 104.350 -4.159 -1.812 141 HG21 ILE 456 HG21 ILE 456 102.631 -4.370 0.855 142 HG22 ILE 456 HG22 ILE 456 102.731 -6.086 0.460 143 HG23 ILE 456 HG23 ILE 456 102.649 -4.887 -0.831 144 HD11 ILE 456 HD11 ILE 456 104.201 -2.376 0.031 145 HD12 ILE 456 HD12 ILE 456 105.083 -1.993 -1.447 146 HD13 ILE 456 HD13 ILE 456 105.963 -2.432 0.017 147 H VAL 457 H VAL 457 103.329 -3.910 3.270 148 HA VAL 457 HA VAL 457 103.448 -6.563 4.545 149 HB VAL 457 HB VAL 457 102.840 -3.869 5.761 150 HG11 VAL 457 HG11 VAL 457 102.567 -5.175 7.894 151 HG12 VAL 457 HG12 VAL 457 102.462 -6.629 6.900 152 HG13 VAL 457 HG13 VAL 457 101.257 -5.352 6.727 153 HG21 VAL 457 HG21 VAL 457 104.717 -4.558 7.282 154 HG22 VAL 457 HG22 VAL 457 105.184 -4.258 5.607 155 HG23 VAL 457 HG23 VAL 457 105.009 -5.913 6.193 156 H LYS 458 H LYS 458 101.747 -7.733 3.825 157 HA LYS 458 HA LYS 458 99.263 -6.433 3.118 158 HB2 LYS 458 HB2 LYS 458 99.915 -8.223 1.691 159 HB3 LYS 458 HB3 LYS 458 100.164 -9.309 3.052 160 HG2 LYS 458 HG2 LYS 458 97.728 -9.190 3.517 161 HG3 LYS 458 HG3 LYS 458 97.537 -8.242 2.042 162 HD2 LYS 458 HD2 LYS 458 99.018 -10.461 1.258 163 HD3 LYS 458 HD3 LYS 458 97.817 -11.105 2.380 164 HE2 LYS 458 HE2 LYS 458 96.029 -10.371 1.080 165 HE3 LYS 458 HE3 LYS 458 97.020 -9.203 0.206 166 HZ1 LYS 458 HZ1 LYS 458 96.462 -11.907 -0.437 167 HZ2 LYS 458 HZ2 LYS 458 98.132 -11.675 -0.305 168 HZ3 LYS 458 HZ3 LYS 458 97.229 -10.724 -1.373 169 H ILE 459 H ILE 459 97.715 -6.005 4.514 170 HA ILE 459 HA ILE 459 97.467 -7.689 6.915 171 HB ILE 459 HB ILE 459 96.342 -4.913 6.751 172 HG12 ILE 459 HG12 ILE 459 99.177 -5.751 7.188 173 HG13 ILE 459 HG13 ILE 459 98.545 -4.317 6.386 174 HG21 ILE 459 HG21 ILE 459 96.208 -5.044 9.083 175 HG22 ILE 459 HG22 ILE 459 97.355 -6.381 9.164 176 HG23 ILE 459 HG23 ILE 459 95.730 -6.651 8.534 177 HD11 ILE 459 HD11 ILE 459 99.670 -3.709 8.427 178 HD12 ILE 459 HD12 ILE 459 98.644 -4.805 9.353 179 HD13 ILE 459 HD13 ILE 459 97.943 -3.385 8.576 180 H ILE 460 H ILE 460 95.687 -8.869 7.071 181 HA ILE 460 HA ILE 460 93.259 -7.951 5.692 182 HB ILE 460 HB ILE 460 94.365 -9.772 4.367 183 HG12 ILE 460 HG12 ILE 460 92.297 -11.047 4.018 184 HG13 ILE 460 HG13 ILE 460 91.662 -10.452 5.549 185 HG21 ILE 460 HG21 ILE 460 93.870 -11.276 6.908 186 HG22 ILE 460 HG22 ILE 460 95.327 -11.208 5.916 187 HG23 ILE 460 HG23 ILE 460 93.919 -12.108 5.354 188 HD11 ILE 460 HD11 ILE 460 91.071 -9.365 3.187 189 HD12 ILE 460 HD12 ILE 460 92.495 -8.408 3.595 190 HD13 ILE 460 HD13 ILE 460 91.113 -8.444 4.691 191 H SER 461 H SER 461 91.416 -8.133 6.820 192 HA SER 461 HA SER 461 91.522 -9.611 9.363 193 HB2 SER 461 HB2 SER 461 91.628 -7.263 9.902 194 HB3 SER 461 HB3 SER 461 90.288 -6.909 8.824 195 HG SER 461 HG SER 461 89.646 -7.026 11.025 196 H THR 462 H THR 462 88.896 -9.172 10.122 197 HA THR 462 HA THR 462 87.369 -10.463 7.953 198 HB THR 462 HB THR 462 86.258 -11.898 9.569 199 HG1 THR 462 HG1 THR 462 88.037 -10.805 11.511 200 HG21 THR 462 HG21 THR 462 87.999 -13.427 9.937 201 HG22 THR 462 HG22 THR 462 89.200 -12.149 10.116 202 HG23 THR 462 HG23 THR 462 88.515 -12.499 8.529 203 H GLU 463 H GLU 463 87.561 -7.852 9.999 204 HA GLU 463 HA GLU 463 85.297 -6.572 9.191 205 HB2 GLU 463 HB2 GLU 463 84.675 -8.648 11.130 206 HB3 GLU 463 HB3 GLU 463 84.158 -7.061 11.683 207 HG2 GLU 463 HG2 GLU 463 82.616 -6.825 10.021 208 HG3 GLU 463 HG3 GLU 463 83.500 -7.860 8.901 209 HA PRO 464 HA PRO 464 86.712 -5.007 13.783 210 HB2 PRO 464 HB2 PRO 464 89.382 -6.263 13.247 211 HB3 PRO 464 HB3 PRO 464 88.611 -5.887 14.793 212 HG2 PRO 464 HG2 PRO 464 88.594 -8.375 13.797 213 HG3 PRO 464 HG3 PRO 464 87.216 -7.725 14.701 214 HD2 PRO 464 HD2 PRO 464 87.463 -8.310 11.823 215 HD3 PRO 464 HD3 PRO 464 86.005 -8.145 12.819 216 H LEU 465 H LEU 465 88.638 -5.380 10.834 217 HA LEU 465 HA LEU 465 90.368 -3.329 10.856 218 HB2 LEU 465 HB2 LEU 465 89.069 -4.815 8.852 219 HB3 LEU 465 HB3 LEU 465 88.897 -3.132 8.389 220 HG LEU 465 HG LEU 465 91.611 -3.876 9.235 221 HD11 LEU 465 HD11 LEU 465 90.190 -5.496 7.282 222 HD12 LEU 465 HD12 LEU 465 91.749 -5.767 8.063 223 HD13 LEU 465 HD13 LEU 465 91.646 -4.747 6.627 224 HD21 LEU 465 HD21 LEU 465 91.591 -1.807 8.300 225 HD22 LEU 465 HD22 LEU 465 90.255 -2.186 7.213 226 HD23 LEU 465 HD23 LEU 465 91.883 -2.754 6.842 227 HA PRO 466 HA PRO 466 87.474 -0.017 12.013 228 HB2 PRO 466 HB2 PRO 466 89.442 1.641 12.909 229 HB3 PRO 466 HB3 PRO 466 88.739 0.347 13.886 230 HG2 PRO 466 HG2 PRO 466 91.291 0.359 12.316 231 HG3 PRO 466 HG3 PRO 466 90.986 -0.262 13.950 232 HD2 PRO 466 HD2 PRO 466 91.114 -1.884 11.806 233 HD3 PRO 466 HD3 PRO 466 90.016 -2.206 13.164 234 H GLY 467 H GLY 467 90.542 0.388 10.255 235 HA2 GLY 467 HA2 GLY 467 89.736 1.444 7.939 236 HA3 GLY 467 HA3 GLY 467 89.565 2.830 9.006 237 H ARG 468 H ARG 468 91.209 3.387 7.094 238 HA ARG 468 HA ARG 468 93.865 2.487 7.300 239 HB2 ARG 468 HB2 ARG 468 94.442 4.350 5.902 240 HB3 ARG 468 HB3 ARG 468 92.898 3.712 5.355 241 HG2 ARG 468 HG2 ARG 468 91.768 5.516 6.641 242 HG3 ARG 468 HG3 ARG 468 93.360 6.195 6.989 243 HD2 ARG 468 HD2 ARG 468 91.950 5.951 4.352 244 HD3 ARG 468 HD3 ARG 468 92.609 7.393 5.124 245 HE ARG 468 HE ARG 468 93.999 5.577 3.427 246 HH11 ARG 468 HH11 ARG 468 94.379 7.701 6.159 247 HH12 ARG 468 HH12 ARG 468 96.072 7.955 5.892 248 HH21 ARG 468 HH21 ARG 468 96.229 5.901 3.066 249 HH22 ARG 468 HH22 ARG 468 97.124 6.931 4.133 250 H LYS 469 H LYS 469 92.153 5.187 8.800 251 HA LYS 469 HA LYS 469 94.365 6.407 10.027 252 HB2 LYS 469 HB2 LYS 469 92.781 7.592 11.380 253 HB3 LYS 469 HB3 LYS 469 92.090 7.420 9.773 254 HG2 LYS 469 HG2 LYS 469 90.745 5.521 10.585 255 HG3 LYS 469 HG3 LYS 469 91.398 5.783 12.203 256 HD2 LYS 469 HD2 LYS 469 89.333 6.888 12.225 257 HD3 LYS 469 HD3 LYS 469 90.514 8.174 11.971 258 HE2 LYS 469 HE2 LYS 469 89.025 8.730 10.343 259 HE3 LYS 469 HE3 LYS 469 90.027 7.604 9.428 260 HZ1 LYS 469 HZ1 LYS 469 88.365 5.854 10.198 261 HZ2 LYS 469 HZ2 LYS 469 87.854 6.935 9.002 262 HZ3 LYS 469 HZ3 LYS 469 87.355 7.150 10.604 263 H GLN 470 H GLN 470 92.144 3.894 11.174 264 HA GLN 470 HA GLN 470 93.442 3.695 13.727 265 HB2 GLN 470 HB2 GLN 470 91.236 2.223 12.348 266 HB3 GLN 470 HB3 GLN 470 91.989 1.514 13.770 267 HG2 GLN 470 HG2 GLN 470 91.458 4.168 14.453 268 HG3 GLN 470 HG3 GLN 470 90.031 3.603 13.586 269 HE21 GLN 470 HE21 GLN 470 88.571 3.170 15.087 270 HE22 GLN 470 HE22 GLN 470 88.819 2.176 16.478 271 H VAL 471 H VAL 471 93.395 1.736 10.751 272 HA VAL 471 HA VAL 471 95.035 -0.339 11.718 273 HB VAL 471 HB VAL 471 94.662 0.662 8.890 274 HG11 VAL 471 HG11 VAL 471 95.653 -2.077 9.472 275 HG12 VAL 471 HG12 VAL 471 96.801 -0.743 9.550 276 HG13 VAL 471 HG13 VAL 471 95.915 -1.057 8.060 277 HG21 VAL 471 HG21 VAL 471 93.132 -1.072 10.658 278 HG22 VAL 471 HG22 VAL 471 93.515 -1.825 9.111 279 HG23 VAL 471 HG23 VAL 471 92.657 -0.288 9.153 280 H ARG 472 H ARG 472 95.778 2.687 10.041 281 HA ARG 472 HA ARG 472 98.563 2.307 9.841 282 HB2 ARG 472 HB2 ARG 472 98.693 4.570 9.215 283 HB3 ARG 472 HB3 ARG 472 97.102 4.058 8.667 284 HG2 ARG 472 HG2 ARG 472 96.050 5.127 10.540 285 HG3 ARG 472 HG3 ARG 472 97.618 5.515 11.249 286 HD2 ARG 472 HD2 ARG 472 97.158 6.461 8.490 287 HD3 ARG 472 HD3 ARG 472 96.195 7.233 9.750 288 HE ARG 472 HE ARG 472 98.799 7.223 10.666 289 HH11 ARG 472 HH11 ARG 472 97.059 8.533 7.949 290 HH12 ARG 472 HH12 ARG 472 98.099 9.908 7.780 291 HH21 ARG 472 HH21 ARG 472 100.175 9.027 10.453 292 HH22 ARG 472 HH22 ARG 472 99.873 10.188 9.204 293 H ASP 473 H ASP 473 96.541 3.876 12.299 294 HA ASP 473 HA ASP 473 98.628 4.776 13.955 295 HB2 ASP 473 HB2 ASP 473 95.944 5.092 13.988 296 HB3 ASP 473 HB3 ASP 473 96.120 3.894 15.267 297 H THR 474 H THR 474 96.916 1.722 13.731 298 HA THR 474 HA THR 474 97.922 0.492 16.055 299 HB THR 474 HB THR 474 97.640 -1.535 14.139 300 HG1 THR 474 HG1 THR 474 95.274 -0.463 13.668 301 HG21 THR 474 HG21 THR 474 95.375 -1.819 15.255 302 HG22 THR 474 HG22 THR 474 95.776 -0.383 16.199 303 HG23 THR 474 HG23 THR 474 96.784 -1.825 16.317 304 H LEU 475 H LEU 475 98.781 -0.706 12.851 305 HA LEU 475 HA LEU 475 101.127 -1.900 13.418 306 HB2 LEU 475 HB2 LEU 475 101.836 -1.358 11.067 307 HB3 LEU 475 HB3 LEU 475 100.251 -2.092 11.229 308 HG LEU 475 HG LEU 475 99.746 0.646 11.295 309 HD11 LEU 475 HD11 LEU 475 102.074 0.007 9.566 310 HD12 LEU 475 HD12 LEU 475 101.688 1.485 10.449 311 HD13 LEU 475 HD13 LEU 475 100.852 1.114 8.941 312 HD21 LEU 475 HD21 LEU 475 98.478 -1.241 10.216 313 HD22 LEU 475 HD22 LEU 475 99.605 -1.122 8.865 314 HD23 LEU 475 HD23 LEU 475 98.572 0.247 9.275 315 H ALA 476 H ALA 476 100.698 1.565 12.797 316 HA ALA 476 HA ALA 476 103.465 2.192 12.887 317 HB1 ALA 476 HB1 ALA 476 101.224 4.101 13.503 318 HB2 ALA 476 HB2 ALA 476 101.654 3.617 11.862 319 HB3 ALA 476 HB3 ALA 476 102.826 4.470 12.866 320 H ALA 477 H ALA 477 101.035 1.716 15.314 321 HA ALA 477 HA ALA 477 102.400 3.088 17.417 322 HB1 ALA 477 HB1 ALA 477 100.792 2.036 18.908 323 HB2 ALA 477 HB2 ALA 477 100.265 0.966 17.609 324 HB3 ALA 477 HB3 ALA 477 99.979 2.703 17.493 325 H ILE 478 H ILE 478 102.470 -0.131 16.090 326 HA ILE 478 HA ILE 478 103.981 -1.230 18.296 327 HB ILE 478 HB ILE 478 103.304 -2.383 15.590 328 HG12 ILE 478 HG12 ILE 478 102.263 -3.705 17.965 329 HG13 ILE 478 HG13 ILE 478 101.746 -2.024 17.871 330 HG21 ILE 478 HG21 ILE 478 104.308 -4.040 17.855 331 HG22 ILE 478 HG22 ILE 478 105.468 -3.173 16.850 332 HG23 ILE 478 HG23 ILE 478 104.373 -4.346 16.120 333 HD11 ILE 478 HD11 ILE 478 100.076 -3.204 16.778 334 HD12 ILE 478 HD12 ILE 478 101.226 -4.259 15.958 335 HD13 ILE 478 HD13 ILE 478 101.073 -2.571 15.468 336 H SER 479 H SER 479 104.596 0.146 15.152 337 HA SER 479 HA SER 479 107.337 0.609 15.739 338 HB2 SER 479 HB2 SER 479 106.929 -1.272 13.423 339 HB3 SER 479 HB3 SER 479 108.427 -0.861 14.257 340 HG SER 479 HG SER 479 108.044 -2.397 15.632 341 H GLU 480 H GLU 480 107.692 2.528 14.852 342 HA GLU 480 HA GLU 480 106.073 3.968 13.236 343 HB2 GLU 480 HB2 GLU 480 108.602 4.323 14.270 344 HB3 GLU 480 HB3 GLU 480 108.881 4.406 12.536 345 HG2 GLU 480 HG2 GLU 480 107.390 6.241 14.311 346 HG3 GLU 480 HG3 GLU 480 108.444 6.590 12.942 347 H VAL 481 H VAL 481 105.394 3.908 11.200 348 HA VAL 481 HA VAL 481 106.865 2.211 9.289 349 HB VAL 481 HB VAL 481 104.672 2.005 8.082 350 HG11 VAL 481 HG11 VAL 481 103.782 0.700 10.389 351 HG12 VAL 481 HG12 VAL 481 105.542 0.718 10.502 352 HG13 VAL 481 HG13 VAL 481 104.755 0.025 9.083 353 HG21 VAL 481 HG21 VAL 481 103.638 4.001 9.171 354 HG22 VAL 481 HG22 VAL 481 103.491 3.050 10.649 355 HG23 VAL 481 HG23 VAL 481 102.628 2.555 9.194 356 H LEU 482 H LEU 482 106.577 2.841 6.990 357 HA LEU 482 HA LEU 482 107.138 5.653 6.694 358 HB2 LEU 482 HB2 LEU 482 108.370 3.837 5.485 359 HB3 LEU 482 HB3 LEU 482 106.914 3.535 4.556 360 HG LEU 482 HG LEU 482 108.817 5.022 3.569 361 HD11 LEU 482 HD11 LEU 482 106.554 4.558 2.605 362 HD12 LEU 482 HD12 LEU 482 107.233 6.131 2.184 363 HD13 LEU 482 HD13 LEU 482 105.980 6.013 3.419 364 HD21 LEU 482 HD21 LEU 482 108.611 6.485 5.728 365 HD22 LEU 482 HD22 LEU 482 107.283 7.237 4.846 366 HD23 LEU 482 HD23 LEU 482 108.908 7.239 4.162 367 H TYR 483 H TYR 483 104.984 3.520 4.822 368 HA TYR 483 HA TYR 483 102.835 5.485 5.073 369 HB2 TYR 483 HB2 TYR 483 103.976 6.218 3.070 370 HB3 TYR 483 HB3 TYR 483 103.977 4.580 2.424 371 HD1 TYR 483 HD1 TYR 483 101.779 3.522 1.791 372 HD2 TYR 483 HD2 TYR 483 102.133 7.655 2.740 373 HE1 TYR 483 HE1 TYR 483 99.630 3.956 0.677 374 HE2 TYR 483 HE2 TYR 483 99.985 8.101 1.628 375 HH TYR 483 HH TYR 483 98.631 6.504 -0.464 376 H VAL 484 H VAL 484 100.793 4.626 4.930 377 HA VAL 484 HA VAL 484 100.663 1.702 4.598 378 HB VAL 484 HB VAL 484 100.096 2.394 6.863 379 HG11 VAL 484 HG11 VAL 484 97.605 3.654 6.562 380 HG12 VAL 484 HG12 VAL 484 98.720 4.504 5.492 381 HG13 VAL 484 HG13 VAL 484 99.092 4.345 7.209 382 HG21 VAL 484 HG21 VAL 484 98.820 0.567 5.504 383 HG22 VAL 484 HG22 VAL 484 97.465 1.687 5.641 384 HG23 VAL 484 HG23 VAL 484 98.236 1.054 7.095 385 H ASP 485 H ASP 485 99.704 1.045 2.791 386 HA ASP 485 HA ASP 485 97.791 2.833 1.468 387 HB2 ASP 485 HB2 ASP 485 99.604 2.193 0.035 388 HB3 ASP 485 HB3 ASP 485 99.398 0.492 0.441 389 H LEU 486 H LEU 486 95.963 2.355 2.709 390 HA LEU 486 HA LEU 486 95.025 -0.410 2.775 391 HB2 LEU 486 HB2 LEU 486 94.796 0.759 4.842 392 HB3 LEU 486 HB3 LEU 486 94.026 2.125 4.056 393 HG LEU 486 HG LEU 486 92.505 -0.268 3.567 394 HD11 LEU 486 HD11 LEU 486 92.156 0.249 6.386 395 HD12 LEU 486 HD12 LEU 486 93.774 -0.361 6.032 396 HD13 LEU 486 HD13 LEU 486 92.355 -1.282 5.534 397 HD21 LEU 486 HD21 LEU 486 91.991 2.339 3.693 398 HD22 LEU 486 HD22 LEU 486 91.532 1.899 5.338 399 HD23 LEU 486 HD23 LEU 486 90.751 1.115 3.964 400 H LEU 487 H LEU 487 93.473 -1.196 1.463 401 HA LEU 487 HA LEU 487 92.583 0.294 -0.767 402 HB2 LEU 487 HB2 LEU 487 92.002 -2.392 0.370 403 HB3 LEU 487 HB3 LEU 487 90.867 -1.740 -0.795 404 HG LEU 487 HG LEU 487 92.360 -3.085 -2.029 405 HD11 LEU 487 HD11 LEU 487 93.850 -0.715 -2.729 406 HD12 LEU 487 HD12 LEU 487 92.140 -0.353 -2.493 407 HD13 LEU 487 HD13 LEU 487 92.628 -1.591 -3.651 408 HD21 LEU 487 HD21 LEU 487 94.395 -1.917 -0.219 409 HD22 LEU 487 HD22 LEU 487 94.905 -2.320 -1.858 410 HD23 LEU 487 HD23 LEU 487 94.220 -3.567 -0.817 411 H GLU 488 H GLU 488 91.618 2.169 0.122 412 HA GLU 488 HA GLU 488 89.750 2.547 1.991 413 HB2 GLU 488 HB2 GLU 488 88.612 4.090 0.108 414 HB3 GLU 488 HB3 GLU 488 90.109 4.517 0.924 415 HG2 GLU 488 HG2 GLU 488 91.422 3.881 -0.900 416 HG3 GLU 488 HG3 GLU 488 90.107 2.965 -1.636 417 H GLY 489 H GLY 489 87.783 1.859 2.495 418 HA2 GLY 489 HA2 GLY 489 85.655 0.996 2.276 419 HA3 GLY 489 HA3 GLY 489 85.822 1.143 0.533 420 H ASP 490 H ASP 490 88.376 -0.558 1.976 421 HA ASP 490 HA ASP 490 87.068 -3.133 1.413 422 HB2 ASP 490 HB2 ASP 490 88.900 -2.098 -0.264 423 HB3 ASP 490 HB3 ASP 490 89.974 -2.920 0.864 424 H THR 491 H THR 491 88.336 -4.996 2.323 425 HA THR 491 HA THR 491 89.143 -4.318 5.061 426 HB THR 491 HB THR 491 88.875 -6.837 5.419 427 HG1 THR 491 HG1 THR 491 88.801 -7.273 3.071 428 HG21 THR 491 HG21 THR 491 86.236 -6.511 5.103 429 HG22 THR 491 HG22 THR 491 86.751 -4.830 4.960 430 HG23 THR 491 HG23 THR 491 87.147 -5.752 6.410 431 H GLU 492 H GLU 492 90.772 -4.467 2.375 432 HA GLU 492 HA GLU 492 92.993 -6.016 3.542 433 HB2 GLU 492 HB2 GLU 492 92.809 -5.637 0.586 434 HB3 GLU 492 HB3 GLU 492 93.562 -6.935 1.503 435 HG2 GLU 492 HG2 GLU 492 91.222 -7.649 2.149 436 HG3 GLU 492 HG3 GLU 492 90.648 -6.521 0.922 437 H CYS 493 H CYS 493 94.567 -4.711 4.172 438 HA CYS 493 HA CYS 493 95.181 -2.341 2.530 439 HB2 CYS 493 HB2 CYS 493 96.152 -1.543 4.873 440 HB3 CYS 493 HB3 CYS 493 94.470 -1.280 4.431 441 HG CYS 493 HG CYS 493 95.180 -2.566 6.877 442 H HIS 494 H HIS 494 97.348 -1.902 2.132 443 HA HIS 494 HA HIS 494 99.268 -3.907 3.121 444 HB2 HIS 494 HB2 HIS 494 99.139 -2.703 0.349 445 HB3 HIS 494 HB3 HIS 494 100.422 -3.759 0.933 446 HD1 HIS 494 HD1 HIS 494 96.631 -4.103 1.105 447 HD2 HIS 494 HD2 HIS 494 99.990 -6.158 -0.222 448 HE1 HIS 494 HE1 HIS 494 95.776 -6.307 0.251 449 HE2 HIS 494 HE2 HIS 494 97.815 -7.494 -0.635 450 H ALA 495 H ALA 495 100.375 -2.769 4.616 451 HA ALA 495 HA ALA 495 101.107 -0.014 4.116 452 HB1 ALA 495 HB1 ALA 495 101.662 0.154 6.355 453 HB2 ALA 495 HB2 ALA 495 102.024 -1.566 6.500 454 HB3 ALA 495 HB3 ALA 495 100.350 -1.026 6.371 455 H ARG 496 H ARG 496 103.033 0.733 3.539 456 HA ARG 496 HA ARG 496 105.144 -1.200 2.933 457 HB2 ARG 496 HB2 ARG 496 105.258 1.699 2.188 458 HB3 ARG 496 HB3 ARG 496 105.951 0.311 1.361 459 HG2 ARG 496 HG2 ARG 496 103.589 -0.394 0.822 460 HG3 ARG 496 HG3 ARG 496 103.079 1.191 1.408 461 HD2 ARG 496 HD2 ARG 496 105.154 1.774 -0.318 462 HD3 ARG 496 HD3 ARG 496 104.319 0.441 -1.116 463 HE ARG 496 HE ARG 496 102.321 2.143 -0.375 464 HH11 ARG 496 HH11 ARG 496 105.240 2.450 -2.248 465 HH12 ARG 496 HH12 ARG 496 104.609 3.697 -3.270 466 HH21 ARG 496 HH21 ARG 496 101.476 3.781 -1.715 467 HH22 ARG 496 HH22 ARG 496 102.466 4.455 -2.967 468 H PHE 497 H PHE 497 107.089 -1.192 3.922 469 HA PHE 497 HA PHE 497 107.530 0.807 6.044 470 HB2 PHE 497 HB2 PHE 497 108.471 -2.063 5.858 471 HB3 PHE 497 HB3 PHE 497 108.980 -0.934 7.108 472 HD1 PHE 497 HD1 PHE 497 108.019 -1.422 9.123 473 HD2 PHE 497 HD2 PHE 497 105.688 -1.830 5.586 474 HE1 PHE 497 HE1 PHE 497 106.072 -2.057 10.485 475 HE2 PHE 497 HE2 PHE 497 103.736 -2.464 6.941 476 HZ PHE 497 HZ PHE 497 103.926 -2.578 9.394 477 H LYS 498 H LYS 498 109.767 1.449 6.430 478 HA LYS 498 HA LYS 498 111.188 1.779 3.931 479 HB2 LYS 498 HB2 LYS 498 110.842 3.474 5.957 480 HB3 LYS 498 HB3 LYS 498 112.339 2.734 6.507 481 HG2 LYS 498 HG2 LYS 498 112.520 4.859 5.127 482 HG3 LYS 498 HG3 LYS 498 113.537 3.498 4.651 483 HD2 LYS 498 HD2 LYS 498 112.278 3.054 2.757 484 HD3 LYS 498 HD3 LYS 498 110.845 3.862 3.398 485 HE2 LYS 498 HE2 LYS 498 111.778 6.008 3.022 486 HE3 LYS 498 HE3 LYS 498 113.375 5.333 2.701 487 HZ1 LYS 498 HZ1 LYS 498 111.904 6.063 0.738 488 HZ2 LYS 498 HZ2 LYS 498 111.090 4.602 0.993 489 HZ3 LYS 498 HZ3 LYS 498 112.741 4.596 0.625 490 H THR 499 H THR 499 111.329 -0.302 6.650 491 HA THR 499 HA THR 499 113.843 -1.426 5.626 492 HB THR 499 HB THR 499 114.178 -2.068 8.179 493 HG1 THR 499 HG1 THR 499 113.641 0.163 9.221 494 HG21 THR 499 HG21 THR 499 115.109 0.102 6.482 495 HG22 THR 499 HG22 THR 499 116.016 -0.959 7.560 496 HG23 THR 499 HG23 THR 499 115.229 0.484 8.200 497 HA PRO 500 HA PRO 500 111.678 -5.261 5.756 498 HB2 PRO 500 HB2 PRO 500 113.733 -6.999 5.920 499 HB3 PRO 500 HB3 PRO 500 113.406 -6.058 4.459 500 HG2 PRO 500 HG2 PRO 500 115.415 -5.560 6.621 501 HG3 PRO 500 HG3 PRO 500 115.609 -5.432 4.863 502 HD2 PRO 500 HD2 PRO 500 115.189 -3.278 6.475 503 HD3 PRO 500 HD3 PRO 500 114.650 -3.344 4.785 504 H GLU 501 H GLU 501 114.189 -4.810 8.220 505 HA GLU 501 HA GLU 501 113.393 -6.879 9.938 506 HB2 GLU 501 HB2 GLU 501 114.809 -5.916 11.557 507 HB3 GLU 501 HB3 GLU 501 115.545 -5.517 10.012 508 HG2 GLU 501 HG2 GLU 501 115.072 -3.292 10.200 509 HG3 GLU 501 HG3 GLU 501 113.671 -3.561 11.234 510 H ASP 502 H ASP 502 112.256 -3.576 9.581 511 HA ASP 502 HA ASP 502 110.748 -3.418 11.953 512 HB2 ASP 502 HB2 ASP 502 111.393 -1.578 10.203 513 HB3 ASP 502 HB3 ASP 502 109.872 -2.035 9.441 514 H ALA 503 H ALA 503 109.939 -4.579 8.711 515 HA ALA 503 HA ALA 503 107.182 -4.990 9.206 516 HB1 ALA 503 HB1 ALA 503 109.095 -5.894 7.110 517 HB2 ALA 503 HB2 ALA 503 107.617 -4.946 6.955 518 HB3 ALA 503 HB3 ALA 503 107.524 -6.686 7.230 519 H GLN 504 H GLN 504 110.013 -7.108 9.429 520 HA GLN 504 HA GLN 504 108.634 -9.483 10.032 521 HB2 GLN 504 HB2 GLN 504 111.082 -9.214 9.376 522 HB3 GLN 504 HB3 GLN 504 111.383 -8.777 11.052 523 HG2 GLN 504 HG2 GLN 504 110.179 -11.025 11.567 524 HG3 GLN 504 HG3 GLN 504 110.583 -11.403 9.893 525 HE21 GLN 504 HE21 GLN 504 112.421 -12.427 9.626 526 HE22 GLN 504 HE22 GLN 504 113.799 -12.347 10.665 527 H ALA 505 H ALA 505 109.974 -6.951 12.102 528 HA ALA 505 HA ALA 505 109.399 -8.199 14.563 529 HB1 ALA 505 HB1 ALA 505 109.942 -5.358 13.782 530 HB2 ALA 505 HB2 ALA 505 110.958 -6.476 14.692 531 HB3 ALA 505 HB3 ALA 505 109.516 -5.786 15.439 532 H VAL 506 H VAL 506 107.524 -5.960 12.552 533 HA VAL 506 HA VAL 506 105.430 -5.575 14.426 534 HB VAL 506 HB VAL 506 105.334 -5.307 11.416 535 HG11 VAL 506 HG11 VAL 506 103.392 -3.952 11.721 536 HG12 VAL 506 HG12 VAL 506 103.555 -4.015 13.476 537 HG13 VAL 506 HG13 VAL 506 103.126 -5.471 12.577 538 HG21 VAL 506 HG21 VAL 506 105.408 -2.801 12.732 539 HG22 VAL 506 HG22 VAL 506 106.604 -3.501 11.640 540 HG23 VAL 506 HG23 VAL 506 106.724 -3.782 13.377 541 H ILE 507 H ILE 507 105.815 -7.791 11.685 542 HA ILE 507 HA ILE 507 103.237 -8.932 11.864 543 HB ILE 507 HB ILE 507 104.238 -10.863 10.598 544 HG12 ILE 507 HG12 ILE 507 106.549 -10.063 9.562 545 HG13 ILE 507 HG13 ILE 507 106.703 -9.266 11.121 546 HG21 ILE 507 HG21 ILE 507 103.188 -9.300 9.266 547 HG22 ILE 507 HG22 ILE 507 104.813 -9.337 8.582 548 HG23 ILE 507 HG23 ILE 507 104.342 -8.028 9.666 549 HD11 ILE 507 HD11 ILE 507 105.935 -12.126 11.100 550 HD12 ILE 507 HD12 ILE 507 106.917 -11.224 12.254 551 HD13 ILE 507 HD13 ILE 507 107.600 -11.706 10.701 552 H ASN 508 H ASN 508 106.278 -9.686 13.415 553 HA ASN 508 HA ASN 508 105.448 -12.182 14.520 554 HB2 ASN 508 HB2 ASN 508 107.709 -10.284 15.077 555 HB3 ASN 508 HB3 ASN 508 107.399 -11.634 16.165 556 HD21 ASN 508 HD21 ASN 508 109.152 -10.674 13.582 557 HD22 ASN 508 HD22 ASN 508 109.506 -12.210 12.875 558 H ALA 509 H ALA 509 105.463 -8.852 15.629 559 HA ALA 509 HA ALA 509 104.482 -9.449 18.252 560 HB1 ALA 509 HB1 ALA 509 104.073 -6.718 17.296 561 HB2 ALA 509 HB2 ALA 509 105.735 -7.294 17.159 562 HB3 ALA 509 HB3 ALA 509 104.922 -7.309 18.725 563 H TYR 510 H TYR 510 103.028 -8.961 15.178 564 HA TYR 510 HA TYR 510 100.549 -7.917 15.963 565 HB2 TYR 510 HB2 TYR 510 101.708 -8.962 13.554 566 HB3 TYR 510 HB3 TYR 510 100.063 -9.565 13.747 567 HD1 TYR 510 HD1 TYR 510 99.000 -8.314 12.013 568 HD2 TYR 510 HD2 TYR 510 101.309 -6.328 14.978 569 HE1 TYR 510 HE1 TYR 510 98.129 -6.153 11.228 570 HE2 TYR 510 HE2 TYR 510 100.444 -4.155 14.201 571 HH TYR 510 HH TYR 510 99.335 -3.108 12.519 572 H THR 511 H THR 511 101.815 -11.104 16.353 573 HA THR 511 HA THR 511 99.554 -12.683 16.281 574 HB THR 511 HB THR 511 100.611 -14.143 17.900 575 HG1 THR 511 HG1 THR 511 102.473 -13.454 19.042 576 HG21 THR 511 HG21 THR 511 102.597 -12.813 16.063 577 HG22 THR 511 HG22 THR 511 101.599 -14.225 15.717 578 HG23 THR 511 HG23 THR 511 102.894 -14.331 16.910 579 H GLU 512 H GLU 512 100.653 -10.422 18.708 580 HA GLU 512 HA GLU 512 98.778 -11.032 20.721 581 HB2 GLU 512 HB2 GLU 512 100.333 -8.520 20.113 582 HB3 GLU 512 HB3 GLU 512 99.306 -8.689 21.530 583 HG2 GLU 512 HG2 GLU 512 101.693 -10.397 20.864 584 HG3 GLU 512 HG3 GLU 512 101.636 -9.111 22.068 585 H ILE 513 H ILE 513 98.606 -9.015 17.876 586 HA ILE 513 HA ILE 513 96.555 -7.311 18.327 587 HB ILE 513 HB ILE 513 96.962 -9.026 15.878 588 HG12 ILE 513 HG12 ILE 513 98.816 -7.485 16.537 589 HG13 ILE 513 HG13 ILE 513 98.103 -7.101 14.974 590 HG21 ILE 513 HG21 ILE 513 95.626 -7.275 14.715 591 HG22 ILE 513 HG22 ILE 513 95.180 -6.635 16.295 592 HG23 ILE 513 HG23 ILE 513 94.696 -8.268 15.837 593 HD11 ILE 513 HD11 ILE 513 97.296 -5.120 15.680 594 HD12 ILE 513 HD12 ILE 513 98.614 -5.271 16.842 595 HD13 ILE 513 HD13 ILE 513 96.970 -5.707 17.310 596 H ASN 514 H ASN 514 96.238 -10.780 17.662 597 HA ASN 514 HA ASN 514 93.482 -10.958 17.453 598 HB2 ASN 514 HB2 ASN 514 94.943 -12.837 16.952 599 HB3 ASN 514 HB3 ASN 514 95.426 -12.947 18.642 600 HD21 ASN 514 HD21 ASN 514 92.211 -12.418 17.288 601 HD22 ASN 514 HD22 ASN 514 91.508 -13.858 17.933 602 H LYS 515 H LYS 515 95.447 -10.432 20.260 603 HA LYS 515 HA LYS 515 93.817 -11.333 22.306 604 HB2 LYS 515 HB2 LYS 515 95.010 -9.900 23.754 605 HB3 LYS 515 HB3 LYS 515 96.143 -10.320 22.477 606 HG2 LYS 515 HG2 LYS 515 96.441 -8.187 21.965 607 HG3 LYS 515 HG3 LYS 515 94.704 -7.941 21.769 608 HD2 LYS 515 HD2 LYS 515 94.639 -6.778 23.662 609 HD3 LYS 515 HD3 LYS 515 95.287 -8.158 24.550 610 HE2 LYS 515 HE2 LYS 515 97.574 -7.389 23.665 611 HE3 LYS 515 HE3 LYS 515 96.762 -5.871 23.286 612 HZ1 LYS 515 HZ1 LYS 515 96.690 -5.288 25.429 613 HZ2 LYS 515 HZ2 LYS 515 97.898 -6.451 25.651 614 HZ3 LYS 515 HZ3 LYS 515 96.282 -6.842 25.960 615 H LYS 516 H LYS 516 93.428 -8.580 20.228 616 HA LYS 516 HA LYS 516 91.047 -7.784 21.770 617 HB2 LYS 516 HB2 LYS 516 93.087 -6.162 21.385 618 HB3 LYS 516 HB3 LYS 516 92.342 -5.938 19.808 619 HG2 LYS 516 HG2 LYS 516 91.360 -4.242 20.969 620 HG3 LYS 516 HG3 LYS 516 90.182 -5.527 21.242 621 HD2 LYS 516 HD2 LYS 516 92.444 -4.927 23.138 622 HD3 LYS 516 HD3 LYS 516 90.842 -4.201 23.283 623 HE2 LYS 516 HE2 LYS 516 90.056 -6.707 23.152 624 HE3 LYS 516 HE3 LYS 516 91.701 -7.025 23.704 625 HZ1 LYS 516 HZ1 LYS 516 89.568 -6.399 25.282 626 HZ2 LYS 516 HZ2 LYS 516 90.429 -4.946 25.201 627 HZ3 LYS 516 HZ3 LYS 516 91.194 -6.352 25.747 628 H HIS 517 H HIS 517 92.374 -8.203 18.511 629 HA HIS 517 HA HIS 517 89.775 -9.025 17.553 630 HB2 HIS 517 HB2 HIS 517 90.969 -6.925 15.842 631 HB3 HIS 517 HB3 HIS 517 89.277 -7.288 16.169 632 HD1 HIS 517 HD1 HIS 517 88.181 -6.114 18.191 633 HD2 HIS 517 HD2 HIS 517 92.155 -5.067 17.572 634 HE1 HIS 517 HE1 HIS 517 88.578 -4.096 19.638 635 HE2 HIS 517 HE2 HIS 517 90.999 -3.499 19.274 636 H CYS 518 H CYS 518 90.011 -10.621 16.121 637 HA CYS 518 HA CYS 518 92.458 -11.736 15.459 638 HB2 CYS 518 HB2 CYS 518 89.675 -12.154 14.718 639 HB3 CYS 518 HB3 CYS 518 90.767 -12.499 13.381 640 HG CYS 518 HG CYS 518 91.970 -14.036 15.445 641 H TRP 519 H TRP 519 94.042 -11.020 14.191 642 HA TRP 519 HA TRP 519 93.331 -9.668 11.695 643 HB2 TRP 519 HB2 TRP 519 94.169 -8.199 13.824 644 HB3 TRP 519 HB3 TRP 519 95.700 -8.530 13.012 645 HD1 TRP 519 HD1 TRP 519 93.475 -8.525 10.267 646 HE1 TRP 519 HE1 TRP 519 93.248 -6.248 9.148 647 HE3 TRP 519 HE3 TRP 519 95.474 -5.609 13.965 648 HZ2 TRP 519 HZ2 TRP 519 93.857 -3.532 9.736 649 HZ3 TRP 519 HZ3 TRP 519 95.617 -3.184 13.602 650 HH2 TRP 519 HH2 TRP 519 94.824 -2.171 11.529 651 H LYS 520 H LYS 520 94.665 -9.983 10.009 652 HA LYS 520 HA LYS 520 96.756 -12.017 10.401 653 HB2 LYS 520 HB2 LYS 520 95.545 -11.382 7.757 654 HB3 LYS 520 HB3 LYS 520 96.207 -12.904 8.334 655 HG2 LYS 520 HG2 LYS 520 93.665 -11.697 9.396 656 HG3 LYS 520 HG3 LYS 520 93.713 -12.838 8.049 657 HD2 LYS 520 HD2 LYS 520 93.990 -14.588 9.416 658 HD3 LYS 520 HD3 LYS 520 95.240 -13.760 10.348 659 HE2 LYS 520 HE2 LYS 520 93.698 -12.809 11.804 660 HE3 LYS 520 HE3 LYS 520 92.358 -13.022 10.679 661 HZ1 LYS 520 HZ1 LYS 520 91.876 -14.912 11.694 662 HZ2 LYS 520 HZ2 LYS 520 93.194 -14.734 12.738 663 HZ3 LYS 520 HZ3 LYS 520 93.386 -15.547 11.268 664 H LEU 521 H LEU 521 98.802 -11.685 9.709 665 HA LEU 521 HA LEU 521 99.365 -9.274 8.125 666 HB2 LEU 521 HB2 LEU 521 99.897 -9.334 10.762 667 HB3 LEU 521 HB3 LEU 521 101.372 -10.057 10.154 668 HG LEU 521 HG LEU 521 101.850 -8.099 8.820 669 HD11 LEU 521 HD11 LEU 521 99.121 -7.230 9.708 670 HD12 LEU 521 HD12 LEU 521 99.772 -7.339 8.072 671 HD13 LEU 521 HD13 LEU 521 100.335 -6.072 9.163 672 HD21 LEU 521 HD21 LEU 521 101.418 -6.424 10.990 673 HD22 LEU 521 HD22 LEU 521 102.845 -7.417 10.689 674 HD23 LEU 521 HD23 LEU 521 101.535 -8.037 11.693 675 H GLU 522 H GLU 522 100.549 -9.693 6.379 676 HA GLU 522 HA GLU 522 102.422 -11.943 6.422 677 HB2 GLU 522 HB2 GLU 522 100.047 -12.418 5.359 678 HB3 GLU 522 HB3 GLU 522 100.744 -11.579 3.979 679 HG2 GLU 522 HG2 GLU 522 100.962 -14.043 3.881 680 HG3 GLU 522 HG3 GLU 522 102.500 -13.184 3.799 681 H ILE 523 H ILE 523 104.298 -11.529 5.429 682 HA ILE 523 HA ILE 523 104.635 -8.904 4.209 683 HB ILE 523 HB ILE 523 106.589 -10.976 5.184 684 HG12 ILE 523 HG12 ILE 523 106.280 -8.077 5.967 685 HG13 ILE 523 HG13 ILE 523 105.417 -9.383 6.773 686 HG21 ILE 523 HG21 ILE 523 107.924 -10.268 3.511 687 HG22 ILE 523 HG22 ILE 523 108.185 -8.893 4.585 688 HG23 ILE 523 HG23 ILE 523 107.015 -8.776 3.271 689 HD11 ILE 523 HD11 ILE 523 107.305 -8.908 8.093 690 HD12 ILE 523 HD12 ILE 523 108.375 -8.893 6.691 691 HD13 ILE 523 HD13 ILE 523 107.667 -10.411 7.244 692 H LEU 524 H LEU 524 104.559 -8.651 2.088 693 HA LEU 524 HA LEU 524 104.382 -10.791 0.259 694 HB2 LEU 524 HB2 LEU 524 104.509 -7.841 0.112 695 HB3 LEU 524 HB3 LEU 524 105.013 -8.701 -1.329 696 HG LEU 524 HG LEU 524 102.636 -8.050 -1.398 697 HD11 LEU 524 HD11 LEU 524 101.739 -10.350 -1.898 698 HD12 LEU 524 HD12 LEU 524 103.284 -10.986 -1.336 699 HD13 LEU 524 HD13 LEU 524 103.229 -9.912 -2.733 700 HD21 LEU 524 HD21 LEU 524 102.313 -9.977 0.898 701 HD22 LEU 524 HD22 LEU 524 101.025 -9.108 0.064 702 HD23 LEU 524 HD23 LEU 524 102.210 -8.221 1.024 703 H SER 525 H SER 525 105.864 -11.732 -1.072 704 HA SER 525 HA SER 525 108.593 -10.712 -1.130 705 HB2 SER 525 HB2 SER 525 109.572 -12.844 -0.466 706 HB3 SER 525 HB3 SER 525 108.502 -12.256 0.807 707 HG SER 525 HG SER 525 107.445 -14.046 0.602 708 H GLY 526 H GLY 526 109.967 -11.874 -2.694 709 HA2 GLY 526 HA2 GLY 526 110.337 -12.536 -4.857 710 HA3 GLY 526 HA3 GLY 526 109.095 -13.735 -4.539 711 H ASP 527 H ASP 527 108.285 -13.652 -6.623 712 HA ASP 527 HA ASP 527 107.657 -11.432 -8.126 713 HB2 ASP 527 HB2 ASP 527 106.839 -14.244 -8.074 714 HB3 ASP 527 HB3 ASP 527 105.620 -13.173 -8.758 715 H HIS 528 H HIS 528 105.929 -12.782 -5.398 716 HA HIS 528 HA HIS 528 103.463 -11.482 -5.823 717 HB2 HIS 528 HB2 HIS 528 104.532 -13.213 -3.902 718 HB3 HIS 528 HB3 HIS 528 104.098 -11.758 -3.011 719 HD1 HIS 528 HD1 HIS 528 102.374 -13.741 -2.040 720 HD2 HIS 528 HD2 HIS 528 101.588 -12.080 -5.767 721 HE1 HIS 528 HE1 HIS 528 99.952 -14.237 -2.500 722 HE2 HIS 528 HE2 HIS 528 99.488 -13.191 -4.745 723 H GLU 529 H GLU 529 106.327 -10.538 -3.931 724 HA GLU 529 HA GLU 529 105.239 -8.072 -3.039 725 HB2 GLU 529 HB2 GLU 529 107.027 -8.813 -1.745 726 HB3 GLU 529 HB3 GLU 529 107.993 -9.248 -3.148 727 HG2 GLU 529 HG2 GLU 529 108.267 -6.838 -3.645 728 HG3 GLU 529 HG3 GLU 529 107.413 -6.471 -2.146 729 H GLN 530 H GLN 530 107.388 -8.939 -5.711 730 HA GLN 530 HA GLN 530 107.787 -6.320 -6.673 731 HB2 GLN 530 HB2 GLN 530 108.910 -7.286 -8.434 732 HB3 GLN 530 HB3 GLN 530 108.978 -8.590 -7.258 733 HG2 GLN 530 HG2 GLN 530 108.378 -9.667 -9.211 734 HG3 GLN 530 HG3 GLN 530 106.836 -9.441 -8.390 735 HE21 GLN 530 HE21 GLN 530 105.525 -9.396 -10.139 736 HE22 GLN 530 HE22 GLN 530 105.591 -8.186 -11.370 737 H ARG 531 H ARG 531 105.360 -8.771 -7.398 738 HA ARG 531 HA ARG 531 104.121 -7.542 -9.573 739 HB2 ARG 531 HB2 ARG 531 103.623 -9.832 -8.946 740 HB3 ARG 531 HB3 ARG 531 102.937 -9.300 -7.417 741 HG2 ARG 531 HG2 ARG 531 101.677 -8.038 -9.713 742 HG3 ARG 531 HG3 ARG 531 101.551 -9.797 -9.737 743 HD2 ARG 531 HD2 ARG 531 100.531 -9.817 -7.569 744 HD3 ARG 531 HD3 ARG 531 100.838 -8.095 -7.356 745 HE ARG 531 HE ARG 531 99.065 -7.612 -8.786 746 HH11 ARG 531 HH11 ARG 531 99.586 -11.056 -8.559 747 HH12 ARG 531 HH12 ARG 531 98.062 -11.459 -9.274 748 HH21 ARG 531 HH21 ARG 531 97.065 -8.142 -9.732 749 HH22 ARG 531 HH22 ARG 531 96.631 -9.805 -9.942 750 H TYR 532 H TYR 532 103.237 -7.359 -6.118 751 HA TYR 532 HA TYR 532 101.137 -5.544 -6.388 752 HB2 TYR 532 HB2 TYR 532 101.504 -6.738 -4.313 753 HB3 TYR 532 HB3 TYR 532 103.061 -5.948 -4.091 754 HD1 TYR 532 HD1 TYR 532 103.116 -3.484 -3.639 755 HD2 TYR 532 HD2 TYR 532 99.501 -5.719 -3.574 756 HE1 TYR 532 HE1 TYR 532 102.036 -1.682 -2.359 757 HE2 TYR 532 HE2 TYR 532 98.407 -3.925 -2.295 758 HH TYR 532 HH TYR 532 98.594 -1.776 -1.604 759 H TRP 533 H TRP 533 104.602 -4.976 -5.930 760 HA TRP 533 HA TRP 533 104.449 -2.177 -5.728 761 HB2 TRP 533 HB2 TRP 533 106.597 -4.147 -6.298 762 HB3 TRP 533 HB3 TRP 533 106.902 -2.473 -6.760 763 HD1 TRP 533 HD1 TRP 533 107.145 -4.734 -3.866 764 HE1 TRP 533 HE1 TRP 533 107.549 -3.407 -1.701 765 HE3 TRP 533 HE3 TRP 533 106.087 -0.037 -5.580 766 HZ2 TRP 533 HZ2 TRP 533 107.433 -0.720 -0.830 767 HZ3 TRP 533 HZ3 TRP 533 106.256 1.856 -4.019 768 HH2 TRP 533 HH2 TRP 533 106.916 1.520 -1.692 769 H GLN 534 H GLN 534 104.791 -4.333 -8.513 770 HA GLN 534 HA GLN 534 105.263 -2.488 -10.512 771 HB2 GLN 534 HB2 GLN 534 103.760 -5.080 -10.432 772 HB3 GLN 534 HB3 GLN 534 103.711 -4.103 -11.894 773 HG2 GLN 534 HG2 GLN 534 106.411 -4.279 -11.072 774 HG3 GLN 534 HG3 GLN 534 105.723 -5.902 -11.019 775 HE21 GLN 534 HE21 GLN 534 107.731 -4.936 -12.809 776 HE22 GLN 534 HE22 GLN 534 107.098 -5.074 -14.410 777 H LYS 535 H LYS 535 102.235 -3.411 -8.964 778 HA LYS 535 HA LYS 535 100.517 -1.820 -10.532 779 HB2 LYS 535 HB2 LYS 535 99.193 -3.215 -9.343 780 HB3 LYS 535 HB3 LYS 535 100.356 -3.356 -8.034 781 HG2 LYS 535 HG2 LYS 535 98.693 -0.886 -8.354 782 HG3 LYS 535 HG3 LYS 535 98.057 -2.320 -7.545 783 HD2 LYS 535 HD2 LYS 535 100.708 -1.657 -6.598 784 HD3 LYS 535 HD3 LYS 535 99.598 -0.299 -6.406 785 HE2 LYS 535 HE2 LYS 535 99.155 -3.113 -5.415 786 HE3 LYS 535 HE3 LYS 535 99.599 -1.724 -4.425 787 HZ1 LYS 535 HZ1 LYS 535 97.195 -1.498 -6.070 788 HZ2 LYS 535 HZ2 LYS 535 97.519 -0.861 -4.537 789 HZ3 LYS 535 HZ3 LYS 535 97.111 -2.493 -4.703 790 H ILE 536 H ILE 536 102.356 -1.190 -7.569 791 HA ILE 536 HA ILE 536 101.281 1.345 -6.996 792 HB ILE 536 HB ILE 536 103.999 0.184 -6.380 793 HG12 ILE 536 HG12 ILE 536 101.527 0.608 -4.683 794 HG13 ILE 536 HG13 ILE 536 102.112 -0.939 -5.288 795 HG21 ILE 536 HG21 ILE 536 102.771 2.787 -5.492 796 HG22 ILE 536 HG22 ILE 536 104.276 2.552 -6.380 797 HG23 ILE 536 HG23 ILE 536 104.155 2.034 -4.699 798 HD11 ILE 536 HD11 ILE 536 104.168 0.434 -3.806 799 HD12 ILE 536 HD12 ILE 536 103.480 -1.170 -3.559 800 HD13 ILE 536 HD13 ILE 536 102.702 0.242 -2.845 801 H LEU 537 H LEU 537 104.338 0.513 -8.648 802 HA LEU 537 HA LEU 537 105.150 3.047 -9.346 803 HB2 LEU 537 HB2 LEU 537 105.616 0.336 -10.395 804 HB3 LEU 537 HB3 LEU 537 105.923 1.631 -11.538 805 HG LEU 537 HG LEU 537 107.198 2.484 -9.224 806 HD11 LEU 537 HD11 LEU 537 107.814 0.754 -7.990 807 HD12 LEU 537 HD12 LEU 537 108.550 -0.013 -9.398 808 HD13 LEU 537 HD13 LEU 537 106.854 -0.312 -9.016 809 HD21 LEU 537 HD21 LEU 537 107.796 1.923 -11.906 810 HD22 LEU 537 HD22 LEU 537 109.005 1.071 -10.945 811 HD23 LEU 537 HD23 LEU 537 108.782 2.808 -10.742 812 H VAL 538 H VAL 538 103.008 0.889 -11.200 813 HA VAL 538 HA VAL 538 102.604 2.538 -13.408 814 HB VAL 538 HB VAL 538 100.641 0.628 -12.126 815 HG11 VAL 538 HG11 VAL 538 100.297 0.934 -14.947 816 HG12 VAL 538 HG12 VAL 538 100.218 2.517 -14.173 817 HG13 VAL 538 HG13 VAL 538 99.139 1.224 -13.648 818 HG21 VAL 538 HG21 VAL 538 102.002 -0.082 -14.632 819 HG22 VAL 538 HG22 VAL 538 101.651 -1.066 -13.212 820 HG23 VAL 538 HG23 VAL 538 103.046 0.013 -13.214 821 H ASP 539 H ASP 539 101.016 2.492 -10.259 822 HA ASP 539 HA ASP 539 98.990 4.363 -10.854 823 HB2 ASP 539 HB2 ASP 539 98.930 2.901 -8.868 824 HB3 ASP 539 HB3 ASP 539 100.302 3.771 -8.190 825 H ARG 540 H ARG 540 102.318 4.690 -9.771 826 HA ARG 540 HA ARG 540 102.260 7.421 -9.110 827 HB2 ARG 540 HB2 ARG 540 104.157 5.421 -9.069 828 HB3 ARG 540 HB3 ARG 540 104.768 6.502 -10.313 829 HG2 ARG 540 HG2 ARG 540 105.631 6.955 -8.022 830 HG3 ARG 540 HG3 ARG 540 104.845 8.334 -8.794 831 HD2 ARG 540 HD2 ARG 540 103.174 8.385 -7.287 832 HD3 ARG 540 HD3 ARG 540 103.064 6.628 -7.201 833 HE ARG 540 HE ARG 540 105.386 7.780 -5.919 834 HH11 ARG 540 HH11 ARG 540 102.097 6.698 -5.562 835 HH12 ARG 540 HH12 ARG 540 102.220 6.470 -3.850 836 HH21 ARG 540 HH21 ARG 540 105.560 7.484 -3.663 837 HH22 ARG 540 HH22 ARG 540 104.189 6.917 -2.770 838 H GLN 541 H GLN 541 102.903 5.747 -12.168 839 HA GLN 541 HA GLN 541 103.601 8.040 -13.656 840 HB2 GLN 541 HB2 GLN 541 102.646 5.291 -14.347 841 HB3 GLN 541 HB3 GLN 541 102.675 6.519 -15.604 842 HG2 GLN 541 HG2 GLN 541 104.811 6.079 -15.931 843 HG3 GLN 541 HG3 GLN 541 105.155 6.675 -14.308 844 HE21 GLN 541 HE21 GLN 541 106.023 5.304 -12.922 845 HE22 GLN 541 HE22 GLN 541 106.054 3.585 -13.084 846 H ALA 542 H ALA 542 100.512 6.408 -13.108 847 HA ALA 542 HA ALA 542 98.958 8.041 -14.796 848 HB1 ALA 542 HB1 ALA 542 97.442 7.089 -12.540 849 HB2 ALA 542 HB2 ALA 542 98.494 5.821 -13.171 850 HB3 ALA 542 HB3 ALA 542 97.342 6.624 -14.238 851 H LYS 543 H LYS 543 100.134 8.441 -11.552 852 HA LYS 543 HA LYS 543 98.376 10.380 -10.596 853 HB2 LYS 543 HB2 LYS 543 100.762 9.181 -9.733 854 HB3 LYS 543 HB3 LYS 543 101.080 10.911 -9.731 855 HG2 LYS 543 HG2 LYS 543 99.894 11.195 -7.882 856 HG3 LYS 543 HG3 LYS 543 98.504 10.357 -8.576 857 HD2 LYS 543 HD2 LYS 543 100.823 8.734 -7.655 858 HD3 LYS 543 HD3 LYS 543 99.751 9.431 -6.439 859 HE2 LYS 543 HE2 LYS 543 98.428 8.085 -8.704 860 HE3 LYS 543 HE3 LYS 543 99.342 7.039 -7.619 861 HZ1 LYS 543 HZ1 LYS 543 97.121 7.164 -6.825 862 HZ2 LYS 543 HZ2 LYS 543 97.109 8.854 -6.898 863 HZ3 LYS 543 HZ3 LYS 543 98.078 8.065 -5.758 864 H LEU 544 H LEU 544 100.637 10.584 -13.127 865 HA LEU 544 HA LEU 544 101.722 13.026 -13.205 866 HB2 LEU 544 HB2 LEU 544 101.858 11.564 -15.106 867 HB3 LEU 544 HB3 LEU 544 100.135 11.703 -15.400 868 HG LEU 544 HG LEU 544 101.275 14.321 -15.473 869 HD11 LEU 544 HD11 LEU 544 102.604 12.384 -17.358 870 HD12 LEU 544 HD12 LEU 544 103.383 13.093 -15.944 871 HD13 LEU 544 HD13 LEU 544 102.848 14.128 -17.268 872 HD21 LEU 544 HD21 LEU 544 99.475 14.265 -16.804 873 HD22 LEU 544 HD22 LEU 544 99.632 12.534 -17.105 874 HD23 LEU 544 HD23 LEU 544 100.593 13.682 -18.037 875 H ASN 545 H ASN 545 98.292 12.350 -13.390 876 HA ASN 545 HA ASN 545 97.585 15.097 -13.944 877 HB2 ASN 545 HB2 ASN 545 96.140 12.523 -13.656 878 HB3 ASN 545 HB3 ASN 545 95.239 13.973 -13.223 879 HD21 ASN 545 HD21 ASN 545 97.702 13.491 -15.710 880 HD22 ASN 545 HD22 ASN 545 96.688 13.908 -17.045 881 H GLN 546 H GLN 546 97.967 16.513 -12.349 882 HA GLN 546 HA GLN 546 97.195 15.763 -9.612 883 HB2 GLN 546 HB2 GLN 546 99.233 17.736 -10.635 884 HB3 GLN 546 HB3 GLN 546 98.696 17.708 -8.960 885 HG2 GLN 546 HG2 GLN 546 99.825 15.278 -10.304 886 HG3 GLN 546 HG3 GLN 546 100.851 16.487 -9.533 887 HE21 GLN 546 HE21 GLN 546 101.098 14.075 -8.549 888 HE22 GLN 546 HE22 GLN 546 100.293 13.900 -7.030 889 HA PRO 547 HA PRO 547 93.878 18.662 -9.737 890 HB2 PRO 547 HB2 PRO 547 93.781 19.273 -7.064 891 HB3 PRO 547 HB3 PRO 547 93.110 17.795 -7.762 892 HG2 PRO 547 HG2 PRO 547 95.730 18.219 -6.380 893 HG3 PRO 547 HG3 PRO 547 94.588 16.870 -6.227 894 HD2 PRO 547 HD2 PRO 547 96.822 16.673 -7.713 895 HD3 PRO 547 HD3 PRO 547 95.311 15.873 -8.190 896 H ARG 548 H ARG 548 93.540 20.834 -8.060 897 HA ARG 548 HA ARG 548 94.170 22.995 -7.678 898 HB2 ARG 548 HB2 ARG 548 96.491 21.588 -7.243 899 HB3 ARG 548 HB3 ARG 548 96.978 22.736 -8.482 900 HG2 ARG 548 HG2 ARG 548 96.297 24.587 -7.110 901 HG3 ARG 548 HG3 ARG 548 95.628 23.491 -5.900 902 HD2 ARG 548 HD2 ARG 548 97.658 22.986 -5.042 903 HD3 ARG 548 HD3 ARG 548 98.457 23.062 -6.612 904 HE ARG 548 HE ARG 548 97.768 25.657 -5.966 905 HH11 ARG 548 HH11 ARG 548 99.758 23.137 -4.617 906 HH12 ARG 548 HH12 ARG 548 100.888 24.235 -3.898 907 HH21 ARG 548 HH21 ARG 548 99.247 27.112 -5.021 908 HH22 ARG 548 HH22 ARG 548 100.597 26.496 -4.127 909 H GLU 549 H GLU 549 95.472 24.857 -8.903 910 HA GLU 549 HA GLU 549 94.616 24.645 -11.691 911 HB2 GLU 549 HB2 GLU 549 95.567 27.254 -11.131 912 HB3 GLU 549 HB3 GLU 549 93.907 26.736 -11.386 913 HG2 GLU 549 HG2 GLU 549 93.756 26.200 -8.972 914 HG3 GLU 549 HG3 GLU 549 95.374 26.869 -8.763 915 H LYS 550 H LYS 550 96.040 24.251 -13.237 916 HA LYS 550 HA LYS 550 98.748 25.327 -13.026 917 HB2 LYS 550 HB2 LYS 550 98.177 22.632 -12.494 918 HB3 LYS 550 HB3 LYS 550 98.845 22.654 -14.121 919 HG2 LYS 550 HG2 LYS 550 100.524 22.317 -12.319 920 HG3 LYS 550 HG3 LYS 550 100.849 23.698 -13.368 921 HD2 LYS 550 HD2 LYS 550 100.429 25.222 -11.722 922 HD3 LYS 550 HD3 LYS 550 99.262 24.180 -10.905 923 HE2 LYS 550 HE2 LYS 550 102.112 23.333 -10.957 924 HE3 LYS 550 HE3 LYS 550 101.658 24.659 -9.887 925 HZ1 LYS 550 HZ1 LYS 550 101.281 21.898 -9.515 926 HZ2 LYS 550 HZ2 LYS 550 99.764 22.645 -9.567 927 HZ3 LYS 550 HZ3 LYS 550 100.924 23.165 -8.451 928 H LYS 551 H LYS 551 99.670 25.854 -14.965 929 HA LYS 551 HA LYS 551 99.846 26.303 -17.189 930 HB2 LYS 551 HB2 LYS 551 98.337 23.753 -17.151 931 HB3 LYS 551 HB3 LYS 551 98.248 24.685 -18.640 932 HG2 LYS 551 HG2 LYS 551 100.683 24.688 -18.791 933 HG3 LYS 551 HG3 LYS 551 100.778 23.765 -17.290 934 HD2 LYS 551 HD2 LYS 551 99.255 22.069 -18.520 935 HD3 LYS 551 HD3 LYS 551 99.787 22.902 -19.982 936 HE2 LYS 551 HE2 LYS 551 101.631 21.693 -17.924 937 HE3 LYS 551 HE3 LYS 551 101.150 20.904 -19.426 938 HZ1 LYS 551 HZ1 LYS 551 102.490 23.547 -19.355 939 HZ2 LYS 551 HZ2 LYS 551 102.257 22.539 -20.693 940 HZ3 LYS 551 HZ3 LYS 551 103.341 22.089 -19.475 941 H ARG 552 H ARG 552 98.378 26.816 -19.197 942 HA ARG 552 HA ARG 552 95.792 27.897 -18.361 943 HB2 ARG 552 HB2 ARG 552 96.510 30.004 -19.757 944 HB3 ARG 552 HB3 ARG 552 96.953 29.865 -18.061 945 HG2 ARG 552 HG2 ARG 552 99.171 29.097 -18.677 946 HG3 ARG 552 HG3 ARG 552 98.733 29.160 -20.386 947 HD2 ARG 552 HD2 ARG 552 99.287 31.307 -20.470 948 HD3 ARG 552 HD3 ARG 552 98.125 31.674 -19.196 949 HE ARG 552 HE ARG 552 99.866 31.868 -17.736 950 HH11 ARG 552 HH11 ARG 552 100.932 30.054 -20.510 951 HH12 ARG 552 HH12 ARG 552 102.585 29.993 -19.997 952 HH21 ARG 552 HH21 ARG 552 102.039 31.791 -17.048 953 HH22 ARG 552 HH22 ARG 552 103.215 30.981 -18.028 954 H GLY 553 H GLY 553 94.256 27.632 -19.868 955 HA2 GLY 553 HA2 GLY 553 93.962 27.959 -22.413 956 HA3 GLY 553 HA3 GLY 553 95.122 26.642 -22.500 957 H THR 554 H THR 554 93.704 25.251 -23.546 958 HA THR 554 HA THR 554 91.157 24.610 -22.316 959 HB THR 554 HB THR 554 90.595 23.522 -24.251 960 HG1 THR 554 HG1 THR 554 93.119 23.030 -25.291 961 HG21 THR 554 HG21 THR 554 91.468 25.882 -24.722 962 HG22 THR 554 HG22 THR 554 91.271 24.799 -26.100 963 HG23 THR 554 HG23 THR 554 92.875 25.085 -25.425 964 H GLU 555 H GLU 555 90.624 22.174 -22.201 965 HA GLU 555 HA GLU 555 92.460 21.007 -20.320 966 HB2 GLU 555 HB2 GLU 555 90.154 20.747 -19.812 967 HB3 GLU 555 HB3 GLU 555 89.793 20.140 -21.422 968 HG2 GLU 555 HG2 GLU 555 91.747 18.550 -19.925 969 HG3 GLU 555 HG3 GLU 555 90.132 18.597 -19.221 970 H LYS 556 H LYS 556 94.296 20.648 -21.670 971 HA LYS 556 HA LYS 556 94.318 18.035 -22.841 972 HB2 LYS 556 HB2 LYS 556 94.612 20.459 -24.613 973 HB3 LYS 556 HB3 LYS 556 95.202 18.866 -25.067 974 HG2 LYS 556 HG2 LYS 556 92.848 18.029 -24.727 975 HG3 LYS 556 HG3 LYS 556 92.361 19.720 -24.601 976 HD2 LYS 556 HD2 LYS 556 93.662 19.959 -26.856 977 HD3 LYS 556 HD3 LYS 556 93.410 18.216 -26.960 978 HE2 LYS 556 HE2 LYS 556 91.539 18.991 -28.042 979 HE3 LYS 556 HE3 LYS 556 90.934 18.845 -26.393 980 HZ1 LYS 556 HZ1 LYS 556 91.524 21.254 -26.130 981 HZ2 LYS 556 HZ2 LYS 556 90.245 20.937 -27.190 982 HZ3 LYS 556 HZ3 LYS 556 91.777 21.311 -27.802 983 H LEU 557 H LEU 557 96.216 17.163 -22.348 984 HA LEU 557 HA LEU 557 98.605 18.863 -22.299 985 HB2 LEU 557 HB2 LEU 557 99.335 17.971 -20.193 986 HB3 LEU 557 HB3 LEU 557 97.735 18.661 -19.992 987 HG LEU 557 HG LEU 557 97.360 15.927 -20.602 988 HD11 LEU 557 HD11 LEU 557 98.595 15.131 -18.427 989 HD12 LEU 557 HD12 LEU 557 99.686 16.459 -18.824 990 HD13 LEU 557 HD13 LEU 557 99.423 15.156 -19.984 991 HD21 LEU 557 HD21 LEU 557 96.716 17.863 -18.543 992 HD22 LEU 557 HD22 LEU 557 96.955 16.245 -17.883 993 HD23 LEU 557 HD23 LEU 557 95.767 16.510 -19.159 994 H ILE 558 H ILE 558 100.535 17.815 -22.784 995 HA ILE 558 HA ILE 558 100.390 14.957 -23.419 996 HB ILE 558 HB ILE 558 101.737 15.464 -25.525 997 HG12 ILE 558 HG12 ILE 558 101.896 17.969 -24.672 998 HG13 ILE 558 HG13 ILE 558 101.852 17.591 -26.391 999 HG21 ILE 558 HG21 ILE 558 99.630 16.025 -26.816 1000 HG22 ILE 558 HG22 ILE 558 98.819 16.127 -25.253 1001 HG23 ILE 558 HG23 ILE 558 99.556 14.609 -25.767 1002 HD11 ILE 558 HD11 ILE 558 100.388 19.436 -25.918 1003 HD12 ILE 558 HD12 ILE 558 99.538 18.494 -24.693 1004 HD13 ILE 558 HD13 ILE 558 99.430 18.034 -26.392 1005 H THR 559 H THR 559 101.650 14.872 -21.428 1006 HA THR 559 HA THR 559 103.591 14.706 -20.245 1007 HB THR 559 HB THR 559 105.676 14.293 -21.693 1008 HG1 THR 559 HG1 THR 559 104.951 15.217 -23.639 1009 HG21 THR 559 HG21 THR 559 103.686 12.644 -20.830 1010 HG22 THR 559 HG22 THR 559 105.177 12.105 -21.601 1011 HG23 THR 559 HG23 THR 559 103.710 12.300 -22.560 1012 H LYS 560 H LYS 560 102.690 17.410 -21.254 1013 HA LYS 560 HA LYS 560 103.378 19.572 -21.093 1014 HB2 LYS 560 HB2 LYS 560 106.007 18.933 -19.915 1015 HB3 LYS 560 HB3 LYS 560 104.764 20.047 -19.362 1016 HG2 LYS 560 HG2 LYS 560 103.580 17.624 -18.944 1017 HG3 LYS 560 HG3 LYS 560 105.278 17.275 -18.607 1018 HD2 LYS 560 HD2 LYS 560 103.877 19.659 -17.429 1019 HD3 LYS 560 HD3 LYS 560 103.827 18.072 -16.658 1020 HE2 LYS 560 HE2 LYS 560 106.334 18.074 -16.707 1021 HE3 LYS 560 HE3 LYS 560 106.259 19.749 -17.252 1022 HZ1 LYS 560 HZ1 LYS 560 106.494 19.944 -14.978 1023 HZ2 LYS 560 HZ2 LYS 560 105.498 18.620 -14.638 1024 HZ3 LYS 560 HZ3 LYS 560 104.817 20.076 -15.164 1025 H ALA 561 H ALA 561 103.592 19.654 -23.393 1026 HA ALA 561 HA ALA 561 106.077 20.636 -24.274 1027 HB1 ALA 561 HB1 ALA 561 106.224 17.953 -24.220 1028 HB2 ALA 561 HB2 ALA 561 107.086 18.953 -25.390 1029 HB3 ALA 561 HB3 ALA 561 105.561 18.188 -25.837 Start of MODEL 2 1 H1 MET 437 HT1 MET 437 113.523 0.103 -39.438 2 H2 MET 437 HT2 MET 437 115.098 -0.219 -38.835 3 H3 MET 437 HT3 MET 437 113.980 0.674 -37.888 4 HA MET 437 HA MET 437 114.029 -2.179 -38.522 5 HB2 MET 437 HB2 MET 437 114.718 -0.560 -36.333 6 HB3 MET 437 HB3 MET 437 113.206 -1.333 -35.879 7 HG2 MET 437 HG2 MET 437 114.257 -3.223 -35.438 8 HG3 MET 437 HG3 MET 437 114.928 -3.273 -37.067 9 HE1 MET 437 HE1 MET 437 115.588 -1.084 -33.691 10 HE2 MET 437 HE2 MET 437 116.989 -2.039 -33.205 11 HE3 MET 437 HE3 MET 437 115.423 -2.819 -33.422 12 H HIS 438 H HIS 438 112.119 -3.241 -37.190 13 HA HIS 438 HA HIS 438 109.643 -1.931 -38.097 14 HB2 HIS 438 HB2 HIS 438 110.167 -4.042 -39.271 15 HB3 HIS 438 HB3 HIS 438 110.171 -4.886 -37.726 16 HD1 HIS 438 HD1 HIS 438 108.190 -5.312 -40.247 17 HD2 HIS 438 HD2 HIS 438 107.329 -3.444 -36.638 18 HE1 HIS 438 HE1 HIS 438 105.692 -5.457 -39.995 19 HE2 HIS 438 HE2 HIS 438 105.186 -4.251 -37.842 20 H HIS 439 H HIS 439 110.422 -4.539 -35.794 21 HA HIS 439 HA HIS 439 108.335 -3.805 -34.016 22 HB2 HIS 439 HB2 HIS 439 110.743 -5.589 -33.602 23 HB3 HIS 439 HB3 HIS 439 109.402 -5.447 -32.471 24 HD1 HIS 439 HD1 HIS 439 107.258 -6.707 -33.022 25 HD2 HIS 439 HD2 HIS 439 110.135 -6.960 -36.009 26 HE1 HIS 439 HE1 HIS 439 106.432 -8.480 -34.603 27 HE2 HIS 439 HE2 HIS 439 108.135 -8.537 -36.458 28 H HIS 440 H HIS 440 108.398 -2.748 -32.049 29 HA HIS 440 HA HIS 440 110.840 -1.179 -31.547 30 HB2 HIS 440 HB2 HIS 440 109.504 0.609 -30.757 31 HB3 HIS 440 HB3 HIS 440 108.719 0.055 -32.232 32 HD1 HIS 440 HD1 HIS 440 107.577 1.441 -29.413 33 HD2 HIS 440 HD2 HIS 440 106.890 -2.344 -30.983 34 HE1 HIS 440 HE1 HIS 440 105.415 0.671 -28.387 35 HE2 HIS 440 HE2 HIS 440 105.018 -1.623 -29.351 36 H HIS 441 H HIS 441 109.720 -3.884 -30.507 37 HA HIS 441 HA HIS 441 109.311 -3.455 -27.708 38 HB2 HIS 441 HB2 HIS 441 109.033 -5.616 -29.515 39 HB3 HIS 441 HB3 HIS 441 110.167 -6.137 -28.273 40 HD1 HIS 441 HD1 HIS 441 106.811 -6.507 -28.911 41 HD2 HIS 441 HD2 HIS 441 108.863 -5.098 -25.584 42 HE1 HIS 441 HE1 HIS 441 105.218 -6.761 -26.982 43 HE2 HIS 441 HE2 HIS 441 106.505 -5.964 -24.968 44 H HIS 442 H HIS 442 110.705 -4.252 -26.007 45 HA HIS 442 HA HIS 442 113.538 -4.488 -26.706 46 HB2 HIS 442 HB2 HIS 442 113.845 -2.964 -24.545 47 HB3 HIS 442 HB3 HIS 442 113.689 -2.270 -26.155 48 HD1 HIS 442 HD1 HIS 442 111.050 -1.655 -26.773 49 HD2 HIS 442 HD2 HIS 442 112.120 -1.889 -22.764 50 HE1 HIS 442 HE1 HIS 442 109.260 -0.403 -25.526 51 HE2 HIS 442 HE2 HIS 442 109.892 -0.615 -23.096 52 H HIS 443 H HIS 443 111.790 -6.531 -25.936 53 HA HIS 443 HA HIS 443 111.944 -8.392 -24.604 54 HB2 HIS 443 HB2 HIS 443 114.332 -7.206 -24.084 55 HB3 HIS 443 HB3 HIS 443 113.590 -7.151 -22.488 56 HD1 HIS 443 HD1 HIS 443 115.879 -8.855 -22.368 57 HD2 HIS 443 HD2 HIS 443 112.309 -10.311 -23.915 58 HE1 HIS 443 HE1 HIS 443 116.045 -11.358 -22.198 59 HE2 HIS 443 HE2 HIS 443 113.838 -12.215 -23.059 60 H SER 444 H SER 444 111.953 -5.396 -22.676 61 HA SER 444 HA SER 444 110.519 -4.603 -21.099 62 HB2 SER 444 HB2 SER 444 108.727 -4.990 -22.671 63 HB3 SER 444 HB3 SER 444 108.691 -6.709 -22.275 64 HG SER 444 HG SER 444 107.131 -5.952 -21.016 65 H ASN 445 H ASN 445 112.348 -6.948 -20.658 66 HA ASN 445 HA ASN 445 111.191 -7.767 -18.089 67 HB2 ASN 445 HB2 ASN 445 112.357 -9.558 -20.207 68 HB3 ASN 445 HB3 ASN 445 112.353 -10.035 -18.512 69 HD21 ASN 445 HD21 ASN 445 110.516 -10.771 -17.606 70 HD22 ASN 445 HD22 ASN 445 109.016 -10.937 -18.446 71 H ALA 446 H ALA 446 112.602 -6.022 -17.352 72 HA ALA 446 HA ALA 446 115.448 -6.329 -17.606 73 HB1 ALA 446 HB1 ALA 446 115.206 -4.527 -15.622 74 HB2 ALA 446 HB2 ALA 446 113.625 -4.360 -16.386 75 HB3 ALA 446 HB3 ALA 446 115.093 -4.119 -17.333 76 H THR 447 H THR 447 116.915 -6.719 -15.871 77 HA THR 447 HA THR 447 115.881 -7.800 -13.388 78 HB THR 447 HB THR 447 116.471 -9.993 -13.615 79 HG1 THR 447 HG1 THR 447 118.507 -9.012 -15.277 80 HG21 THR 447 HG21 THR 447 115.902 -9.077 -16.424 81 HG22 THR 447 HG22 THR 447 114.783 -9.788 -15.259 82 HG23 THR 447 HG23 THR 447 116.047 -10.779 -15.987 83 H GLY 448 H GLY 448 117.394 -7.836 -11.735 84 HA2 GLY 448 HA2 GLY 448 119.820 -7.900 -11.170 85 HA3 GLY 448 HA3 GLY 448 120.031 -6.697 -12.433 86 HA PRO 449 HA PRO 449 118.946 -3.189 -9.953 87 HB2 PRO 449 HB2 PRO 449 116.031 -3.268 -10.549 88 HB3 PRO 449 HB3 PRO 449 117.179 -1.936 -10.719 89 HG2 PRO 449 HG2 PRO 449 116.300 -3.258 -12.858 90 HG3 PRO 449 HG3 PRO 449 117.985 -2.714 -12.749 91 HD2 PRO 449 HD2 PRO 449 116.846 -5.453 -12.396 92 HD3 PRO 449 HD3 PRO 449 118.387 -4.954 -13.125 93 H GLN 450 H GLN 450 117.425 -2.354 -8.141 94 HA GLN 450 HA GLN 450 116.123 -4.487 -6.650 95 HB2 GLN 450 HB2 GLN 450 118.482 -4.602 -5.945 96 HB3 GLN 450 HB3 GLN 450 118.425 -2.904 -5.493 97 HG2 GLN 450 HG2 GLN 450 117.666 -3.430 -3.488 98 HG3 GLN 450 HG3 GLN 450 116.287 -4.267 -4.199 99 HE21 GLN 450 HE21 GLN 450 117.595 -6.323 -5.510 100 HE22 GLN 450 HE22 GLN 450 118.306 -7.377 -4.339 101 H PHE 451 H PHE 451 114.522 -2.801 -7.576 102 HA PHE 451 HA PHE 451 114.271 -0.239 -6.523 103 HB2 PHE 451 HB2 PHE 451 111.927 -0.357 -7.172 104 HB3 PHE 451 HB3 PHE 451 112.933 -1.100 -8.411 105 HD1 PHE 451 HD1 PHE 451 112.822 -3.458 -8.856 106 HD2 PHE 451 HD2 PHE 451 110.475 -1.710 -5.766 107 HE1 PHE 451 HE1 PHE 451 111.461 -5.505 -8.737 108 HE2 PHE 451 HE2 PHE 451 109.110 -3.753 -5.641 109 HZ PHE 451 HZ PHE 451 109.601 -5.656 -7.128 110 H VAL 452 H VAL 452 114.047 0.419 -4.500 111 HA VAL 452 HA VAL 452 113.731 -1.132 -2.259 112 HB VAL 452 HB VAL 452 114.436 1.134 -2.003 113 HG11 VAL 452 HG11 VAL 452 113.201 2.070 -3.914 114 HG12 VAL 452 HG12 VAL 452 113.017 3.049 -2.458 115 HG13 VAL 452 HG13 VAL 452 111.709 1.984 -2.976 116 HG21 VAL 452 HG21 VAL 452 111.934 1.646 -0.650 117 HG22 VAL 452 HG22 VAL 452 113.528 1.301 0.023 118 HG23 VAL 452 HG23 VAL 452 112.456 -0.024 -0.428 119 H SER 453 H SER 453 112.138 -2.663 -2.252 120 HA SER 453 HA SER 453 109.453 -2.138 -3.054 121 HB2 SER 453 HB2 SER 453 109.055 -4.378 -2.681 122 HB3 SER 453 HB3 SER 453 110.803 -4.392 -2.917 123 HG SER 453 HG SER 453 110.792 -5.338 -1.035 124 H GLY 454 H GLY 454 110.693 -0.582 -0.659 125 HA2 GLY 454 HA2 GLY 454 110.105 -0.031 1.523 126 HA3 GLY 454 HA3 GLY 454 108.588 0.262 0.689 127 H VAL 455 H VAL 455 109.933 -2.953 1.145 128 HA VAL 455 HA VAL 455 108.842 -4.810 1.986 129 HB VAL 455 HB VAL 455 108.364 -3.820 4.623 130 HG11 VAL 455 HG11 VAL 455 109.449 -6.018 3.450 131 HG12 VAL 455 HG12 VAL 455 109.549 -5.644 5.171 132 HG13 VAL 455 HG13 VAL 455 110.884 -5.222 4.098 133 HG21 VAL 455 HG21 VAL 455 110.651 -2.960 5.110 134 HG22 VAL 455 HG22 VAL 455 109.678 -1.880 4.115 135 HG23 VAL 455 HG23 VAL 455 110.938 -2.867 3.373 136 H ILE 456 H ILE 456 106.852 -4.996 1.018 137 HA ILE 456 HA ILE 456 104.598 -3.410 1.816 138 HB ILE 456 HB ILE 456 104.650 -5.930 0.155 139 HG12 ILE 456 HG12 ILE 456 105.975 -4.294 -0.963 140 HG13 ILE 456 HG13 ILE 456 104.397 -4.279 -1.746 141 HG21 ILE 456 HG21 ILE 456 102.520 -3.866 0.650 142 HG22 ILE 456 HG22 ILE 456 102.444 -5.601 0.953 143 HG23 ILE 456 HG23 ILE 456 102.472 -4.995 -0.703 144 HD11 ILE 456 HD11 ILE 456 104.745 -2.047 -1.530 145 HD12 ILE 456 HD12 ILE 456 105.704 -2.224 -0.060 146 HD13 ILE 456 HD13 ILE 456 103.947 -2.362 0.011 147 H VAL 457 H VAL 457 103.215 -3.782 3.426 148 HA VAL 457 HA VAL 457 103.232 -6.435 4.707 149 HB VAL 457 HB VAL 457 102.720 -3.717 5.912 150 HG11 VAL 457 HG11 VAL 457 101.368 -4.664 7.398 151 HG12 VAL 457 HG12 VAL 457 102.702 -5.697 7.913 152 HG13 VAL 457 HG13 VAL 457 101.600 -6.245 6.650 153 HG21 VAL 457 HG21 VAL 457 104.523 -4.836 7.512 154 HG22 VAL 457 HG22 VAL 457 104.982 -3.959 6.052 155 HG23 VAL 457 HG23 VAL 457 104.907 -5.720 6.034 156 H LYS 458 H LYS 458 101.550 -7.428 3.637 157 HA LYS 458 HA LYS 458 99.099 -6.048 3.083 158 HB2 LYS 458 HB2 LYS 458 99.917 -7.841 1.618 159 HB3 LYS 458 HB3 LYS 458 99.732 -8.999 2.929 160 HG2 LYS 458 HG2 LYS 458 97.338 -8.674 2.931 161 HG3 LYS 458 HG3 LYS 458 97.483 -7.418 1.701 162 HD2 LYS 458 HD2 LYS 458 97.640 -8.912 0.037 163 HD3 LYS 458 HD3 LYS 458 98.751 -9.938 0.946 164 HE2 LYS 458 HE2 LYS 458 96.608 -10.538 2.318 165 HE3 LYS 458 HE3 LYS 458 95.765 -9.960 0.881 166 HZ1 LYS 458 HZ1 LYS 458 96.019 -12.129 0.325 167 HZ2 LYS 458 HZ2 LYS 458 97.433 -12.332 1.230 168 HZ3 LYS 458 HZ3 LYS 458 97.496 -11.558 -0.272 169 H ILE 459 H ILE 459 97.511 -5.697 4.441 170 HA ILE 459 HA ILE 459 97.181 -7.486 6.757 171 HB ILE 459 HB ILE 459 96.194 -4.642 6.616 172 HG12 ILE 459 HG12 ILE 459 98.801 -5.746 7.653 173 HG13 ILE 459 HG13 ILE 459 98.554 -4.420 6.522 174 HG21 ILE 459 HG21 ILE 459 95.206 -6.426 8.198 175 HG22 ILE 459 HG22 ILE 459 95.664 -4.861 8.871 176 HG23 ILE 459 HG23 ILE 459 96.721 -6.257 9.084 177 HD11 ILE 459 HD11 ILE 459 98.501 -4.440 9.456 178 HD12 ILE 459 HD12 ILE 459 97.260 -3.458 8.675 179 HD13 ILE 459 HD13 ILE 459 98.964 -3.163 8.332 180 H ILE 460 H ILE 460 95.354 -8.616 6.845 181 HA ILE 460 HA ILE 460 93.009 -7.592 5.406 182 HB ILE 460 HB ILE 460 94.215 -9.434 4.108 183 HG12 ILE 460 HG12 ILE 460 91.768 -8.648 3.922 184 HG13 ILE 460 HG13 ILE 460 92.194 -10.199 3.205 185 HG21 ILE 460 HG21 ILE 460 93.263 -11.741 4.949 186 HG22 ILE 460 HG22 ILE 460 93.356 -10.945 6.518 187 HG23 ILE 460 HG23 ILE 460 94.805 -11.112 5.528 188 HD11 ILE 460 HD11 ILE 460 90.867 -11.340 4.595 189 HD12 ILE 460 HD12 ILE 460 90.080 -9.780 4.834 190 HD13 ILE 460 HD13 ILE 460 91.290 -10.344 5.987 191 H SER 461 H SER 461 91.097 -7.811 6.433 192 HA SER 461 HA SER 461 91.106 -9.341 8.956 193 HB2 SER 461 HB2 SER 461 90.410 -7.559 10.158 194 HB3 SER 461 HB3 SER 461 91.013 -6.599 8.809 195 HG SER 461 HG SER 461 88.924 -6.594 7.943 196 H THR 462 H THR 462 88.552 -9.123 9.719 197 HA THR 462 HA THR 462 86.905 -10.003 7.449 198 HB THR 462 HB THR 462 85.891 -11.671 9.202 199 HG1 THR 462 HG1 THR 462 87.709 -12.543 10.476 200 HG21 THR 462 HG21 THR 462 88.380 -12.879 8.410 201 HG22 THR 462 HG22 THR 462 87.731 -11.884 7.107 202 HG23 THR 462 HG23 THR 462 86.751 -13.174 7.803 203 H GLU 463 H GLU 463 87.201 -7.648 9.440 204 HA GLU 463 HA GLU 463 84.793 -6.511 9.394 205 HB2 GLU 463 HB2 GLU 463 84.745 -8.764 11.299 206 HB3 GLU 463 HB3 GLU 463 84.105 -7.251 11.927 207 HG2 GLU 463 HG2 GLU 463 83.168 -8.097 9.254 208 HG3 GLU 463 HG3 GLU 463 82.610 -9.033 10.640 209 HA PRO 464 HA PRO 464 87.175 -5.373 13.683 210 HB2 PRO 464 HB2 PRO 464 89.702 -6.464 12.496 211 HB3 PRO 464 HB3 PRO 464 89.242 -6.300 14.196 212 HG2 PRO 464 HG2 PRO 464 89.081 -8.659 12.979 213 HG3 PRO 464 HG3 PRO 464 87.833 -8.144 14.129 214 HD2 PRO 464 HD2 PRO 464 87.714 -8.333 11.170 215 HD3 PRO 464 HD3 PRO 464 86.415 -8.496 12.365 216 H LEU 465 H LEU 465 88.871 -5.460 10.533 217 HA LEU 465 HA LEU 465 90.336 -3.210 10.570 218 HB2 LEU 465 HB2 LEU 465 89.124 -4.779 8.539 219 HB3 LEU 465 HB3 LEU 465 88.871 -3.094 8.124 220 HG LEU 465 HG LEU 465 91.615 -3.819 8.953 221 HD11 LEU 465 HD11 LEU 465 90.236 -5.288 6.889 222 HD12 LEU 465 HD12 LEU 465 91.856 -5.521 7.549 223 HD13 LEU 465 HD13 LEU 465 91.596 -4.377 6.231 224 HD21 LEU 465 HD21 LEU 465 90.372 -2.103 6.817 225 HD22 LEU 465 HD22 LEU 465 92.112 -2.341 6.990 226 HD23 LEU 465 HD23 LEU 465 91.191 -1.576 8.287 227 HA PRO 466 HA PRO 466 87.063 -0.308 11.766 228 HB2 PRO 466 HB2 PRO 466 89.293 1.279 12.759 229 HB3 PRO 466 HB3 PRO 466 87.959 0.553 13.657 230 HG2 PRO 466 HG2 PRO 466 90.518 -0.326 13.862 231 HG3 PRO 466 HG3 PRO 466 89.117 -1.393 14.055 232 HD2 PRO 466 HD2 PRO 466 90.904 -1.019 11.683 233 HD3 PRO 466 HD3 PRO 466 90.228 -2.516 12.362 234 H GLY 467 H GLY 467 90.143 0.399 10.177 235 HA2 GLY 467 HA2 GLY 467 89.269 1.699 7.977 236 HA3 GLY 467 HA3 GLY 467 89.219 2.962 9.200 237 H ARG 468 H ARG 468 90.815 3.555 7.201 238 HA ARG 468 HA ARG 468 93.429 2.528 7.251 239 HB2 ARG 468 HB2 ARG 468 94.056 4.560 6.041 240 HB3 ARG 468 HB3 ARG 468 92.562 3.888 5.403 241 HG2 ARG 468 HG2 ARG 468 91.300 5.540 6.757 242 HG3 ARG 468 HG3 ARG 468 92.839 6.259 7.235 243 HD2 ARG 468 HD2 ARG 468 93.285 6.438 4.702 244 HD3 ARG 468 HD3 ARG 468 91.549 6.183 4.530 245 HE ARG 468 HE ARG 468 91.234 8.344 5.180 246 HH11 ARG 468 HH11 ARG 468 94.370 7.304 6.281 247 HH12 ARG 468 HH12 ARG 468 94.804 8.853 6.920 248 HH21 ARG 468 HH21 ARG 468 91.794 10.389 6.021 249 HH22 ARG 468 HH22 ARG 468 93.339 10.609 6.773 250 H LYS 469 H LYS 469 91.930 5.230 8.966 251 HA LYS 469 HA LYS 469 94.254 6.218 10.203 252 HB2 LYS 469 HB2 LYS 469 92.484 7.042 11.948 253 HB3 LYS 469 HB3 LYS 469 92.488 7.702 10.317 254 HG2 LYS 469 HG2 LYS 469 90.505 6.773 9.791 255 HG3 LYS 469 HG3 LYS 469 90.820 5.310 10.725 256 HD2 LYS 469 HD2 LYS 469 89.089 6.335 11.898 257 HD3 LYS 469 HD3 LYS 469 90.532 6.831 12.787 258 HE2 LYS 469 HE2 LYS 469 90.437 8.999 11.989 259 HE3 LYS 469 HE3 LYS 469 89.491 8.544 10.571 260 HZ1 LYS 469 HZ1 LYS 469 87.596 8.137 12.044 261 HZ2 LYS 469 HZ2 LYS 469 88.128 9.740 12.140 262 HZ3 LYS 469 HZ3 LYS 469 88.509 8.647 13.373 263 H GLN 470 H GLN 470 91.851 3.847 11.278 264 HA GLN 470 HA GLN 470 93.069 3.428 13.818 265 HB2 GLN 470 HB2 GLN 470 90.973 1.942 12.253 266 HB3 GLN 470 HB3 GLN 470 91.569 1.347 13.797 267 HG2 GLN 470 HG2 GLN 470 90.345 4.063 13.381 268 HG3 GLN 470 HG3 GLN 470 89.469 2.650 13.966 269 HE21 GLN 470 HE21 GLN 470 89.152 2.759 16.058 270 HE22 GLN 470 HE22 GLN 470 90.270 3.350 17.236 271 H VAL 471 H VAL 471 93.166 1.671 10.728 272 HA VAL 471 HA VAL 471 94.737 -0.484 11.670 273 HB VAL 471 HB VAL 471 94.522 0.635 8.870 274 HG11 VAL 471 HG11 VAL 471 96.318 -0.660 8.506 275 HG12 VAL 471 HG12 VAL 471 95.156 -1.985 8.576 276 HG13 VAL 471 HG13 VAL 471 96.098 -1.562 10.005 277 HG21 VAL 471 HG21 VAL 471 93.231 -1.813 9.005 278 HG22 VAL 471 HG22 VAL 471 92.471 -0.226 8.929 279 HG23 VAL 471 HG23 VAL 471 92.761 -0.990 10.492 280 H ARG 472 H ARG 472 95.585 2.600 10.135 281 HA ARG 472 HA ARG 472 98.362 2.153 9.990 282 HB2 ARG 472 HB2 ARG 472 98.579 4.456 9.494 283 HB3 ARG 472 HB3 ARG 472 97.031 3.971 8.816 284 HG2 ARG 472 HG2 ARG 472 95.822 5.112 10.436 285 HG3 ARG 472 HG3 ARG 472 97.190 5.179 11.548 286 HD2 ARG 472 HD2 ARG 472 98.323 6.629 9.769 287 HD3 ARG 472 HD3 ARG 472 96.718 6.780 9.052 288 HE ARG 472 HE ARG 472 96.532 7.419 11.768 289 HH11 ARG 472 HH11 ARG 472 97.955 8.663 8.844 290 HH12 ARG 472 HH12 ARG 472 97.902 10.313 9.365 291 HH21 ARG 472 HH21 ARG 472 96.457 9.590 12.466 292 HH22 ARG 472 HH22 ARG 472 97.052 10.841 11.426 293 H ASP 473 H ASP 473 96.292 3.458 12.520 294 HA ASP 473 HA ASP 473 98.362 4.358 14.227 295 HB2 ASP 473 HB2 ASP 473 95.499 4.193 14.295 296 HB3 ASP 473 HB3 ASP 473 96.149 3.573 15.811 297 H THR 474 H THR 474 96.654 1.290 13.915 298 HA THR 474 HA THR 474 97.728 0.039 16.205 299 HB THR 474 HB THR 474 97.310 -1.984 14.313 300 HG1 THR 474 HG1 THR 474 95.527 -1.410 13.182 301 HG21 THR 474 HG21 THR 474 96.599 -1.969 16.674 302 HG22 THR 474 HG22 THR 474 95.294 -2.439 15.582 303 HG23 THR 474 HG23 THR 474 95.330 -0.812 16.266 304 H LEU 475 H LEU 475 98.673 -0.158 12.775 305 HA LEU 475 HA LEU 475 100.949 -1.773 13.213 306 HB2 LEU 475 HB2 LEU 475 101.654 -0.931 10.947 307 HB3 LEU 475 HB3 LEU 475 100.081 -1.704 11.013 308 HG LEU 475 HG LEU 475 99.329 0.859 11.345 309 HD11 LEU 475 HD11 LEU 475 101.049 1.597 9.216 310 HD12 LEU 475 HD12 LEU 475 102.050 1.031 10.553 311 HD13 LEU 475 HD13 LEU 475 100.892 2.335 10.811 312 HD21 LEU 475 HD21 LEU 475 99.020 0.842 8.806 313 HD22 LEU 475 HD22 LEU 475 98.283 -0.469 9.727 314 HD23 LEU 475 HD23 LEU 475 99.787 -0.745 8.850 315 H ALA 476 H ALA 476 100.447 1.717 13.064 316 HA ALA 476 HA ALA 476 103.196 2.410 13.258 317 HB1 ALA 476 HB1 ALA 476 100.838 4.098 14.081 318 HB2 ALA 476 HB2 ALA 476 101.418 3.945 12.423 319 HB3 ALA 476 HB3 ALA 476 102.458 4.653 13.659 320 H ALA 477 H ALA 477 100.772 1.457 15.539 321 HA ALA 477 HA ALA 477 102.059 2.529 17.857 322 HB1 ALA 477 HB1 ALA 477 100.450 0.302 18.570 323 HB2 ALA 477 HB2 ALA 477 99.613 1.199 17.304 324 HB3 ALA 477 HB3 ALA 477 100.110 2.019 18.784 325 H ILE 478 H ILE 478 102.284 -0.412 16.001 326 HA ILE 478 HA ILE 478 103.814 -1.812 18.014 327 HB ILE 478 HB ILE 478 103.059 -2.443 15.174 328 HG12 ILE 478 HG12 ILE 478 102.438 -4.584 16.778 329 HG13 ILE 478 HG13 ILE 478 102.221 -3.226 17.877 330 HG21 ILE 478 HG21 ILE 478 105.103 -3.845 16.873 331 HG22 ILE 478 HG22 ILE 478 105.258 -3.279 15.210 332 HG23 ILE 478 HG23 ILE 478 104.233 -4.666 15.578 333 HD11 ILE 478 HD11 ILE 478 100.453 -4.185 15.916 334 HD12 ILE 478 HD12 ILE 478 101.007 -2.599 15.381 335 HD13 ILE 478 HD13 ILE 478 100.262 -2.783 16.968 336 H SER 479 H SER 479 104.468 0.151 15.188 337 HA SER 479 HA SER 479 107.144 0.640 15.987 338 HB2 SER 479 HB2 SER 479 107.394 -1.672 15.060 339 HB3 SER 479 HB3 SER 479 106.855 -1.056 13.497 340 HG SER 479 HG SER 479 108.975 0.238 14.782 341 H GLU 480 H GLU 480 108.342 1.942 14.326 342 HA GLU 480 HA GLU 480 106.607 3.960 13.289 343 HB2 GLU 480 HB2 GLU 480 108.847 4.450 14.230 344 HB3 GLU 480 HB3 GLU 480 109.582 3.597 12.879 345 HG2 GLU 480 HG2 GLU 480 107.776 5.568 11.878 346 HG3 GLU 480 HG3 GLU 480 108.869 6.311 13.044 347 H VAL 481 H VAL 481 105.469 3.680 11.492 348 HA VAL 481 HA VAL 481 106.582 2.054 9.318 349 HB VAL 481 HB VAL 481 104.232 2.208 8.387 350 HG11 VAL 481 HG11 VAL 481 104.031 0.945 11.063 351 HG12 VAL 481 HG12 VAL 481 105.330 0.403 10.000 352 HG13 VAL 481 HG13 VAL 481 103.652 0.293 9.469 353 HG21 VAL 481 HG21 VAL 481 102.523 3.183 9.529 354 HG22 VAL 481 HG22 VAL 481 103.838 4.216 10.091 355 HG23 VAL 481 HG23 VAL 481 103.262 2.894 11.104 356 H LEU 482 H LEU 482 106.420 2.773 7.126 357 HA LEU 482 HA LEU 482 107.077 5.560 6.836 358 HB2 LEU 482 HB2 LEU 482 108.030 3.476 5.571 359 HB3 LEU 482 HB3 LEU 482 106.644 3.708 4.525 360 HG LEU 482 HG LEU 482 108.594 5.929 5.081 361 HD11 LEU 482 HD11 LEU 482 109.901 5.325 3.240 362 HD12 LEU 482 HD12 LEU 482 108.714 4.154 2.665 363 HD13 LEU 482 HD13 LEU 482 109.658 3.814 4.115 364 HD21 LEU 482 HD21 LEU 482 106.868 6.967 4.052 365 HD22 LEU 482 HD22 LEU 482 106.275 5.483 3.306 366 HD23 LEU 482 HD23 LEU 482 107.652 6.334 2.605 367 H TYR 483 H TYR 483 104.839 3.601 4.877 368 HA TYR 483 HA TYR 483 102.721 5.561 5.309 369 HB2 TYR 483 HB2 TYR 483 103.637 6.611 3.430 370 HB3 TYR 483 HB3 TYR 483 104.065 5.083 2.666 371 HD1 TYR 483 HD1 TYR 483 102.219 3.646 1.718 372 HD2 TYR 483 HD2 TYR 483 101.566 7.651 2.994 373 HE1 TYR 483 HE1 TYR 483 100.139 3.717 0.409 374 HE2 TYR 483 HE2 TYR 483 99.483 7.734 1.689 375 HH TYR 483 HH TYR 483 98.440 6.625 -0.192 376 H VAL 484 H VAL 484 100.672 4.739 5.060 377 HA VAL 484 HA VAL 484 100.540 1.846 4.629 378 HB VAL 484 HB VAL 484 98.219 3.435 5.636 379 HG11 VAL 484 HG11 VAL 484 98.840 0.939 6.953 380 HG12 VAL 484 HG12 VAL 484 98.737 0.736 5.204 381 HG13 VAL 484 HG13 VAL 484 97.378 1.425 6.094 382 HG21 VAL 484 HG21 VAL 484 99.156 2.957 7.968 383 HG22 VAL 484 HG22 VAL 484 99.855 4.303 7.069 384 HG23 VAL 484 HG23 VAL 484 100.715 2.767 7.166 385 H ASP 485 H ASP 485 99.735 1.043 2.816 386 HA ASP 485 HA ASP 485 98.205 2.812 1.045 387 HB2 ASP 485 HB2 ASP 485 100.188 1.793 0.060 388 HB3 ASP 485 HB3 ASP 485 99.594 0.187 0.470 389 H LEU 486 H LEU 486 96.358 2.519 2.476 390 HA LEU 486 HA LEU 486 95.082 -0.091 2.463 391 HB2 LEU 486 HB2 LEU 486 94.803 0.939 4.520 392 HB3 LEU 486 HB3 LEU 486 94.556 2.523 3.810 393 HG LEU 486 HG LEU 486 92.544 1.388 4.901 394 HD11 LEU 486 HD11 LEU 486 91.216 2.719 3.670 395 HD12 LEU 486 HD12 LEU 486 91.747 2.016 2.143 396 HD13 LEU 486 HD13 LEU 486 92.737 3.237 2.943 397 HD21 LEU 486 HD21 LEU 486 93.184 -0.534 2.829 398 HD22 LEU 486 HD22 LEU 486 91.520 0.035 2.716 399 HD23 LEU 486 HD23 LEU 486 92.107 -0.684 4.215 400 H LEU 487 H LEU 487 93.613 -0.723 1.031 401 HA LEU 487 HA LEU 487 92.905 0.799 -1.211 402 HB2 LEU 487 HB2 LEU 487 92.016 -1.776 -0.026 403 HB3 LEU 487 HB3 LEU 487 90.968 -1.041 -1.223 404 HG LEU 487 HG LEU 487 93.875 -1.712 -1.675 405 HD11 LEU 487 HD11 LEU 487 91.434 -3.307 -1.878 406 HD12 LEU 487 HD12 LEU 487 93.121 -3.815 -1.801 407 HD13 LEU 487 HD13 LEU 487 92.422 -3.307 -3.339 408 HD21 LEU 487 HD21 LEU 487 93.594 -1.045 -3.879 409 HD22 LEU 487 HD22 LEU 487 92.714 0.190 -2.978 410 HD23 LEU 487 HD23 LEU 487 91.835 -1.112 -3.781 411 H GLU 488 H GLU 488 91.959 2.737 -0.797 412 HA GLU 488 HA GLU 488 90.255 3.584 1.083 413 HB2 GLU 488 HB2 GLU 488 89.288 5.148 -0.547 414 HB3 GLU 488 HB3 GLU 488 91.034 5.022 -0.717 415 HG2 GLU 488 HG2 GLU 488 89.844 3.101 -2.430 416 HG3 GLU 488 HG3 GLU 488 89.026 4.643 -2.678 417 H GLY 489 H GLY 489 88.508 2.700 1.958 418 HA2 GLY 489 HA2 GLY 489 86.307 1.994 2.077 419 HA3 GLY 489 HA3 GLY 489 86.218 2.084 0.326 420 H ASP 490 H ASP 490 88.862 0.251 1.429 421 HA ASP 490 HA ASP 490 87.331 -2.226 0.974 422 HB2 ASP 490 HB2 ASP 490 89.215 -1.387 -0.694 423 HB3 ASP 490 HB3 ASP 490 90.272 -2.148 0.491 424 H THR 491 H THR 491 88.207 -4.164 2.017 425 HA THR 491 HA THR 491 89.033 -3.547 4.745 426 HB THR 491 HB THR 491 88.490 -5.902 5.236 427 HG1 THR 491 HG1 THR 491 87.394 -7.084 3.518 428 HG21 THR 491 HG21 THR 491 86.019 -5.762 4.575 429 HG22 THR 491 HG22 THR 491 86.438 -4.214 3.839 430 HG23 THR 491 HG23 THR 491 86.674 -4.461 5.569 431 H GLU 492 H GLU 492 90.750 -3.788 2.129 432 HA GLU 492 HA GLU 492 92.846 -5.436 3.383 433 HB2 GLU 492 HB2 GLU 492 92.676 -5.083 0.408 434 HB3 GLU 492 HB3 GLU 492 93.494 -6.337 1.328 435 HG2 GLU 492 HG2 GLU 492 91.529 -7.499 1.736 436 HG3 GLU 492 HG3 GLU 492 90.516 -6.099 1.388 437 H CYS 493 H CYS 493 94.560 -4.281 3.942 438 HA CYS 493 HA CYS 493 95.312 -1.957 2.299 439 HB2 CYS 493 HB2 CYS 493 96.159 -1.005 4.577 440 HB3 CYS 493 HB3 CYS 493 94.455 -0.864 4.163 441 HG CYS 493 HG CYS 493 94.507 -3.274 5.730 442 H HIS 494 H HIS 494 97.517 -1.596 2.045 443 HA HIS 494 HA HIS 494 99.283 -3.676 3.158 444 HB2 HIS 494 HB2 HIS 494 99.398 -2.446 0.397 445 HB3 HIS 494 HB3 HIS 494 100.581 -3.573 1.053 446 HD1 HIS 494 HD1 HIS 494 96.775 -3.749 1.007 447 HD2 HIS 494 HD2 HIS 494 100.105 -5.910 -0.218 448 HE1 HIS 494 HE1 HIS 494 95.870 -5.887 0.042 449 HE2 HIS 494 HE2 HIS 494 97.897 -7.130 -0.791 450 H ALA 495 H ALA 495 100.375 -2.629 4.708 451 HA ALA 495 HA ALA 495 101.154 0.126 4.407 452 HB1 ALA 495 HB1 ALA 495 101.698 -1.858 6.604 453 HB2 ALA 495 HB2 ALA 495 100.462 -0.600 6.586 454 HB3 ALA 495 HB3 ALA 495 102.169 -0.159 6.649 455 H ARG 496 H ARG 496 103.038 0.910 3.773 456 HA ARG 496 HA ARG 496 105.143 -0.958 2.996 457 HB2 ARG 496 HB2 ARG 496 105.305 1.971 2.441 458 HB3 ARG 496 HB3 ARG 496 105.864 0.616 1.470 459 HG2 ARG 496 HG2 ARG 496 103.214 0.184 1.383 460 HG3 ARG 496 HG3 ARG 496 103.238 1.941 1.543 461 HD2 ARG 496 HD2 ARG 496 104.674 0.315 -0.553 462 HD3 ARG 496 HD3 ARG 496 103.228 1.291 -0.801 463 HE ARG 496 HE ARG 496 105.554 2.696 0.217 464 HH11 ARG 496 HH11 ARG 496 103.652 1.788 -2.556 465 HH12 ARG 496 HH12 ARG 496 104.256 3.069 -3.553 466 HH21 ARG 496 HH21 ARG 496 106.355 4.388 -1.087 467 HH22 ARG 496 HH22 ARG 496 105.793 4.547 -2.717 468 H PHE 497 H PHE 497 107.073 -1.056 3.972 469 HA PHE 497 HA PHE 497 107.575 0.795 6.207 470 HB2 PHE 497 HB2 PHE 497 108.427 -2.073 5.792 471 HB3 PHE 497 HB3 PHE 497 109.045 -1.054 7.088 472 HD1 PHE 497 HD1 PHE 497 105.658 -1.696 5.655 473 HD2 PHE 497 HD2 PHE 497 108.135 -1.609 9.114 474 HE1 PHE 497 HE1 PHE 497 103.726 -2.304 7.047 475 HE2 PHE 497 HE2 PHE 497 106.206 -2.220 10.514 476 HZ PHE 497 HZ PHE 497 103.997 -2.568 9.481 477 H LYS 498 H LYS 498 109.787 1.409 6.624 478 HA LYS 498 HA LYS 498 111.191 2.023 4.186 479 HB2 LYS 498 HB2 LYS 498 111.115 3.017 6.901 480 HB3 LYS 498 HB3 LYS 498 112.774 2.820 6.352 481 HG2 LYS 498 HG2 LYS 498 111.724 4.051 4.207 482 HG3 LYS 498 HG3 LYS 498 110.697 4.716 5.479 483 HD2 LYS 498 HD2 LYS 498 112.442 6.227 5.456 484 HD3 LYS 498 HD3 LYS 498 112.964 5.103 6.714 485 HE2 LYS 498 HE2 LYS 498 113.969 3.955 4.440 486 HE3 LYS 498 HE3 LYS 498 114.133 5.676 4.096 487 HZ1 LYS 498 HZ1 LYS 498 116.038 5.425 5.233 488 HZ2 LYS 498 HZ2 LYS 498 115.516 4.038 6.049 489 HZ3 LYS 498 HZ3 LYS 498 115.046 5.567 6.596 490 H THR 499 H THR 499 111.411 -0.408 6.609 491 HA THR 499 HA THR 499 113.785 -1.479 5.293 492 HB THR 499 HB THR 499 114.426 -2.094 7.858 493 HG1 THR 499 HG1 THR 499 114.037 -0.416 9.185 494 HG21 THR 499 HG21 THR 499 115.994 -0.001 7.607 495 HG22 THR 499 HG22 THR 499 115.312 0.045 5.981 496 HG23 THR 499 HG23 THR 499 116.170 -1.391 6.537 497 HA PRO 500 HA PRO 500 111.650 -5.294 5.819 498 HB2 PRO 500 HB2 PRO 500 113.704 -7.043 5.682 499 HB3 PRO 500 HB3 PRO 500 113.140 -6.129 4.279 500 HG2 PRO 500 HG2 PRO 500 115.475 -5.587 6.073 501 HG3 PRO 500 HG3 PRO 500 115.384 -5.509 4.303 502 HD2 PRO 500 HD2 PRO 500 115.233 -3.306 5.883 503 HD3 PRO 500 HD3 PRO 500 114.397 -3.428 4.322 504 H GLU 501 H GLU 501 114.537 -4.848 7.842 505 HA GLU 501 HA GLU 501 114.017 -6.878 9.699 506 HB2 GLU 501 HB2 GLU 501 115.467 -5.554 11.239 507 HB3 GLU 501 HB3 GLU 501 116.175 -5.813 9.650 508 HG2 GLU 501 HG2 GLU 501 115.493 -3.549 8.994 509 HG3 GLU 501 HG3 GLU 501 114.832 -3.296 10.608 510 H ASP 502 H ASP 502 112.927 -3.531 9.545 511 HA ASP 502 HA ASP 502 111.708 -3.411 12.077 512 HB2 ASP 502 HB2 ASP 502 111.134 -1.901 9.523 513 HB3 ASP 502 HB3 ASP 502 110.386 -1.520 11.071 514 H ALA 503 H ALA 503 110.461 -4.387 8.905 515 HA ALA 503 HA ALA 503 107.773 -4.711 9.730 516 HB1 ALA 503 HB1 ALA 503 108.197 -6.504 7.628 517 HB2 ALA 503 HB2 ALA 503 109.293 -5.156 7.325 518 HB3 ALA 503 HB3 ALA 503 107.565 -4.860 7.522 519 H GLN 504 H GLN 504 110.557 -6.868 9.654 520 HA GLN 504 HA GLN 504 109.220 -9.270 10.233 521 HB2 GLN 504 HB2 GLN 504 111.605 -9.042 9.473 522 HB3 GLN 504 HB3 GLN 504 112.018 -8.510 11.096 523 HG2 GLN 504 HG2 GLN 504 112.137 -10.593 11.827 524 HG3 GLN 504 HG3 GLN 504 110.544 -10.977 11.179 525 HE21 GLN 504 HE21 GLN 504 113.091 -12.499 11.255 526 HE22 GLN 504 HE22 GLN 504 113.391 -12.958 9.617 527 H ALA 505 H ALA 505 110.636 -6.803 12.347 528 HA ALA 505 HA ALA 505 110.122 -8.155 14.775 529 HB1 ALA 505 HB1 ALA 505 110.835 -5.365 14.038 530 HB2 ALA 505 HB2 ALA 505 111.656 -6.499 15.111 531 HB3 ALA 505 HB3 ALA 505 110.199 -5.667 15.656 532 H VAL 506 H VAL 506 108.265 -5.813 12.891 533 HA VAL 506 HA VAL 506 106.181 -5.488 14.790 534 HB VAL 506 HB VAL 506 106.328 -4.947 11.829 535 HG11 VAL 506 HG11 VAL 506 104.022 -4.560 13.717 536 HG12 VAL 506 HG12 VAL 506 104.037 -5.373 12.153 537 HG13 VAL 506 HG13 VAL 506 104.201 -3.620 12.236 538 HG21 VAL 506 HG21 VAL 506 105.829 -2.675 13.498 539 HG22 VAL 506 HG22 VAL 506 107.201 -2.999 12.437 540 HG23 VAL 506 HG23 VAL 506 107.225 -3.564 14.108 541 H ILE 507 H ILE 507 106.546 -7.568 11.937 542 HA ILE 507 HA ILE 507 103.949 -8.665 12.047 543 HB ILE 507 HB ILE 507 104.893 -10.540 10.683 544 HG12 ILE 507 HG12 ILE 507 107.265 -9.789 9.749 545 HG13 ILE 507 HG13 ILE 507 107.406 -9.100 11.361 546 HG21 ILE 507 HG21 ILE 507 103.982 -8.359 9.786 547 HG22 ILE 507 HG22 ILE 507 105.057 -9.252 8.710 548 HG23 ILE 507 HG23 ILE 507 105.657 -7.846 9.590 549 HD11 ILE 507 HD11 ILE 507 106.505 -11.594 11.929 550 HD12 ILE 507 HD12 ILE 507 108.203 -11.119 11.900 551 HD13 ILE 507 HD13 ILE 507 107.480 -11.889 10.489 552 H ASN 508 H ASN 508 106.939 -9.492 13.631 553 HA ASN 508 HA ASN 508 106.108 -12.049 14.588 554 HB2 ASN 508 HB2 ASN 508 108.268 -10.146 15.512 555 HB3 ASN 508 HB3 ASN 508 108.013 -11.737 16.222 556 HD21 ASN 508 HD21 ASN 508 110.213 -10.456 14.592 557 HD22 ASN 508 HD22 ASN 508 110.525 -11.601 13.337 558 H ALA 509 H ALA 509 106.037 -8.773 15.837 559 HA ALA 509 HA ALA 509 104.959 -9.491 18.394 560 HB1 ALA 509 HB1 ALA 509 106.321 -7.367 17.664 561 HB2 ALA 509 HB2 ALA 509 105.124 -7.282 18.956 562 HB3 ALA 509 HB3 ALA 509 104.712 -6.725 17.333 563 H TYR 510 H TYR 510 103.640 -8.919 15.285 564 HA TYR 510 HA TYR 510 101.128 -7.892 15.948 565 HB2 TYR 510 HB2 TYR 510 102.402 -8.945 13.603 566 HB3 TYR 510 HB3 TYR 510 100.751 -9.552 13.714 567 HD1 TYR 510 HD1 TYR 510 99.688 -8.326 12.002 568 HD2 TYR 510 HD2 TYR 510 102.006 -6.293 14.928 569 HE1 TYR 510 HE1 TYR 510 98.847 -6.177 11.154 570 HE2 TYR 510 HE2 TYR 510 101.179 -4.129 14.084 571 HH TYR 510 HH TYR 510 98.549 -3.879 11.940 572 H THR 511 H THR 511 102.364 -11.073 16.425 573 HA THR 511 HA THR 511 100.147 -12.680 16.226 574 HB THR 511 HB THR 511 101.064 -14.012 18.114 575 HG1 THR 511 HG1 THR 511 103.277 -13.100 18.772 576 HG21 THR 511 HG21 THR 511 103.560 -13.433 16.743 577 HG22 THR 511 HG22 THR 511 102.196 -13.571 15.634 578 HG23 THR 511 HG23 THR 511 102.576 -14.897 16.731 579 H GLU 512 H GLU 512 100.961 -10.332 18.684 580 HA GLU 512 HA GLU 512 98.955 -10.980 20.554 581 HB2 GLU 512 HB2 GLU 512 100.488 -8.445 20.024 582 HB3 GLU 512 HB3 GLU 512 99.319 -8.581 21.330 583 HG2 GLU 512 HG2 GLU 512 100.628 -10.509 22.205 584 HG3 GLU 512 HG3 GLU 512 101.847 -10.170 20.978 585 H ILE 513 H ILE 513 98.702 -9.526 17.493 586 HA ILE 513 HA ILE 513 96.610 -7.715 17.871 587 HB ILE 513 HB ILE 513 97.308 -9.401 15.472 588 HG12 ILE 513 HG12 ILE 513 98.998 -7.758 16.121 589 HG13 ILE 513 HG13 ILE 513 98.218 -7.273 14.618 590 HG21 ILE 513 HG21 ILE 513 95.115 -8.931 14.985 591 HG22 ILE 513 HG22 ILE 513 95.913 -7.506 14.318 592 HG23 ILE 513 HG23 ILE 513 95.120 -7.418 15.891 593 HD11 ILE 513 HD11 ILE 513 98.312 -5.296 15.787 594 HD12 ILE 513 HD12 ILE 513 97.998 -6.074 17.338 595 HD13 ILE 513 HD13 ILE 513 96.690 -5.869 16.174 596 H ASN 514 H ASN 514 96.482 -11.203 17.132 597 HA ASN 514 HA ASN 514 93.688 -11.383 16.938 598 HB2 ASN 514 HB2 ASN 514 94.893 -13.207 16.077 599 HB3 ASN 514 HB3 ASN 514 95.850 -13.383 17.544 600 HD21 ASN 514 HD21 ASN 514 92.358 -13.004 17.246 601 HD22 ASN 514 HD22 ASN 514 91.952 -14.538 17.930 602 H LYS 515 H LYS 515 95.807 -11.244 19.687 603 HA LYS 515 HA LYS 515 94.185 -12.405 21.642 604 HB2 LYS 515 HB2 LYS 515 96.143 -10.116 21.908 605 HB3 LYS 515 HB3 LYS 515 95.466 -11.022 23.255 606 HG2 LYS 515 HG2 LYS 515 96.796 -12.604 21.149 607 HG3 LYS 515 HG3 LYS 515 97.833 -11.577 22.142 608 HD2 LYS 515 HD2 LYS 515 97.804 -13.575 23.323 609 HD3 LYS 515 HD3 LYS 515 96.557 -12.625 24.134 610 HE2 LYS 515 HE2 LYS 515 94.820 -13.790 22.995 611 HE3 LYS 515 HE3 LYS 515 95.973 -14.579 21.920 612 HZ1 LYS 515 HZ1 LYS 515 94.991 -15.576 24.276 613 HZ2 LYS 515 HZ2 LYS 515 96.569 -15.099 24.655 614 HZ3 LYS 515 HZ3 LYS 515 96.296 -16.189 23.391 615 H LYS 516 H LYS 516 93.873 -9.423 19.962 616 HA LYS 516 HA LYS 516 91.728 -8.598 21.808 617 HB2 LYS 516 HB2 LYS 516 93.693 -7.040 21.634 618 HB3 LYS 516 HB3 LYS 516 93.280 -6.799 19.942 619 HG2 LYS 516 HG2 LYS 516 92.367 -4.972 21.111 620 HG3 LYS 516 HG3 LYS 516 91.010 -6.033 20.729 621 HD2 LYS 516 HD2 LYS 516 92.328 -6.540 23.313 622 HD3 LYS 516 HD3 LYS 516 91.486 -4.994 23.181 623 HE2 LYS 516 HE2 LYS 516 90.026 -7.340 22.158 624 HE3 LYS 516 HE3 LYS 516 90.298 -7.311 23.900 625 HZ1 LYS 516 HZ1 LYS 516 89.431 -4.882 23.651 626 HZ2 LYS 516 HZ2 LYS 516 88.340 -6.170 23.732 627 HZ3 LYS 516 HZ3 LYS 516 88.720 -5.479 22.236 628 H HIS 517 H HIS 517 92.710 -8.334 18.386 629 HA HIS 517 HA HIS 517 89.951 -8.955 17.620 630 HB2 HIS 517 HB2 HIS 517 91.338 -6.865 16.020 631 HB3 HIS 517 HB3 HIS 517 89.621 -7.087 16.329 632 HD1 HIS 517 HD1 HIS 517 88.612 -5.843 18.299 633 HD2 HIS 517 HD2 HIS 517 92.739 -5.435 18.036 634 HE1 HIS 517 HE1 HIS 517 89.211 -4.019 19.924 635 HE2 HIS 517 HE2 HIS 517 91.702 -3.730 19.684 636 H CYS 518 H CYS 518 89.903 -10.519 16.139 637 HA CYS 518 HA CYS 518 92.124 -11.815 15.136 638 HB2 CYS 518 HB2 CYS 518 89.617 -12.506 15.125 639 HB3 CYS 518 HB3 CYS 518 89.570 -11.711 13.555 640 HG CYS 518 HG CYS 518 90.104 -14.125 13.008 641 H TRP 519 H TRP 519 93.641 -11.205 13.740 642 HA TRP 519 HA TRP 519 92.903 -9.645 11.389 643 HB2 TRP 519 HB2 TRP 519 93.886 -8.337 13.598 644 HB3 TRP 519 HB3 TRP 519 95.331 -8.597 12.622 645 HD1 TRP 519 HD1 TRP 519 93.129 -8.364 9.967 646 HE1 TRP 519 HE1 TRP 519 92.739 -5.986 9.133 647 HE3 TRP 519 HE3 TRP 519 94.840 -5.803 14.042 648 HZ2 TRP 519 HZ2 TRP 519 93.108 -3.316 10.082 649 HZ3 TRP 519 HZ3 TRP 519 94.788 -3.343 14.000 650 HH2 TRP 519 HH2 TRP 519 93.942 -2.131 12.060 651 H LYS 520 H LYS 520 94.291 -9.804 9.688 652 HA LYS 520 HA LYS 520 96.290 -11.949 9.898 653 HB2 LYS 520 HB2 LYS 520 95.102 -10.972 7.342 654 HB3 LYS 520 HB3 LYS 520 95.768 -12.559 7.709 655 HG2 LYS 520 HG2 LYS 520 93.170 -11.436 8.746 656 HG3 LYS 520 HG3 LYS 520 93.347 -12.647 7.475 657 HD2 LYS 520 HD2 LYS 520 93.532 -14.292 8.969 658 HD3 LYS 520 HD3 LYS 520 94.777 -13.418 9.865 659 HE2 LYS 520 HE2 LYS 520 93.075 -13.627 11.426 660 HE3 LYS 520 HE3 LYS 520 92.805 -12.013 10.770 661 HZ1 LYS 520 HZ1 LYS 520 90.771 -13.402 10.987 662 HZ2 LYS 520 HZ2 LYS 520 91.391 -14.434 9.799 663 HZ3 LYS 520 HZ3 LYS 520 91.043 -12.823 9.421 664 H LEU 521 H LEU 521 98.374 -11.523 9.448 665 HA LEU 521 HA LEU 521 99.022 -9.114 7.917 666 HB2 LEU 521 HB2 LEU 521 99.448 -8.162 9.940 667 HB3 LEU 521 HB3 LEU 521 99.749 -9.700 10.724 668 HG LEU 521 HG LEU 521 101.799 -8.947 8.766 669 HD11 LEU 521 HD11 LEU 521 100.891 -6.813 10.125 670 HD12 LEU 521 HD12 LEU 521 102.578 -7.028 9.657 671 HD13 LEU 521 HD13 LEU 521 102.055 -7.446 11.290 672 HD21 LEU 521 HD21 LEU 521 103.171 -10.058 10.196 673 HD22 LEU 521 HD22 LEU 521 101.639 -10.780 10.682 674 HD23 LEU 521 HD23 LEU 521 102.336 -9.471 11.634 675 H GLU 522 H GLU 522 100.386 -9.579 6.321 676 HA GLU 522 HA GLU 522 102.420 -11.645 6.727 677 HB2 GLU 522 HB2 GLU 522 100.631 -12.840 5.638 678 HB3 GLU 522 HB3 GLU 522 100.464 -11.577 4.427 679 HG2 GLU 522 HG2 GLU 522 101.622 -13.576 3.587 680 HG3 GLU 522 HG3 GLU 522 102.604 -12.116 3.485 681 H ILE 523 H ILE 523 104.330 -11.286 5.670 682 HA ILE 523 HA ILE 523 104.616 -8.661 4.426 683 HB ILE 523 HB ILE 523 106.595 -10.639 5.537 684 HG12 ILE 523 HG12 ILE 523 106.422 -7.700 6.120 685 HG13 ILE 523 HG13 ILE 523 105.300 -8.822 6.882 686 HG21 ILE 523 HG21 ILE 523 107.087 -8.417 3.607 687 HG22 ILE 523 HG22 ILE 523 107.827 -10.016 3.697 688 HG23 ILE 523 HG23 ILE 523 108.283 -8.766 4.856 689 HD11 ILE 523 HD11 ILE 523 108.286 -8.725 7.146 690 HD12 ILE 523 HD12 ILE 523 107.319 -10.097 7.687 691 HD13 ILE 523 HD13 ILE 523 107.066 -8.504 8.401 692 H LEU 524 H LEU 524 104.401 -8.525 2.298 693 HA LEU 524 HA LEU 524 104.282 -10.653 0.519 694 HB2 LEU 524 HB2 LEU 524 104.952 -7.755 0.042 695 HB3 LEU 524 HB3 LEU 524 104.682 -8.908 -1.246 696 HG LEU 524 HG LEU 524 102.769 -7.293 -0.129 697 HD11 LEU 524 HD11 LEU 524 101.198 -8.576 -1.437 698 HD12 LEU 524 HD12 LEU 524 102.320 -9.935 -1.504 699 HD13 LEU 524 HD13 LEU 524 102.721 -8.420 -2.313 700 HD21 LEU 524 HD21 LEU 524 101.201 -8.998 0.924 701 HD22 LEU 524 HD22 LEU 524 102.533 -8.417 1.922 702 HD23 LEU 524 HD23 LEU 524 102.629 -10.004 1.159 703 H SER 525 H SER 525 105.722 -11.721 -0.737 704 HA SER 525 HA SER 525 108.502 -10.845 -0.800 705 HB2 SER 525 HB2 SER 525 109.051 -12.290 0.844 706 HB3 SER 525 HB3 SER 525 107.503 -13.129 0.740 707 HG SER 525 HG SER 525 108.300 -14.434 -0.818 708 H GLY 526 H GLY 526 109.822 -12.117 -2.323 709 HA2 GLY 526 HA2 GLY 526 110.174 -12.839 -4.468 710 HA3 GLY 526 HA3 GLY 526 108.884 -13.979 -4.127 711 H ASP 527 H ASP 527 107.718 -13.993 -5.940 712 HA ASP 527 HA ASP 527 107.315 -11.805 -7.649 713 HB2 ASP 527 HB2 ASP 527 105.777 -14.380 -7.300 714 HB3 ASP 527 HB3 ASP 527 105.429 -13.215 -8.573 715 H HIS 528 H HIS 528 105.569 -12.884 -4.810 716 HA HIS 528 HA HIS 528 103.183 -11.457 -5.262 717 HB2 HIS 528 HB2 HIS 528 103.856 -13.255 -3.434 718 HB3 HIS 528 HB3 HIS 528 104.195 -11.816 -2.478 719 HD1 HIS 528 HD1 HIS 528 102.214 -12.417 -0.893 720 HD2 HIS 528 HD2 HIS 528 101.115 -11.675 -4.831 721 HE1 HIS 528 HE1 HIS 528 99.718 -12.126 -0.851 722 HE2 HIS 528 HE2 HIS 528 99.092 -11.559 -3.224 723 H GLU 529 H GLU 529 106.146 -10.571 -3.498 724 HA GLU 529 HA GLU 529 105.214 -7.995 -2.740 725 HB2 GLU 529 HB2 GLU 529 106.988 -8.726 -1.436 726 HB3 GLU 529 HB3 GLU 529 107.884 -9.342 -2.818 727 HG2 GLU 529 HG2 GLU 529 108.756 -7.293 -3.346 728 HG3 GLU 529 HG3 GLU 529 107.429 -6.411 -2.593 729 H GLN 530 H GLN 530 107.258 -9.135 -5.396 730 HA GLN 530 HA GLN 530 107.754 -6.604 -6.526 731 HB2 GLN 530 HB2 GLN 530 108.824 -7.725 -8.215 732 HB3 GLN 530 HB3 GLN 530 108.799 -8.989 -6.994 733 HG2 GLN 530 HG2 GLN 530 108.097 -10.145 -8.831 734 HG3 GLN 530 HG3 GLN 530 106.551 -9.651 -8.144 735 HE21 GLN 530 HE21 GLN 530 105.456 -9.711 -10.074 736 HE22 GLN 530 HE22 GLN 530 105.728 -8.579 -11.349 737 H ARG 531 H ARG 531 105.193 -8.973 -7.056 738 HA ARG 531 HA ARG 531 103.971 -7.777 -9.267 739 HB2 ARG 531 HB2 ARG 531 103.497 -10.067 -8.398 740 HB3 ARG 531 HB3 ARG 531 102.614 -9.338 -7.063 741 HG2 ARG 531 HG2 ARG 531 101.875 -8.743 -9.901 742 HG3 ARG 531 HG3 ARG 531 101.299 -10.200 -9.091 743 HD2 ARG 531 HD2 ARG 531 100.748 -8.316 -7.222 744 HD3 ARG 531 HD3 ARG 531 100.534 -7.386 -8.705 745 HE ARG 531 HE ARG 531 99.174 -9.774 -9.055 746 HH11 ARG 531 HH11 ARG 531 99.025 -7.008 -6.943 747 HH12 ARG 531 HH12 ARG 531 97.318 -7.138 -6.679 748 HH21 ARG 531 HH21 ARG 531 96.925 -9.954 -8.714 749 HH22 ARG 531 HH22 ARG 531 96.125 -8.813 -7.685 750 H TYR 532 H TYR 532 103.012 -7.533 -5.826 751 HA TYR 532 HA TYR 532 100.980 -5.689 -6.124 752 HB2 TYR 532 HB2 TYR 532 101.419 -6.799 -3.999 753 HB3 TYR 532 HB3 TYR 532 102.943 -5.931 -3.837 754 HD1 TYR 532 HD1 TYR 532 102.925 -3.486 -3.449 755 HD2 TYR 532 HD2 TYR 532 99.350 -5.779 -3.396 756 HE1 TYR 532 HE1 TYR 532 101.775 -1.650 -2.279 757 HE2 TYR 532 HE2 TYR 532 98.184 -3.952 -2.231 758 HH TYR 532 HH TYR 532 98.438 -1.989 -1.166 759 H TRP 533 H TRP 533 104.456 -5.114 -5.778 760 HA TRP 533 HA TRP 533 104.316 -2.310 -5.676 761 HB2 TRP 533 HB2 TRP 533 106.442 -4.302 -6.262 762 HB3 TRP 533 HB3 TRP 533 106.732 -2.636 -6.764 763 HD1 TRP 533 HD1 TRP 533 107.111 -4.834 -3.851 764 HE1 TRP 533 HE1 TRP 533 107.558 -3.467 -1.720 765 HE3 TRP 533 HE3 TRP 533 105.882 -0.188 -5.594 766 HZ2 TRP 533 HZ2 TRP 533 107.407 -0.773 -0.884 767 HZ3 TRP 533 HZ3 TRP 533 106.062 1.732 -4.065 768 HH2 TRP 533 HH2 TRP 533 106.810 1.442 -1.757 769 H GLN 534 H GLN 534 104.567 -4.552 -8.403 770 HA GLN 534 HA GLN 534 104.985 -2.773 -10.473 771 HB2 GLN 534 HB2 GLN 534 103.343 -5.299 -10.332 772 HB3 GLN 534 HB3 GLN 534 103.530 -4.400 -11.830 773 HG2 GLN 534 HG2 GLN 534 105.661 -5.773 -10.221 774 HG3 GLN 534 HG3 GLN 534 105.128 -6.139 -11.861 775 HE21 GLN 534 HE21 GLN 534 107.488 -4.703 -10.076 776 HE22 GLN 534 HE22 GLN 534 108.151 -3.646 -11.271 777 H LYS 535 H LYS 535 101.971 -3.684 -8.874 778 HA LYS 535 HA LYS 535 100.249 -2.092 -10.439 779 HB2 LYS 535 HB2 LYS 535 98.962 -3.534 -9.246 780 HB3 LYS 535 HB3 LYS 535 100.092 -3.591 -7.903 781 HG2 LYS 535 HG2 LYS 535 98.399 -1.168 -8.347 782 HG3 LYS 535 HG3 LYS 535 97.737 -2.594 -7.546 783 HD2 LYS 535 HD2 LYS 535 100.342 -1.878 -6.498 784 HD3 LYS 535 HD3 LYS 535 99.190 -0.547 -6.360 785 HE2 LYS 535 HE2 LYS 535 98.178 -3.211 -5.601 786 HE3 LYS 535 HE3 LYS 535 99.422 -2.536 -4.551 787 HZ1 LYS 535 HZ1 LYS 535 96.796 -1.997 -4.358 788 HZ2 LYS 535 HZ2 LYS 535 97.335 -0.676 -5.267 789 HZ3 LYS 535 HZ3 LYS 535 98.025 -1.000 -3.757 790 H ILE 536 H ILE 536 102.153 -1.476 -7.544 791 HA ILE 536 HA ILE 536 101.101 1.049 -6.881 792 HB ILE 536 HB ILE 536 103.866 -0.078 -6.415 793 HG12 ILE 536 HG12 ILE 536 101.361 0.051 -4.735 794 HG13 ILE 536 HG13 ILE 536 102.255 -1.381 -5.236 795 HG21 ILE 536 HG21 ILE 536 103.094 1.957 -4.545 796 HG22 ILE 536 HG22 ILE 536 103.035 2.588 -6.191 797 HG23 ILE 536 HG23 ILE 536 104.522 1.868 -5.575 798 HD11 ILE 536 HD11 ILE 536 103.990 0.337 -3.759 799 HD12 ILE 536 HD12 ILE 536 103.463 -1.304 -3.386 800 HD13 ILE 536 HD13 ILE 536 102.504 0.074 -2.846 801 H LEU 537 H LEU 537 104.289 0.427 -8.344 802 HA LEU 537 HA LEU 537 104.789 3.017 -9.185 803 HB2 LEU 537 HB2 LEU 537 105.867 0.357 -9.751 804 HB3 LEU 537 HB3 LEU 537 106.059 1.480 -11.083 805 HG LEU 537 HG LEU 537 107.373 2.963 -9.781 806 HD11 LEU 537 HD11 LEU 537 106.370 3.163 -7.717 807 HD12 LEU 537 HD12 LEU 537 107.827 2.254 -7.319 808 HD13 LEU 537 HD13 LEU 537 106.281 1.419 -7.471 809 HD21 LEU 537 HD21 LEU 537 109.189 1.686 -9.915 810 HD22 LEU 537 HD22 LEU 537 108.121 0.319 -10.232 811 HD23 LEU 537 HD23 LEU 537 108.644 0.664 -8.584 812 H VAL 538 H VAL 538 103.413 0.331 -11.086 813 HA VAL 538 HA VAL 538 103.092 1.648 -13.497 814 HB VAL 538 HB VAL 538 101.330 -0.465 -12.254 815 HG11 VAL 538 HG11 VAL 538 99.934 -0.310 -13.969 816 HG12 VAL 538 HG12 VAL 538 101.269 -0.472 -15.111 817 HG13 VAL 538 HG13 VAL 538 100.802 1.123 -14.520 818 HG21 VAL 538 HG21 VAL 538 103.222 -0.955 -14.500 819 HG22 VAL 538 HG22 VAL 538 102.676 -2.043 -13.224 820 HG23 VAL 538 HG23 VAL 538 103.869 -0.795 -12.867 821 H ASP 539 H ASP 539 100.966 1.651 -10.665 822 HA ASP 539 HA ASP 539 98.843 3.087 -11.863 823 HB2 ASP 539 HB2 ASP 539 98.389 1.920 -9.829 824 HB3 ASP 539 HB3 ASP 539 99.694 2.748 -8.984 825 H ARG 540 H ARG 540 101.761 4.054 -10.158 826 HA ARG 540 HA ARG 540 101.201 6.804 -9.941 827 HB2 ARG 540 HB2 ARG 540 103.840 5.341 -10.122 828 HB3 ARG 540 HB3 ARG 540 103.680 7.043 -9.712 829 HG2 ARG 540 HG2 ARG 540 102.114 5.117 -8.101 830 HG3 ARG 540 HG3 ARG 540 103.865 5.133 -7.876 831 HD2 ARG 540 HD2 ARG 540 102.684 7.798 -7.964 832 HD3 ARG 540 HD3 ARG 540 102.066 6.809 -6.642 833 HE ARG 540 HE ARG 540 104.647 6.428 -6.304 834 HH11 ARG 540 HH11 ARG 540 102.966 9.388 -7.071 835 HH12 ARG 540 HH12 ARG 540 104.132 10.400 -6.285 836 HH21 ARG 540 HH21 ARG 540 106.176 7.758 -5.262 837 HH22 ARG 540 HH22 ARG 540 105.952 9.476 -5.259 838 H GLN 541 H GLN 541 102.747 4.876 -12.460 839 HA GLN 541 HA GLN 541 103.612 6.988 -14.095 840 HB2 GLN 541 HB2 GLN 541 103.351 4.105 -14.292 841 HB3 GLN 541 HB3 GLN 541 102.944 4.886 -15.814 842 HG2 GLN 541 HG2 GLN 541 105.079 5.212 -16.271 843 HG3 GLN 541 HG3 GLN 541 105.320 6.063 -14.747 844 HE21 GLN 541 HE21 GLN 541 106.087 4.941 -12.963 845 HE22 GLN 541 HE22 GLN 541 106.821 3.384 -13.099 846 H ALA 542 H ALA 542 100.566 5.188 -14.003 847 HA ALA 542 HA ALA 542 99.392 6.382 -16.264 848 HB1 ALA 542 HB1 ALA 542 97.332 5.454 -15.540 849 HB2 ALA 542 HB2 ALA 542 97.886 5.357 -13.868 850 HB3 ALA 542 HB3 ALA 542 98.593 4.305 -15.094 851 H LYS 543 H LYS 543 99.501 7.334 -12.877 852 HA LYS 543 HA LYS 543 97.568 9.364 -12.963 853 HB2 LYS 543 HB2 LYS 543 99.399 8.333 -11.076 854 HB3 LYS 543 HB3 LYS 543 99.691 10.065 -11.161 855 HG2 LYS 543 HG2 LYS 543 97.388 10.529 -10.646 856 HG3 LYS 543 HG3 LYS 543 96.992 8.811 -10.706 857 HD2 LYS 543 HD2 LYS 543 99.025 9.940 -8.797 858 HD3 LYS 543 HD3 LYS 543 97.311 9.821 -8.398 859 HE2 LYS 543 HE2 LYS 543 97.530 7.669 -7.894 860 HE3 LYS 543 HE3 LYS 543 98.227 7.330 -9.478 861 HZ1 LYS 543 HZ1 LYS 543 100.393 8.032 -8.592 862 HZ2 LYS 543 HZ2 LYS 543 99.763 6.702 -7.759 863 HZ3 LYS 543 HZ3 LYS 543 99.699 8.243 -7.065 864 H LEU 544 H LEU 544 100.800 9.262 -14.171 865 HA LEU 544 HA LEU 544 101.412 12.005 -14.161 866 HB2 LEU 544 HB2 LEU 544 102.800 9.816 -14.791 867 HB3 LEU 544 HB3 LEU 544 102.363 10.322 -16.414 868 HG LEU 544 HG LEU 544 104.566 11.164 -15.791 869 HD11 LEU 544 HD11 LEU 544 102.609 13.449 -15.860 870 HD12 LEU 544 HD12 LEU 544 103.020 12.472 -17.270 871 HD13 LEU 544 HD13 LEU 544 104.266 13.423 -16.462 872 HD21 LEU 544 HD21 LEU 544 105.047 12.273 -13.880 873 HD22 LEU 544 HD22 LEU 544 103.637 11.395 -13.286 874 HD23 LEU 544 HD23 LEU 544 103.474 13.069 -13.817 875 H ASN 545 H ASN 545 99.208 10.196 -16.058 876 HA ASN 545 HA ASN 545 98.899 12.480 -17.894 877 HB2 ASN 545 HB2 ASN 545 99.078 9.618 -18.401 878 HB3 ASN 545 HB3 ASN 545 97.624 10.326 -19.099 879 HD21 ASN 545 HD21 ASN 545 100.582 12.107 -18.629 880 HD22 ASN 545 HD22 ASN 545 100.981 12.270 -20.302 881 H GLN 546 H GLN 546 96.837 9.682 -17.209 882 HA GLN 546 HA GLN 546 94.394 10.715 -17.466 883 HB2 GLN 546 HB2 GLN 546 95.503 8.536 -16.007 884 HB3 GLN 546 HB3 GLN 546 94.284 9.300 -14.996 885 HG2 GLN 546 HG2 GLN 546 93.285 9.040 -17.661 886 HG3 GLN 546 HG3 GLN 546 93.904 7.486 -17.105 887 HE21 GLN 546 HE21 GLN 546 92.202 10.184 -15.543 888 HE22 GLN 546 HE22 GLN 546 90.938 9.219 -14.868 889 HA PRO 547 HA PRO 547 94.561 14.201 -14.599 890 HB2 PRO 547 HB2 PRO 547 92.327 15.405 -15.557 891 HB3 PRO 547 HB3 PRO 547 93.897 15.527 -16.361 892 HG2 PRO 547 HG2 PRO 547 91.582 13.734 -16.990 893 HG3 PRO 547 HG3 PRO 547 92.609 14.662 -18.099 894 HD2 PRO 547 HD2 PRO 547 92.952 12.010 -17.669 895 HD3 PRO 547 HD3 PRO 547 94.305 13.101 -18.031 896 H ARG 548 H ARG 548 94.047 13.364 -12.624 897 HA ARG 548 HA ARG 548 92.804 12.757 -10.825 898 HB2 ARG 548 HB2 ARG 548 90.937 14.002 -10.426 899 HB3 ARG 548 HB3 ARG 548 91.551 14.894 -11.807 900 HG2 ARG 548 HG2 ARG 548 89.965 12.934 -12.946 901 HG3 ARG 548 HG3 ARG 548 89.081 13.415 -11.498 902 HD2 ARG 548 HD2 ARG 548 88.373 15.229 -12.560 903 HD3 ARG 548 HD3 ARG 548 90.044 15.779 -12.692 904 HE ARG 548 HE ARG 548 89.271 13.884 -14.717 905 HH11 ARG 548 HH11 ARG 548 89.352 17.247 -13.816 906 HH12 ARG 548 HH12 ARG 548 89.312 17.820 -15.450 907 HH21 ARG 548 HH21 ARG 548 89.222 14.628 -16.873 908 HH22 ARG 548 HH22 ARG 548 89.239 16.331 -17.188 909 H GLU 549 H GLU 549 91.188 11.238 -10.052 910 HA GLU 549 HA GLU 549 89.891 9.550 -12.024 911 HB2 GLU 549 HB2 GLU 549 90.978 7.512 -10.776 912 HB3 GLU 549 HB3 GLU 549 91.828 8.304 -12.097 913 HG2 GLU 549 HG2 GLU 549 93.345 9.323 -10.686 914 HG3 GLU 549 HG3 GLU 549 92.287 9.186 -9.283 915 H LYS 550 H LYS 550 88.704 7.702 -10.870 916 HA LYS 550 HA LYS 550 87.032 7.123 -9.442 917 HB2 LYS 550 HB2 LYS 550 88.525 6.478 -7.811 918 HB3 LYS 550 HB3 LYS 550 89.221 8.085 -7.660 919 HG2 LYS 550 HG2 LYS 550 88.052 7.576 -5.646 920 HG3 LYS 550 HG3 LYS 550 87.138 8.813 -6.511 921 HD2 LYS 550 HD2 LYS 550 85.675 7.072 -5.584 922 HD3 LYS 550 HD3 LYS 550 85.603 7.121 -7.347 923 HE2 LYS 550 HE2 LYS 550 86.331 5.022 -7.517 924 HE3 LYS 550 HE3 LYS 550 87.673 5.327 -6.417 925 HZ1 LYS 550 HZ1 LYS 550 85.923 5.143 -4.594 926 HZ2 LYS 550 HZ2 LYS 550 86.404 3.712 -5.356 927 HZ3 LYS 550 HZ3 LYS 550 84.932 4.435 -5.770 928 H LYS 551 H LYS 551 85.192 8.201 -9.768 929 HA LYS 551 HA LYS 551 84.511 10.421 -8.106 930 HB2 LYS 551 HB2 LYS 551 85.828 11.188 -10.359 931 HB3 LYS 551 HB3 LYS 551 84.164 11.205 -10.929 932 HG2 LYS 551 HG2 LYS 551 83.574 12.948 -9.591 933 HG3 LYS 551 HG3 LYS 551 84.748 12.531 -8.340 934 HD2 LYS 551 HD2 LYS 551 86.009 14.189 -9.145 935 HD3 LYS 551 HD3 LYS 551 86.309 13.154 -10.543 936 HE2 LYS 551 HE2 LYS 551 85.489 14.935 -11.668 937 HE3 LYS 551 HE3 LYS 551 83.943 14.194 -11.258 938 HZ1 LYS 551 HZ1 LYS 551 83.437 15.838 -9.841 939 HZ2 LYS 551 HZ2 LYS 551 84.586 16.728 -10.707 940 HZ3 LYS 551 HZ3 LYS 551 85.017 15.983 -9.252 941 H ARG 552 H ARG 552 82.457 11.421 -9.902 942 HA ARG 552 HA ARG 552 80.686 9.067 -9.974 943 HB2 ARG 552 HB2 ARG 552 80.390 11.595 -8.626 944 HB3 ARG 552 HB3 ARG 552 79.095 11.381 -9.796 945 HG2 ARG 552 HG2 ARG 552 78.399 9.347 -8.775 946 HG3 ARG 552 HG3 ARG 552 79.825 9.319 -7.733 947 HD2 ARG 552 HD2 ARG 552 79.044 11.070 -6.413 948 HD3 ARG 552 HD3 ARG 552 77.909 11.619 -7.644 949 HE ARG 552 HE ARG 552 76.950 9.188 -7.039 950 HH11 ARG 552 HH11 ARG 552 77.940 11.865 -5.044 951 HH12 ARG 552 HH12 ARG 552 76.818 11.504 -3.775 952 HH21 ARG 552 HH21 ARG 552 75.465 8.704 -5.374 953 HH22 ARG 552 HH22 ARG 552 75.410 9.707 -3.963 954 H GLY 553 H GLY 553 81.195 12.295 -11.362 955 HA2 GLY 553 HA2 GLY 553 80.658 13.156 -13.429 956 HA3 GLY 553 HA3 GLY 553 81.206 11.591 -14.015 957 H THR 554 H THR 554 78.413 12.070 -11.942 958 HA THR 554 HA THR 554 76.212 11.555 -12.219 959 HB THR 554 HB THR 554 75.466 12.062 -14.769 960 HG1 THR 554 HG1 THR 554 76.903 13.222 -15.809 961 HG21 THR 554 HG21 THR 554 74.774 14.196 -14.017 962 HG22 THR 554 HG22 THR 554 76.085 14.289 -12.843 963 HG23 THR 554 HG23 THR 554 74.761 13.153 -12.594 964 H GLU 555 H GLU 555 75.494 9.537 -12.217 965 HA GLU 555 HA GLU 555 76.637 7.476 -13.787 966 HB2 GLU 555 HB2 GLU 555 75.741 6.869 -11.675 967 HB3 GLU 555 HB3 GLU 555 74.186 7.603 -12.039 968 HG2 GLU 555 HG2 GLU 555 74.030 5.856 -13.911 969 HG3 GLU 555 HG3 GLU 555 75.337 5.037 -13.058 970 H LYS 556 H LYS 556 76.434 7.888 -15.960 971 HA LYS 556 HA LYS 556 75.432 8.196 -18.000 972 HB2 LYS 556 HB2 LYS 556 73.202 6.397 -17.347 973 HB3 LYS 556 HB3 LYS 556 74.417 6.273 -18.612 974 HG2 LYS 556 HG2 LYS 556 76.034 5.547 -16.817 975 HG3 LYS 556 HG3 LYS 556 74.642 5.422 -15.740 976 HD2 LYS 556 HD2 LYS 556 73.885 4.075 -18.062 977 HD3 LYS 556 HD3 LYS 556 75.559 3.595 -17.779 978 HE2 LYS 556 HE2 LYS 556 74.494 2.038 -16.495 979 HE3 LYS 556 HE3 LYS 556 74.692 3.322 -15.301 980 HZ1 LYS 556 HZ1 LYS 556 72.247 2.857 -16.923 981 HZ2 LYS 556 HZ2 LYS 556 72.439 4.039 -15.728 982 HZ3 LYS 556 HZ3 LYS 556 72.446 2.402 -15.304 983 H LEU 557 H LEU 557 72.664 7.818 -18.675 984 HA LEU 557 HA LEU 557 71.682 10.433 -17.880 985 HB2 LEU 557 HB2 LEU 557 71.010 8.456 -20.006 986 HB3 LEU 557 HB3 LEU 557 69.777 9.607 -19.524 987 HG LEU 557 HG LEU 557 72.013 11.194 -19.911 988 HD11 LEU 557 HD11 LEU 557 72.663 10.527 -22.266 989 HD12 LEU 557 HD12 LEU 557 71.957 8.951 -21.911 990 HD13 LEU 557 HD13 LEU 557 73.322 9.541 -20.961 991 HD21 LEU 557 HD21 LEU 557 69.775 11.805 -20.543 992 HD22 LEU 557 HD22 LEU 557 69.729 10.534 -21.764 993 HD23 LEU 557 HD23 LEU 557 70.816 11.909 -21.962 994 H ILE 558 H ILE 558 70.202 10.768 -16.362 995 HA ILE 558 HA ILE 558 68.428 8.550 -15.592 996 HB ILE 558 HB ILE 558 68.614 9.668 -13.222 997 HG12 ILE 558 HG12 ILE 558 71.385 10.202 -14.295 998 HG13 ILE 558 HG13 ILE 558 70.157 11.456 -14.163 999 HG21 ILE 558 HG21 ILE 558 70.368 8.052 -12.633 1000 HG22 ILE 558 HG22 ILE 558 70.724 7.832 -14.347 1001 HG23 ILE 558 HG23 ILE 558 69.154 7.353 -13.704 1002 HD11 ILE 558 HD11 ILE 558 70.280 10.161 -11.666 1003 HD12 ILE 558 HD12 ILE 558 70.782 11.801 -12.076 1004 HD13 ILE 558 HD13 ILE 558 71.939 10.474 -12.178 1005 H THR 559 H THR 559 66.391 9.162 -14.743 1006 HA THR 559 HA THR 559 65.307 11.519 -15.926 1007 HB THR 559 HB THR 559 63.217 10.847 -14.631 1008 HG1 THR 559 HG1 THR 559 63.249 9.028 -13.458 1009 HG21 THR 559 HG21 THR 559 62.908 10.031 -16.695 1010 HG22 THR 559 HG22 THR 559 63.351 8.475 -15.995 1011 HG23 THR 559 HG23 THR 559 64.570 9.453 -16.813 1012 H LYS 560 H LYS 560 65.595 13.488 -15.131 1013 HA LYS 560 HA LYS 560 66.215 13.927 -12.352 1014 HB2 LYS 560 HB2 LYS 560 65.797 15.844 -14.650 1015 HB3 LYS 560 HB3 LYS 560 66.290 16.331 -13.035 1016 HG2 LYS 560 HG2 LYS 560 68.037 14.270 -13.902 1017 HG3 LYS 560 HG3 LYS 560 67.905 15.468 -15.191 1018 HD2 LYS 560 HD2 LYS 560 69.627 16.337 -13.926 1019 HD3 LYS 560 HD3 LYS 560 68.233 17.178 -13.247 1020 HE2 LYS 560 HE2 LYS 560 68.327 16.035 -11.280 1021 HE3 LYS 560 HE3 LYS 560 68.981 14.581 -12.033 1022 HZ1 LYS 560 HZ1 LYS 560 70.518 17.080 -11.580 1023 HZ2 LYS 560 HZ2 LYS 560 71.125 15.621 -12.184 1024 HZ3 LYS 560 HZ3 LYS 560 70.586 15.714 -10.584 1025 H ALA 561 H ALA 561 64.832 14.421 -10.777 1026 HA ALA 561 HA ALA 561 62.849 14.733 -9.696 1027 HB1 ALA 561 HB1 ALA 561 63.124 17.013 -10.073 1028 HB2 ALA 561 HB2 ALA 561 61.489 16.696 -10.655 1029 HB3 ALA 561 HB3 ALA 561 62.817 16.863 -11.803 Start of MODEL 3 1 H1 MET 437 HT1 MET 437 123.490 -7.775 -33.567 2 H2 MET 437 HT2 MET 437 123.169 -8.449 -35.112 3 H3 MET 437 HT3 MET 437 121.876 -8.119 -34.032 4 HA MET 437 HA MET 437 123.634 -5.943 -34.807 5 HB2 MET 437 HB2 MET 437 122.095 -7.603 -36.634 6 HB3 MET 437 HB3 MET 437 121.553 -5.930 -36.661 7 HG2 MET 437 HG2 MET 437 124.409 -6.009 -36.705 8 HG3 MET 437 HG3 MET 437 123.764 -7.058 -37.965 9 HE1 MET 437 HE1 MET 437 123.278 -2.682 -37.222 10 HE2 MET 437 HE2 MET 437 124.842 -3.101 -37.919 11 HE3 MET 437 HE3 MET 437 124.302 -3.882 -36.434 12 H HIS 438 H HIS 438 120.188 -6.724 -35.176 13 HA HIS 438 HA HIS 438 119.571 -4.693 -33.137 14 HB2 HIS 438 HB2 HIS 438 119.244 -4.133 -35.723 15 HB3 HIS 438 HB3 HIS 438 117.733 -4.998 -35.462 16 HD1 HIS 438 HD1 HIS 438 116.156 -3.970 -33.537 17 HD2 HIS 438 HD2 HIS 438 119.243 -1.537 -34.882 18 HE1 HIS 438 HE1 HIS 438 115.550 -1.645 -32.795 19 HE2 HIS 438 HE2 HIS 438 117.486 -0.207 -33.528 20 H HIS 439 H HIS 439 119.485 -6.800 -31.906 21 HA HIS 439 HA HIS 439 116.718 -7.636 -31.738 22 HB2 HIS 439 HB2 HIS 439 118.143 -9.171 -33.362 23 HB3 HIS 439 HB3 HIS 439 118.686 -9.878 -31.845 24 HD1 HIS 439 HD1 HIS 439 117.476 -12.101 -32.348 25 HD2 HIS 439 HD2 HIS 439 114.956 -8.802 -32.165 26 HE1 HIS 439 HE1 HIS 439 115.146 -13.040 -32.240 27 HE2 HIS 439 HE2 HIS 439 113.635 -11.025 -32.200 28 H HIS 440 H HIS 440 120.029 -8.083 -30.564 29 HA HIS 440 HA HIS 440 119.148 -8.914 -27.945 30 HB2 HIS 440 HB2 HIS 440 121.494 -9.197 -29.399 31 HB3 HIS 440 HB3 HIS 440 121.926 -8.040 -28.144 32 HD1 HIS 440 HD1 HIS 440 123.041 -9.262 -26.318 33 HD2 HIS 440 HD2 HIS 440 119.852 -11.417 -27.885 34 HE1 HIS 440 HE1 HIS 440 122.898 -11.355 -24.932 35 HE2 HIS 440 HE2 HIS 440 120.916 -12.609 -25.851 36 H HIS 441 H HIS 441 120.887 -7.586 -26.259 37 HA HIS 441 HA HIS 441 119.484 -5.127 -25.860 38 HB2 HIS 441 HB2 HIS 441 121.453 -6.744 -24.381 39 HB3 HIS 441 HB3 HIS 441 121.564 -5.010 -24.099 40 HD1 HIS 441 HD1 HIS 441 118.194 -6.410 -24.761 41 HD2 HIS 441 HD2 HIS 441 120.550 -5.435 -21.481 42 HE1 HIS 441 HE1 HIS 441 116.635 -6.415 -22.790 43 HE2 HIS 441 HE2 HIS 441 118.091 -5.873 -20.807 44 H HIS 442 H HIS 442 120.300 -3.017 -25.915 45 HA HIS 442 HA HIS 442 122.610 -2.686 -27.699 46 HB2 HIS 442 HB2 HIS 442 120.079 -1.198 -27.301 47 HB3 HIS 442 HB3 HIS 442 121.504 -0.226 -27.651 48 HD1 HIS 442 HD1 HIS 442 119.527 -0.029 -29.776 49 HD2 HIS 442 HD2 HIS 442 122.196 -3.213 -29.648 50 HE1 HIS 442 HE1 HIS 442 119.620 -0.924 -32.124 51 HE2 HIS 442 HE2 HIS 442 121.296 -2.803 -32.039 52 H HIS 443 H HIS 443 121.229 -0.303 -25.486 53 HA HIS 443 HA HIS 443 123.461 -0.460 -23.669 54 HB2 HIS 443 HB2 HIS 443 124.498 0.816 -25.462 55 HB3 HIS 443 HB3 HIS 443 123.149 1.948 -25.471 56 HD1 HIS 443 HD1 HIS 443 123.670 4.050 -24.296 57 HD2 HIS 443 HD2 HIS 443 125.736 0.832 -22.670 58 HE1 HIS 443 HE1 HIS 443 125.077 5.018 -22.450 59 HE2 HIS 443 HE2 HIS 443 126.303 3.050 -21.465 60 H SER 444 H SER 444 120.931 -0.858 -22.968 61 HA SER 444 HA SER 444 119.593 1.558 -22.179 62 HB2 SER 444 HB2 SER 444 119.030 -1.202 -21.099 63 HB3 SER 444 HB3 SER 444 117.915 0.154 -21.264 64 HG SER 444 HG SER 444 117.989 -0.103 -23.496 65 H ASN 445 H ASN 445 119.226 2.250 -20.003 66 HA ASN 445 HA ASN 445 121.504 1.657 -18.258 67 HB2 ASN 445 HB2 ASN 445 120.424 3.736 -17.016 68 HB3 ASN 445 HB3 ASN 445 121.464 3.947 -18.421 69 HD21 ASN 445 HD21 ASN 445 120.642 5.742 -19.300 70 HD22 ASN 445 HD22 ASN 445 119.011 5.919 -19.840 71 H ALA 446 H ALA 446 121.011 1.774 -15.859 72 HA ALA 446 HA ALA 446 118.628 1.390 -14.627 73 HB1 ALA 446 HB1 ALA 446 119.122 -0.828 -16.347 74 HB2 ALA 446 HB2 ALA 446 117.747 -0.534 -15.283 75 HB3 ALA 446 HB3 ALA 446 119.170 -1.379 -14.673 76 H THR 447 H THR 447 120.187 2.458 -13.227 77 HA THR 447 HA THR 447 122.139 0.711 -11.938 78 HB THR 447 HB THR 447 122.063 3.305 -10.737 79 HG1 THR 447 HG1 THR 447 121.147 4.062 -12.685 80 HG21 THR 447 HG21 THR 447 124.100 2.204 -12.663 81 HG22 THR 447 HG22 THR 447 123.983 1.694 -10.979 82 HG23 THR 447 HG23 THR 447 124.355 3.374 -11.367 83 H GLY 448 H GLY 448 122.276 1.702 -9.413 84 HA2 GLY 448 HA2 GLY 448 121.386 1.295 -7.332 85 HA3 GLY 448 HA3 GLY 448 119.980 2.142 -7.961 86 HA PRO 449 HA PRO 449 119.528 -2.764 -8.652 87 HB2 PRO 449 HB2 PRO 449 120.841 -3.403 -6.054 88 HB3 PRO 449 HB3 PRO 449 120.841 -4.313 -7.569 89 HG2 PRO 449 HG2 PRO 449 122.989 -2.933 -6.813 90 HG3 PRO 449 HG3 PRO 449 122.497 -2.994 -8.516 91 HD2 PRO 449 HD2 PRO 449 122.190 -0.787 -6.531 92 HD3 PRO 449 HD3 PRO 449 122.517 -0.703 -8.273 93 H GLN 450 H GLN 450 117.864 -4.000 -7.633 94 HA GLN 450 HA GLN 450 115.928 -4.231 -6.464 95 HB2 GLN 450 HB2 GLN 450 117.883 -4.228 -4.628 96 HB3 GLN 450 HB3 GLN 450 117.005 -2.802 -4.093 97 HG2 GLN 450 HG2 GLN 450 116.087 -4.534 -2.852 98 HG3 GLN 450 HG3 GLN 450 114.925 -4.279 -4.153 99 HE21 GLN 450 HE21 GLN 450 114.410 -6.521 -3.271 100 HE22 GLN 450 HE22 GLN 450 115.169 -7.848 -4.075 101 H PHE 451 H PHE 451 114.169 -3.109 -6.904 102 HA PHE 451 HA PHE 451 114.235 -0.225 -7.022 103 HB2 PHE 451 HB2 PHE 451 111.976 -0.415 -7.926 104 HB3 PHE 451 HB3 PHE 451 113.058 -1.536 -8.744 105 HD1 PHE 451 HD1 PHE 451 110.393 -2.105 -9.198 106 HD2 PHE 451 HD2 PHE 451 112.655 -3.038 -5.714 107 HE1 PHE 451 HE1 PHE 451 108.853 -3.956 -8.695 108 HE2 PHE 451 HE2 PHE 451 111.119 -4.888 -5.208 109 HZ PHE 451 HZ PHE 451 109.215 -5.351 -6.698 110 H VAL 452 H VAL 452 114.722 -0.840 -4.464 111 HA VAL 452 HA VAL 452 113.835 -0.997 -2.293 112 HB VAL 452 HB VAL 452 112.946 1.261 -1.691 113 HG11 VAL 452 HG11 VAL 452 115.149 1.512 -1.424 114 HG12 VAL 452 HG12 VAL 452 115.128 2.345 -2.979 115 HG13 VAL 452 HG13 VAL 452 115.512 0.625 -2.905 116 HG21 VAL 452 HG21 VAL 452 112.559 1.377 -4.562 117 HG22 VAL 452 HG22 VAL 452 113.480 2.756 -3.962 118 HG23 VAL 452 HG23 VAL 452 111.889 2.398 -3.292 119 H SER 453 H SER 453 112.273 -2.679 -2.465 120 HA SER 453 HA SER 453 109.594 -2.182 -3.267 121 HB2 SER 453 HB2 SER 453 109.468 -4.411 -3.231 122 HB3 SER 453 HB3 SER 453 111.146 -4.433 -2.689 123 HG SER 453 HG SER 453 110.407 -4.435 -0.555 124 H GLY 454 H GLY 454 110.789 -0.567 -0.888 125 HA2 GLY 454 HA2 GLY 454 110.185 0.010 1.283 126 HA3 GLY 454 HA3 GLY 454 108.664 0.255 0.445 127 H VAL 455 H VAL 455 110.071 -2.917 0.941 128 HA VAL 455 HA VAL 455 109.010 -4.787 1.789 129 HB VAL 455 HB VAL 455 108.630 -3.647 4.430 130 HG11 VAL 455 HG11 VAL 455 109.533 -5.601 5.036 131 HG12 VAL 455 HG12 VAL 455 110.920 -5.396 3.968 132 HG13 VAL 455 HG13 VAL 455 109.403 -6.031 3.331 133 HG21 VAL 455 HG21 VAL 455 110.309 -2.037 3.305 134 HG22 VAL 455 HG22 VAL 455 111.438 -3.386 3.419 135 HG23 VAL 455 HG23 VAL 455 110.711 -2.718 4.879 136 H ILE 456 H ILE 456 107.000 -4.876 0.787 137 HA ILE 456 HA ILE 456 104.751 -3.370 1.692 138 HB ILE 456 HB ILE 456 104.847 -5.855 -0.019 139 HG12 ILE 456 HG12 ILE 456 106.019 -3.998 -1.054 140 HG13 ILE 456 HG13 ILE 456 104.482 -4.246 -1.878 141 HG21 ILE 456 HG21 ILE 456 102.657 -4.814 1.277 142 HG22 ILE 456 HG22 ILE 456 102.618 -5.840 -0.157 143 HG23 ILE 456 HG23 ILE 456 102.559 -4.084 -0.324 144 HD11 ILE 456 HD11 ILE 456 105.478 -1.932 -0.441 145 HD12 ILE 456 HD12 ILE 456 103.857 -2.408 0.067 146 HD13 ILE 456 HD13 ILE 456 104.183 -2.059 -1.632 147 H VAL 457 H VAL 457 103.403 -3.772 3.328 148 HA VAL 457 HA VAL 457 103.543 -6.416 4.623 149 HB VAL 457 HB VAL 457 102.964 -3.705 5.815 150 HG11 VAL 457 HG11 VAL 457 101.969 -6.282 6.617 151 HG12 VAL 457 HG12 VAL 457 101.636 -4.690 7.302 152 HG13 VAL 457 HG13 VAL 457 103.031 -5.616 7.858 153 HG21 VAL 457 HG21 VAL 457 104.845 -4.433 7.343 154 HG22 VAL 457 HG22 VAL 457 105.297 -4.087 5.673 155 HG23 VAL 457 HG23 VAL 457 105.129 -5.757 6.214 156 H LYS 458 H LYS 458 101.887 -7.458 3.547 157 HA LYS 458 HA LYS 458 99.373 -6.223 3.016 158 HB2 LYS 458 HB2 LYS 458 100.114 -7.997 1.580 159 HB3 LYS 458 HB3 LYS 458 100.276 -9.102 2.937 160 HG2 LYS 458 HG2 LYS 458 97.773 -8.826 3.268 161 HG3 LYS 458 HG3 LYS 458 97.761 -8.055 1.680 162 HD2 LYS 458 HD2 LYS 458 98.874 -10.109 0.772 163 HD3 LYS 458 HD3 LYS 458 98.627 -10.866 2.348 164 HE2 LYS 458 HE2 LYS 458 96.146 -10.180 1.996 165 HE3 LYS 458 HE3 LYS 458 96.605 -10.047 0.298 166 HZ1 LYS 458 HZ1 LYS 458 97.200 -12.321 0.238 167 HZ2 LYS 458 HZ2 LYS 458 95.687 -12.250 0.991 168 HZ3 LYS 458 HZ3 LYS 458 97.082 -12.485 1.918 169 H ILE 459 H ILE 459 97.867 -5.786 4.465 170 HA ILE 459 HA ILE 459 97.597 -7.555 6.806 171 HB ILE 459 HB ILE 459 96.806 -4.645 6.624 172 HG12 ILE 459 HG12 ILE 459 99.085 -6.031 8.053 173 HG13 ILE 459 HG13 ILE 459 99.218 -4.869 6.736 174 HG21 ILE 459 HG21 ILE 459 96.742 -5.225 9.247 175 HG22 ILE 459 HG22 ILE 459 96.269 -6.792 8.588 176 HG23 ILE 459 HG23 ILE 459 95.333 -5.349 8.196 177 HD11 ILE 459 HD11 ILE 459 99.406 -3.271 8.248 178 HD12 ILE 459 HD12 ILE 459 99.088 -4.412 9.554 179 HD13 ILE 459 HD13 ILE 459 97.747 -3.594 8.750 180 H ILE 460 H ILE 460 95.810 -8.702 6.919 181 HA ILE 460 HA ILE 460 93.378 -7.691 5.613 182 HB ILE 460 HB ILE 460 94.531 -9.442 4.198 183 HG12 ILE 460 HG12 ILE 460 91.929 -8.849 4.491 184 HG13 ILE 460 HG13 ILE 460 92.513 -10.046 3.342 185 HG21 ILE 460 HG21 ILE 460 93.876 -11.825 5.024 186 HG22 ILE 460 HG22 ILE 460 93.927 -11.073 6.617 187 HG23 ILE 460 HG23 ILE 460 95.361 -11.061 5.591 188 HD11 ILE 460 HD11 ILE 460 90.536 -10.513 5.061 189 HD12 ILE 460 HD12 ILE 460 91.899 -11.014 6.061 190 HD13 ILE 460 HD13 ILE 460 91.630 -11.773 4.492 191 H SER 461 H SER 461 91.537 -7.939 6.763 192 HA SER 461 HA SER 461 91.745 -9.453 9.283 193 HB2 SER 461 HB2 SER 461 90.307 -7.835 10.338 194 HB3 SER 461 HB3 SER 461 91.612 -6.958 9.542 195 HG SER 461 HG SER 461 89.084 -7.411 8.347 196 H THR 462 H THR 462 89.132 -9.329 10.083 197 HA THR 462 HA THR 462 87.778 -10.933 8.013 198 HB THR 462 HB THR 462 86.505 -11.940 9.958 199 HG1 THR 462 HG1 THR 462 88.607 -11.274 11.659 200 HG21 THR 462 HG21 THR 462 88.288 -13.495 10.545 201 HG22 THR 462 HG22 THR 462 89.491 -12.372 9.911 202 HG23 THR 462 HG23 THR 462 88.326 -13.122 8.821 203 H GLU 463 H GLU 463 87.667 -8.045 9.732 204 HA GLU 463 HA GLU 463 85.601 -6.841 8.547 205 HB2 GLU 463 HB2 GLU 463 84.583 -8.891 10.391 206 HB3 GLU 463 HB3 GLU 463 83.858 -7.304 10.607 207 HG2 GLU 463 HG2 GLU 463 84.025 -8.115 7.816 208 HG3 GLU 463 HG3 GLU 463 83.066 -9.212 8.809 209 HA PRO 464 HA PRO 464 86.041 -5.248 13.268 210 HB2 PRO 464 HB2 PRO 464 88.762 -6.458 13.505 211 HB3 PRO 464 HB3 PRO 464 87.553 -6.153 14.759 212 HG2 PRO 464 HG2 PRO 464 87.922 -8.611 13.813 213 HG3 PRO 464 HG3 PRO 464 86.293 -8.016 14.184 214 HD2 PRO 464 HD2 PRO 464 87.611 -8.411 11.545 215 HD3 PRO 464 HD3 PRO 464 85.901 -8.581 11.991 216 H LEU 465 H LEU 465 88.322 -5.528 10.651 217 HA LEU 465 HA LEU 465 90.220 -3.672 11.046 218 HB2 LEU 465 HB2 LEU 465 89.086 -4.857 8.807 219 HB3 LEU 465 HB3 LEU 465 88.916 -3.140 8.501 220 HG LEU 465 HG LEU 465 91.587 -3.918 9.443 221 HD11 LEU 465 HD11 LEU 465 91.846 -4.588 6.812 222 HD12 LEU 465 HD12 LEU 465 90.315 -5.354 7.235 223 HD13 LEU 465 HD13 LEU 465 91.774 -5.734 8.149 224 HD21 LEU 465 HD21 LEU 465 90.293 -1.977 7.701 225 HD22 LEU 465 HD22 LEU 465 91.782 -2.630 7.018 226 HD23 LEU 465 HD23 LEU 465 91.801 -1.861 8.606 227 HA PRO 466 HA PRO 466 87.640 -0.192 12.374 228 HB2 PRO 466 HB2 PRO 466 89.814 1.322 13.119 229 HB3 PRO 466 HB3 PRO 466 89.006 0.150 14.162 230 HG2 PRO 466 HG2 PRO 466 91.508 -0.155 12.553 231 HG3 PRO 466 HG3 PRO 466 91.141 -0.746 14.183 232 HD2 PRO 466 HD2 PRO 466 91.081 -2.364 12.039 233 HD3 PRO 466 HD3 PRO 466 89.949 -2.563 13.393 234 H GLY 467 H GLY 467 90.685 0.194 10.546 235 HA2 GLY 467 HA2 GLY 467 89.844 1.230 8.236 236 HA3 GLY 467 HA3 GLY 467 89.656 2.614 9.300 237 H ARG 468 H ARG 468 91.228 3.340 7.496 238 HA ARG 468 HA ARG 468 93.904 2.475 7.520 239 HB2 ARG 468 HB2 ARG 468 93.799 3.768 5.696 240 HB3 ARG 468 HB3 ARG 468 92.338 4.556 6.268 241 HG2 ARG 468 HG2 ARG 468 93.528 6.273 7.306 242 HG3 ARG 468 HG3 ARG 468 95.039 5.362 7.286 243 HD2 ARG 468 HD2 ARG 468 95.501 6.653 5.501 244 HD3 ARG 468 HD3 ARG 468 94.502 5.481 4.643 245 HE ARG 468 HE ARG 468 92.687 7.283 5.453 246 HH11 ARG 468 HH11 ARG 468 95.758 7.625 3.852 247 HH12 ARG 468 HH12 ARG 468 95.300 9.059 2.995 248 HH21 ARG 468 HH21 ARG 468 92.070 9.171 4.331 249 HH22 ARG 468 HH22 ARG 468 93.203 9.939 3.269 250 H LYS 469 H LYS 469 92.213 5.008 9.305 251 HA LYS 469 HA LYS 469 94.437 6.190 10.526 252 HB2 LYS 469 HB2 LYS 469 92.794 7.011 12.217 253 HB3 LYS 469 HB3 LYS 469 92.318 7.314 10.552 254 HG2 LYS 469 HG2 LYS 469 91.165 4.879 11.077 255 HG3 LYS 469 HG3 LYS 469 91.010 5.731 12.614 256 HD2 LYS 469 HD2 LYS 469 90.193 7.700 11.089 257 HD3 LYS 469 HD3 LYS 469 89.860 6.402 9.941 258 HE2 LYS 469 HE2 LYS 469 87.863 6.786 11.186 259 HE3 LYS 469 HE3 LYS 469 88.551 5.261 11.742 260 HZ1 LYS 469 HZ1 LYS 469 88.126 6.232 13.731 261 HZ2 LYS 469 HZ2 LYS 469 88.302 7.809 13.148 262 HZ3 LYS 469 HZ3 LYS 469 89.672 6.874 13.481 263 H GLN 470 H GLN 470 92.349 3.540 11.629 264 HA GLN 470 HA GLN 470 93.802 3.216 14.080 265 HB2 GLN 470 HB2 GLN 470 91.592 1.708 12.728 266 HB3 GLN 470 HB3 GLN 470 92.417 1.016 14.118 267 HG2 GLN 470 HG2 GLN 470 91.097 3.719 14.120 268 HG3 GLN 470 HG3 GLN 470 90.314 2.235 14.657 269 HE21 GLN 470 HE21 GLN 470 92.050 0.954 16.137 270 HE22 GLN 470 HE22 GLN 470 92.601 1.901 17.472 271 H VAL 471 H VAL 471 93.656 1.462 10.987 272 HA VAL 471 HA VAL 471 95.405 -0.620 11.746 273 HB VAL 471 HB VAL 471 94.719 0.503 9.032 274 HG11 VAL 471 HG11 VAL 471 95.757 -2.127 8.827 275 HG12 VAL 471 HG12 VAL 471 96.923 -1.155 9.723 276 HG13 VAL 471 HG13 VAL 471 96.390 -0.639 8.123 277 HG21 VAL 471 HG21 VAL 471 92.823 -0.564 9.785 278 HG22 VAL 471 HG22 VAL 471 93.732 -1.748 10.724 279 HG23 VAL 471 HG23 VAL 471 93.654 -1.887 8.968 280 H ARG 472 H ARG 472 95.978 2.475 10.096 281 HA ARG 472 HA ARG 472 98.753 2.103 9.738 282 HB2 ARG 472 HB2 ARG 472 98.825 4.283 8.974 283 HB3 ARG 472 HB3 ARG 472 97.147 3.859 8.680 284 HG2 ARG 472 HG2 ARG 472 96.613 4.944 10.895 285 HG3 ARG 472 HG3 ARG 472 98.265 5.565 10.883 286 HD2 ARG 472 HD2 ARG 472 97.247 6.135 8.348 287 HD3 ARG 472 HD3 ARG 472 95.934 6.507 9.464 288 HE ARG 472 HE ARG 472 98.078 7.698 10.607 289 HH11 ARG 472 HH11 ARG 472 96.700 7.802 7.409 290 HH12 ARG 472 HH12 ARG 472 97.200 9.433 7.107 291 HH21 ARG 472 HH21 ARG 472 98.737 9.844 10.221 292 HH22 ARG 472 HH22 ARG 472 98.358 10.595 8.706 293 H ASP 473 H ASP 473 96.838 3.582 12.316 294 HA ASP 473 HA ASP 473 99.018 4.526 13.847 295 HB2 ASP 473 HB2 ASP 473 96.507 5.097 14.067 296 HB3 ASP 473 HB3 ASP 473 96.404 3.640 15.049 297 H THR 474 H THR 474 97.309 1.446 13.743 298 HA THR 474 HA THR 474 98.480 0.299 16.041 299 HB THR 474 HB THR 474 97.949 -1.912 14.838 300 HG1 THR 474 HG1 THR 474 96.612 -1.727 13.028 301 HG21 THR 474 HG21 THR 474 96.335 -1.450 16.369 302 HG22 THR 474 HG22 THR 474 95.372 -1.223 14.908 303 HG23 THR 474 HG23 THR 474 96.052 0.175 15.743 304 H LEU 475 H LEU 475 99.143 -0.863 12.743 305 HA LEU 475 HA LEU 475 101.514 -2.098 13.214 306 HB2 LEU 475 HB2 LEU 475 102.136 -1.533 10.841 307 HB3 LEU 475 HB3 LEU 475 100.565 -2.284 11.057 308 HG LEU 475 HG LEU 475 99.958 0.399 11.147 309 HD11 LEU 475 HD11 LEU 475 101.061 1.213 8.998 310 HD12 LEU 475 HD12 LEU 475 102.253 -0.058 9.269 311 HD13 LEU 475 HD13 LEU 475 102.042 1.221 10.464 312 HD21 LEU 475 HD21 LEU 475 98.723 -0.040 9.256 313 HD22 LEU 475 HD22 LEU 475 98.999 -1.670 9.871 314 HD23 LEU 475 HD23 LEU 475 99.977 -1.054 8.540 315 H ALA 476 H ALA 476 101.050 1.371 12.632 316 HA ALA 476 HA ALA 476 103.820 2.014 12.659 317 HB1 ALA 476 HB1 ALA 476 103.091 4.340 12.895 318 HB2 ALA 476 HB2 ALA 476 101.441 3.791 13.189 319 HB3 ALA 476 HB3 ALA 476 102.200 3.505 11.623 320 H ALA 477 H ALA 477 101.437 1.483 15.101 321 HA ALA 477 HA ALA 477 102.758 2.834 17.231 322 HB1 ALA 477 HB1 ALA 477 100.470 2.444 17.576 323 HB2 ALA 477 HB2 ALA 477 101.285 1.331 18.675 324 HB3 ALA 477 HB3 ALA 477 100.608 0.736 17.159 325 H ILE 478 H ILE 478 103.048 -0.296 15.763 326 HA ILE 478 HA ILE 478 104.596 -1.444 17.912 327 HB ILE 478 HB ILE 478 104.559 -2.519 15.110 328 HG12 ILE 478 HG12 ILE 478 102.232 -1.995 15.625 329 HG13 ILE 478 HG13 ILE 478 102.482 -3.737 15.668 330 HG21 ILE 478 HG21 ILE 478 104.692 -4.669 16.274 331 HG22 ILE 478 HG22 ILE 478 104.638 -3.831 17.824 332 HG23 ILE 478 HG23 ILE 478 106.011 -3.595 16.742 333 HD11 ILE 478 HD11 ILE 478 101.314 -2.146 17.627 334 HD12 ILE 478 HD12 ILE 478 102.896 -2.590 18.270 335 HD13 ILE 478 HD13 ILE 478 101.767 -3.845 17.757 336 H SER 479 H SER 479 105.173 0.283 14.952 337 HA SER 479 HA SER 479 107.850 0.905 15.658 338 HB2 SER 479 HB2 SER 479 107.884 -1.531 14.673 339 HB3 SER 479 HB3 SER 479 107.732 -0.697 13.125 340 HG SER 479 HG SER 479 109.828 -0.631 14.993 341 H GLU 480 H GLU 480 108.893 2.286 14.008 342 HA GLU 480 HA GLU 480 106.968 4.070 12.863 343 HB2 GLU 480 HB2 GLU 480 108.841 5.169 13.710 344 HB3 GLU 480 HB3 GLU 480 109.961 4.005 13.017 345 HG2 GLU 480 HG2 GLU 480 108.363 5.526 11.076 346 HG3 GLU 480 HG3 GLU 480 109.516 6.467 12.022 347 H VAL 481 H VAL 481 106.059 3.881 10.938 348 HA VAL 481 HA VAL 481 107.452 2.329 8.856 349 HB VAL 481 HB VAL 481 105.225 2.013 7.818 350 HG11 VAL 481 HG11 VAL 481 105.298 1.072 10.680 351 HG12 VAL 481 HG12 VAL 481 106.225 0.347 9.365 352 HG13 VAL 481 HG13 VAL 481 104.462 0.310 9.327 353 HG21 VAL 481 HG21 VAL 481 103.364 2.428 9.731 354 HG22 VAL 481 HG22 VAL 481 103.713 3.568 8.431 355 HG23 VAL 481 HG23 VAL 481 104.436 3.797 10.023 356 H LEU 482 H LEU 482 106.958 3.025 6.596 357 HA LEU 482 HA LEU 482 107.424 5.861 6.378 358 HB2 LEU 482 HB2 LEU 482 108.375 3.824 4.957 359 HB3 LEU 482 HB3 LEU 482 106.965 4.170 3.973 360 HG LEU 482 HG LEU 482 109.346 5.917 4.507 361 HD11 LEU 482 HD11 LEU 482 108.007 5.526 1.876 362 HD12 LEU 482 HD12 LEU 482 109.004 4.227 2.531 363 HD13 LEU 482 HD13 LEU 482 109.706 5.819 2.247 364 HD21 LEU 482 HD21 LEU 482 107.888 7.582 3.080 365 HD22 LEU 482 HD22 LEU 482 107.780 7.550 4.840 366 HD23 LEU 482 HD23 LEU 482 106.558 6.733 3.866 367 H TYR 483 H TYR 483 105.151 3.741 4.623 368 HA TYR 483 HA TYR 483 103.040 5.727 5.070 369 HB2 TYR 483 HB2 TYR 483 104.080 6.327 2.928 370 HB3 TYR 483 HB3 TYR 483 103.813 4.690 2.336 371 HD1 TYR 483 HD1 TYR 483 101.256 3.900 2.543 372 HD2 TYR 483 HD2 TYR 483 102.568 7.939 2.276 373 HE1 TYR 483 HE1 TYR 483 99.039 4.559 1.709 374 HE2 TYR 483 HE2 TYR 483 100.354 8.608 1.441 375 HH TYR 483 HH TYR 483 98.049 7.807 1.492 376 H VAL 484 H VAL 484 101.007 4.893 5.228 377 HA VAL 484 HA VAL 484 100.774 1.972 4.945 378 HB VAL 484 HB VAL 484 98.798 3.556 6.525 379 HG11 VAL 484 HG11 VAL 484 99.758 1.082 7.657 380 HG12 VAL 484 HG12 VAL 484 99.235 0.859 5.988 381 HG13 VAL 484 HG13 VAL 484 98.125 1.539 7.177 382 HG21 VAL 484 HG21 VAL 484 100.358 3.016 8.533 383 HG22 VAL 484 HG22 VAL 484 100.657 4.459 7.564 384 HG23 VAL 484 HG23 VAL 484 101.631 3.011 7.312 385 H ASP 485 H ASP 485 99.734 1.396 3.156 386 HA ASP 485 HA ASP 485 97.716 3.183 2.017 387 HB2 ASP 485 HB2 ASP 485 99.626 2.216 0.629 388 HB3 ASP 485 HB3 ASP 485 98.806 0.662 0.766 389 H LEU 486 H LEU 486 95.603 2.733 2.069 390 HA LEU 486 HA LEU 486 94.762 0.000 2.768 391 HB2 LEU 486 HB2 LEU 486 94.562 1.218 4.801 392 HB3 LEU 486 HB3 LEU 486 93.847 2.596 3.988 393 HG LEU 486 HG LEU 486 92.142 0.398 3.490 394 HD11 LEU 486 HD11 LEU 486 93.549 0.033 5.926 395 HD12 LEU 486 HD12 LEU 486 92.207 -0.910 5.276 396 HD13 LEU 486 HD13 LEU 486 91.887 0.481 6.312 397 HD21 LEU 486 HD21 LEU 486 91.945 3.040 4.131 398 HD22 LEU 486 HD22 LEU 486 91.359 2.267 5.603 399 HD23 LEU 486 HD23 LEU 486 90.589 1.913 4.056 400 H LEU 487 H LEU 487 93.313 -0.811 1.351 401 HA LEU 487 HA LEU 487 92.405 0.675 -0.853 402 HB2 LEU 487 HB2 LEU 487 91.812 -2.007 0.290 403 HB3 LEU 487 HB3 LEU 487 90.682 -1.358 -0.884 404 HG LEU 487 HG LEU 487 92.977 -0.954 -2.226 405 HD11 LEU 487 HD11 LEU 487 94.617 -2.516 -1.833 406 HD12 LEU 487 HD12 LEU 487 93.529 -3.603 -0.970 407 HD13 LEU 487 HD13 LEU 487 94.105 -2.130 -0.190 408 HD21 LEU 487 HD21 LEU 487 92.125 -3.709 -2.540 409 HD22 LEU 487 HD22 LEU 487 92.001 -2.354 -3.660 410 HD23 LEU 487 HD23 LEU 487 90.761 -2.596 -2.431 411 H GLU 488 H GLU 488 91.432 2.555 -0.011 412 HA GLU 488 HA GLU 488 89.582 3.001 1.847 413 HB2 GLU 488 HB2 GLU 488 90.299 4.271 -0.569 414 HB3 GLU 488 HB3 GLU 488 88.543 4.204 -0.550 415 HG2 GLU 488 HG2 GLU 488 88.741 6.119 0.592 416 HG3 GLU 488 HG3 GLU 488 89.008 5.041 1.963 417 H GLY 489 H GLY 489 87.694 2.185 2.456 418 HA2 GLY 489 HA2 GLY 489 85.553 1.323 2.299 419 HA3 GLY 489 HA3 GLY 489 85.680 1.426 0.548 420 H ASP 490 H ASP 490 88.349 -0.174 1.746 421 HA ASP 490 HA ASP 490 87.059 -2.790 1.344 422 HB2 ASP 490 HB2 ASP 490 88.818 -1.764 -0.390 423 HB3 ASP 490 HB3 ASP 490 89.954 -2.491 0.742 424 H THR 491 H THR 491 88.207 -4.608 2.346 425 HA THR 491 HA THR 491 89.125 -3.856 5.023 426 HB THR 491 HB THR 491 88.343 -5.863 5.817 427 HG1 THR 491 HG1 THR 491 87.906 -7.627 4.125 428 HG21 THR 491 HG21 THR 491 86.167 -5.880 5.224 429 HG22 THR 491 HG22 THR 491 86.529 -6.085 3.509 430 HG23 THR 491 HG23 THR 491 86.628 -4.486 4.246 431 H GLU 492 H GLU 492 90.698 -4.105 2.336 432 HA GLU 492 HA GLU 492 92.881 -5.746 3.440 433 HB2 GLU 492 HB2 GLU 492 92.846 -5.200 0.528 434 HB3 GLU 492 HB3 GLU 492 93.333 -6.648 1.398 435 HG2 GLU 492 HG2 GLU 492 90.658 -6.632 1.856 436 HG3 GLU 492 HG3 GLU 492 90.742 -5.918 0.246 437 H CYS 493 H CYS 493 94.484 -4.511 4.164 438 HA CYS 493 HA CYS 493 95.176 -2.085 2.644 439 HB2 CYS 493 HB2 CYS 493 95.967 -1.175 4.892 440 HB3 CYS 493 HB3 CYS 493 94.226 -1.278 4.652 441 HG CYS 493 HG CYS 493 94.191 -3.353 6.228 442 H HIS 494 H HIS 494 97.321 -1.676 2.295 443 HA HIS 494 HA HIS 494 99.261 -3.618 3.353 444 HB2 HIS 494 HB2 HIS 494 99.171 -2.545 0.524 445 HB3 HIS 494 HB3 HIS 494 100.410 -3.611 1.178 446 HD1 HIS 494 HD1 HIS 494 96.604 -3.824 1.226 447 HD2 HIS 494 HD2 HIS 494 99.938 -6.064 0.165 448 HE1 HIS 494 HE1 HIS 494 95.705 -6.040 0.448 449 HE2 HIS 494 HE2 HIS 494 97.733 -7.332 -0.302 450 H ALA 495 H ALA 495 100.719 -2.573 4.556 451 HA ALA 495 HA ALA 495 101.229 0.257 4.007 452 HB1 ALA 495 HB1 ALA 495 101.350 0.555 6.205 453 HB2 ALA 495 HB2 ALA 495 102.499 -0.769 6.394 454 HB3 ALA 495 HB3 ALA 495 100.768 -1.100 6.376 455 H ARG 496 H ARG 496 103.161 1.039 3.422 456 HA ARG 496 HA ARG 496 105.252 -0.872 2.720 457 HB2 ARG 496 HB2 ARG 496 105.624 2.015 2.167 458 HB3 ARG 496 HB3 ARG 496 105.937 0.621 1.142 459 HG2 ARG 496 HG2 ARG 496 103.181 0.661 1.385 460 HG3 ARG 496 HG3 ARG 496 103.629 2.363 1.250 461 HD2 ARG 496 HD2 ARG 496 105.059 0.628 -0.612 462 HD3 ARG 496 HD3 ARG 496 103.311 0.617 -0.844 463 HE ARG 496 HE ARG 496 105.084 2.691 -1.559 464 HH11 ARG 496 HH11 ARG 496 101.932 2.174 -0.170 465 HH12 ARG 496 HH12 ARG 496 101.293 3.683 -0.734 466 HH21 ARG 496 HH21 ARG 496 104.255 4.678 -2.305 467 HH22 ARG 496 HH22 ARG 496 102.615 5.106 -1.949 468 H PHE 497 H PHE 497 107.113 -1.072 3.800 469 HA PHE 497 HA PHE 497 107.623 0.789 6.025 470 HB2 PHE 497 HB2 PHE 497 108.407 -2.101 5.639 471 HB3 PHE 497 HB3 PHE 497 109.020 -1.095 6.947 472 HD1 PHE 497 HD1 PHE 497 105.651 -1.665 5.441 473 HD2 PHE 497 HD2 PHE 497 108.060 -1.625 8.947 474 HE1 PHE 497 HE1 PHE 497 103.680 -2.235 6.797 475 HE2 PHE 497 HE2 PHE 497 106.095 -2.196 10.311 476 HZ PHE 497 HZ PHE 497 103.900 -2.503 9.236 477 H LYS 498 H LYS 498 109.737 1.513 6.433 478 HA LYS 498 HA LYS 498 111.311 1.924 4.064 479 HB2 LYS 498 HB2 LYS 498 111.002 3.678 5.794 480 HB3 LYS 498 HB3 LYS 498 111.922 2.692 6.923 481 HG2 LYS 498 HG2 LYS 498 113.689 2.804 4.925 482 HG3 LYS 498 HG3 LYS 498 112.841 4.326 4.643 483 HD2 LYS 498 HD2 LYS 498 113.263 4.203 7.406 484 HD3 LYS 498 HD3 LYS 498 114.771 3.651 6.674 485 HE2 LYS 498 HE2 LYS 498 114.656 5.689 5.192 486 HE3 LYS 498 HE3 LYS 498 113.333 6.256 6.213 487 HZ1 LYS 498 HZ1 LYS 498 114.766 6.935 7.745 488 HZ2 LYS 498 HZ2 LYS 498 116.015 6.640 6.644 489 HZ3 LYS 498 HZ3 LYS 498 115.580 5.452 7.766 490 H THR 499 H THR 499 111.274 -0.349 6.625 491 HA THR 499 HA THR 499 113.750 -1.530 5.600 492 HB THR 499 HB THR 499 114.071 -2.192 8.169 493 HG1 THR 499 HG1 THR 499 112.626 -0.978 9.227 494 HG21 THR 499 HG21 THR 499 116.005 -1.222 7.662 495 HG22 THR 499 HG22 THR 499 115.277 0.352 7.987 496 HG23 THR 499 HG23 THR 499 115.240 -0.317 6.355 497 HA PRO 500 HA PRO 500 111.405 -5.256 5.783 498 HB2 PRO 500 HB2 PRO 500 113.387 -7.078 5.772 499 HB3 PRO 500 HB3 PRO 500 113.028 -6.074 4.363 500 HG2 PRO 500 HG2 PRO 500 115.161 -5.728 6.436 501 HG3 PRO 500 HG3 PRO 500 115.282 -5.572 4.674 502 HD2 PRO 500 HD2 PRO 500 115.036 -3.434 6.339 503 HD3 PRO 500 HD3 PRO 500 114.407 -3.444 4.679 504 H GLU 501 H GLU 501 114.084 -4.964 8.089 505 HA GLU 501 HA GLU 501 113.341 -7.040 9.810 506 HB2 GLU 501 HB2 GLU 501 114.746 -5.943 11.479 507 HB3 GLU 501 HB3 GLU 501 115.529 -5.937 9.904 508 HG2 GLU 501 HG2 GLU 501 114.228 -3.559 9.852 509 HG3 GLU 501 HG3 GLU 501 114.610 -3.709 11.566 510 H ASP 502 H ASP 502 112.297 -3.676 9.660 511 HA ASP 502 HA ASP 502 110.942 -3.570 12.114 512 HB2 ASP 502 HB2 ASP 502 110.779 -2.033 9.554 513 HB3 ASP 502 HB3 ASP 502 109.518 -1.803 10.764 514 H ALA 503 H ALA 503 109.865 -4.619 8.907 515 HA ALA 503 HA ALA 503 107.140 -4.951 9.597 516 HB1 ALA 503 HB1 ALA 503 108.807 -5.474 7.291 517 HB2 ALA 503 HB2 ALA 503 107.091 -5.075 7.378 518 HB3 ALA 503 HB3 ALA 503 107.618 -6.750 7.547 519 H GLN 504 H GLN 504 109.890 -7.190 9.556 520 HA GLN 504 HA GLN 504 108.446 -9.522 10.164 521 HB2 GLN 504 HB2 GLN 504 110.834 -9.366 9.347 522 HB3 GLN 504 HB3 GLN 504 111.292 -8.946 10.992 523 HG2 GLN 504 HG2 GLN 504 109.670 -11.367 10.793 524 HG3 GLN 504 HG3 GLN 504 111.220 -11.465 9.961 525 HE21 GLN 504 HE21 GLN 504 112.954 -11.938 11.125 526 HE22 GLN 504 HE22 GLN 504 113.052 -11.900 12.850 527 H ALA 505 H ALA 505 110.046 -7.157 12.258 528 HA ALA 505 HA ALA 505 109.529 -8.506 14.684 529 HB1 ALA 505 HB1 ALA 505 111.085 -6.988 15.191 530 HB2 ALA 505 HB2 ALA 505 109.727 -5.887 15.427 531 HB3 ALA 505 HB3 ALA 505 110.591 -5.905 13.889 532 H VAL 506 H VAL 506 107.724 -5.999 12.935 533 HA VAL 506 HA VAL 506 105.811 -5.549 14.971 534 HB VAL 506 HB VAL 506 106.137 -3.902 13.243 535 HG11 VAL 506 HG11 VAL 506 105.013 -5.926 11.310 536 HG12 VAL 506 HG12 VAL 506 106.707 -5.446 11.419 537 HG13 VAL 506 HG13 VAL 506 105.488 -4.268 10.936 538 HG21 VAL 506 HG21 VAL 506 103.657 -4.823 14.128 539 HG22 VAL 506 HG22 VAL 506 103.449 -4.523 12.403 540 HG23 VAL 506 HG23 VAL 506 104.026 -3.234 13.459 541 H ILE 507 H ILE 507 105.774 -7.667 12.118 542 HA ILE 507 HA ILE 507 103.104 -8.539 12.444 543 HB ILE 507 HB ILE 507 103.791 -10.501 11.048 544 HG12 ILE 507 HG12 ILE 507 106.163 -9.876 9.941 545 HG13 ILE 507 HG13 ILE 507 106.450 -9.309 11.580 546 HG21 ILE 507 HG21 ILE 507 103.080 -9.086 9.488 547 HG22 ILE 507 HG22 ILE 507 104.763 -8.618 9.241 548 HG23 ILE 507 HG23 ILE 507 103.748 -7.703 10.356 549 HD11 ILE 507 HD11 ILE 507 105.979 -11.496 12.465 550 HD12 ILE 507 HD12 ILE 507 107.201 -11.621 11.199 551 HD13 ILE 507 HD13 ILE 507 105.533 -12.082 10.862 552 H ASN 508 H ASN 508 106.130 -9.582 13.809 553 HA ASN 508 HA ASN 508 105.171 -12.053 14.883 554 HB2 ASN 508 HB2 ASN 508 107.606 -10.359 15.315 555 HB3 ASN 508 HB3 ASN 508 107.244 -11.655 16.451 556 HD21 ASN 508 HD21 ASN 508 108.834 -10.878 13.667 557 HD22 ASN 508 HD22 ASN 508 109.047 -12.462 13.013 558 H ALA 509 H ALA 509 105.505 -8.768 16.059 559 HA ALA 509 HA ALA 509 104.609 -9.347 18.719 560 HB1 ALA 509 HB1 ALA 509 105.063 -7.175 19.216 561 HB2 ALA 509 HB2 ALA 509 104.485 -6.579 17.658 562 HB3 ALA 509 HB3 ALA 509 106.067 -7.352 17.776 563 H TYR 510 H TYR 510 103.076 -8.539 15.725 564 HA TYR 510 HA TYR 510 100.715 -7.381 16.680 565 HB2 TYR 510 HB2 TYR 510 101.723 -8.308 14.169 566 HB3 TYR 510 HB3 TYR 510 100.064 -8.865 14.376 567 HD1 TYR 510 HD1 TYR 510 98.973 -7.484 12.787 568 HD2 TYR 510 HD2 TYR 510 101.489 -5.742 15.742 569 HE1 TYR 510 HE1 TYR 510 98.145 -5.253 12.164 570 HE2 TYR 510 HE2 TYR 510 100.669 -3.502 15.127 571 HH TYR 510 HH TYR 510 98.344 -3.057 12.480 572 H THR 511 H THR 511 101.776 -10.520 17.230 573 HA THR 511 HA THR 511 99.545 -12.114 16.925 574 HB THR 511 HB THR 511 100.343 -13.397 18.905 575 HG1 THR 511 HG1 THR 511 101.229 -11.940 20.283 576 HG21 THR 511 HG21 THR 511 101.617 -14.332 17.334 577 HG22 THR 511 HG22 THR 511 102.914 -13.247 17.838 578 HG23 THR 511 HG23 THR 511 101.844 -12.788 16.513 579 H GLU 512 H GLU 512 100.298 -9.741 19.373 580 HA GLU 512 HA GLU 512 98.339 -10.229 21.256 581 HB2 GLU 512 HB2 GLU 512 99.504 -7.600 20.339 582 HB3 GLU 512 HB3 GLU 512 98.493 -7.775 21.767 583 HG2 GLU 512 HG2 GLU 512 100.126 -9.302 22.743 584 HG3 GLU 512 HG3 GLU 512 101.138 -9.136 21.308 585 H ILE 513 H ILE 513 98.068 -8.369 18.251 586 HA ILE 513 HA ILE 513 95.692 -7.111 18.479 587 HB ILE 513 HB ILE 513 96.602 -8.734 16.099 588 HG12 ILE 513 HG12 ILE 513 98.230 -7.091 16.482 589 HG13 ILE 513 HG13 ILE 513 97.164 -6.342 15.298 590 HG21 ILE 513 HG21 ILE 513 94.361 -8.398 15.630 591 HG22 ILE 513 HG22 ILE 513 95.112 -6.983 14.893 592 HG23 ILE 513 HG23 ILE 513 94.312 -6.844 16.460 593 HD11 ILE 513 HD11 ILE 513 97.235 -5.826 18.258 594 HD12 ILE 513 HD12 ILE 513 96.022 -5.167 17.160 595 HD13 ILE 513 HD13 ILE 513 97.719 -4.728 16.966 596 H ASN 514 H ASN 514 96.079 -10.574 17.754 597 HA ASN 514 HA ASN 514 93.476 -11.305 17.344 598 HB2 ASN 514 HB2 ASN 514 95.341 -12.865 17.121 599 HB3 ASN 514 HB3 ASN 514 95.593 -12.843 18.863 600 HD21 ASN 514 HD21 ASN 514 92.619 -13.040 16.961 601 HD22 ASN 514 HD22 ASN 514 92.096 -14.552 17.611 602 H LYS 515 H LYS 515 95.019 -10.512 20.391 603 HA LYS 515 HA LYS 515 93.295 -11.606 22.226 604 HB2 LYS 515 HB2 LYS 515 94.260 -10.226 23.766 605 HB3 LYS 515 HB3 LYS 515 95.413 -10.016 22.459 606 HG2 LYS 515 HG2 LYS 515 95.093 -7.833 22.698 607 HG3 LYS 515 HG3 LYS 515 93.508 -8.073 21.963 608 HD2 LYS 515 HD2 LYS 515 93.517 -8.733 24.790 609 HD3 LYS 515 HD3 LYS 515 94.025 -7.069 24.497 610 HE2 LYS 515 HE2 LYS 515 91.991 -6.449 23.676 611 HE3 LYS 515 HE3 LYS 515 91.644 -8.049 23.027 612 HZ1 LYS 515 HZ1 LYS 515 91.125 -6.971 25.680 613 HZ2 LYS 515 HZ2 LYS 515 91.605 -8.591 25.612 614 HZ3 LYS 515 HZ3 LYS 515 90.231 -8.080 24.768 615 H LYS 516 H LYS 516 92.682 -9.051 19.995 616 HA LYS 516 HA LYS 516 90.018 -8.667 21.195 617 HB2 LYS 516 HB2 LYS 516 91.792 -6.705 21.146 618 HB3 LYS 516 HB3 LYS 516 91.236 -6.542 19.487 619 HG2 LYS 516 HG2 LYS 516 90.074 -5.063 21.106 620 HG3 LYS 516 HG3 LYS 516 88.998 -6.127 20.200 621 HD2 LYS 516 HD2 LYS 516 89.953 -7.289 22.705 622 HD3 LYS 516 HD3 LYS 516 89.013 -5.811 22.926 623 HE2 LYS 516 HE2 LYS 516 87.183 -6.751 21.643 624 HE3 LYS 516 HE3 LYS 516 88.127 -8.203 21.318 625 HZ1 LYS 516 HZ1 LYS 516 86.638 -8.673 23.091 626 HZ2 LYS 516 HZ2 LYS 516 87.098 -7.288 23.946 627 HZ3 LYS 516 HZ3 LYS 516 88.188 -8.570 23.761 628 H HIS 517 H HIS 517 91.918 -8.856 18.235 629 HA HIS 517 HA HIS 517 89.639 -9.966 16.838 630 HB2 HIS 517 HB2 HIS 517 90.965 -7.748 15.362 631 HB3 HIS 517 HB3 HIS 517 89.313 -8.342 15.252 632 HD1 HIS 517 HD1 HIS 517 87.561 -7.248 16.749 633 HD2 HIS 517 HD2 HIS 517 91.413 -5.833 17.401 634 HE1 HIS 517 HE1 HIS 517 87.291 -5.207 18.192 635 HE2 HIS 517 HE2 HIS 517 89.637 -4.378 18.593 636 H CYS 518 H CYS 518 90.259 -11.471 15.396 637 HA CYS 518 HA CYS 518 93.007 -12.197 15.235 638 HB2 CYS 518 HB2 CYS 518 92.253 -14.014 13.812 639 HB3 CYS 518 HB3 CYS 518 91.155 -13.842 15.177 640 HG CYS 518 HG CYS 518 90.280 -12.542 12.520 641 H TRP 519 H TRP 519 94.335 -10.834 14.176 642 HA TRP 519 HA TRP 519 93.530 -9.875 11.512 643 HB2 TRP 519 HB2 TRP 519 94.544 -8.454 13.605 644 HB3 TRP 519 HB3 TRP 519 96.004 -8.800 12.683 645 HD1 TRP 519 HD1 TRP 519 93.457 -8.630 10.151 646 HE1 TRP 519 HE1 TRP 519 93.302 -6.305 9.090 647 HE3 TRP 519 HE3 TRP 519 96.106 -5.984 13.629 648 HZ2 TRP 519 HZ2 TRP 519 94.183 -3.670 9.654 649 HZ3 TRP 519 HZ3 TRP 519 96.404 -3.564 13.294 650 HH2 TRP 519 HH2 TRP 519 95.461 -2.434 11.347 651 H LYS 520 H LYS 520 94.876 -10.063 9.757 652 HA LYS 520 HA LYS 520 96.877 -12.206 9.972 653 HB2 LYS 520 HB2 LYS 520 95.681 -11.300 7.393 654 HB3 LYS 520 HB3 LYS 520 96.313 -12.882 7.820 655 HG2 LYS 520 HG2 LYS 520 93.782 -11.723 8.961 656 HG3 LYS 520 HG3 LYS 520 93.837 -12.777 7.546 657 HD2 LYS 520 HD2 LYS 520 94.304 -14.629 8.773 658 HD3 LYS 520 HD3 LYS 520 95.239 -13.732 9.971 659 HE2 LYS 520 HE2 LYS 520 93.489 -13.825 11.335 660 HE3 LYS 520 HE3 LYS 520 92.596 -12.815 10.198 661 HZ1 LYS 520 HZ1 LYS 520 91.229 -14.581 10.168 662 HZ2 LYS 520 HZ2 LYS 520 92.418 -15.671 10.675 663 HZ3 LYS 520 HZ3 LYS 520 92.340 -15.201 9.052 664 H LEU 521 H LEU 521 98.944 -11.681 9.687 665 HA LEU 521 HA LEU 521 99.568 -9.272 8.116 666 HB2 LEU 521 HB2 LEU 521 101.254 -10.191 10.429 667 HB3 LEU 521 HB3 LEU 521 101.275 -8.640 9.612 668 HG LEU 521 HG LEU 521 100.297 -8.357 11.785 669 HD11 LEU 521 HD11 LEU 521 99.286 -6.894 10.293 670 HD12 LEU 521 HD12 LEU 521 97.917 -7.683 11.077 671 HD13 LEU 521 HD13 LEU 521 98.418 -8.184 9.462 672 HD21 LEU 521 HD21 LEU 521 99.295 -10.926 11.391 673 HD22 LEU 521 HD22 LEU 521 97.874 -9.884 11.446 674 HD23 LEU 521 HD23 LEU 521 99.023 -9.880 12.784 675 H GLU 522 H GLU 522 100.790 -9.678 6.403 676 HA GLU 522 HA GLU 522 102.739 -11.862 6.512 677 HB2 GLU 522 HB2 GLU 522 100.533 -12.592 5.444 678 HB3 GLU 522 HB3 GLU 522 100.937 -11.502 4.125 679 HG2 GLU 522 HG2 GLU 522 102.779 -13.688 5.035 680 HG3 GLU 522 HG3 GLU 522 101.530 -13.936 3.816 681 H ILE 523 H ILE 523 104.605 -11.467 5.449 682 HA ILE 523 HA ILE 523 104.925 -8.808 4.290 683 HB ILE 523 HB ILE 523 106.911 -10.894 5.177 684 HG12 ILE 523 HG12 ILE 523 106.725 -8.053 6.132 685 HG13 ILE 523 HG13 ILE 523 105.632 -9.275 6.775 686 HG21 ILE 523 HG21 ILE 523 107.259 -8.864 3.193 687 HG22 ILE 523 HG22 ILE 523 108.425 -10.040 3.798 688 HG23 ILE 523 HG23 ILE 523 108.245 -8.482 4.604 689 HD11 ILE 523 HD11 ILE 523 108.229 -8.677 7.619 690 HD12 ILE 523 HD12 ILE 523 108.321 -10.253 6.831 691 HD13 ILE 523 HD13 ILE 523 107.193 -9.996 8.162 692 H LEU 524 H LEU 524 104.816 -8.538 2.173 693 HA LEU 524 HA LEU 524 104.615 -10.651 0.326 694 HB2 LEU 524 HB2 LEU 524 104.806 -7.702 0.193 695 HB3 LEU 524 HB3 LEU 524 105.224 -8.579 -1.265 696 HG LEU 524 HG LEU 524 102.855 -7.844 -1.199 697 HD11 LEU 524 HD11 LEU 524 103.882 -10.437 -1.804 698 HD12 LEU 524 HD12 LEU 524 102.584 -9.542 -2.596 699 HD13 LEU 524 HD13 LEU 524 102.224 -10.589 -1.224 700 HD21 LEU 524 HD21 LEU 524 101.295 -8.846 0.312 701 HD22 LEU 524 HD22 LEU 524 102.597 -8.138 1.266 702 HD23 LEU 524 HD23 LEU 524 102.546 -9.881 0.999 703 H SER 525 H SER 525 106.048 -11.580 -1.062 704 HA SER 525 HA SER 525 108.782 -10.605 -1.199 705 HB2 SER 525 HB2 SER 525 108.595 -12.199 0.779 706 HB3 SER 525 HB3 SER 525 108.279 -13.473 -0.399 707 HG SER 525 HG SER 525 110.321 -13.500 -0.893 708 H GLY 526 H GLY 526 110.092 -11.814 -2.785 709 HA2 GLY 526 HA2 GLY 526 110.381 -12.506 -4.951 710 HA3 GLY 526 HA3 GLY 526 109.142 -13.691 -4.568 711 H ASP 527 H ASP 527 108.236 -13.651 -6.604 712 HA ASP 527 HA ASP 527 107.576 -11.438 -8.125 713 HB2 ASP 527 HB2 ASP 527 107.295 -14.124 -8.431 714 HB3 ASP 527 HB3 ASP 527 105.616 -13.643 -8.207 715 H HIS 528 H HIS 528 105.915 -12.785 -5.353 716 HA HIS 528 HA HIS 528 103.428 -11.512 -5.728 717 HB2 HIS 528 HB2 HIS 528 104.409 -13.303 -3.925 718 HB3 HIS 528 HB3 HIS 528 104.330 -11.847 -2.940 719 HD1 HIS 528 HD1 HIS 528 102.377 -12.682 -1.515 720 HD2 HIS 528 HD2 HIS 528 101.543 -12.585 -5.585 721 HE1 HIS 528 HE1 HIS 528 99.895 -13.039 -1.702 722 HE2 HIS 528 HE2 HIS 528 99.401 -12.896 -4.169 723 H GLU 529 H GLU 529 106.330 -10.523 -3.928 724 HA GLU 529 HA GLU 529 105.252 -8.062 -3.021 725 HB2 GLU 529 HB2 GLU 529 107.097 -8.743 -1.784 726 HB3 GLU 529 HB3 GLU 529 107.999 -9.233 -3.211 727 HG2 GLU 529 HG2 GLU 529 108.595 -7.029 -3.731 728 HG3 GLU 529 HG3 GLU 529 107.381 -6.355 -2.644 729 H GLN 530 H GLN 530 107.280 -8.958 -5.768 730 HA GLN 530 HA GLN 530 107.643 -6.362 -6.801 731 HB2 GLN 530 HB2 GLN 530 109.022 -8.249 -7.510 732 HB3 GLN 530 HB3 GLN 530 107.621 -9.024 -8.236 733 HG2 GLN 530 HG2 GLN 530 107.851 -6.407 -9.314 734 HG3 GLN 530 HG3 GLN 530 109.428 -7.192 -9.402 735 HE21 GLN 530 HE21 GLN 530 106.088 -7.339 -10.395 736 HE22 GLN 530 HE22 GLN 530 106.315 -8.464 -11.686 737 H ARG 531 H ARG 531 105.158 -8.805 -7.347 738 HA ARG 531 HA ARG 531 103.811 -7.614 -9.471 739 HB2 ARG 531 HB2 ARG 531 103.435 -9.919 -8.453 740 HB3 ARG 531 HB3 ARG 531 102.451 -9.115 -7.238 741 HG2 ARG 531 HG2 ARG 531 101.949 -9.030 -10.205 742 HG3 ARG 531 HG3 ARG 531 101.112 -10.076 -9.056 743 HD2 ARG 531 HD2 ARG 531 100.496 -7.924 -7.824 744 HD3 ARG 531 HD3 ARG 531 101.011 -7.083 -9.285 745 HE ARG 531 HE ARG 531 98.575 -8.507 -8.900 746 HH11 ARG 531 HH11 ARG 531 100.974 -7.677 -11.283 747 HH12 ARG 531 HH12 ARG 531 99.873 -7.782 -12.617 748 HH21 ARG 531 HH21 ARG 531 97.116 -8.648 -10.650 749 HH22 ARG 531 HH22 ARG 531 97.681 -8.335 -12.257 750 H TYR 532 H TYR 532 103.109 -7.332 -5.982 751 HA TYR 532 HA TYR 532 101.029 -5.495 -6.181 752 HB2 TYR 532 HB2 TYR 532 101.553 -6.644 -4.099 753 HB3 TYR 532 HB3 TYR 532 103.094 -5.798 -3.994 754 HD1 TYR 532 HD1 TYR 532 103.118 -3.348 -3.575 755 HD2 TYR 532 HD2 TYR 532 99.540 -5.630 -3.340 756 HE1 TYR 532 HE1 TYR 532 102.053 -1.536 -2.293 757 HE2 TYR 532 HE2 TYR 532 98.462 -3.825 -2.064 758 HH TYR 532 HH TYR 532 100.079 -0.741 -1.521 759 H TRP 533 H TRP 533 104.520 -4.939 -5.957 760 HA TRP 533 HA TRP 533 104.392 -2.133 -5.846 761 HB2 TRP 533 HB2 TRP 533 106.507 -4.120 -6.521 762 HB3 TRP 533 HB3 TRP 533 106.782 -2.433 -6.951 763 HD1 TRP 533 HD1 TRP 533 107.320 -4.740 -4.180 764 HE1 TRP 533 HE1 TRP 533 107.768 -3.477 -1.985 765 HE3 TRP 533 HE3 TRP 533 105.799 -0.075 -5.609 766 HZ2 TRP 533 HZ2 TRP 533 107.504 -0.836 -0.988 767 HZ3 TRP 533 HZ3 TRP 533 105.926 1.762 -3.978 768 HH2 TRP 533 HH2 TRP 533 106.762 1.387 -1.716 769 H GLN 534 H GLN 534 104.467 -4.397 -8.545 770 HA GLN 534 HA GLN 534 104.880 -2.636 -10.651 771 HB2 GLN 534 HB2 GLN 534 103.290 -5.176 -10.409 772 HB3 GLN 534 HB3 GLN 534 103.301 -4.269 -11.914 773 HG2 GLN 534 HG2 GLN 534 105.699 -5.427 -10.512 774 HG3 GLN 534 HG3 GLN 534 104.935 -6.050 -11.974 775 HE21 GLN 534 HE21 GLN 534 106.950 -3.577 -10.620 776 HE22 GLN 534 HE22 GLN 534 107.505 -2.919 -12.117 777 H LYS 535 H LYS 535 101.908 -3.496 -8.949 778 HA LYS 535 HA LYS 535 100.146 -1.937 -10.490 779 HB2 LYS 535 HB2 LYS 535 98.867 -3.290 -9.206 780 HB3 LYS 535 HB3 LYS 535 100.078 -3.386 -7.938 781 HG2 LYS 535 HG2 LYS 535 98.523 -0.867 -8.232 782 HG3 LYS 535 HG3 LYS 535 97.740 -2.275 -7.512 783 HD2 LYS 535 HD2 LYS 535 100.405 -1.826 -6.448 784 HD3 LYS 535 HD3 LYS 535 99.346 -0.437 -6.205 785 HE2 LYS 535 HE2 LYS 535 98.221 -3.111 -5.612 786 HE3 LYS 535 HE3 LYS 535 99.452 -2.501 -4.508 787 HZ1 LYS 535 HZ1 LYS 535 97.123 -0.855 -5.283 788 HZ2 LYS 535 HZ2 LYS 535 98.144 -0.674 -3.948 789 HZ3 LYS 535 HZ3 LYS 535 97.038 -1.952 -3.998 790 H ILE 536 H ILE 536 102.106 -1.228 -7.634 791 HA ILE 536 HA ILE 536 101.088 1.349 -7.110 792 HB ILE 536 HB ILE 536 103.818 0.184 -6.551 793 HG12 ILE 536 HG12 ILE 536 101.346 0.543 -4.847 794 HG13 ILE 536 HG13 ILE 536 102.044 -0.981 -5.384 795 HG21 ILE 536 HG21 ILE 536 102.641 2.650 -5.294 796 HG22 ILE 536 HG22 ILE 536 103.751 2.700 -6.664 797 HG23 ILE 536 HG23 ILE 536 104.278 2.019 -5.126 798 HD11 ILE 536 HD11 ILE 536 103.917 0.676 -3.895 799 HD12 ILE 536 HD12 ILE 536 103.500 -1.025 -3.700 800 HD13 ILE 536 HD13 ILE 536 102.487 0.222 -2.971 801 H LEU 537 H LEU 537 104.244 0.550 -8.568 802 HA LEU 537 HA LEU 537 104.930 3.038 -9.488 803 HB2 LEU 537 HB2 LEU 537 105.648 0.282 -10.153 804 HB3 LEU 537 HB3 LEU 537 105.863 1.395 -11.490 805 HG LEU 537 HG LEU 537 106.964 2.472 -9.033 806 HD11 LEU 537 HD11 LEU 537 108.039 -0.169 -10.013 807 HD12 LEU 537 HD12 LEU 537 107.317 0.152 -8.436 808 HD13 LEU 537 HD13 LEU 537 108.852 0.903 -8.872 809 HD21 LEU 537 HD21 LEU 537 108.150 3.485 -10.610 810 HD22 LEU 537 HD22 LEU 537 107.468 2.421 -11.841 811 HD23 LEU 537 HD23 LEU 537 108.936 1.952 -10.984 812 H VAL 538 H VAL 538 103.328 0.523 -11.459 813 HA VAL 538 HA VAL 538 102.896 1.978 -13.747 814 HB VAL 538 HB VAL 538 101.114 -0.107 -12.485 815 HG11 VAL 538 HG11 VAL 538 100.820 1.440 -15.004 816 HG12 VAL 538 HG12 VAL 538 99.589 0.805 -13.914 817 HG13 VAL 538 HG13 VAL 538 100.416 -0.276 -15.034 818 HG21 VAL 538 HG21 VAL 538 102.845 -0.459 -14.905 819 HG22 VAL 538 HG22 VAL 538 102.225 -1.676 -13.790 820 HG23 VAL 538 HG23 VAL 538 103.527 -0.598 -13.284 821 H ASP 539 H ASP 539 100.981 1.974 -10.776 822 HA ASP 539 HA ASP 539 98.858 3.569 -11.739 823 HB2 ASP 539 HB2 ASP 539 98.997 2.179 -9.564 824 HB3 ASP 539 HB3 ASP 539 99.797 3.590 -8.878 825 H ARG 540 H ARG 540 101.956 4.318 -10.247 826 HA ARG 540 HA ARG 540 101.557 7.081 -9.892 827 HB2 ARG 540 HB2 ARG 540 103.742 5.205 -9.686 828 HB3 ARG 540 HB3 ARG 540 104.284 6.683 -10.471 829 HG2 ARG 540 HG2 ARG 540 104.663 6.934 -8.146 830 HG3 ARG 540 HG3 ARG 540 103.287 7.957 -8.562 831 HD2 ARG 540 HD2 ARG 540 101.821 6.006 -7.848 832 HD3 ARG 540 HD3 ARG 540 103.278 5.303 -7.150 833 HE ARG 540 HE ARG 540 103.151 7.847 -6.137 834 HH11 ARG 540 HH11 ARG 540 101.062 5.063 -6.149 835 HH12 ARG 540 HH12 ARG 540 100.341 5.434 -4.619 836 HH21 ARG 540 HH21 ARG 540 102.212 8.346 -4.120 837 HH22 ARG 540 HH22 ARG 540 100.995 7.303 -3.465 838 H GLN 541 H GLN 541 102.745 5.160 -12.593 839 HA GLN 541 HA GLN 541 103.542 7.282 -14.258 840 HB2 GLN 541 HB2 GLN 541 102.781 4.422 -14.700 841 HB3 GLN 541 HB3 GLN 541 102.950 5.483 -16.092 842 HG2 GLN 541 HG2 GLN 541 105.125 5.104 -16.063 843 HG3 GLN 541 HG3 GLN 541 105.215 5.926 -14.506 844 HE21 GLN 541 HE21 GLN 541 105.571 4.766 -12.690 845 HE22 GLN 541 HE22 GLN 541 105.820 3.056 -12.664 846 H ALA 542 H ALA 542 100.450 5.659 -13.778 847 HA ALA 542 HA ALA 542 99.054 6.872 -15.898 848 HB1 ALA 542 HB1 ALA 542 97.180 5.874 -15.072 849 HB2 ALA 542 HB2 ALA 542 97.591 6.234 -13.395 850 HB3 ALA 542 HB3 ALA 542 98.400 4.913 -14.237 851 H LYS 543 H LYS 543 99.718 7.876 -12.598 852 HA LYS 543 HA LYS 543 97.965 10.016 -12.353 853 HB2 LYS 543 HB2 LYS 543 100.514 9.210 -11.114 854 HB3 LYS 543 HB3 LYS 543 100.167 10.931 -11.029 855 HG2 LYS 543 HG2 LYS 543 99.383 9.324 -9.133 856 HG3 LYS 543 HG3 LYS 543 98.339 10.638 -9.678 857 HD2 LYS 543 HD2 LYS 543 96.831 9.230 -10.616 858 HD3 LYS 543 HD3 LYS 543 98.066 8.071 -11.113 859 HE2 LYS 543 HE2 LYS 543 97.876 6.872 -9.220 860 HE3 LYS 543 HE3 LYS 543 97.714 8.308 -8.212 861 HZ1 LYS 543 HZ1 LYS 543 95.669 7.234 -8.053 862 HZ2 LYS 543 HZ2 LYS 543 95.608 6.870 -9.704 863 HZ3 LYS 543 HZ3 LYS 543 95.385 8.462 -9.182 864 H LEU 544 H LEU 544 100.713 9.671 -14.379 865 HA LEU 544 HA LEU 544 101.479 12.358 -14.695 866 HB2 LEU 544 HB2 LEU 544 102.644 10.210 -15.503 867 HB3 LEU 544 HB3 LEU 544 101.589 10.317 -16.899 868 HG LEU 544 HG LEU 544 102.627 12.820 -16.887 869 HD11 LEU 544 HD11 LEU 544 104.831 12.907 -16.209 870 HD12 LEU 544 HD12 LEU 544 105.013 11.153 -16.220 871 HD13 LEU 544 HD13 LEU 544 104.098 11.936 -14.932 872 HD21 LEU 544 HD21 LEU 544 104.127 10.557 -18.162 873 HD22 LEU 544 HD22 LEU 544 103.807 12.174 -18.792 874 HD23 LEU 544 HD23 LEU 544 102.500 10.993 -18.688 875 H ASN 545 H ASN 545 98.945 10.441 -16.196 876 HA ASN 545 HA ASN 545 97.862 12.907 -17.360 877 HB2 ASN 545 HB2 ASN 545 98.074 10.258 -18.808 878 HB3 ASN 545 HB3 ASN 545 97.232 11.682 -19.411 879 HD21 ASN 545 HD21 ASN 545 98.992 13.669 -18.702 880 HD22 ASN 545 HD22 ASN 545 100.456 13.484 -19.602 881 H GLN 546 H GLN 546 95.920 13.230 -16.526 882 HA GLN 546 HA GLN 546 94.260 10.885 -15.867 883 HB2 GLN 546 HB2 GLN 546 93.696 13.528 -14.624 884 HB3 GLN 546 HB3 GLN 546 93.504 11.911 -13.960 885 HG2 GLN 546 HG2 GLN 546 95.838 11.734 -13.518 886 HG3 GLN 546 HG3 GLN 546 96.172 13.225 -14.400 887 HE21 GLN 546 HE21 GLN 546 96.926 12.673 -11.725 888 HE22 GLN 546 HE22 GLN 546 96.117 13.808 -10.705 889 HA PRO 547 HA PRO 547 92.111 12.840 -19.434 890 HB2 PRO 547 HB2 PRO 547 90.548 10.577 -19.799 891 HB3 PRO 547 HB3 PRO 547 92.086 10.893 -20.607 892 HG2 PRO 547 HG2 PRO 547 91.513 9.212 -18.207 893 HG3 PRO 547 HG3 PRO 547 92.642 8.918 -19.542 894 HD2 PRO 547 HD2 PRO 547 93.498 9.770 -17.151 895 HD3 PRO 547 HD3 PRO 547 94.255 10.330 -18.657 896 H ARG 548 H ARG 548 90.798 14.336 -18.538 897 HA ARG 548 HA ARG 548 89.128 15.237 -17.226 898 HB2 ARG 548 HB2 ARG 548 87.383 13.147 -18.484 899 HB3 ARG 548 HB3 ARG 548 87.037 14.845 -18.190 900 HG2 ARG 548 HG2 ARG 548 89.030 13.835 -20.208 901 HG3 ARG 548 HG3 ARG 548 87.366 14.297 -20.576 902 HD2 ARG 548 HD2 ARG 548 87.766 16.532 -20.234 903 HD3 ARG 548 HD3 ARG 548 89.105 16.231 -19.127 904 HE ARG 548 HE ARG 548 89.985 15.320 -21.550 905 HH11 ARG 548 HH11 ARG 548 88.749 18.339 -20.339 906 HH12 ARG 548 HH12 ARG 548 89.661 19.307 -21.448 907 HH21 ARG 548 HH21 ARG 548 91.199 16.584 -23.012 908 HH22 ARG 548 HH22 ARG 548 91.055 18.310 -22.967 909 H GLU 549 H GLU 549 90.000 14.408 -15.201 910 HA GLU 549 HA GLU 549 89.861 13.320 -13.203 911 HB2 GLU 549 HB2 GLU 549 87.236 14.111 -13.999 912 HB3 GLU 549 HB3 GLU 549 87.117 12.570 -13.163 913 HG2 GLU 549 HG2 GLU 549 88.884 14.319 -11.740 914 HG3 GLU 549 HG3 GLU 549 87.345 15.123 -12.043 915 H LYS 550 H LYS 550 88.230 11.249 -12.295 916 HA LYS 550 HA LYS 550 89.007 9.026 -14.069 917 HB2 LYS 550 HB2 LYS 550 88.927 8.956 -11.050 918 HB3 LYS 550 HB3 LYS 550 89.498 7.683 -12.121 919 HG2 LYS 550 HG2 LYS 550 91.490 8.581 -11.508 920 HG3 LYS 550 HG3 LYS 550 91.148 9.588 -12.917 921 HD2 LYS 550 HD2 LYS 550 89.976 11.141 -11.194 922 HD3 LYS 550 HD3 LYS 550 90.944 10.263 -10.007 923 HE2 LYS 550 HE2 LYS 550 92.234 11.411 -12.447 924 HE3 LYS 550 HE3 LYS 550 91.867 12.450 -11.071 925 HZ1 LYS 550 HZ1 LYS 550 93.759 10.206 -11.246 926 HZ2 LYS 550 HZ2 LYS 550 93.084 10.607 -9.748 927 HZ3 LYS 550 HZ3 LYS 550 93.989 11.753 -10.602 928 H LYS 551 H LYS 551 86.441 10.521 -13.778 929 HA LYS 551 HA LYS 551 84.253 9.893 -14.086 930 HB2 LYS 551 HB2 LYS 551 84.837 7.143 -13.031 931 HB3 LYS 551 HB3 LYS 551 83.601 7.645 -14.175 932 HG2 LYS 551 HG2 LYS 551 86.072 8.292 -15.345 933 HG3 LYS 551 HG3 LYS 551 86.238 6.667 -14.676 934 HD2 LYS 551 HD2 LYS 551 83.746 7.259 -16.162 935 HD3 LYS 551 HD3 LYS 551 85.231 7.147 -17.108 936 HE2 LYS 551 HE2 LYS 551 85.505 4.965 -15.565 937 HE3 LYS 551 HE3 LYS 551 83.747 5.056 -15.639 938 HZ1 LYS 551 HZ1 LYS 551 83.846 5.009 -18.026 939 HZ2 LYS 551 HZ2 LYS 551 84.712 3.690 -17.417 940 HZ3 LYS 551 HZ3 LYS 551 85.538 5.044 -18.007 941 H ARG 552 H ARG 552 83.049 10.918 -12.631 942 HA ARG 552 HA ARG 552 83.394 11.182 -9.957 943 HB2 ARG 552 HB2 ARG 552 80.964 11.248 -11.684 944 HB3 ARG 552 HB3 ARG 552 80.744 11.297 -9.940 945 HG2 ARG 552 HG2 ARG 552 82.615 13.189 -10.185 946 HG3 ARG 552 HG3 ARG 552 81.860 13.325 -11.774 947 HD2 ARG 552 HD2 ARG 552 80.599 13.661 -9.066 948 HD3 ARG 552 HD3 ARG 552 80.699 14.833 -10.381 949 HE ARG 552 HE ARG 552 79.266 12.707 -11.381 950 HH11 ARG 552 HH11 ARG 552 78.947 14.943 -8.731 951 HH12 ARG 552 HH12 ARG 552 77.216 14.914 -8.745 952 HH21 ARG 552 HH21 ARG 552 76.986 12.661 -11.410 953 HH22 ARG 552 HH22 ARG 552 76.101 13.618 -10.268 954 H GLY 553 H GLY 553 81.888 10.341 -8.177 955 HA2 GLY 553 HA2 GLY 553 81.797 7.399 -8.397 956 HA3 GLY 553 HA3 GLY 553 82.125 8.270 -6.907 957 H THR 554 H THR 554 80.432 9.106 -5.708 958 HA THR 554 HA THR 554 77.952 7.779 -5.926 959 HB THR 554 HB THR 554 78.133 10.328 -4.384 960 HG1 THR 554 HG1 THR 554 79.420 9.406 -2.832 961 HG21 THR 554 HG21 THR 554 77.242 7.694 -3.311 962 HG22 THR 554 HG22 THR 554 76.214 8.534 -4.472 963 HG23 THR 554 HG23 THR 554 76.649 9.315 -2.951 964 H GLU 555 H GLU 555 76.526 8.132 -7.495 965 HA GLU 555 HA GLU 555 75.856 10.918 -8.164 966 HB2 GLU 555 HB2 GLU 555 75.313 9.702 -10.503 967 HB3 GLU 555 HB3 GLU 555 76.856 10.470 -10.150 968 HG2 GLU 555 HG2 GLU 555 77.930 8.448 -9.801 969 HG3 GLU 555 HG3 GLU 555 76.420 7.584 -9.511 970 H LYS 556 H LYS 556 74.496 9.418 -6.267 971 HA LYS 556 HA LYS 556 72.001 8.698 -7.658 972 HB2 LYS 556 HB2 LYS 556 72.446 7.920 -4.820 973 HB3 LYS 556 HB3 LYS 556 71.575 7.074 -6.092 974 HG2 LYS 556 HG2 LYS 556 74.017 6.844 -7.096 975 HG3 LYS 556 HG3 LYS 556 74.454 7.014 -5.394 976 HD2 LYS 556 HD2 LYS 556 74.222 4.679 -5.881 977 HD3 LYS 556 HD3 LYS 556 72.861 5.171 -4.870 978 HE2 LYS 556 HE2 LYS 556 71.430 4.461 -6.412 979 HE3 LYS 556 HE3 LYS 556 72.150 5.540 -7.606 980 HZ1 LYS 556 HZ1 LYS 556 73.273 3.867 -8.552 981 HZ2 LYS 556 HZ2 LYS 556 72.154 2.864 -7.777 982 HZ3 LYS 556 HZ3 LYS 556 73.669 3.138 -7.077 983 H LEU 557 H LEU 557 70.068 8.957 -5.995 984 HA LEU 557 HA LEU 557 70.265 11.687 -4.907 985 HB2 LEU 557 HB2 LEU 557 67.954 10.271 -6.224 986 HB3 LEU 557 HB3 LEU 557 67.773 11.767 -5.328 987 HG LEU 557 HG LEU 557 69.706 12.527 -7.027 988 HD11 LEU 557 HD11 LEU 557 69.106 11.629 -9.274 989 HD12 LEU 557 HD12 LEU 557 68.148 10.388 -8.466 990 HD13 LEU 557 HD13 LEU 557 69.892 10.460 -8.212 991 HD21 LEU 557 HD21 LEU 557 66.898 12.884 -6.756 992 HD22 LEU 557 HD22 LEU 557 67.288 12.796 -8.474 993 HD23 LEU 557 HD23 LEU 557 68.091 13.984 -7.448 994 H ILE 558 H ILE 558 68.403 8.666 -4.551 995 HA ILE 558 HA ILE 558 67.819 7.500 -2.667 996 HB ILE 558 HB ILE 558 69.203 9.633 -1.043 997 HG12 ILE 558 HG12 ILE 558 70.752 8.681 -2.706 998 HG13 ILE 558 HG13 ILE 558 71.180 8.185 -1.070 999 HG21 ILE 558 HG21 ILE 558 67.817 7.157 -0.429 1000 HG22 ILE 558 HG22 ILE 558 68.313 8.471 0.638 1001 HG23 ILE 558 HG23 ILE 558 69.456 7.193 0.221 1002 HD11 ILE 558 HD11 ILE 558 71.121 6.489 -3.094 1003 HD12 ILE 558 HD12 ILE 558 69.423 6.387 -2.633 1004 HD13 ILE 558 HD13 ILE 558 70.680 6.007 -1.456 1005 H THR 559 H THR 559 65.760 8.530 -3.572 1006 HA THR 559 HA THR 559 64.546 10.229 -1.494 1007 HB THR 559 HB THR 559 63.567 10.146 -4.338 1008 HG1 THR 559 HG1 THR 559 64.767 12.104 -4.634 1009 HG21 THR 559 HG21 THR 559 63.319 12.590 -2.755 1010 HG22 THR 559 HG22 THR 559 62.474 11.204 -2.063 1011 HG23 THR 559 HG23 THR 559 62.111 11.728 -3.708 1012 H LYS 560 H LYS 560 63.800 7.802 -3.979 1013 HA LYS 560 HA LYS 560 62.448 6.037 -2.336 1014 HB2 LYS 560 HB2 LYS 560 60.930 8.328 -2.590 1015 HB3 LYS 560 HB3 LYS 560 60.238 7.265 -3.808 1016 HG2 LYS 560 HG2 LYS 560 59.285 5.943 -2.281 1017 HG3 LYS 560 HG3 LYS 560 60.705 5.964 -1.235 1018 HD2 LYS 560 HD2 LYS 560 59.181 8.485 -1.398 1019 HD3 LYS 560 HD3 LYS 560 58.365 7.139 -0.601 1020 HE2 LYS 560 HE2 LYS 560 60.959 8.463 0.134 1021 HE3 LYS 560 HE3 LYS 560 59.505 8.273 1.114 1022 HZ1 LYS 560 HZ1 LYS 560 59.987 5.778 0.867 1023 HZ2 LYS 560 HZ2 LYS 560 60.927 6.674 1.949 1024 HZ3 LYS 560 HZ3 LYS 560 61.548 6.261 0.431 1025 H ALA 561 H ALA 561 63.418 4.536 -3.659 1026 HA ALA 561 HA ALA 561 63.898 3.363 -5.586 1027 HB1 ALA 561 HB1 ALA 561 60.991 3.338 -5.092 1028 HB2 ALA 561 HB2 ALA 561 62.139 2.003 -5.199 1029 HB3 ALA 561 HB3 ALA 561 61.515 2.750 -6.670 Start of MODEL 4 1 H1 MET 437 HT1 MET 437 130.510 -21.062 -10.560 2 H2 MET 437 HT2 MET 437 131.436 -21.988 -9.451 3 H3 MET 437 HT3 MET 437 130.972 -20.384 -9.055 4 HA MET 437 HA MET 437 128.897 -22.307 -9.692 5 HB2 MET 437 HB2 MET 437 128.957 -23.298 -7.532 6 HB3 MET 437 HB3 MET 437 130.597 -23.400 -8.158 7 HG2 MET 437 HG2 MET 437 130.452 -20.968 -6.777 8 HG3 MET 437 HG3 MET 437 129.633 -22.155 -5.765 9 HE1 MET 437 HE1 MET 437 132.262 -20.316 -5.738 10 HE2 MET 437 HE2 MET 437 133.727 -21.223 -5.362 11 HE3 MET 437 HE3 MET 437 132.394 -21.182 -4.208 12 H HIS 438 H HIS 438 126.945 -21.472 -9.146 13 HA HIS 438 HA HIS 438 126.776 -19.255 -7.275 14 HB2 HIS 438 HB2 HIS 438 127.131 -18.574 -9.857 15 HB3 HIS 438 HB3 HIS 438 125.380 -18.746 -9.839 16 HD1 HIS 438 HD1 HIS 438 127.757 -16.214 -9.539 17 HD2 HIS 438 HD2 HIS 438 124.394 -17.223 -7.316 18 HE1 HIS 438 HE1 HIS 438 127.119 -14.121 -8.298 19 HE2 HIS 438 HE2 HIS 438 125.079 -14.753 -6.963 20 H HIS 439 H HIS 439 125.819 -21.819 -6.946 21 HA HIS 439 HA HIS 439 122.928 -21.584 -7.428 22 HB2 HIS 439 HB2 HIS 439 122.814 -23.997 -6.982 23 HB3 HIS 439 HB3 HIS 439 123.941 -23.642 -8.288 24 HD1 HIS 439 HD1 HIS 439 124.219 -24.061 -4.506 25 HD2 HIS 439 HD2 HIS 439 126.199 -25.080 -8.015 26 HE1 HIS 439 HE1 HIS 439 126.204 -25.427 -3.785 27 HE2 HIS 439 HE2 HIS 439 127.392 -26.029 -5.925 28 H HIS 440 H HIS 440 125.341 -21.466 -5.019 29 HA HIS 440 HA HIS 440 123.524 -22.034 -2.823 30 HB2 HIS 440 HB2 HIS 440 126.337 -22.097 -3.189 31 HB3 HIS 440 HB3 HIS 440 126.003 -20.903 -1.940 32 HD1 HIS 440 HD1 HIS 440 123.567 -22.392 -0.638 33 HD2 HIS 440 HD2 HIS 440 127.231 -24.118 -1.568 34 HE1 HIS 440 HE1 HIS 440 123.772 -24.391 0.874 35 HE2 HIS 440 HE2 HIS 440 125.962 -25.463 0.240 36 H HIS 441 H HIS 441 124.173 -19.412 -4.755 37 HA HIS 441 HA HIS 441 123.693 -17.452 -2.625 38 HB2 HIS 441 HB2 HIS 441 125.563 -17.302 -4.490 39 HB3 HIS 441 HB3 HIS 441 124.239 -16.651 -5.450 40 HD1 HIS 441 HD1 HIS 441 126.848 -15.595 -3.268 41 HD2 HIS 441 HD2 HIS 441 122.939 -14.370 -3.958 42 HE1 HIS 441 HE1 HIS 441 126.706 -13.258 -2.352 43 HE2 HIS 441 HE2 HIS 441 124.330 -12.535 -2.782 44 H HIS 442 H HIS 442 121.585 -19.180 -3.518 45 HA HIS 442 HA HIS 442 119.363 -19.048 -3.995 46 HB2 HIS 442 HB2 HIS 442 119.859 -16.064 -4.082 47 HB3 HIS 442 HB3 HIS 442 118.280 -16.840 -4.020 48 HD1 HIS 442 HD1 HIS 442 119.735 -14.877 -1.854 49 HD2 HIS 442 HD2 HIS 442 119.049 -18.964 -1.560 50 HE1 HIS 442 HE1 HIS 442 119.749 -15.385 0.609 51 HE2 HIS 442 HE2 HIS 442 119.395 -17.875 0.760 52 H HIS 443 H HIS 443 119.671 -20.116 -5.977 53 HA HIS 443 HA HIS 443 119.386 -20.393 -8.218 54 HB2 HIS 443 HB2 HIS 443 117.963 -17.975 -7.590 55 HB3 HIS 443 HB3 HIS 443 118.708 -17.822 -9.178 56 HD1 HIS 443 HD1 HIS 443 115.660 -17.972 -8.913 57 HD2 HIS 443 HD2 HIS 443 118.096 -21.277 -9.552 58 HE1 HIS 443 HE1 HIS 443 114.174 -19.711 -9.956 59 HE2 HIS 443 HE2 HIS 443 115.682 -21.683 -10.386 60 H SER 444 H SER 444 119.936 -18.879 -10.411 61 HA SER 444 HA SER 444 122.820 -18.656 -10.237 62 HB2 SER 444 HB2 SER 444 121.049 -19.468 -12.228 63 HB3 SER 444 HB3 SER 444 121.670 -17.922 -12.807 64 HG SER 444 HG SER 444 123.809 -18.850 -12.252 65 H ASN 445 H ASN 445 123.424 -16.780 -12.131 66 HA ASN 445 HA ASN 445 123.216 -14.364 -10.639 67 HB2 ASN 445 HB2 ASN 445 125.218 -14.555 -11.818 68 HB3 ASN 445 HB3 ASN 445 124.422 -15.121 -13.280 69 HD21 ASN 445 HD21 ASN 445 123.817 -13.682 -14.792 70 HD22 ASN 445 HD22 ASN 445 124.040 -11.974 -14.662 71 H ALA 446 H ALA 446 122.165 -12.442 -11.164 72 HA ALA 446 HA ALA 446 120.539 -12.115 -13.454 73 HB1 ALA 446 HB1 ALA 446 118.553 -12.057 -11.421 74 HB2 ALA 446 HB2 ALA 446 119.349 -13.630 -11.377 75 HB3 ALA 446 HB3 ALA 446 118.616 -13.055 -12.874 76 H THR 447 H THR 447 122.116 -10.290 -13.012 77 HA THR 447 HA THR 447 121.533 -8.433 -10.931 78 HB THR 447 HB THR 447 122.838 -6.949 -12.842 79 HG1 THR 447 HG1 THR 447 124.561 -8.769 -13.268 80 HG21 THR 447 HG21 THR 447 124.661 -7.070 -11.424 81 HG22 THR 447 HG22 THR 447 124.389 -8.771 -11.050 82 HG23 THR 447 HG23 THR 447 123.338 -7.537 -10.356 83 H GLY 448 H GLY 448 119.527 -7.580 -10.894 84 HA2 GLY 448 HA2 GLY 448 118.596 -6.249 -13.364 85 HA3 GLY 448 HA3 GLY 448 117.502 -7.059 -12.253 86 HA PRO 449 HA PRO 449 117.610 -2.487 -11.262 87 HB2 PRO 449 HB2 PRO 449 114.897 -2.312 -10.933 88 HB3 PRO 449 HB3 PRO 449 115.719 -2.040 -12.474 89 HG2 PRO 449 HG2 PRO 449 114.327 -4.495 -11.477 90 HG3 PRO 449 HG3 PRO 449 114.272 -3.753 -13.087 91 HD2 PRO 449 HD2 PRO 449 115.793 -5.911 -12.577 92 HD3 PRO 449 HD3 PRO 449 116.318 -4.644 -13.705 93 H GLN 450 H GLN 450 117.574 -1.648 -9.222 94 HA GLN 450 HA GLN 450 116.653 -3.441 -7.073 95 HB2 GLN 450 HB2 GLN 450 119.114 -1.895 -7.441 96 HB3 GLN 450 HB3 GLN 450 118.372 -1.665 -5.864 97 HG2 GLN 450 HG2 GLN 450 118.417 -4.453 -6.586 98 HG3 GLN 450 HG3 GLN 450 120.031 -3.746 -6.660 99 HE21 GLN 450 HE21 GLN 450 118.773 -5.678 -4.782 100 HE22 GLN 450 HE22 GLN 450 119.024 -5.003 -3.211 101 H PHE 451 H PHE 451 114.534 -2.478 -7.337 102 HA PHE 451 HA PHE 451 114.239 0.315 -6.578 103 HB2 PHE 451 HB2 PHE 451 111.952 0.090 -7.193 104 HB3 PHE 451 HB3 PHE 451 112.873 -0.802 -8.400 105 HD1 PHE 451 HD1 PHE 451 112.801 -3.231 -8.477 106 HD2 PHE 451 HD2 PHE 451 110.510 -1.040 -5.638 107 HE1 PHE 451 HE1 PHE 451 111.449 -5.237 -8.024 108 HE2 PHE 451 HE2 PHE 451 109.155 -3.040 -5.180 109 HZ PHE 451 HZ PHE 451 109.624 -5.143 -6.373 110 H VAL 452 H VAL 452 113.787 1.002 -4.581 111 HA VAL 452 HA VAL 452 113.818 -0.683 -2.343 112 HB VAL 452 HB VAL 452 112.622 2.089 -2.517 113 HG11 VAL 452 HG11 VAL 452 112.131 1.845 -0.370 114 HG12 VAL 452 HG12 VAL 452 113.842 1.590 -0.021 115 HG13 VAL 452 HG13 VAL 452 112.799 0.213 -0.378 116 HG21 VAL 452 HG21 VAL 452 114.949 2.648 -1.506 117 HG22 VAL 452 HG22 VAL 452 114.792 2.420 -3.247 118 HG23 VAL 452 HG23 VAL 452 115.438 1.122 -2.243 119 H SER 453 H SER 453 112.324 -2.313 -2.298 120 HA SER 453 HA SER 453 109.603 -1.958 -3.050 121 HB2 SER 453 HB2 SER 453 109.434 -4.209 -2.844 122 HB3 SER 453 HB3 SER 453 111.194 -4.120 -2.801 123 HG SER 453 HG SER 453 110.613 -5.304 -1.047 124 H GLY 454 H GLY 454 110.770 -0.355 -0.630 125 HA2 GLY 454 HA2 GLY 454 110.151 0.108 1.573 126 HA3 GLY 454 HA3 GLY 454 108.645 0.384 0.719 127 H VAL 455 H VAL 455 110.054 -2.810 1.157 128 HA VAL 455 HA VAL 455 109.007 -4.706 1.951 129 HB VAL 455 HB VAL 455 108.579 -3.264 4.523 130 HG11 VAL 455 HG11 VAL 455 109.408 -5.273 5.485 131 HG12 VAL 455 HG12 VAL 455 110.034 -5.834 3.935 132 HG13 VAL 455 HG13 VAL 455 108.294 -5.743 4.203 133 HG21 VAL 455 HG21 VAL 455 111.257 -3.852 4.606 134 HG22 VAL 455 HG22 VAL 455 110.567 -2.243 4.386 135 HG23 VAL 455 HG23 VAL 455 111.058 -3.193 2.983 136 H ILE 456 H ILE 456 107.059 -4.985 0.930 137 HA ILE 456 HA ILE 456 104.720 -3.479 1.638 138 HB ILE 456 HB ILE 456 104.979 -5.986 -0.021 139 HG12 ILE 456 HG12 ILE 456 106.179 -4.012 -0.918 140 HG13 ILE 456 HG13 ILE 456 104.829 -4.497 -1.939 141 HG21 ILE 456 HG21 ILE 456 102.741 -5.345 -0.883 142 HG22 ILE 456 HG22 ILE 456 102.660 -4.100 0.364 143 HG23 ILE 456 HG23 ILE 456 102.736 -5.802 0.820 144 HD11 ILE 456 HD11 ILE 456 104.985 -2.072 -1.699 145 HD12 ILE 456 HD12 ILE 456 104.786 -2.236 0.045 146 HD13 ILE 456 HD13 ILE 456 103.475 -2.701 -1.039 147 H VAL 457 H VAL 457 103.319 -3.881 3.222 148 HA VAL 457 HA VAL 457 103.383 -6.526 4.524 149 HB VAL 457 HB VAL 457 102.719 -3.828 5.706 150 HG11 VAL 457 HG11 VAL 457 102.797 -5.691 7.759 151 HG12 VAL 457 HG12 VAL 457 101.865 -6.480 6.487 152 HG13 VAL 457 HG13 VAL 457 101.361 -4.906 7.102 153 HG21 VAL 457 HG21 VAL 457 104.970 -5.781 6.093 154 HG22 VAL 457 HG22 VAL 457 104.586 -4.542 7.287 155 HG23 VAL 457 HG23 VAL 457 105.055 -4.075 5.653 156 H LYS 458 H LYS 458 101.683 -7.694 3.830 157 HA LYS 458 HA LYS 458 99.227 -6.376 3.036 158 HB2 LYS 458 HB2 LYS 458 99.952 -8.171 1.630 159 HB3 LYS 458 HB3 LYS 458 100.112 -9.260 3.000 160 HG2 LYS 458 HG2 LYS 458 97.518 -8.679 3.233 161 HG3 LYS 458 HG3 LYS 458 97.706 -8.443 1.494 162 HD2 LYS 458 HD2 LYS 458 98.585 -10.681 1.246 163 HD3 LYS 458 HD3 LYS 458 98.550 -10.922 2.993 164 HE2 LYS 458 HE2 LYS 458 96.156 -10.824 3.021 165 HE3 LYS 458 HE3 LYS 458 96.107 -10.351 1.323 166 HZ1 LYS 458 HZ1 LYS 458 97.538 -12.753 1.545 167 HZ2 LYS 458 HZ2 LYS 458 96.063 -12.478 0.765 168 HZ3 LYS 458 HZ3 LYS 458 96.085 -12.930 2.394 169 H ILE 459 H ILE 459 97.691 -5.897 4.448 170 HA ILE 459 HA ILE 459 97.364 -7.625 6.815 171 HB ILE 459 HB ILE 459 96.528 -4.736 6.560 172 HG12 ILE 459 HG12 ILE 459 98.885 -6.016 7.959 173 HG13 ILE 459 HG13 ILE 459 98.940 -4.855 6.636 174 HG21 ILE 459 HG21 ILE 459 95.086 -5.537 8.140 175 HG22 ILE 459 HG22 ILE 459 96.470 -5.173 9.171 176 HG23 ILE 459 HG23 ILE 459 96.175 -6.831 8.644 177 HD11 ILE 459 HD11 ILE 459 98.599 -4.429 9.512 178 HD12 ILE 459 HD12 ILE 459 97.537 -3.465 8.485 179 HD13 ILE 459 HD13 ILE 459 99.286 -3.376 8.275 180 H ILE 460 H ILE 460 95.577 -8.776 6.917 181 HA ILE 460 HA ILE 460 93.156 -7.764 5.590 182 HB ILE 460 HB ILE 460 94.279 -9.550 4.194 183 HG12 ILE 460 HG12 ILE 460 91.744 -8.915 4.343 184 HG13 ILE 460 HG13 ILE 460 92.239 -10.343 3.439 185 HG21 ILE 460 HG21 ILE 460 93.588 -11.911 5.084 186 HG22 ILE 460 HG22 ILE 460 93.706 -11.122 6.657 187 HG23 ILE 460 HG23 ILE 460 95.105 -11.167 5.584 188 HD11 ILE 460 HD11 ILE 460 90.247 -10.374 5.185 189 HD12 ILE 460 HD12 ILE 460 91.574 -10.715 6.296 190 HD13 ILE 460 HD13 ILE 460 91.287 -11.771 4.913 191 H SER 461 H SER 461 91.307 -7.996 6.739 192 HA SER 461 HA SER 461 91.495 -9.520 9.254 193 HB2 SER 461 HB2 SER 461 90.122 -7.843 10.341 194 HB3 SER 461 HB3 SER 461 91.512 -7.052 9.599 195 HG SER 461 HG SER 461 88.882 -6.673 9.132 196 H THR 462 H THR 462 88.896 -9.270 10.087 197 HA THR 462 HA THR 462 87.421 -10.715 7.979 198 HB THR 462 HB THR 462 86.141 -11.556 10.176 199 HG1 THR 462 HG1 THR 462 87.273 -11.076 11.898 200 HG21 THR 462 HG21 THR 462 88.695 -12.970 9.648 201 HG22 THR 462 HG22 THR 462 87.594 -12.741 8.289 202 HG23 THR 462 HG23 THR 462 87.049 -13.597 9.731 203 H GLU 463 H GLU 463 87.492 -7.952 9.882 204 HA GLU 463 HA GLU 463 85.475 -6.547 8.877 205 HB2 GLU 463 HB2 GLU 463 84.351 -8.723 10.485 206 HB3 GLU 463 HB3 GLU 463 83.749 -7.134 10.942 207 HG2 GLU 463 HG2 GLU 463 83.777 -7.503 8.069 208 HG3 GLU 463 HG3 GLU 463 82.814 -8.729 8.892 209 HA PRO 464 HA PRO 464 86.049 -5.510 13.757 210 HB2 PRO 464 HB2 PRO 464 88.733 -6.832 13.711 211 HB3 PRO 464 HB3 PRO 464 87.613 -6.608 15.061 212 HG2 PRO 464 HG2 PRO 464 87.808 -8.965 13.840 213 HG3 PRO 464 HG3 PRO 464 86.237 -8.348 14.384 214 HD2 PRO 464 HD2 PRO 464 87.343 -8.549 11.635 215 HD3 PRO 464 HD3 PRO 464 85.658 -8.626 12.183 216 H LEU 465 H LEU 465 88.273 -5.589 11.062 217 HA LEU 465 HA LEU 465 90.194 -3.783 11.611 218 HB2 LEU 465 HB2 LEU 465 89.122 -4.824 9.297 219 HB3 LEU 465 HB3 LEU 465 88.856 -3.103 9.101 220 HG LEU 465 HG LEU 465 91.572 -3.856 9.972 221 HD11 LEU 465 HD11 LEU 465 90.352 -4.890 7.475 222 HD12 LEU 465 HD12 LEU 465 91.635 -5.570 8.479 223 HD13 LEU 465 HD13 LEU 465 91.987 -4.236 7.381 224 HD21 LEU 465 HD21 LEU 465 90.309 -1.923 8.057 225 HD22 LEU 465 HD22 LEU 465 92.050 -2.209 8.069 226 HD23 LEU 465 HD23 LEU 465 91.248 -1.589 9.513 227 HA PRO 466 HA PRO 466 87.757 -0.335 13.180 228 HB2 PRO 466 HB2 PRO 466 89.965 1.216 13.716 229 HB3 PRO 466 HB3 PRO 466 89.311 -0.003 14.814 230 HG2 PRO 466 HG2 PRO 466 91.608 -0.201 12.909 231 HG3 PRO 466 HG3 PRO 466 91.464 -0.829 14.562 232 HD2 PRO 466 HD2 PRO 466 91.184 -2.421 12.417 233 HD3 PRO 466 HD3 PRO 466 90.218 -2.664 13.889 234 H GLY 467 H GLY 467 90.560 0.135 11.022 235 HA2 GLY 467 HA2 GLY 467 89.422 1.235 8.860 236 HA3 GLY 467 HA3 GLY 467 89.411 2.591 9.976 237 H ARG 468 H ARG 468 90.755 3.229 7.891 238 HA ARG 468 HA ARG 468 93.411 2.325 7.656 239 HB2 ARG 468 HB2 ARG 468 93.676 3.963 6.065 240 HB3 ARG 468 HB3 ARG 468 91.924 3.829 6.084 241 HG2 ARG 468 HG2 ARG 468 91.991 5.736 7.797 242 HG3 ARG 468 HG3 ARG 468 93.655 5.973 7.258 243 HD2 ARG 468 HD2 ARG 468 92.092 5.723 4.935 244 HD3 ARG 468 HD3 ARG 468 91.205 6.798 6.015 245 HE ARG 468 HE ARG 468 92.891 8.368 5.810 246 HH11 ARG 468 HH11 ARG 468 93.825 5.373 4.296 247 HH12 ARG 468 HH12 ARG 468 95.194 6.059 3.487 248 HH21 ARG 468 HH21 ARG 468 94.694 9.281 4.750 249 HH22 ARG 468 HH22 ARG 468 95.689 8.280 3.746 250 H LYS 469 H LYS 469 91.945 4.950 9.499 251 HA LYS 469 HA LYS 469 94.310 6.135 10.436 252 HB2 LYS 469 HB2 LYS 469 92.885 7.120 12.197 253 HB3 LYS 469 HB3 LYS 469 92.172 7.273 10.597 254 HG2 LYS 469 HG2 LYS 469 90.770 5.282 11.101 255 HG3 LYS 469 HG3 LYS 469 91.405 5.312 12.746 256 HD2 LYS 469 HD2 LYS 469 89.794 6.751 13.278 257 HD3 LYS 469 HD3 LYS 469 90.553 7.928 12.203 258 HE2 LYS 469 HE2 LYS 469 88.643 5.839 11.195 259 HE3 LYS 469 HE3 LYS 469 88.085 7.392 11.814 260 HZ1 LYS 469 HZ1 LYS 469 89.214 6.771 9.281 261 HZ2 LYS 469 HZ2 LYS 469 90.098 7.995 10.042 262 HZ3 LYS 469 HZ3 LYS 469 88.437 8.186 9.788 263 H GLN 470 H GLN 470 92.309 3.533 11.773 264 HA GLN 470 HA GLN 470 93.906 3.275 14.138 265 HB2 GLN 470 HB2 GLN 470 91.677 1.669 12.926 266 HB3 GLN 470 HB3 GLN 470 92.579 1.058 14.307 267 HG2 GLN 470 HG2 GLN 470 90.911 2.092 15.423 268 HG3 GLN 470 HG3 GLN 470 92.006 3.466 15.261 269 HE21 GLN 470 HE21 GLN 470 89.572 4.202 15.707 270 HE22 GLN 470 HE22 GLN 470 88.751 4.733 14.282 271 H VAL 471 H VAL 471 93.625 1.459 11.091 272 HA VAL 471 HA VAL 471 95.484 -0.556 11.770 273 HB VAL 471 HB VAL 471 94.705 0.516 9.052 274 HG11 VAL 471 HG11 VAL 471 95.991 -2.144 9.573 275 HG12 VAL 471 HG12 VAL 471 96.948 -0.701 9.242 276 HG13 VAL 471 HG13 VAL 471 95.799 -1.289 8.042 277 HG21 VAL 471 HG21 VAL 471 93.659 -1.995 9.280 278 HG22 VAL 471 HG22 VAL 471 92.775 -0.500 9.572 279 HG23 VAL 471 HG23 VAL 471 93.490 -1.379 10.923 280 H ARG 472 H ARG 472 95.807 2.543 10.108 281 HA ARG 472 HA ARG 472 98.566 2.360 9.548 282 HB2 ARG 472 HB2 ARG 472 98.461 4.656 8.993 283 HB3 ARG 472 HB3 ARG 472 96.886 4.001 8.567 284 HG2 ARG 472 HG2 ARG 472 95.933 4.905 10.608 285 HG3 ARG 472 HG3 ARG 472 97.516 5.520 11.088 286 HD2 ARG 472 HD2 ARG 472 97.463 6.759 8.823 287 HD3 ARG 472 HD3 ARG 472 95.731 6.432 8.862 288 HE ARG 472 HE ARG 472 96.106 7.549 11.254 289 HH11 ARG 472 HH11 ARG 472 97.216 8.493 8.091 290 HH12 ARG 472 HH12 ARG 472 97.231 10.186 8.459 291 HH21 ARG 472 HH21 ARG 472 96.123 9.775 11.750 292 HH22 ARG 472 HH22 ARG 472 96.610 10.915 10.540 293 H ASP 473 H ASP 473 96.741 3.732 12.242 294 HA ASP 473 HA ASP 473 98.922 4.786 13.670 295 HB2 ASP 473 HB2 ASP 473 96.530 5.349 14.093 296 HB3 ASP 473 HB3 ASP 473 96.311 3.749 14.793 297 H THR 474 H THR 474 97.395 1.606 13.677 298 HA THR 474 HA THR 474 98.769 0.540 15.891 299 HB THR 474 HB THR 474 98.309 -1.705 14.723 300 HG1 THR 474 HG1 THR 474 97.244 -1.693 12.861 301 HG21 THR 474 HG21 THR 474 96.437 -1.707 15.928 302 HG22 THR 474 HG22 THR 474 95.668 -0.550 14.842 303 HG23 THR 474 HG23 THR 474 96.671 0.023 16.177 304 H LEU 475 H LEU 475 99.321 -0.551 12.551 305 HA LEU 475 HA LEU 475 101.770 -1.662 12.847 306 HB2 LEU 475 HB2 LEU 475 102.226 -0.918 10.459 307 HB3 LEU 475 HB3 LEU 475 100.764 -1.846 10.737 308 HG LEU 475 HG LEU 475 99.861 0.731 10.998 309 HD11 LEU 475 HD11 LEU 475 101.370 2.109 10.111 310 HD12 LEU 475 HD12 LEU 475 100.934 1.404 8.554 311 HD13 LEU 475 HD13 LEU 475 102.319 0.778 9.449 312 HD21 LEU 475 HD21 LEU 475 98.642 0.300 9.060 313 HD22 LEU 475 HD22 LEU 475 99.002 -1.306 9.694 314 HD23 LEU 475 HD23 LEU 475 99.937 -0.660 8.345 315 H ALA 476 H ALA 476 101.118 1.797 12.376 316 HA ALA 476 HA ALA 476 103.861 2.554 12.301 317 HB1 ALA 476 HB1 ALA 476 101.729 3.861 11.529 318 HB2 ALA 476 HB2 ALA 476 103.141 4.730 12.131 319 HB3 ALA 476 HB3 ALA 476 101.751 4.467 13.185 320 H ALA 477 H ALA 477 101.580 1.946 14.829 321 HA ALA 477 HA ALA 477 102.893 3.339 16.915 322 HB1 ALA 477 HB1 ALA 477 101.603 1.374 18.250 323 HB2 ALA 477 HB2 ALA 477 100.717 1.367 16.725 324 HB3 ALA 477 HB3 ALA 477 100.829 2.850 17.672 325 H ILE 478 H ILE 478 103.373 0.236 15.430 326 HA ILE 478 HA ILE 478 105.085 -0.760 17.535 327 HB ILE 478 HB ILE 478 104.306 -1.788 14.823 328 HG12 ILE 478 HG12 ILE 478 104.055 -3.781 16.726 329 HG13 ILE 478 HG13 ILE 478 103.658 -2.318 17.622 330 HG21 ILE 478 HG21 ILE 478 105.760 -3.831 15.543 331 HG22 ILE 478 HG22 ILE 478 106.656 -2.625 16.466 332 HG23 ILE 478 HG23 ILE 478 106.508 -2.465 14.717 333 HD11 ILE 478 HD11 ILE 478 101.802 -3.655 16.398 334 HD12 ILE 478 HD12 ILE 478 102.393 -2.804 14.970 335 HD13 ILE 478 HD13 ILE 478 101.793 -1.892 16.357 336 H SER 479 H SER 479 105.438 0.968 14.529 337 HA SER 479 HA SER 479 107.991 1.929 15.113 338 HB2 SER 479 HB2 SER 479 107.914 -0.587 13.483 339 HB3 SER 479 HB3 SER 479 109.154 0.625 13.161 340 HG SER 479 HG SER 479 109.982 0.325 15.157 341 H GLU 480 H GLU 480 108.704 3.444 13.608 342 HA GLU 480 HA GLU 480 106.789 4.701 12.038 343 HB2 GLU 480 HB2 GLU 480 109.486 5.143 12.743 344 HB3 GLU 480 HB3 GLU 480 109.417 5.220 10.988 345 HG2 GLU 480 HG2 GLU 480 107.234 6.701 11.769 346 HG3 GLU 480 HG3 GLU 480 108.454 7.100 12.977 347 H VAL 481 H VAL 481 105.914 4.201 10.145 348 HA VAL 481 HA VAL 481 107.282 2.244 8.437 349 HB VAL 481 HB VAL 481 105.101 1.882 7.370 350 HG11 VAL 481 HG11 VAL 481 104.503 1.650 10.271 351 HG12 VAL 481 HG12 VAL 481 105.933 0.827 9.647 352 HG13 VAL 481 HG13 VAL 481 104.341 0.457 8.982 353 HG21 VAL 481 HG21 VAL 481 103.087 2.859 8.591 354 HG22 VAL 481 HG22 VAL 481 103.998 3.948 7.542 355 HG23 VAL 481 HG23 VAL 481 104.219 4.016 9.291 356 H LEU 482 H LEU 482 106.504 2.559 6.014 357 HA LEU 482 HA LEU 482 107.510 5.175 5.250 358 HB2 LEU 482 HB2 LEU 482 108.551 3.539 4.000 359 HB3 LEU 482 HB3 LEU 482 107.097 2.569 3.861 360 HG LEU 482 HG LEU 482 106.190 4.394 2.335 361 HD11 LEU 482 HD11 LEU 482 107.499 6.259 2.621 362 HD12 LEU 482 HD12 LEU 482 108.219 5.562 1.170 363 HD13 LEU 482 HD13 LEU 482 108.992 5.328 2.738 364 HD21 LEU 482 HD21 LEU 482 108.100 2.284 1.829 365 HD22 LEU 482 HD22 LEU 482 108.209 3.563 0.620 366 HD23 LEU 482 HD23 LEU 482 106.669 2.755 0.912 367 H TYR 483 H TYR 483 104.524 3.378 5.215 368 HA TYR 483 HA TYR 483 102.788 5.446 5.074 369 HB2 TYR 483 HB2 TYR 483 103.611 6.331 3.057 370 HB3 TYR 483 HB3 TYR 483 103.766 4.740 2.319 371 HD1 TYR 483 HD1 TYR 483 101.719 7.626 2.667 372 HD2 TYR 483 HD2 TYR 483 101.581 3.454 1.851 373 HE1 TYR 483 HE1 TYR 483 99.508 7.910 1.627 374 HE2 TYR 483 HE2 TYR 483 99.370 3.724 0.809 375 HH TYR 483 HH TYR 483 97.656 5.128 0.462 376 H VAL 484 H VAL 484 100.719 4.724 5.224 377 HA VAL 484 HA VAL 484 100.313 1.851 4.994 378 HB VAL 484 HB VAL 484 99.559 3.193 7.005 379 HG11 VAL 484 HG11 VAL 484 98.606 5.024 5.477 380 HG12 VAL 484 HG12 VAL 484 97.679 4.572 6.905 381 HG13 VAL 484 HG13 VAL 484 97.203 3.970 5.319 382 HG21 VAL 484 HG21 VAL 484 98.441 1.291 7.303 383 HG22 VAL 484 HG22 VAL 484 98.216 1.087 5.567 384 HG23 VAL 484 HG23 VAL 484 97.064 2.043 6.498 385 H ASP 485 H ASP 485 99.493 0.970 3.221 386 HA ASP 485 HA ASP 485 97.948 2.649 1.377 387 HB2 ASP 485 HB2 ASP 485 100.049 1.176 0.783 388 HB3 ASP 485 HB3 ASP 485 98.848 -0.101 0.655 389 H LEU 486 H LEU 486 96.162 2.408 2.971 390 HA LEU 486 HA LEU 486 94.820 -0.164 3.020 391 HB2 LEU 486 HB2 LEU 486 94.882 1.365 4.995 392 HB3 LEU 486 HB3 LEU 486 93.866 2.484 4.104 393 HG LEU 486 HG LEU 486 92.709 -0.176 4.172 394 HD11 LEU 486 HD11 LEU 486 93.967 0.724 6.584 395 HD12 LEU 486 HD12 LEU 486 93.080 -0.769 6.271 396 HD13 LEU 486 HD13 LEU 486 92.216 0.678 6.792 397 HD21 LEU 486 HD21 LEU 486 90.866 1.056 4.068 398 HD22 LEU 486 HD22 LEU 486 91.896 2.487 4.034 399 HD23 LEU 486 HD23 LEU 486 91.268 1.889 5.570 400 H LEU 487 H LEU 487 93.401 -0.802 1.531 401 HA LEU 487 HA LEU 487 92.653 0.807 -0.655 402 HB2 LEU 487 HB2 LEU 487 91.964 -1.893 0.342 403 HB3 LEU 487 HB3 LEU 487 90.813 -1.155 -0.755 404 HG LEU 487 HG LEU 487 93.227 -0.749 -2.031 405 HD11 LEU 487 HD11 LEU 487 94.622 -2.521 -1.799 406 HD12 LEU 487 HD12 LEU 487 93.321 -3.631 -1.367 407 HD13 LEU 487 HD13 LEU 487 93.956 -2.506 -0.167 408 HD21 LEU 487 HD21 LEU 487 90.772 -2.039 -2.472 409 HD22 LEU 487 HD22 LEU 487 92.028 -3.204 -2.896 410 HD23 LEU 487 HD23 LEU 487 92.001 -1.616 -3.664 411 H GLU 488 H GLU 488 91.687 2.691 0.050 412 HA GLU 488 HA GLU 488 89.863 3.282 1.888 413 HB2 GLU 488 HB2 GLU 488 89.143 5.088 0.592 414 HB3 GLU 488 HB3 GLU 488 90.743 4.733 -0.048 415 HG2 GLU 488 HG2 GLU 488 89.540 3.326 -1.801 416 HG3 GLU 488 HG3 GLU 488 88.070 4.135 -1.263 417 H GLY 489 H GLY 489 87.947 2.578 2.547 418 HA2 GLY 489 HA2 GLY 489 85.809 1.722 2.500 419 HA3 GLY 489 HA3 GLY 489 85.846 1.868 0.750 420 H ASP 490 H ASP 490 88.495 0.119 1.842 421 HA ASP 490 HA ASP 490 87.101 -2.408 1.257 422 HB2 ASP 490 HB2 ASP 490 89.056 -1.408 -0.241 423 HB3 ASP 490 HB3 ASP 490 90.059 -2.205 0.968 424 H THR 491 H THR 491 88.139 -4.353 2.245 425 HA THR 491 HA THR 491 88.757 -3.776 5.051 426 HB THR 491 HB THR 491 88.417 -6.429 5.084 427 HG1 THR 491 HG1 THR 491 87.373 -7.171 3.395 428 HG21 THR 491 HG21 THR 491 86.977 -5.402 6.499 429 HG22 THR 491 HG22 THR 491 85.821 -5.727 5.206 430 HG23 THR 491 HG23 THR 491 86.572 -4.137 5.339 431 H GLU 492 H GLU 492 90.578 -3.961 2.505 432 HA GLU 492 HA GLU 492 92.641 -5.611 3.803 433 HB2 GLU 492 HB2 GLU 492 93.507 -6.110 1.513 434 HB3 GLU 492 HB3 GLU 492 91.926 -6.804 1.845 435 HG2 GLU 492 HG2 GLU 492 90.836 -5.136 0.535 436 HG3 GLU 492 HG3 GLU 492 92.333 -4.222 0.359 437 H CYS 493 H CYS 493 94.361 -4.471 4.396 438 HA CYS 493 HA CYS 493 95.032 -2.049 2.865 439 HB2 CYS 493 HB2 CYS 493 94.259 -1.157 4.864 440 HB3 CYS 493 HB3 CYS 493 94.900 -2.483 5.827 441 HG CYS 493 HG CYS 493 96.791 -0.336 4.605 442 H HIS 494 H HIS 494 97.182 -1.655 2.466 443 HA HIS 494 HA HIS 494 99.092 -3.704 3.359 444 HB2 HIS 494 HB2 HIS 494 98.810 -2.524 0.591 445 HB3 HIS 494 HB3 HIS 494 100.199 -3.474 1.113 446 HD1 HIS 494 HD1 HIS 494 96.418 -3.982 1.196 447 HD2 HIS 494 HD2 HIS 494 99.923 -6.032 0.314 448 HE1 HIS 494 HE1 HIS 494 95.691 -6.283 0.490 449 HE2 HIS 494 HE2 HIS 494 97.822 -7.469 -0.142 450 H ALA 495 H ALA 495 100.416 -2.684 4.726 451 HA ALA 495 HA ALA 495 101.090 0.112 4.254 452 HB1 ALA 495 HB1 ALA 495 100.477 -0.190 6.474 453 HB2 ALA 495 HB2 ALA 495 102.239 -0.164 6.533 454 HB3 ALA 495 HB3 ALA 495 101.377 -1.700 6.619 455 H ARG 496 H ARG 496 102.988 0.837 3.612 456 HA ARG 496 HA ARG 496 105.090 -1.077 2.943 457 HB2 ARG 496 HB2 ARG 496 105.490 1.779 2.324 458 HB3 ARG 496 HB3 ARG 496 105.715 0.364 1.307 459 HG2 ARG 496 HG2 ARG 496 102.974 0.506 1.623 460 HG3 ARG 496 HG3 ARG 496 103.473 2.192 1.484 461 HD2 ARG 496 HD2 ARG 496 104.671 0.270 -0.422 462 HD3 ARG 496 HD3 ARG 496 102.961 0.643 -0.634 463 HE ARG 496 HE ARG 496 105.190 2.375 -1.156 464 HH11 ARG 496 HH11 ARG 496 101.805 2.250 -0.339 465 HH12 ARG 496 HH12 ARG 496 101.456 3.815 -0.994 466 HH21 ARG 496 HH21 ARG 496 104.741 4.439 -2.017 467 HH22 ARG 496 HH22 ARG 496 103.125 5.058 -1.948 468 H PHE 497 H PHE 497 107.048 -1.123 3.950 469 HA PHE 497 HA PHE 497 107.484 0.820 6.124 470 HB2 PHE 497 HB2 PHE 497 108.316 -2.084 5.965 471 HB3 PHE 497 HB3 PHE 497 108.800 -0.977 7.247 472 HD1 PHE 497 HD1 PHE 497 107.685 -1.343 9.208 473 HD2 PHE 497 HD2 PHE 497 105.589 -1.822 5.536 474 HE1 PHE 497 HE1 PHE 497 105.635 -1.894 10.453 475 HE2 PHE 497 HE2 PHE 497 103.536 -2.371 6.774 476 HZ PHE 497 HZ PHE 497 103.557 -2.408 9.237 477 H LYS 498 H LYS 498 109.712 1.355 6.618 478 HA LYS 498 HA LYS 498 111.241 1.754 4.208 479 HB2 LYS 498 HB2 LYS 498 110.974 3.499 5.979 480 HB3 LYS 498 HB3 LYS 498 111.963 2.507 7.043 481 HG2 LYS 498 HG2 LYS 498 113.353 4.197 6.110 482 HG3 LYS 498 HG3 LYS 498 113.799 2.660 5.366 483 HD2 LYS 498 HD2 LYS 498 112.468 3.218 3.397 484 HD3 LYS 498 HD3 LYS 498 111.988 4.743 4.143 485 HE2 LYS 498 HE2 LYS 498 114.230 5.560 4.085 486 HE3 LYS 498 HE3 LYS 498 114.852 3.983 3.599 487 HZ1 LYS 498 HZ1 LYS 498 113.345 4.299 1.569 488 HZ2 LYS 498 HZ2 LYS 498 114.788 5.178 1.634 489 HZ3 LYS 498 HZ3 LYS 498 113.322 5.935 2.003 490 H THR 499 H THR 499 111.220 -0.528 6.769 491 HA THR 499 HA THR 499 113.704 -1.681 5.714 492 HB THR 499 HB THR 499 113.845 -2.458 8.321 493 HG1 THR 499 HG1 THR 499 113.728 -0.158 9.298 494 HG21 THR 499 HG21 THR 499 115.294 -0.779 6.533 495 HG22 THR 499 HG22 THR 499 115.890 -1.684 7.924 496 HG23 THR 499 HG23 THR 499 115.302 -0.035 8.132 497 HA PRO 500 HA PRO 500 111.409 -5.442 5.697 498 HB2 PRO 500 HB2 PRO 500 113.402 -7.246 5.700 499 HB3 PRO 500 HB3 PRO 500 113.100 -6.189 4.316 500 HG2 PRO 500 HG2 PRO 500 115.153 -5.941 6.477 501 HG3 PRO 500 HG3 PRO 500 115.324 -5.670 4.734 502 HD2 PRO 500 HD2 PRO 500 114.989 -3.658 6.560 503 HD3 PRO 500 HD3 PRO 500 114.494 -3.540 4.860 504 H GLU 501 H GLU 501 113.993 -5.202 8.111 505 HA GLU 501 HA GLU 501 113.107 -7.326 9.750 506 HB2 GLU 501 HB2 GLU 501 114.588 -4.918 10.777 507 HB3 GLU 501 HB3 GLU 501 114.685 -6.582 11.336 508 HG2 GLU 501 HG2 GLU 501 115.582 -7.031 8.927 509 HG3 GLU 501 HG3 GLU 501 115.941 -5.305 8.959 510 H ASP 502 H ASP 502 112.278 -3.929 9.573 511 HA ASP 502 HA ASP 502 110.939 -3.689 12.033 512 HB2 ASP 502 HB2 ASP 502 111.630 -1.891 10.238 513 HB3 ASP 502 HB3 ASP 502 110.005 -2.180 9.623 514 H ALA 503 H ALA 503 109.784 -4.633 8.819 515 HA ALA 503 HA ALA 503 107.053 -4.815 9.504 516 HB1 ALA 503 HB1 ALA 503 107.943 -4.710 7.178 517 HB2 ALA 503 HB2 ALA 503 106.749 -5.982 7.438 518 HB3 ALA 503 HB3 ALA 503 108.465 -6.384 7.354 519 H GLN 504 H GLN 504 109.669 -7.200 9.494 520 HA GLN 504 HA GLN 504 108.100 -9.441 10.143 521 HB2 GLN 504 HB2 GLN 504 110.587 -9.266 9.368 522 HB3 GLN 504 HB3 GLN 504 110.931 -9.162 11.089 523 HG2 GLN 504 HG2 GLN 504 110.922 -11.371 11.149 524 HG3 GLN 504 HG3 GLN 504 109.188 -11.319 10.831 525 HE21 GLN 504 HE21 GLN 504 108.542 -12.460 9.159 526 HE22 GLN 504 HE22 GLN 504 109.490 -12.878 7.777 527 H ALA 505 H ALA 505 109.692 -7.021 12.163 528 HA ALA 505 HA ALA 505 109.248 -8.329 14.630 529 HB1 ALA 505 HB1 ALA 505 110.737 -6.225 13.947 530 HB2 ALA 505 HB2 ALA 505 110.224 -6.535 15.605 531 HB3 ALA 505 HB3 ALA 505 109.343 -5.374 14.613 532 H VAL 506 H VAL 506 107.360 -5.913 12.842 533 HA VAL 506 HA VAL 506 105.411 -5.536 14.869 534 HB VAL 506 HB VAL 506 105.665 -3.856 13.173 535 HG11 VAL 506 HG11 VAL 506 106.428 -5.271 11.347 536 HG12 VAL 506 HG12 VAL 506 105.077 -4.263 10.828 537 HG13 VAL 506 HG13 VAL 506 104.815 -5.968 11.195 538 HG21 VAL 506 HG21 VAL 506 103.008 -5.038 12.485 539 HG22 VAL 506 HG22 VAL 506 103.438 -3.361 12.821 540 HG23 VAL 506 HG23 VAL 506 103.338 -4.526 14.140 541 H ILE 507 H ILE 507 105.503 -7.599 11.983 542 HA ILE 507 HA ILE 507 102.881 -8.617 12.276 543 HB ILE 507 HB ILE 507 103.769 -10.543 10.857 544 HG12 ILE 507 HG12 ILE 507 106.023 -9.211 9.799 545 HG13 ILE 507 HG13 ILE 507 106.239 -9.247 11.544 546 HG21 ILE 507 HG21 ILE 507 104.414 -8.174 9.291 547 HG22 ILE 507 HG22 ILE 507 102.928 -8.005 10.225 548 HG23 ILE 507 HG23 ILE 507 103.109 -9.343 9.091 549 HD11 ILE 507 HD11 ILE 507 105.347 -11.806 10.723 550 HD12 ILE 507 HD12 ILE 507 106.903 -11.348 11.414 551 HD13 ILE 507 HD13 ILE 507 106.671 -11.314 9.667 552 H ASN 508 H ASN 508 105.979 -9.564 13.581 553 HA ASN 508 HA ASN 508 105.136 -12.094 14.606 554 HB2 ASN 508 HB2 ASN 508 107.485 -10.298 15.192 555 HB3 ASN 508 HB3 ASN 508 107.215 -11.787 16.091 556 HD21 ASN 508 HD21 ASN 508 109.437 -11.128 14.403 557 HD22 ASN 508 HD22 ASN 508 109.471 -12.301 13.135 558 H ALA 509 H ALA 509 105.362 -8.833 15.896 559 HA ALA 509 HA ALA 509 104.520 -9.556 18.538 560 HB1 ALA 509 HB1 ALA 509 104.487 -6.787 17.371 561 HB2 ALA 509 HB2 ALA 509 105.959 -7.566 17.956 562 HB3 ALA 509 HB3 ALA 509 104.623 -7.257 19.066 563 H TYR 510 H TYR 510 102.940 -8.748 15.594 564 HA TYR 510 HA TYR 510 100.551 -7.670 16.549 565 HB2 TYR 510 HB2 TYR 510 101.574 -8.625 14.047 566 HB3 TYR 510 HB3 TYR 510 99.915 -9.176 14.269 567 HD1 TYR 510 HD1 TYR 510 98.831 -7.807 12.655 568 HD2 TYR 510 HD2 TYR 510 101.339 -6.047 15.603 569 HE1 TYR 510 HE1 TYR 510 98.013 -5.582 12.006 570 HE2 TYR 510 HE2 TYR 510 100.525 -3.811 14.964 571 HH TYR 510 HH TYR 510 98.817 -3.217 12.132 572 H THR 511 H THR 511 101.707 -10.823 16.999 573 HA THR 511 HA THR 511 99.462 -12.417 16.780 574 HB THR 511 HB THR 511 101.347 -13.616 17.409 575 HG1 THR 511 HG1 THR 511 100.109 -13.274 19.951 576 HG21 THR 511 HG21 THR 511 102.006 -11.229 18.850 577 HG22 THR 511 HG22 THR 511 103.060 -12.549 18.343 578 HG23 THR 511 HG23 THR 511 102.226 -12.634 19.895 579 H GLU 512 H GLU 512 100.360 -10.115 19.247 580 HA GLU 512 HA GLU 512 98.394 -10.722 21.155 581 HB2 GLU 512 HB2 GLU 512 100.206 -8.454 20.609 582 HB3 GLU 512 HB3 GLU 512 98.787 -8.080 21.577 583 HG2 GLU 512 HG2 GLU 512 100.736 -8.646 22.947 584 HG3 GLU 512 HG3 GLU 512 99.393 -9.763 23.194 585 H ILE 513 H ILE 513 98.101 -9.205 18.103 586 HA ILE 513 HA ILE 513 95.976 -7.447 18.523 587 HB ILE 513 HB ILE 513 96.605 -9.122 16.091 588 HG12 ILE 513 HG12 ILE 513 98.387 -7.684 16.173 589 HG13 ILE 513 HG13 ILE 513 97.234 -6.624 15.373 590 HG21 ILE 513 HG21 ILE 513 95.243 -7.210 14.974 591 HG22 ILE 513 HG22 ILE 513 94.525 -7.034 16.574 592 HG23 ILE 513 HG23 ILE 513 94.398 -8.568 15.714 593 HD11 ILE 513 HD11 ILE 513 98.422 -5.464 17.140 594 HD12 ILE 513 HD12 ILE 513 97.858 -6.651 18.316 595 HD13 ILE 513 HD13 ILE 513 96.703 -5.586 17.515 596 H ASN 514 H ASN 514 95.930 -10.925 17.791 597 HA ASN 514 HA ASN 514 93.232 -11.332 17.462 598 HB2 ASN 514 HB2 ASN 514 94.729 -13.149 17.096 599 HB3 ASN 514 HB3 ASN 514 95.326 -13.081 18.751 600 HD21 ASN 514 HD21 ASN 514 92.118 -13.214 17.238 601 HD22 ASN 514 HD22 ASN 514 91.548 -14.555 18.166 602 H LYS 515 H LYS 515 94.981 -10.699 20.419 603 HA LYS 515 HA LYS 515 93.325 -11.624 22.377 604 HB2 LYS 515 HB2 LYS 515 94.790 -8.989 22.235 605 HB3 LYS 515 HB3 LYS 515 93.992 -9.565 23.690 606 HG2 LYS 515 HG2 LYS 515 95.501 -11.712 23.109 607 HG3 LYS 515 HG3 LYS 515 96.513 -10.428 22.443 608 HD2 LYS 515 HD2 LYS 515 97.098 -9.705 24.476 609 HD3 LYS 515 HD3 LYS 515 95.433 -9.760 25.061 610 HE2 LYS 515 HE2 LYS 515 95.773 -12.305 25.162 611 HE3 LYS 515 HE3 LYS 515 97.493 -11.942 25.032 612 HZ1 LYS 515 HZ1 LYS 515 96.612 -10.262 26.985 613 HZ2 LYS 515 HZ2 LYS 515 97.435 -11.719 27.230 614 HZ3 LYS 515 HZ3 LYS 515 95.745 -11.684 27.283 615 H LYS 516 H LYS 516 92.690 -9.096 20.109 616 HA LYS 516 HA LYS 516 90.089 -8.604 21.404 617 HB2 LYS 516 HB2 LYS 516 91.867 -6.693 21.280 618 HB3 LYS 516 HB3 LYS 516 91.380 -6.594 19.593 619 HG2 LYS 516 HG2 LYS 516 89.787 -5.212 20.272 620 HG3 LYS 516 HG3 LYS 516 88.982 -6.625 20.955 621 HD2 LYS 516 HD2 LYS 516 89.252 -4.744 22.561 622 HD3 LYS 516 HD3 LYS 516 90.013 -6.246 23.091 623 HE2 LYS 516 HE2 LYS 516 92.160 -5.456 22.652 624 HE3 LYS 516 HE3 LYS 516 91.572 -4.181 21.584 625 HZ1 LYS 516 HZ1 LYS 516 92.319 -3.313 23.725 626 HZ2 LYS 516 HZ2 LYS 516 91.178 -4.266 24.529 627 HZ3 LYS 516 HZ3 LYS 516 90.666 -3.030 23.495 628 H HIS 517 H HIS 517 91.813 -8.576 18.305 629 HA HIS 517 HA HIS 517 89.493 -9.804 17.035 630 HB2 HIS 517 HB2 HIS 517 90.696 -7.664 15.405 631 HB3 HIS 517 HB3 HIS 517 89.009 -8.133 15.582 632 HD1 HIS 517 HD1 HIS 517 87.661 -7.005 17.499 633 HD2 HIS 517 HD2 HIS 517 91.552 -5.609 17.080 634 HE1 HIS 517 HE1 HIS 517 87.770 -4.887 18.853 635 HE2 HIS 517 HE2 HIS 517 90.128 -4.051 18.568 636 H CYS 518 H CYS 518 90.075 -11.339 15.606 637 HA CYS 518 HA CYS 518 92.792 -12.079 15.344 638 HB2 CYS 518 HB2 CYS 518 90.624 -13.030 13.489 639 HB3 CYS 518 HB3 CYS 518 92.031 -13.909 14.078 640 HG CYS 518 HG CYS 518 90.476 -14.858 15.709 641 H TRP 519 H TRP 519 94.277 -11.131 14.118 642 HA TRP 519 HA TRP 519 93.424 -9.922 11.566 643 HB2 TRP 519 HB2 TRP 519 94.505 -8.575 13.683 644 HB3 TRP 519 HB3 TRP 519 95.931 -8.921 12.710 645 HD1 TRP 519 HD1 TRP 519 93.326 -8.641 10.253 646 HE1 TRP 519 HE1 TRP 519 93.178 -6.288 9.267 647 HE3 TRP 519 HE3 TRP 519 96.101 -6.135 13.738 648 HZ2 TRP 519 HZ2 TRP 519 94.120 -3.681 9.880 649 HZ3 TRP 519 HZ3 TRP 519 96.429 -3.714 13.466 650 HH2 TRP 519 HH2 TRP 519 95.460 -2.512 11.577 651 H LYS 520 H LYS 520 94.744 -10.090 9.802 652 HA LYS 520 HA LYS 520 96.703 -12.278 9.925 653 HB2 LYS 520 HB2 LYS 520 95.448 -11.275 7.408 654 HB3 LYS 520 HB3 LYS 520 96.083 -12.877 7.759 655 HG2 LYS 520 HG2 LYS 520 93.542 -11.683 8.850 656 HG3 LYS 520 HG3 LYS 520 93.665 -12.933 7.610 657 HD2 LYS 520 HD2 LYS 520 93.792 -14.520 9.163 658 HD3 LYS 520 HD3 LYS 520 95.158 -13.711 9.935 659 HE2 LYS 520 HE2 LYS 520 93.841 -13.239 11.661 660 HE3 LYS 520 HE3 LYS 520 92.883 -12.208 10.599 661 HZ1 LYS 520 HZ1 LYS 520 92.386 -14.989 11.421 662 HZ2 LYS 520 HZ2 LYS 520 91.751 -14.423 9.960 663 HZ3 LYS 520 HZ3 LYS 520 91.326 -13.670 11.413 664 H LEU 521 H LEU 521 98.770 -11.905 9.356 665 HA LEU 521 HA LEU 521 99.411 -9.424 7.924 666 HB2 LEU 521 HB2 LEU 521 101.050 -10.420 10.244 667 HB3 LEU 521 HB3 LEU 521 101.202 -8.892 9.398 668 HG LEU 521 HG LEU 521 100.203 -8.431 11.503 669 HD11 LEU 521 HD11 LEU 521 97.657 -8.119 10.452 670 HD12 LEU 521 HD12 LEU 521 98.720 -8.085 9.044 671 HD13 LEU 521 HD13 LEU 521 98.981 -6.957 10.375 672 HD21 LEU 521 HD21 LEU 521 99.038 -9.973 12.590 673 HD22 LEU 521 HD22 LEU 521 99.011 -10.991 11.150 674 HD23 LEU 521 HD23 LEU 521 97.731 -9.809 11.418 675 H GLU 522 H GLU 522 100.599 -9.820 6.191 676 HA GLU 522 HA GLU 522 102.560 -11.990 6.251 677 HB2 GLU 522 HB2 GLU 522 100.428 -12.823 5.216 678 HB3 GLU 522 HB3 GLU 522 100.633 -11.615 3.955 679 HG2 GLU 522 HG2 GLU 522 102.899 -13.450 4.475 680 HG3 GLU 522 HG3 GLU 522 101.470 -14.114 3.688 681 H ILE 523 H ILE 523 104.421 -11.531 5.210 682 HA ILE 523 HA ILE 523 104.654 -8.865 4.034 683 HB ILE 523 HB ILE 523 106.727 -10.837 4.987 684 HG12 ILE 523 HG12 ILE 523 106.475 -8.030 5.965 685 HG13 ILE 523 HG13 ILE 523 105.276 -9.205 6.501 686 HG21 ILE 523 HG21 ILE 523 108.228 -9.885 3.661 687 HG22 ILE 523 HG22 ILE 523 107.913 -8.337 4.445 688 HG23 ILE 523 HG23 ILE 523 107.000 -8.800 3.009 689 HD11 ILE 523 HD11 ILE 523 106.943 -9.183 8.149 690 HD12 ILE 523 HD12 ILE 523 108.239 -9.233 6.955 691 HD13 ILE 523 HD13 ILE 523 107.224 -10.652 7.214 692 H LEU 524 H LEU 524 104.598 -8.631 1.900 693 HA LEU 524 HA LEU 524 104.551 -10.795 0.096 694 HB2 LEU 524 HB2 LEU 524 104.764 -7.829 -0.189 695 HB3 LEU 524 HB3 LEU 524 105.035 -8.845 -1.591 696 HG LEU 524 HG LEU 524 102.722 -8.004 -1.465 697 HD11 LEU 524 HD11 LEU 524 103.576 -10.578 -2.029 698 HD12 LEU 524 HD12 LEU 524 102.035 -9.854 -2.492 699 HD13 LEU 524 HD13 LEU 524 102.153 -10.806 -1.012 700 HD21 LEU 524 HD21 LEU 524 102.666 -8.024 1.057 701 HD22 LEU 524 HD22 LEU 524 102.396 -9.763 0.953 702 HD23 LEU 524 HD23 LEU 524 101.226 -8.645 0.253 703 H SER 525 H SER 525 106.081 -11.623 -1.307 704 HA SER 525 HA SER 525 108.790 -10.560 -1.223 705 HB2 SER 525 HB2 SER 525 109.830 -12.494 -0.386 706 HB3 SER 525 HB3 SER 525 108.419 -12.300 0.653 707 HG SER 525 HG SER 525 107.359 -13.872 -0.587 708 H GLY 526 H GLY 526 110.246 -11.631 -2.755 709 HA2 GLY 526 HA2 GLY 526 110.717 -12.170 -4.935 710 HA3 GLY 526 HA3 GLY 526 109.557 -13.464 -4.682 711 H ASP 527 H ASP 527 108.806 -13.377 -6.797 712 HA ASP 527 HA ASP 527 108.074 -11.188 -8.273 713 HB2 ASP 527 HB2 ASP 527 106.564 -13.807 -8.195 714 HB3 ASP 527 HB3 ASP 527 106.599 -12.656 -9.526 715 H HIS 528 H HIS 528 106.367 -12.647 -5.588 716 HA HIS 528 HA HIS 528 103.864 -11.408 -6.007 717 HB2 HIS 528 HB2 HIS 528 104.807 -13.247 -4.228 718 HB3 HIS 528 HB3 HIS 528 104.676 -11.823 -3.201 719 HD1 HIS 528 HD1 HIS 528 102.765 -13.297 -2.003 720 HD2 HIS 528 HD2 HIS 528 101.912 -11.930 -5.833 721 HE1 HIS 528 HE1 HIS 528 100.272 -13.516 -2.255 722 HE2 HIS 528 HE2 HIS 528 99.769 -12.587 -4.542 723 H GLU 529 H GLU 529 106.709 -10.451 -4.115 724 HA GLU 529 HA GLU 529 105.597 -8.035 -3.130 725 HB2 GLU 529 HB2 GLU 529 107.599 -7.760 -2.076 726 HB3 GLU 529 HB3 GLU 529 107.792 -9.451 -2.502 727 HG2 GLU 529 HG2 GLU 529 109.063 -8.803 -4.489 728 HG3 GLU 529 HG3 GLU 529 108.878 -7.107 -4.048 729 H GLN 530 H GLN 530 107.667 -8.810 -5.873 730 HA GLN 530 HA GLN 530 108.012 -6.177 -6.817 731 HB2 GLN 530 HB2 GLN 530 109.459 -7.961 -7.573 732 HB3 GLN 530 HB3 GLN 530 108.096 -8.822 -8.277 733 HG2 GLN 530 HG2 GLN 530 108.121 -6.240 -9.411 734 HG3 GLN 530 HG3 GLN 530 109.775 -6.848 -9.452 735 HE21 GLN 530 HE21 GLN 530 106.539 -8.250 -9.900 736 HE22 GLN 530 HE22 GLN 530 106.901 -9.033 -11.396 737 H ARG 531 H ARG 531 105.553 -8.622 -7.442 738 HA ARG 531 HA ARG 531 104.247 -7.373 -9.573 739 HB2 ARG 531 HB2 ARG 531 103.710 -9.632 -9.123 740 HB3 ARG 531 HB3 ARG 531 103.298 -9.285 -7.449 741 HG2 ARG 531 HG2 ARG 531 101.573 -7.703 -8.966 742 HG3 ARG 531 HG3 ARG 531 101.631 -9.262 -9.792 743 HD2 ARG 531 HD2 ARG 531 101.281 -10.289 -7.474 744 HD3 ARG 531 HD3 ARG 531 100.823 -8.664 -6.963 745 HE ARG 531 HE ARG 531 99.225 -8.992 -9.056 746 HH11 ARG 531 HH11 ARG 531 99.990 -11.168 -6.448 747 HH12 ARG 531 HH12 ARG 531 98.455 -11.968 -6.492 748 HH21 ARG 531 HH21 ARG 531 97.199 -10.039 -9.124 749 HH22 ARG 531 HH22 ARG 531 96.867 -11.326 -8.014 750 H TYR 532 H TYR 532 103.371 -7.304 -6.102 751 HA TYR 532 HA TYR 532 101.262 -5.514 -6.286 752 HB2 TYR 532 HB2 TYR 532 101.773 -6.735 -4.236 753 HB3 TYR 532 HB3 TYR 532 103.277 -5.841 -4.051 754 HD1 TYR 532 HD1 TYR 532 103.125 -3.324 -3.667 755 HD2 TYR 532 HD2 TYR 532 99.777 -5.923 -3.315 756 HE1 TYR 532 HE1 TYR 532 101.962 -1.633 -2.313 757 HE2 TYR 532 HE2 TYR 532 98.601 -4.236 -1.965 758 HH TYR 532 HH TYR 532 98.610 -1.993 -1.399 759 H TRP 533 H TRP 533 104.729 -4.866 -5.917 760 HA TRP 533 HA TRP 533 104.515 -2.065 -5.716 761 HB2 TRP 533 HB2 TRP 533 106.701 -3.983 -6.346 762 HB3 TRP 533 HB3 TRP 533 106.953 -2.290 -6.767 763 HD1 TRP 533 HD1 TRP 533 107.299 -4.621 -3.941 764 HE1 TRP 533 HE1 TRP 533 107.707 -3.341 -1.747 765 HE3 TRP 533 HE3 TRP 533 106.101 0.093 -5.515 766 HZ2 TRP 533 HZ2 TRP 533 107.539 -0.682 -0.805 767 HZ3 TRP 533 HZ3 TRP 533 106.251 1.948 -3.905 768 HH2 TRP 533 HH2 TRP 533 106.956 1.565 -1.599 769 H GLN 534 H GLN 534 104.882 -4.226 -8.489 770 HA GLN 534 HA GLN 534 105.290 -2.390 -10.507 771 HB2 GLN 534 HB2 GLN 534 103.760 -4.983 -10.444 772 HB3 GLN 534 HB3 GLN 534 103.895 -4.039 -11.921 773 HG2 GLN 534 HG2 GLN 534 106.386 -4.692 -10.446 774 HG3 GLN 534 HG3 GLN 534 105.583 -5.978 -11.346 775 HE21 GLN 534 HE21 GLN 534 108.016 -3.935 -11.578 776 HE22 GLN 534 HE22 GLN 534 108.014 -3.596 -13.272 777 H LYS 535 H LYS 535 102.251 -3.432 -9.022 778 HA LYS 535 HA LYS 535 100.548 -1.864 -10.622 779 HB2 LYS 535 HB2 LYS 535 98.918 -2.820 -9.400 780 HB3 LYS 535 HB3 LYS 535 100.209 -3.763 -8.673 781 HG2 LYS 535 HG2 LYS 535 100.374 -1.908 -6.942 782 HG3 LYS 535 HG3 LYS 535 98.825 -1.343 -7.578 783 HD2 LYS 535 HD2 LYS 535 97.766 -3.415 -7.031 784 HD3 LYS 535 HD3 LYS 535 99.315 -4.158 -6.621 785 HE2 LYS 535 HE2 LYS 535 99.129 -3.452 -4.532 786 HE3 LYS 535 HE3 LYS 535 99.000 -1.784 -5.081 787 HZ1 LYS 535 HZ1 LYS 535 96.893 -3.664 -4.331 788 HZ2 LYS 535 HZ2 LYS 535 96.547 -2.571 -5.574 789 HZ3 LYS 535 HZ3 LYS 535 97.006 -1.998 -4.050 790 H ILE 536 H ILE 536 102.293 -1.227 -7.631 791 HA ILE 536 HA ILE 536 101.143 1.265 -7.002 792 HB ILE 536 HB ILE 536 103.953 0.293 -6.453 793 HG12 ILE 536 HG12 ILE 536 101.375 0.078 -4.902 794 HG13 ILE 536 HG13 ILE 536 102.448 -1.222 -5.413 795 HG21 ILE 536 HG21 ILE 536 102.843 2.852 -6.108 796 HG22 ILE 536 HG22 ILE 536 104.388 2.250 -5.510 797 HG23 ILE 536 HG23 ILE 536 102.945 2.125 -4.505 798 HD11 ILE 536 HD11 ILE 536 103.936 0.555 -3.776 799 HD12 ILE 536 HD12 ILE 536 103.493 -1.122 -3.466 800 HD13 ILE 536 HD13 ILE 536 102.420 0.182 -2.957 801 H LEU 537 H LEU 537 104.215 0.538 -8.647 802 HA LEU 537 HA LEU 537 104.851 3.164 -9.357 803 HB2 LEU 537 HB2 LEU 537 105.599 0.639 -10.829 804 HB3 LEU 537 HB3 LEU 537 106.418 2.185 -10.939 805 HG LEU 537 HG LEU 537 106.357 1.403 -8.195 806 HD11 LEU 537 HD11 LEU 537 106.146 -0.869 -9.580 807 HD12 LEU 537 HD12 LEU 537 107.099 -0.732 -8.102 808 HD13 LEU 537 HD13 LEU 537 107.893 -0.645 -9.675 809 HD21 LEU 537 HD21 LEU 537 108.049 2.665 -9.933 810 HD22 LEU 537 HD22 LEU 537 108.883 1.138 -9.642 811 HD23 LEU 537 HD23 LEU 537 108.454 2.181 -8.286 812 H VAL 538 H VAL 538 103.504 0.611 -11.477 813 HA VAL 538 HA VAL 538 103.101 2.085 -13.747 814 HB VAL 538 HB VAL 538 101.310 -0.064 -12.608 815 HG11 VAL 538 HG11 VAL 538 100.865 1.667 -14.838 816 HG12 VAL 538 HG12 VAL 538 99.860 0.347 -14.238 817 HG13 VAL 538 HG13 VAL 538 101.128 0.023 -15.420 818 HG21 VAL 538 HG21 VAL 538 103.589 -0.096 -14.579 819 HG22 VAL 538 HG22 VAL 538 102.480 -1.448 -14.348 820 HG23 VAL 538 HG23 VAL 538 103.499 -0.906 -13.016 821 H ASP 539 H ASP 539 101.038 1.974 -10.873 822 HA ASP 539 HA ASP 539 98.926 3.529 -11.930 823 HB2 ASP 539 HB2 ASP 539 98.487 2.272 -9.949 824 HB3 ASP 539 HB3 ASP 539 99.846 3.003 -9.102 825 H ARG 540 H ARG 540 101.920 4.330 -10.262 826 HA ARG 540 HA ARG 540 101.430 7.073 -9.876 827 HB2 ARG 540 HB2 ARG 540 103.648 5.255 -9.592 828 HB3 ARG 540 HB3 ARG 540 104.192 6.754 -10.332 829 HG2 ARG 540 HG2 ARG 540 104.460 7.215 -8.102 830 HG3 ARG 540 HG3 ARG 540 102.851 7.875 -8.405 831 HD2 ARG 540 HD2 ARG 540 101.808 6.252 -7.199 832 HD3 ARG 540 HD3 ARG 540 103.020 5.032 -7.587 833 HE ARG 540 HE ARG 540 104.138 5.599 -5.678 834 HH11 ARG 540 HH11 ARG 540 101.934 8.167 -6.497 835 HH12 ARG 540 HH12 ARG 540 102.221 9.055 -5.039 836 HH21 ARG 540 HH21 ARG 540 104.527 6.762 -3.753 837 HH22 ARG 540 HH22 ARG 540 103.698 8.257 -3.478 838 H GLN 541 H GLN 541 102.815 5.255 -12.561 839 HA GLN 541 HA GLN 541 103.642 7.434 -14.126 840 HB2 GLN 541 HB2 GLN 541 103.328 4.578 -14.453 841 HB3 GLN 541 HB3 GLN 541 102.796 5.426 -15.897 842 HG2 GLN 541 HG2 GLN 541 104.896 5.661 -16.528 843 HG3 GLN 541 HG3 GLN 541 105.231 6.602 -15.075 844 HE21 GLN 541 HE21 GLN 541 106.007 5.514 -13.219 845 HE22 GLN 541 HE22 GLN 541 106.823 3.997 -13.355 846 H ALA 542 H ALA 542 100.564 5.698 -13.934 847 HA ALA 542 HA ALA 542 99.265 7.036 -16.039 848 HB1 ALA 542 HB1 ALA 542 98.042 5.214 -15.440 849 HB2 ALA 542 HB2 ALA 542 97.177 6.431 -14.502 850 HB3 ALA 542 HB3 ALA 542 98.383 5.410 -13.721 851 H LYS 543 H LYS 543 99.764 7.840 -12.667 852 HA LYS 543 HA LYS 543 97.943 9.808 -12.182 853 HB2 LYS 543 HB2 LYS 543 100.882 9.891 -11.473 854 HB3 LYS 543 HB3 LYS 543 99.626 10.860 -10.716 855 HG2 LYS 543 HG2 LYS 543 99.796 7.854 -10.654 856 HG3 LYS 543 HG3 LYS 543 100.252 8.942 -9.343 857 HD2 LYS 543 HD2 LYS 543 97.923 9.782 -9.284 858 HD3 LYS 543 HD3 LYS 543 97.495 8.599 -10.523 859 HE2 LYS 543 HE2 LYS 543 96.872 7.567 -8.525 860 HE3 LYS 543 HE3 LYS 543 98.440 6.851 -8.901 861 HZ1 LYS 543 HZ1 LYS 543 99.228 7.585 -6.983 862 HZ2 LYS 543 HZ2 LYS 543 97.694 8.169 -6.577 863 HZ3 LYS 543 HZ3 LYS 543 98.803 9.181 -7.354 864 H LEU 544 H LEU 544 100.591 9.903 -14.419 865 HA LEU 544 HA LEU 544 100.906 12.661 -14.735 866 HB2 LEU 544 HB2 LEU 544 102.139 10.541 -15.780 867 HB3 LEU 544 HB3 LEU 544 101.087 10.912 -17.133 868 HG LEU 544 HG LEU 544 102.019 13.261 -17.081 869 HD11 LEU 544 HD11 LEU 544 102.881 13.149 -14.771 870 HD12 LEU 544 HD12 LEU 544 104.107 13.641 -15.940 871 HD13 LEU 544 HD13 LEU 544 104.100 11.994 -15.309 872 HD21 LEU 544 HD21 LEU 544 102.794 11.916 -18.819 873 HD22 LEU 544 HD22 LEU 544 103.681 10.851 -17.728 874 HD23 LEU 544 HD23 LEU 544 104.270 12.484 -18.039 875 H ASN 545 H ASN 545 98.505 10.451 -15.998 876 HA ASN 545 HA ASN 545 97.266 12.632 -17.527 877 HB2 ASN 545 HB2 ASN 545 97.200 9.656 -17.727 878 HB3 ASN 545 HB3 ASN 545 95.774 10.549 -18.246 879 HD21 ASN 545 HD21 ASN 545 99.130 11.571 -18.474 880 HD22 ASN 545 HD22 ASN 545 99.190 11.616 -20.201 881 H GLN 546 H GLN 546 94.839 12.701 -17.458 882 HA GLN 546 HA GLN 546 92.985 13.195 -16.218 883 HB2 GLN 546 HB2 GLN 546 92.988 10.635 -16.414 884 HB3 GLN 546 HB3 GLN 546 93.537 10.627 -14.744 885 HG2 GLN 546 HG2 GLN 546 91.490 11.001 -13.975 886 HG3 GLN 546 HG3 GLN 546 91.225 12.328 -15.105 887 HE21 GLN 546 HE21 GLN 546 90.331 9.231 -14.243 888 HE22 GLN 546 HE22 GLN 546 89.457 8.801 -15.670 889 HA PRO 547 HA PRO 547 95.068 15.071 -12.665 890 HB2 PRO 547 HB2 PRO 547 93.327 17.135 -12.426 891 HB3 PRO 547 HB3 PRO 547 94.629 17.116 -13.621 892 HG2 PRO 547 HG2 PRO 547 91.728 16.457 -13.971 893 HG3 PRO 547 HG3 PRO 547 92.789 17.423 -15.014 894 HD2 PRO 547 HD2 PRO 547 92.176 14.845 -15.562 895 HD3 PRO 547 HD3 PRO 547 93.749 15.557 -15.980 896 H ARG 548 H ARG 548 94.769 14.103 -10.766 897 HA ARG 548 HA ARG 548 92.194 13.189 -9.889 898 HB2 ARG 548 HB2 ARG 548 94.975 13.103 -8.785 899 HB3 ARG 548 HB3 ARG 548 93.618 12.766 -7.718 900 HG2 ARG 548 HG2 ARG 548 93.086 11.215 -9.932 901 HG3 ARG 548 HG3 ARG 548 94.840 11.109 -9.760 902 HD2 ARG 548 HD2 ARG 548 94.616 9.708 -8.053 903 HD3 ARG 548 HD3 ARG 548 93.642 10.890 -7.181 904 HE ARG 548 HE ARG 548 91.765 9.709 -7.751 905 HH11 ARG 548 HH11 ARG 548 94.412 8.689 -9.770 906 HH12 ARG 548 HH12 ARG 548 93.536 7.373 -10.478 907 HH21 ARG 548 HH21 ARG 548 90.603 7.975 -8.675 908 HH22 ARG 548 HH22 ARG 548 91.372 6.968 -9.856 909 H GLU 549 H GLU 549 90.743 14.643 -9.228 910 HA GLU 549 HA GLU 549 91.656 16.844 -7.500 911 HB2 GLU 549 HB2 GLU 549 89.889 16.764 -9.767 912 HB3 GLU 549 HB3 GLU 549 89.011 17.338 -8.355 913 HG2 GLU 549 HG2 GLU 549 90.969 18.943 -8.018 914 HG3 GLU 549 HG3 GLU 549 91.429 18.523 -9.667 915 H LYS 550 H LYS 550 89.587 17.661 -6.176 916 HA LYS 550 HA LYS 550 88.233 17.296 -4.391 917 HB2 LYS 550 HB2 LYS 550 87.573 15.148 -6.269 918 HB3 LYS 550 HB3 LYS 550 87.206 14.751 -4.596 919 HG2 LYS 550 HG2 LYS 550 86.093 17.120 -4.595 920 HG3 LYS 550 HG3 LYS 550 86.049 16.864 -6.340 921 HD2 LYS 550 HD2 LYS 550 84.926 14.665 -5.893 922 HD3 LYS 550 HD3 LYS 550 84.809 15.144 -4.198 923 HE2 LYS 550 HE2 LYS 550 83.789 17.333 -5.441 924 HE3 LYS 550 HE3 LYS 550 83.273 16.051 -6.533 925 HZ1 LYS 550 HZ1 LYS 550 82.239 16.746 -3.994 926 HZ2 LYS 550 HZ2 LYS 550 82.766 15.140 -3.973 927 HZ3 LYS 550 HZ3 LYS 550 81.632 15.642 -5.123 928 H LYS 551 H LYS 551 89.057 17.040 -2.440 929 HA LYS 551 HA LYS 551 90.805 14.742 -1.912 930 HB2 LYS 551 HB2 LYS 551 91.623 16.035 0.011 931 HB3 LYS 551 HB3 LYS 551 91.799 16.934 -1.489 932 HG2 LYS 551 HG2 LYS 551 90.610 18.614 -0.680 933 HG3 LYS 551 HG3 LYS 551 89.267 17.536 -0.297 934 HD2 LYS 551 HD2 LYS 551 91.002 16.917 1.691 935 HD3 LYS 551 HD3 LYS 551 91.382 18.622 1.437 936 HE2 LYS 551 HE2 LYS 551 88.775 17.372 2.240 937 HE3 LYS 551 HE3 LYS 551 89.694 18.632 3.060 938 HZ1 LYS 551 HZ1 LYS 551 88.121 18.879 0.560 939 HZ2 LYS 551 HZ2 LYS 551 89.203 20.067 1.085 940 HZ3 LYS 551 HZ3 LYS 551 87.859 19.672 2.032 941 H ARG 552 H ARG 552 88.047 14.278 -1.996 942 HA ARG 552 HA ARG 552 87.014 14.285 0.699 943 HB2 ARG 552 HB2 ARG 552 85.528 14.598 -1.244 944 HB3 ARG 552 HB3 ARG 552 85.926 12.977 -1.801 945 HG2 ARG 552 HG2 ARG 552 84.032 12.438 -0.724 946 HG3 ARG 552 HG3 ARG 552 85.086 12.419 0.692 947 HD2 ARG 552 HD2 ARG 552 83.522 13.820 1.521 948 HD3 ARG 552 HD3 ARG 552 84.451 15.026 0.632 949 HE ARG 552 HE ARG 552 82.395 13.826 -0.955 950 HH11 ARG 552 HH11 ARG 552 83.077 16.285 1.413 951 HH12 ARG 552 HH12 ARG 552 81.717 17.266 0.977 952 HH21 ARG 552 HH21 ARG 552 80.602 15.109 -1.539 953 HH22 ARG 552 HH22 ARG 552 80.309 16.596 -0.702 954 H GLY 553 H GLY 553 87.260 12.737 2.170 955 HA2 GLY 553 HA2 GLY 553 87.333 10.516 2.950 956 HA3 GLY 553 HA3 GLY 553 87.720 9.981 1.322 957 H THR 554 H THR 554 89.793 12.280 1.347 958 HA THR 554 HA THR 554 91.841 10.796 2.863 959 HB THR 554 HB THR 554 93.402 11.960 1.080 960 HG1 THR 554 HG1 THR 554 91.653 13.032 -0.008 961 HG21 THR 554 HG21 THR 554 93.435 9.941 -0.173 962 HG22 THR 554 HG22 THR 554 91.763 9.573 0.252 963 HG23 THR 554 HG23 THR 554 93.023 9.502 1.485 964 H GLU 555 H GLU 555 92.708 11.901 4.485 965 HA GLU 555 HA GLU 555 92.356 14.789 4.616 966 HB2 GLU 555 HB2 GLU 555 93.140 12.673 6.593 967 HB3 GLU 555 HB3 GLU 555 93.466 14.366 6.936 968 HG2 GLU 555 HG2 GLU 555 91.304 14.849 7.311 969 HG3 GLU 555 HG3 GLU 555 90.729 13.756 6.052 970 H LYS 556 H LYS 556 93.991 16.274 4.613 971 HA LYS 556 HA LYS 556 96.758 15.407 4.640 972 HB2 LYS 556 HB2 LYS 556 95.529 16.726 2.213 973 HB3 LYS 556 HB3 LYS 556 97.259 16.553 2.478 974 HG2 LYS 556 HG2 LYS 556 97.139 14.193 2.316 975 HG3 LYS 556 HG3 LYS 556 95.375 14.212 2.383 976 HD2 LYS 556 HD2 LYS 556 95.166 14.801 0.198 977 HD3 LYS 556 HD3 LYS 556 96.639 15.771 0.208 978 HE2 LYS 556 HE2 LYS 556 97.206 13.979 -1.153 979 HE3 LYS 556 HE3 LYS 556 97.858 13.506 0.416 980 HZ1 LYS 556 HZ1 LYS 556 95.222 12.628 -0.630 981 HZ2 LYS 556 HZ2 LYS 556 95.983 12.088 0.780 982 HZ3 LYS 556 HZ3 LYS 556 96.641 11.712 -0.732 983 H LEU 557 H LEU 557 97.935 16.849 5.707 984 HA LEU 557 HA LEU 557 96.793 19.486 6.232 985 HB2 LEU 557 HB2 LEU 557 98.680 17.689 7.606 986 HB3 LEU 557 HB3 LEU 557 99.080 19.393 7.704 987 HG LEU 557 HG LEU 557 96.286 19.006 8.286 988 HD11 LEU 557 HD11 LEU 557 98.237 17.374 9.899 989 HD12 LEU 557 HD12 LEU 557 96.839 16.787 8.997 990 HD13 LEU 557 HD13 LEU 557 96.607 17.791 10.428 991 HD21 LEU 557 HD21 LEU 557 98.693 20.141 9.660 992 HD22 LEU 557 HD22 LEU 557 97.148 20.008 10.500 993 HD23 LEU 557 HD23 LEU 557 97.272 20.974 9.030 994 H ILE 558 H ILE 558 98.736 21.174 6.602 995 HA ILE 558 HA ILE 558 100.273 22.540 5.619 996 HB ILE 558 HB ILE 558 101.132 20.046 4.146 997 HG12 ILE 558 HG12 ILE 558 102.156 21.311 6.698 998 HG13 ILE 558 HG13 ILE 558 101.305 19.775 6.564 999 HG21 ILE 558 HG21 ILE 558 101.918 22.007 2.999 1000 HG22 ILE 558 HG22 ILE 558 103.270 21.267 3.857 1001 HG23 ILE 558 HG23 ILE 558 102.494 22.709 4.512 1002 HD11 ILE 558 HD11 ILE 558 103.395 19.392 4.870 1003 HD12 ILE 558 HD12 ILE 558 103.353 18.892 6.561 1004 HD13 ILE 558 HD13 ILE 558 104.116 20.417 6.111 1005 H THR 559 H THR 559 100.507 23.834 3.779 1006 HA THR 559 HA THR 559 98.377 23.509 1.828 1007 HB THR 559 HB THR 559 99.837 25.798 1.158 1008 HG1 THR 559 HG1 THR 559 99.514 25.622 3.986 1009 HG21 THR 559 HG21 THR 559 97.767 26.610 1.209 1010 HG22 THR 559 HG22 THR 559 97.684 26.406 2.959 1011 HG23 THR 559 HG23 THR 559 97.228 25.077 1.894 1012 H LYS 560 H LYS 560 98.884 24.076 -0.485 1013 HA LYS 560 HA LYS 560 100.837 22.266 -1.480 1014 HB2 LYS 560 HB2 LYS 560 99.353 24.407 -3.013 1015 HB3 LYS 560 HB3 LYS 560 100.113 22.966 -3.678 1016 HG2 LYS 560 HG2 LYS 560 98.460 21.742 -2.037 1017 HG3 LYS 560 HG3 LYS 560 97.557 23.251 -2.193 1018 HD2 LYS 560 HD2 LYS 560 97.583 23.000 -4.635 1019 HD3 LYS 560 HD3 LYS 560 98.463 21.480 -4.463 1020 HE2 LYS 560 HE2 LYS 560 96.079 21.524 -2.825 1021 HE3 LYS 560 HE3 LYS 560 95.702 21.821 -4.522 1022 HZ1 LYS 560 HZ1 LYS 560 97.335 19.789 -4.812 1023 HZ2 LYS 560 HZ2 LYS 560 95.684 19.568 -4.520 1024 HZ3 LYS 560 HZ3 LYS 560 96.792 19.429 -3.250 1025 H ALA 561 H ALA 561 100.529 25.748 -2.174 1026 HA ALA 561 HA ALA 561 102.088 27.329 -2.684 1027 HB1 ALA 561 HB1 ALA 561 103.513 25.843 -0.490 1028 HB2 ALA 561 HB2 ALA 561 102.550 27.314 -0.356 1029 HB3 ALA 561 HB3 ALA 561 104.105 27.352 -1.187 Start of MODEL 5 1 H1 MET 437 HT1 MET 437 136.512 4.270 6.576 2 H2 MET 437 HT2 MET 437 135.485 4.989 5.404 3 H3 MET 437 HT3 MET 437 137.074 4.506 4.974 4 HA MET 437 HA MET 437 135.990 2.262 5.980 5 HB2 MET 437 HB2 MET 437 133.968 3.794 4.334 6 HB3 MET 437 HB3 MET 437 133.850 2.081 4.705 7 HG2 MET 437 HG2 MET 437 134.076 2.959 7.181 8 HG3 MET 437 HG3 MET 437 133.443 4.438 6.460 9 HE1 MET 437 HE1 MET 437 129.805 3.898 6.173 10 HE2 MET 437 HE2 MET 437 131.070 4.509 5.108 11 HE3 MET 437 HE3 MET 437 131.093 4.910 6.825 12 H HIS 438 H HIS 438 135.641 0.635 4.190 13 HA HIS 438 HA HIS 438 136.651 1.368 1.583 14 HB2 HIS 438 HB2 HIS 438 138.190 -0.730 3.097 15 HB3 HIS 438 HB3 HIS 438 138.628 0.080 1.597 16 HD1 HIS 438 HD1 HIS 438 138.755 0.448 5.292 17 HD2 HIS 438 HD2 HIS 438 139.724 2.668 1.917 18 HE1 HIS 438 HE1 HIS 438 140.176 2.349 6.123 19 HE2 HIS 438 HE2 HIS 438 140.681 3.725 4.074 20 H HIS 439 H HIS 439 134.377 0.600 1.341 21 HA HIS 439 HA HIS 439 134.245 -1.862 0.093 22 HB2 HIS 439 HB2 HIS 439 132.773 -3.083 1.798 23 HB3 HIS 439 HB3 HIS 439 134.505 -3.045 2.117 24 HD1 HIS 439 HD1 HIS 439 135.259 -1.981 4.274 25 HD2 HIS 439 HD2 HIS 439 131.235 -1.325 3.474 26 HE1 HIS 439 HE1 HIS 439 134.320 -0.939 6.361 27 HE2 HIS 439 HE2 HIS 439 131.870 -0.605 5.875 28 H HIS 440 H HIS 440 132.216 -2.264 -0.837 29 HA HIS 440 HA HIS 440 130.314 -1.515 -1.866 30 HB2 HIS 440 HB2 HIS 440 129.826 -2.069 0.840 31 HB3 HIS 440 HB3 HIS 440 128.967 -0.568 0.512 32 HD1 HIS 440 HD1 HIS 440 128.826 -4.200 -0.062 33 HD2 HIS 440 HD2 HIS 440 126.965 -0.791 -1.538 34 HE1 HIS 440 HE1 HIS 440 126.792 -5.023 -1.292 35 HE2 HIS 440 HE2 HIS 440 125.650 -2.937 -2.128 36 H HIS 441 H HIS 441 131.990 0.362 -2.403 37 HA HIS 441 HA HIS 441 131.866 2.879 -1.354 38 HB2 HIS 441 HB2 HIS 441 131.969 3.511 -3.983 39 HB3 HIS 441 HB3 HIS 441 133.349 2.916 -3.067 40 HD1 HIS 441 HD1 HIS 441 130.604 1.572 -5.320 41 HD2 HIS 441 HD2 HIS 441 134.456 0.645 -4.067 42 HE1 HIS 441 HE1 HIS 441 131.293 -0.424 -6.686 43 HE2 HIS 441 HE2 HIS 441 133.656 -0.918 -5.966 44 H HIS 442 H HIS 442 130.094 3.907 -0.713 45 HA HIS 442 HA HIS 442 127.509 3.636 -1.375 46 HB2 HIS 442 HB2 HIS 442 127.433 6.273 -1.081 47 HB3 HIS 442 HB3 HIS 442 127.782 5.206 0.276 48 HD1 HIS 442 HD1 HIS 442 129.735 7.161 -2.344 49 HD2 HIS 442 HD2 HIS 442 130.042 5.880 1.597 50 HE1 HIS 442 HE1 HIS 442 131.880 8.150 -1.482 51 HE2 HIS 442 HE2 HIS 442 132.095 7.278 0.873 52 H HIS 443 H HIS 443 126.648 3.381 -3.333 53 HA HIS 443 HA HIS 443 127.665 4.484 -5.714 54 HB2 HIS 443 HB2 HIS 443 125.222 3.004 -4.917 55 HB3 HIS 443 HB3 HIS 443 125.114 3.944 -6.402 56 HD1 HIS 443 HD1 HIS 443 124.998 1.836 -7.872 57 HD2 HIS 443 HD2 HIS 443 128.448 2.099 -5.572 58 HE1 HIS 443 HE1 HIS 443 126.555 0.087 -8.793 59 HE2 HIS 443 HE2 HIS 443 128.610 0.219 -7.340 60 H SER 444 H SER 444 124.800 5.378 -3.802 61 HA SER 444 HA SER 444 123.610 7.308 -3.643 62 HB2 SER 444 HB2 SER 444 125.152 8.772 -2.908 63 HB3 SER 444 HB3 SER 444 126.386 8.132 -3.993 64 HG SER 444 HG SER 444 125.876 10.301 -4.482 65 H ASN 445 H ASN 445 122.577 9.044 -4.890 66 HA ASN 445 HA ASN 445 121.211 9.413 -6.715 67 HB2 ASN 445 HB2 ASN 445 124.037 9.950 -7.578 68 HB3 ASN 445 HB3 ASN 445 122.699 10.220 -8.690 69 HD21 ASN 445 HD21 ASN 445 123.777 12.416 -8.447 70 HD22 ASN 445 HD22 ASN 445 123.110 13.458 -7.242 71 H ALA 446 H ALA 446 123.784 8.301 -8.802 72 HA ALA 446 HA ALA 446 123.967 6.535 -10.232 73 HB1 ALA 446 HB1 ALA 446 121.636 5.058 -9.170 74 HB2 ALA 446 HB2 ALA 446 122.979 5.328 -8.058 75 HB3 ALA 446 HB3 ALA 446 123.253 4.487 -9.584 76 H THR 447 H THR 447 121.874 4.925 -11.314 77 HA THR 447 HA THR 447 120.069 6.900 -12.522 78 HB THR 447 HB THR 447 120.421 5.718 -14.742 79 HG1 THR 447 HG1 THR 447 122.137 4.284 -13.225 80 HG21 THR 447 HG21 THR 447 122.898 6.839 -14.817 81 HG22 THR 447 HG22 THR 447 122.202 7.624 -13.400 82 HG23 THR 447 HG23 THR 447 121.387 7.737 -14.960 83 H GLY 448 H GLY 448 118.028 6.242 -12.427 84 HA2 GLY 448 HA2 GLY 448 116.320 4.640 -12.960 85 HA3 GLY 448 HA3 GLY 448 117.460 3.357 -12.581 86 HA PRO 449 HA PRO 449 114.936 4.905 -8.757 87 HB2 PRO 449 HB2 PRO 449 112.479 3.823 -9.074 88 HB3 PRO 449 HB3 PRO 449 112.885 5.440 -9.663 89 HG2 PRO 449 HG2 PRO 449 112.759 2.854 -11.169 90 HG3 PRO 449 HG3 PRO 449 112.141 4.450 -11.636 91 HD2 PRO 449 HD2 PRO 449 114.486 3.459 -12.567 92 HD3 PRO 449 HD3 PRO 449 114.215 5.195 -12.310 93 H GLN 450 H GLN 450 113.976 3.467 -7.058 94 HA GLN 450 HA GLN 450 114.201 0.621 -7.423 95 HB2 GLN 450 HB2 GLN 450 116.554 1.837 -6.836 96 HB3 GLN 450 HB3 GLN 450 115.940 1.531 -5.216 97 HG2 GLN 450 HG2 GLN 450 117.430 -0.243 -6.203 98 HG3 GLN 450 HG3 GLN 450 115.882 -0.791 -5.561 99 HE21 GLN 450 HE21 GLN 450 117.221 0.439 -8.612 100 HE22 GLN 450 HE22 GLN 450 116.423 -0.713 -9.624 101 H PHE 451 H PHE 451 112.256 0.194 -6.575 102 HA PHE 451 HA PHE 451 111.270 1.561 -4.237 103 HB2 PHE 451 HB2 PHE 451 109.250 0.315 -4.567 104 HB3 PHE 451 HB3 PHE 451 109.823 0.806 -6.159 105 HD1 PHE 451 HD1 PHE 451 109.600 -2.029 -3.808 106 HD2 PHE 451 HD2 PHE 451 110.383 -0.791 -7.803 107 HE1 PHE 451 HE1 PHE 451 109.553 -4.378 -4.540 108 HE2 PHE 451 HE2 PHE 451 110.335 -3.138 -8.543 109 HZ PHE 451 HZ PHE 451 109.920 -4.935 -6.911 110 H VAL 452 H VAL 452 111.364 0.891 -2.172 111 HA VAL 452 HA VAL 452 113.091 -1.096 -1.315 112 HB VAL 452 HB VAL 452 112.369 0.635 0.197 113 HG11 VAL 452 HG11 VAL 452 109.693 -0.349 -0.510 114 HG12 VAL 452 HG12 VAL 452 110.229 1.270 -0.067 115 HG13 VAL 452 HG13 VAL 452 109.920 0.070 1.188 116 HG21 VAL 452 HG21 VAL 452 112.989 -0.869 1.716 117 HG22 VAL 452 HG22 VAL 452 112.196 -2.185 0.851 118 HG23 VAL 452 HG23 VAL 452 111.270 -1.175 1.962 119 H SER 453 H SER 453 112.835 -3.014 -2.318 120 HA SER 453 HA SER 453 110.378 -4.381 -2.628 121 HB2 SER 453 HB2 SER 453 111.566 -5.860 -3.868 122 HB3 SER 453 HB3 SER 453 112.800 -4.603 -3.792 123 HG SER 453 HG SER 453 113.974 -5.833 -2.542 124 H GLY 454 H GLY 454 109.532 -6.148 -1.628 125 HA2 GLY 454 HA2 GLY 454 109.049 -7.631 0.040 126 HA3 GLY 454 HA3 GLY 454 110.754 -7.616 0.435 127 H VAL 455 H VAL 455 108.703 -4.743 0.611 128 HA VAL 455 HA VAL 455 108.814 -4.977 3.541 129 HB VAL 455 HB VAL 455 109.123 -2.600 3.766 130 HG11 VAL 455 HG11 VAL 455 111.178 -3.427 1.751 131 HG12 VAL 455 HG12 VAL 455 111.066 -4.234 3.313 132 HG13 VAL 455 HG13 VAL 455 111.387 -2.503 3.240 133 HG21 VAL 455 HG21 VAL 455 108.628 -1.144 2.160 134 HG22 VAL 455 HG22 VAL 455 108.151 -2.497 1.135 135 HG23 VAL 455 HG23 VAL 455 109.801 -1.883 1.072 136 H ILE 456 H ILE 456 106.795 -5.287 1.139 137 HA ILE 456 HA ILE 456 104.675 -3.508 2.045 138 HB ILE 456 HB ILE 456 104.697 -5.583 -0.148 139 HG12 ILE 456 HG12 ILE 456 105.967 -3.900 -1.057 140 HG13 ILE 456 HG13 ILE 456 104.363 -3.291 -1.451 141 HG21 ILE 456 HG21 ILE 456 102.560 -4.528 -0.840 142 HG22 ILE 456 HG22 ILE 456 102.574 -3.606 0.663 143 HG23 ILE 456 HG23 ILE 456 102.465 -5.365 0.708 144 HD11 ILE 456 HD11 ILE 456 104.547 -2.024 0.786 145 HD12 ILE 456 HD12 ILE 456 105.448 -1.434 -0.610 146 HD13 ILE 456 HD13 ILE 456 106.273 -2.357 0.646 147 H VAL 457 H VAL 457 104.032 -4.214 4.034 148 HA VAL 457 HA VAL 457 103.511 -7.012 4.523 149 HB VAL 457 HB VAL 457 104.390 -5.293 6.235 150 HG11 VAL 457 HG11 VAL 457 101.520 -4.851 6.902 151 HG12 VAL 457 HG12 VAL 457 102.291 -3.821 5.696 152 HG13 VAL 457 HG13 VAL 457 102.937 -3.897 7.336 153 HG21 VAL 457 HG21 VAL 457 102.890 -7.677 6.464 154 HG22 VAL 457 HG22 VAL 457 102.363 -6.597 7.754 155 HG23 VAL 457 HG23 VAL 457 104.069 -7.015 7.596 156 H LYS 458 H LYS 458 101.734 -7.946 3.820 157 HA LYS 458 HA LYS 458 99.369 -6.455 3.160 158 HB2 LYS 458 HB2 LYS 458 99.909 -8.304 1.745 159 HB3 LYS 458 HB3 LYS 458 100.015 -9.402 3.115 160 HG2 LYS 458 HG2 LYS 458 97.557 -8.942 3.501 161 HG3 LYS 458 HG3 LYS 458 97.556 -8.160 1.919 162 HD2 LYS 458 HD2 LYS 458 98.397 -10.255 0.920 163 HD3 LYS 458 HD3 LYS 458 98.305 -11.024 2.506 164 HE2 LYS 458 HE2 LYS 458 95.897 -10.618 2.568 165 HE3 LYS 458 HE3 LYS 458 95.985 -9.831 0.992 166 HZ1 LYS 458 HZ1 LYS 458 96.778 -11.937 0.058 167 HZ2 LYS 458 HZ2 LYS 458 95.243 -12.092 0.747 168 HZ3 LYS 458 HZ3 LYS 458 96.601 -12.678 1.568 169 H ILE 459 H ILE 459 97.732 -6.004 4.462 170 HA ILE 459 HA ILE 459 97.437 -7.557 6.948 171 HB ILE 459 HB ILE 459 96.518 -4.719 6.475 172 HG12 ILE 459 HG12 ILE 459 98.928 -5.840 7.909 173 HG13 ILE 459 HG13 ILE 459 98.901 -4.670 6.593 174 HG21 ILE 459 HG21 ILE 459 96.292 -4.831 9.025 175 HG22 ILE 459 HG22 ILE 459 96.369 -6.583 8.829 176 HG23 ILE 459 HG23 ILE 459 95.074 -5.664 8.060 177 HD11 ILE 459 HD11 ILE 459 99.192 -3.187 8.243 178 HD12 ILE 459 HD12 ILE 459 98.568 -4.280 9.477 179 HD13 ILE 459 HD13 ILE 459 97.452 -3.364 8.464 180 H ILE 460 H ILE 460 95.710 -8.794 7.044 181 HA ILE 460 HA ILE 460 93.278 -7.909 5.660 182 HB ILE 460 HB ILE 460 94.532 -9.714 4.358 183 HG12 ILE 460 HG12 ILE 460 92.030 -9.030 4.270 184 HG13 ILE 460 HG13 ILE 460 92.531 -10.528 3.491 185 HG21 ILE 460 HG21 ILE 460 93.804 -11.224 6.809 186 HG22 ILE 460 HG22 ILE 460 95.228 -11.348 5.778 187 HG23 ILE 460 HG23 ILE 460 93.697 -12.046 5.254 188 HD11 ILE 460 HD11 ILE 460 90.425 -10.342 5.122 189 HD12 ILE 460 HD12 ILE 460 91.674 -10.744 6.301 190 HD13 ILE 460 HD13 ILE 460 91.377 -11.815 4.932 191 H SER 461 H SER 461 91.425 -8.158 6.762 192 HA SER 461 HA SER 461 91.583 -9.606 9.325 193 HB2 SER 461 HB2 SER 461 90.370 -7.909 10.425 194 HB3 SER 461 HB3 SER 461 91.544 -7.042 9.438 195 HG SER 461 HG SER 461 89.809 -6.891 7.838 196 H THR 462 H THR 462 88.914 -9.196 10.055 197 HA THR 462 HA THR 462 87.505 -10.797 8.015 198 HB THR 462 HB THR 462 86.332 -11.972 9.741 199 HG1 THR 462 HG1 THR 462 87.328 -11.367 12.016 200 HG21 THR 462 HG21 THR 462 88.017 -13.349 10.373 201 HG22 THR 462 HG22 THR 462 89.013 -12.028 10.985 202 HG23 THR 462 HG23 THR 462 88.941 -12.350 9.252 203 H GLU 463 H GLU 463 87.547 -7.888 9.689 204 HA GLU 463 HA GLU 463 85.570 -6.561 8.509 205 HB2 GLU 463 HB2 GLU 463 84.387 -8.584 10.266 206 HB3 GLU 463 HB3 GLU 463 83.779 -6.962 10.564 207 HG2 GLU 463 HG2 GLU 463 83.740 -7.177 7.813 208 HG3 GLU 463 HG3 GLU 463 83.247 -8.776 8.369 209 HA PRO 464 HA PRO 464 86.008 -5.118 13.312 210 HB2 PRO 464 HB2 PRO 464 88.719 -6.388 13.389 211 HB3 PRO 464 HB3 PRO 464 87.595 -6.059 14.714 212 HG2 PRO 464 HG2 PRO 464 87.818 -8.513 13.705 213 HG3 PRO 464 HG3 PRO 464 86.241 -7.868 14.195 214 HD2 PRO 464 HD2 PRO 464 87.339 -8.317 11.477 215 HD3 PRO 464 HD3 PRO 464 85.654 -8.331 12.032 216 H LEU 465 H LEU 465 88.367 -5.394 10.721 217 HA LEU 465 HA LEU 465 90.185 -3.467 11.158 218 HB2 LEU 465 HB2 LEU 465 89.176 -4.735 8.892 219 HB3 LEU 465 HB3 LEU 465 89.014 -3.024 8.539 220 HG LEU 465 HG LEU 465 91.631 -3.865 9.626 221 HD11 LEU 465 HD11 LEU 465 92.111 -4.392 7.041 222 HD12 LEU 465 HD12 LEU 465 90.471 -5.027 7.175 223 HD13 LEU 465 HD13 LEU 465 91.744 -5.637 8.234 224 HD21 LEU 465 HD21 LEU 465 90.680 -2.033 7.433 225 HD22 LEU 465 HD22 LEU 465 92.381 -2.331 7.792 226 HD23 LEU 465 HD23 LEU 465 91.342 -1.586 9.006 227 HA PRO 466 HA PRO 466 87.325 -0.114 12.376 228 HB2 PRO 466 HB2 PRO 466 89.470 1.505 13.112 229 HB3 PRO 466 HB3 PRO 466 88.576 0.428 14.186 230 HG2 PRO 466 HG2 PRO 466 91.176 -0.015 12.789 231 HG3 PRO 466 HG3 PRO 466 90.673 -0.516 14.414 232 HD2 PRO 466 HD2 PRO 466 90.768 -2.258 12.395 233 HD3 PRO 466 HD3 PRO 466 89.478 -2.340 13.614 234 H GLY 467 H GLY 467 90.369 0.316 10.574 235 HA2 GLY 467 HA2 GLY 467 89.525 1.304 8.245 236 HA3 GLY 467 HA3 GLY 467 89.306 2.702 9.284 237 H ARG 468 H ARG 468 90.866 3.430 7.489 238 HA ARG 468 HA ARG 468 93.552 2.619 7.487 239 HB2 ARG 468 HB2 ARG 468 93.928 4.941 6.488 240 HB3 ARG 468 HB3 ARG 468 92.827 3.870 5.632 241 HG2 ARG 468 HG2 ARG 468 91.278 5.334 7.478 242 HG3 ARG 468 HG3 ARG 468 92.348 6.479 6.669 243 HD2 ARG 468 HD2 ARG 468 91.532 5.882 4.534 244 HD3 ARG 468 HD3 ARG 468 90.730 4.442 5.161 245 HE ARG 468 HE ARG 468 89.648 6.705 6.418 246 HH11 ARG 468 HH11 ARG 468 89.746 5.174 3.291 247 HH12 ARG 468 HH12 ARG 468 88.205 5.790 2.797 248 HH21 ARG 468 HH21 ARG 468 87.615 7.518 5.778 249 HH22 ARG 468 HH22 ARG 468 86.994 7.123 4.210 250 H LYS 469 H LYS 469 91.863 5.124 9.322 251 HA LYS 469 HA LYS 469 94.109 6.322 10.494 252 HB2 LYS 469 HB2 LYS 469 92.432 7.026 12.287 253 HB3 LYS 469 HB3 LYS 469 92.096 7.523 10.635 254 HG2 LYS 469 HG2 LYS 469 90.413 5.875 10.385 255 HG3 LYS 469 HG3 LYS 469 90.882 5.076 11.888 256 HD2 LYS 469 HD2 LYS 469 89.752 7.868 11.678 257 HD3 LYS 469 HD3 LYS 469 88.835 6.429 12.134 258 HE2 LYS 469 HE2 LYS 469 91.083 6.434 13.792 259 HE3 LYS 469 HE3 LYS 469 90.539 8.111 13.744 260 HZ1 LYS 469 HZ1 LYS 469 88.222 6.897 14.100 261 HZ2 LYS 469 HZ2 LYS 469 89.209 7.363 15.392 262 HZ3 LYS 469 HZ3 LYS 469 89.223 5.760 14.855 263 H GLN 470 H GLN 470 92.065 3.655 11.640 264 HA GLN 470 HA GLN 470 93.522 3.365 14.087 265 HB2 GLN 470 HB2 GLN 470 91.336 1.855 12.722 266 HB3 GLN 470 HB3 GLN 470 92.211 1.084 14.038 267 HG2 GLN 470 HG2 GLN 470 90.751 3.712 14.203 268 HG3 GLN 470 HG3 GLN 470 90.163 2.162 14.807 269 HE21 GLN 470 HE21 GLN 470 90.971 4.832 16.046 270 HE22 GLN 470 HE22 GLN 470 91.999 4.376 17.358 271 H VAL 471 H VAL 471 93.457 1.600 11.000 272 HA VAL 471 HA VAL 471 95.276 -0.414 11.785 273 HB VAL 471 HB VAL 471 94.585 0.634 9.040 274 HG11 VAL 471 HG11 VAL 471 96.310 -0.512 8.238 275 HG12 VAL 471 HG12 VAL 471 95.567 -1.987 8.858 276 HG13 VAL 471 HG13 VAL 471 96.724 -1.097 9.849 277 HG21 VAL 471 HG21 VAL 471 93.462 -1.409 10.853 278 HG22 VAL 471 HG22 VAL 471 93.574 -1.849 9.149 279 HG23 VAL 471 HG23 VAL 471 92.669 -0.415 9.632 280 H ARG 472 H ARG 472 95.726 2.683 10.110 281 HA ARG 472 HA ARG 472 98.493 2.424 9.661 282 HB2 ARG 472 HB2 ARG 472 98.483 4.709 9.073 283 HB3 ARG 472 HB3 ARG 472 96.898 4.103 8.611 284 HG2 ARG 472 HG2 ARG 472 96.022 5.010 10.775 285 HG3 ARG 472 HG3 ARG 472 97.593 5.782 11.005 286 HD2 ARG 472 HD2 ARG 472 95.624 6.258 8.775 287 HD3 ARG 472 HD3 ARG 472 96.103 7.389 10.037 288 HE ARG 472 HE ARG 472 98.296 6.492 8.417 289 HH11 ARG 472 HH11 ARG 472 95.697 8.797 8.676 290 HH12 ARG 472 HH12 ARG 472 96.460 9.967 7.651 291 HH21 ARG 472 HH21 ARG 472 99.307 8.025 7.063 292 HH22 ARG 472 HH22 ARG 472 98.511 9.528 6.733 293 H ASP 473 H ASP 473 96.669 3.920 12.317 294 HA ASP 473 HA ASP 473 98.928 4.845 13.744 295 HB2 ASP 473 HB2 ASP 473 96.047 4.599 14.219 296 HB3 ASP 473 HB3 ASP 473 97.010 4.395 15.678 297 H THR 474 H THR 474 97.241 1.788 13.635 298 HA THR 474 HA THR 474 98.379 0.615 15.943 299 HB THR 474 HB THR 474 97.937 -1.535 14.338 300 HG1 THR 474 HG1 THR 474 97.111 -0.643 12.553 301 HG21 THR 474 HG21 THR 474 96.803 -1.576 16.330 302 HG22 THR 474 HG22 THR 474 95.470 -1.265 15.216 303 HG23 THR 474 HG23 THR 474 96.181 0.063 16.136 304 H LEU 475 H LEU 475 99.002 -0.670 12.710 305 HA LEU 475 HA LEU 475 101.382 -1.867 13.188 306 HB2 LEU 475 HB2 LEU 475 101.949 -1.445 10.773 307 HB3 LEU 475 HB3 LEU 475 100.386 -2.180 11.071 308 HG LEU 475 HG LEU 475 99.780 0.505 11.006 309 HD11 LEU 475 HD11 LEU 475 100.825 1.291 8.890 310 HD12 LEU 475 HD12 LEU 475 101.934 -0.076 8.985 311 HD13 LEU 475 HD13 LEU 475 101.950 1.162 10.241 312 HD21 LEU 475 HD21 LEU 475 99.713 -0.993 8.451 313 HD22 LEU 475 HD22 LEU 475 98.439 -0.093 9.273 314 HD23 LEU 475 HD23 LEU 475 98.878 -1.706 9.832 315 H ALA 476 H ALA 476 100.923 1.567 12.429 316 HA ALA 476 HA ALA 476 103.698 2.180 12.332 317 HB1 ALA 476 HB1 ALA 476 103.008 4.521 12.457 318 HB2 ALA 476 HB2 ALA 476 101.365 4.019 12.858 319 HB3 ALA 476 HB3 ALA 476 102.044 3.630 11.278 320 H ALA 477 H ALA 477 101.400 1.812 14.890 321 HA ALA 477 HA ALA 477 102.851 3.252 16.879 322 HB1 ALA 477 HB1 ALA 477 101.327 1.503 18.309 323 HB2 ALA 477 HB2 ALA 477 100.430 1.604 16.794 324 HB3 ALA 477 HB3 ALA 477 100.777 3.069 17.713 325 H ILE 478 H ILE 478 102.950 0.023 15.607 326 HA ILE 478 HA ILE 478 104.470 -1.080 17.788 327 HB ILE 478 HB ILE 478 103.752 -2.094 15.048 328 HG12 ILE 478 HG12 ILE 478 102.665 -3.882 16.458 329 HG13 ILE 478 HG13 ILE 478 103.087 -2.927 17.876 330 HG21 ILE 478 HG21 ILE 478 104.816 -4.282 15.911 331 HG22 ILE 478 HG22 ILE 478 105.740 -3.227 16.981 332 HG23 ILE 478 HG23 ILE 478 105.867 -3.040 15.231 333 HD11 ILE 478 HD11 ILE 478 100.732 -2.761 16.644 334 HD12 ILE 478 HD12 ILE 478 101.611 -1.528 15.739 335 HD13 ILE 478 HD13 ILE 478 101.471 -1.403 17.494 336 H SER 479 H SER 479 105.165 0.437 14.717 337 HA SER 479 HA SER 479 107.863 0.958 15.456 338 HB2 SER 479 HB2 SER 479 107.385 -1.095 13.284 339 HB3 SER 479 HB3 SER 479 108.930 -0.297 13.576 340 HG SER 479 HG SER 479 109.148 -1.364 15.451 341 H GLU 480 H GLU 480 109.071 2.029 13.601 342 HA GLU 480 HA GLU 480 107.368 4.018 12.469 343 HB2 GLU 480 HB2 GLU 480 109.624 4.577 13.196 344 HB3 GLU 480 HB3 GLU 480 110.305 3.458 12.022 345 HG2 GLU 480 HG2 GLU 480 109.958 4.861 10.272 346 HG3 GLU 480 HG3 GLU 480 108.529 5.594 10.998 347 H VAL 481 H VAL 481 106.027 3.438 10.875 348 HA VAL 481 HA VAL 481 106.990 1.689 8.733 349 HB VAL 481 HB VAL 481 104.611 1.698 7.975 350 HG11 VAL 481 HG11 VAL 481 104.291 -0.113 9.234 351 HG12 VAL 481 HG12 VAL 481 104.250 0.835 10.722 352 HG13 VAL 481 HG13 VAL 481 105.796 0.311 10.051 353 HG21 VAL 481 HG21 VAL 481 104.228 3.954 9.233 354 HG22 VAL 481 HG22 VAL 481 103.850 2.904 10.599 355 HG23 VAL 481 HG23 VAL 481 102.919 2.779 9.108 356 H LEU 482 H LEU 482 106.713 2.268 6.512 357 HA LEU 482 HA LEU 482 107.327 5.035 6.030 358 HB2 LEU 482 HB2 LEU 482 108.084 2.762 4.801 359 HB3 LEU 482 HB3 LEU 482 106.771 3.245 3.742 360 HG LEU 482 HG LEU 482 109.224 4.873 4.405 361 HD11 LEU 482 HD11 LEU 482 110.053 4.342 2.350 362 HD12 LEU 482 HD12 LEU 482 108.458 4.056 1.655 363 HD13 LEU 482 HD13 LEU 482 109.188 2.849 2.714 364 HD21 LEU 482 HD21 LEU 482 106.616 5.641 3.378 365 HD22 LEU 482 HD22 LEU 482 107.935 6.073 2.289 366 HD23 LEU 482 HD23 LEU 482 107.947 6.643 3.957 367 H TYR 483 H TYR 483 104.990 2.967 4.298 368 HA TYR 483 HA TYR 483 102.951 5.035 4.677 369 HB2 TYR 483 HB2 TYR 483 103.949 5.736 2.620 370 HB3 TYR 483 HB3 TYR 483 103.934 4.094 1.984 371 HD1 TYR 483 HD1 TYR 483 102.210 7.189 2.102 372 HD2 TYR 483 HD2 TYR 483 101.595 2.999 1.696 373 HE1 TYR 483 HE1 TYR 483 100.016 7.616 1.076 374 HE2 TYR 483 HE2 TYR 483 99.401 3.414 0.669 375 HH TYR 483 HH TYR 483 98.018 6.629 0.519 376 H VAL 484 H VAL 484 100.962 4.248 4.962 377 HA VAL 484 HA VAL 484 100.581 1.361 4.686 378 HB VAL 484 HB VAL 484 99.972 2.178 6.846 379 HG11 VAL 484 HG11 VAL 484 98.262 4.197 5.402 380 HG12 VAL 484 HG12 VAL 484 99.712 4.524 6.350 381 HG13 VAL 484 HG13 VAL 484 98.254 3.931 7.144 382 HG21 VAL 484 HG21 VAL 484 97.398 1.825 5.318 383 HG22 VAL 484 HG22 VAL 484 97.694 1.464 7.018 384 HG23 VAL 484 HG23 VAL 484 98.473 0.500 5.764 385 H ASP 485 H ASP 485 99.586 0.580 2.952 386 HA ASP 485 HA ASP 485 97.948 2.374 1.321 387 HB2 ASP 485 HB2 ASP 485 99.874 0.947 0.383 388 HB3 ASP 485 HB3 ASP 485 98.772 -0.416 0.550 389 H LEU 486 H LEU 486 95.814 2.172 1.096 390 HA LEU 486 HA LEU 486 94.508 -0.246 2.164 391 HB2 LEU 486 HB2 LEU 486 94.208 2.516 2.955 392 HB3 LEU 486 HB3 LEU 486 92.686 1.882 2.358 393 HG LEU 486 HG LEU 486 93.485 -0.122 4.032 394 HD11 LEU 486 HD11 LEU 486 95.303 0.826 5.072 395 HD12 LEU 486 HD12 LEU 486 93.997 1.303 6.156 396 HD13 LEU 486 HD13 LEU 486 94.639 2.457 4.987 397 HD21 LEU 486 HD21 LEU 486 91.947 1.232 5.698 398 HD22 LEU 486 HD22 LEU 486 91.296 0.493 4.234 399 HD23 LEU 486 HD23 LEU 486 91.666 2.217 4.262 400 H LEU 487 H LEU 487 93.286 -1.285 0.665 401 HA LEU 487 HA LEU 487 92.870 -0.054 -1.898 402 HB2 LEU 487 HB2 LEU 487 92.444 -2.746 -0.713 403 HB3 LEU 487 HB3 LEU 487 91.492 -2.325 -2.124 404 HG LEU 487 HG LEU 487 94.510 -2.280 -1.999 405 HD11 LEU 487 HD11 LEU 487 93.805 -4.547 -1.894 406 HD12 LEU 487 HD12 LEU 487 94.286 -4.229 -3.560 407 HD13 LEU 487 HD13 LEU 487 92.576 -4.289 -3.133 408 HD21 LEU 487 HD21 LEU 487 93.553 -2.392 -4.639 409 HD22 LEU 487 HD22 LEU 487 94.398 -1.059 -3.851 410 HD23 LEU 487 HD23 LEU 487 92.635 -1.121 -3.831 411 H GLU 488 H GLU 488 91.356 1.479 -2.016 412 HA GLU 488 HA GLU 488 89.373 2.584 -1.803 413 HB2 GLU 488 HB2 GLU 488 88.960 0.384 -3.241 414 HB3 GLU 488 HB3 GLU 488 87.899 -0.000 -1.893 415 HG2 GLU 488 HG2 GLU 488 87.147 2.542 -2.411 416 HG3 GLU 488 HG3 GLU 488 87.608 1.997 -4.022 417 H GLY 489 H GLY 489 90.571 1.796 0.710 418 HA2 GLY 489 HA2 GLY 489 90.023 1.903 2.938 419 HA3 GLY 489 HA3 GLY 489 88.416 2.400 2.436 420 H ASP 490 H ASP 490 89.366 -0.553 1.085 421 HA ASP 490 HA ASP 490 87.316 -2.006 2.347 422 HB2 ASP 490 HB2 ASP 490 88.775 -2.414 0.139 423 HB3 ASP 490 HB3 ASP 490 89.646 -3.483 1.235 424 H THR 491 H THR 491 88.602 -4.466 2.972 425 HA THR 491 HA THR 491 89.675 -3.776 5.612 426 HB THR 491 HB THR 491 89.203 -6.139 6.200 427 HG1 THR 491 HG1 THR 491 87.541 -6.604 4.067 428 HG21 THR 491 HG21 THR 491 86.649 -5.941 5.909 429 HG22 THR 491 HG22 THR 491 87.005 -4.380 5.171 430 HG23 THR 491 HG23 THR 491 87.486 -4.698 6.837 431 H GLU 492 H GLU 492 91.025 -4.082 2.802 432 HA GLU 492 HA GLU 492 93.239 -5.762 3.773 433 HB2 GLU 492 HB2 GLU 492 92.566 -5.367 0.861 434 HB3 GLU 492 HB3 GLU 492 93.644 -6.559 1.574 435 HG2 GLU 492 HG2 GLU 492 91.991 -8.005 1.895 436 HG3 GLU 492 HG3 GLU 492 90.946 -6.776 2.604 437 H CYS 493 H CYS 493 94.863 -4.481 4.329 438 HA CYS 493 HA CYS 493 95.589 -2.261 2.536 439 HB2 CYS 493 HB2 CYS 493 96.466 -1.789 5.241 440 HB3 CYS 493 HB3 CYS 493 95.477 -0.777 4.197 441 HG CYS 493 HG CYS 493 93.568 -1.314 5.614 442 H HIS 494 H HIS 494 97.773 -2.017 2.101 443 HA HIS 494 HA HIS 494 99.560 -4.028 3.310 444 HB2 HIS 494 HB2 HIS 494 99.556 -2.971 0.476 445 HB3 HIS 494 HB3 HIS 494 100.807 -4.010 1.149 446 HD1 HIS 494 HD1 HIS 494 97.010 -4.306 1.264 447 HD2 HIS 494 HD2 HIS 494 100.367 -6.448 0.076 448 HE1 HIS 494 HE1 HIS 494 96.145 -6.535 0.484 449 HE2 HIS 494 HE2 HIS 494 98.200 -7.837 -0.176 450 H ALA 495 H ALA 495 100.700 -2.887 4.780 451 HA ALA 495 HA ALA 495 101.537 -0.178 4.246 452 HB1 ALA 495 HB1 ALA 495 100.839 -0.677 6.479 453 HB2 ALA 495 HB2 ALA 495 102.566 -0.319 6.505 454 HB3 ALA 495 HB3 ALA 495 102.009 -1.990 6.604 455 H ARG 496 H ARG 496 103.416 0.463 3.461 456 HA ARG 496 HA ARG 496 105.466 -1.504 2.835 457 HB2 ARG 496 HB2 ARG 496 106.054 1.259 2.113 458 HB3 ARG 496 HB3 ARG 496 105.974 -0.172 1.095 459 HG2 ARG 496 HG2 ARG 496 103.384 0.146 1.414 460 HG3 ARG 496 HG3 ARG 496 103.861 1.811 1.755 461 HD2 ARG 496 HD2 ARG 496 105.164 1.746 -0.408 462 HD3 ARG 496 HD3 ARG 496 104.353 0.219 -0.750 463 HE ARG 496 HE ARG 496 102.371 1.362 -1.105 464 HH11 ARG 496 HH11 ARG 496 104.846 3.526 0.050 465 HH12 ARG 496 HH12 ARG 496 103.949 4.959 -0.325 466 HH21 ARG 496 HH21 ARG 496 101.182 3.240 -1.599 467 HH22 ARG 496 HH22 ARG 496 101.865 4.796 -1.262 468 H PHE 497 H PHE 497 107.342 -1.702 3.904 469 HA PHE 497 HA PHE 497 107.918 0.279 6.006 470 HB2 PHE 497 HB2 PHE 497 108.590 -2.656 5.799 471 HB3 PHE 497 HB3 PHE 497 109.295 -1.594 7.017 472 HD1 PHE 497 HD1 PHE 497 108.378 -2.063 9.072 473 HD2 PHE 497 HD2 PHE 497 105.843 -1.956 5.657 474 HE1 PHE 497 HE1 PHE 497 106.418 -2.417 10.519 475 HE2 PHE 497 HE2 PHE 497 103.884 -2.307 7.090 476 HZ PHE 497 HZ PHE 497 104.166 -2.538 9.528 477 H LYS 498 H LYS 498 110.033 0.992 6.357 478 HA LYS 498 HA LYS 498 111.537 1.563 4.075 479 HB2 LYS 498 HB2 LYS 498 112.333 1.606 6.989 480 HB3 LYS 498 HB3 LYS 498 113.307 2.284 5.692 481 HG2 LYS 498 HG2 LYS 498 110.571 3.253 5.647 482 HG3 LYS 498 HG3 LYS 498 111.398 3.611 7.164 483 HD2 LYS 498 HD2 LYS 498 113.230 4.139 5.082 484 HD3 LYS 498 HD3 LYS 498 111.692 4.867 4.611 485 HE2 LYS 498 HE2 LYS 498 111.996 5.468 7.321 486 HE3 LYS 498 HE3 LYS 498 113.591 5.711 6.611 487 HZ1 LYS 498 HZ1 LYS 498 112.863 7.645 5.860 488 HZ2 LYS 498 HZ2 LYS 498 111.291 7.335 6.399 489 HZ3 LYS 498 HZ3 LYS 498 111.769 6.833 4.857 490 H THR 499 H THR 499 111.445 -1.250 6.012 491 HA THR 499 HA THR 499 113.512 -2.474 4.383 492 HB THR 499 HB THR 499 114.488 -3.490 6.583 493 HG1 THR 499 HG1 THR 499 114.346 -2.165 8.358 494 HG21 THR 499 HG21 THR 499 115.321 -0.661 6.256 495 HG22 THR 499 HG22 THR 499 115.427 -1.712 4.843 496 HG23 THR 499 HG23 THR 499 116.296 -2.128 6.321 497 HA PRO 500 HA PRO 500 110.850 -5.969 4.751 498 HB2 PRO 500 HB2 PRO 500 112.595 -7.991 4.300 499 HB3 PRO 500 HB3 PRO 500 112.067 -6.887 3.024 500 HG2 PRO 500 HG2 PRO 500 114.594 -6.852 4.632 501 HG3 PRO 500 HG3 PRO 500 114.374 -6.601 2.891 502 HD2 PRO 500 HD2 PRO 500 114.695 -4.548 4.631 503 HD3 PRO 500 HD3 PRO 500 113.708 -4.410 3.162 504 H GLU 501 H GLU 501 113.902 -6.133 6.543 505 HA GLU 501 HA GLU 501 113.147 -8.213 8.298 506 HB2 GLU 501 HB2 GLU 501 115.045 -7.472 9.674 507 HB3 GLU 501 HB3 GLU 501 115.481 -7.586 7.975 508 HG2 GLU 501 HG2 GLU 501 116.466 -5.606 8.655 509 HG3 GLU 501 HG3 GLU 501 114.973 -5.075 7.882 510 H ASP 502 H ASP 502 112.806 -4.710 8.446 511 HA ASP 502 HA ASP 502 112.000 -4.493 11.125 512 HB2 ASP 502 HB2 ASP 502 111.913 -2.795 8.722 513 HB3 ASP 502 HB3 ASP 502 110.658 -2.448 9.908 514 H ALA 503 H ALA 503 110.159 -5.110 8.174 515 HA ALA 503 HA ALA 503 107.584 -4.877 9.255 516 HB1 ALA 503 HB1 ALA 503 106.926 -6.423 7.358 517 HB2 ALA 503 HB2 ALA 503 108.637 -6.467 6.931 518 HB3 ALA 503 HB3 ALA 503 107.761 -4.936 6.904 519 H GLN 504 H GLN 504 109.894 -7.498 9.295 520 HA GLN 504 HA GLN 504 108.191 -9.587 10.082 521 HB2 GLN 504 HB2 GLN 504 110.780 -9.474 9.407 522 HB3 GLN 504 HB3 GLN 504 110.963 -9.527 11.155 523 HG2 GLN 504 HG2 GLN 504 110.839 -11.731 10.981 524 HG3 GLN 504 HG3 GLN 504 109.124 -11.517 10.632 525 HE21 GLN 504 HE21 GLN 504 108.402 -11.661 8.514 526 HE22 GLN 504 HE22 GLN 504 109.366 -12.345 7.254 527 H ALA 505 H ALA 505 109.872 -7.113 11.940 528 HA ALA 505 HA ALA 505 109.381 -8.209 14.494 529 HB1 ALA 505 HB1 ALA 505 110.994 -6.650 14.709 530 HB2 ALA 505 HB2 ALA 505 109.619 -5.607 15.073 531 HB3 ALA 505 HB3 ALA 505 110.316 -5.613 13.453 532 H VAL 506 H VAL 506 107.541 -5.905 12.516 533 HA VAL 506 HA VAL 506 105.655 -5.254 14.522 534 HB VAL 506 HB VAL 506 105.854 -3.757 12.694 535 HG11 VAL 506 HG11 VAL 506 105.193 -6.115 10.940 536 HG12 VAL 506 HG12 VAL 506 106.685 -5.174 10.967 537 HG13 VAL 506 HG13 VAL 506 105.192 -4.444 10.376 538 HG21 VAL 506 HG21 VAL 506 103.503 -4.444 13.664 539 HG22 VAL 506 HG22 VAL 506 103.233 -4.994 12.010 540 HG23 VAL 506 HG23 VAL 506 103.639 -3.306 12.323 541 H ILE 507 H ILE 507 105.589 -7.660 11.910 542 HA ILE 507 HA ILE 507 102.936 -8.510 12.372 543 HB ILE 507 HB ILE 507 103.624 -10.607 11.181 544 HG12 ILE 507 HG12 ILE 507 105.965 -10.074 9.967 545 HG13 ILE 507 HG13 ILE 507 106.272 -9.320 11.526 546 HG21 ILE 507 HG21 ILE 507 103.111 -8.099 10.228 547 HG22 ILE 507 HG22 ILE 507 103.196 -9.562 9.248 548 HG23 ILE 507 HG23 ILE 507 104.608 -8.516 9.395 549 HD11 ILE 507 HD11 ILE 507 105.141 -11.850 12.036 550 HD12 ILE 507 HD12 ILE 507 106.785 -11.298 12.354 551 HD13 ILE 507 HD13 ILE 507 106.395 -12.064 10.815 552 H ASN 508 H ASN 508 105.985 -9.371 13.809 553 HA ASN 508 HA ASN 508 105.068 -11.728 15.140 554 HB2 ASN 508 HB2 ASN 508 107.443 -9.917 15.605 555 HB3 ASN 508 HB3 ASN 508 107.138 -11.363 16.563 556 HD21 ASN 508 HD21 ASN 508 109.230 -10.491 14.527 557 HD22 ASN 508 HD22 ASN 508 109.339 -11.840 13.453 558 H ALA 509 H ALA 509 105.369 -8.337 15.974 559 HA ALA 509 HA ALA 509 104.479 -8.656 18.682 560 HB1 ALA 509 HB1 ALA 509 105.041 -6.499 18.965 561 HB2 ALA 509 HB2 ALA 509 104.270 -5.989 17.462 562 HB3 ALA 509 HB3 ALA 509 105.875 -6.720 17.426 563 H TYR 510 H TYR 510 102.970 -8.123 15.620 564 HA TYR 510 HA TYR 510 100.572 -6.943 16.481 565 HB2 TYR 510 HB2 TYR 510 101.659 -7.955 14.040 566 HB3 TYR 510 HB3 TYR 510 100.010 -8.543 14.230 567 HD1 TYR 510 HD1 TYR 510 99.037 -7.252 12.459 568 HD2 TYR 510 HD2 TYR 510 101.223 -5.341 15.565 569 HE1 TYR 510 HE1 TYR 510 98.183 -5.073 11.706 570 HE2 TYR 510 HE2 TYR 510 100.377 -3.151 14.822 571 HH TYR 510 HH TYR 510 97.793 -2.764 12.818 572 H THR 511 H THR 511 101.702 -10.097 17.024 573 HA THR 511 HA THR 511 99.461 -11.692 16.797 574 HB THR 511 HB THR 511 100.346 -12.982 18.748 575 HG1 THR 511 HG1 THR 511 102.647 -11.423 18.836 576 HG21 THR 511 HG21 THR 511 101.340 -12.840 16.250 577 HG22 THR 511 HG22 THR 511 101.961 -13.936 17.485 578 HG23 THR 511 HG23 THR 511 102.775 -12.402 17.177 579 H GLU 512 H GLU 512 100.312 -9.358 19.258 580 HA GLU 512 HA GLU 512 98.458 -9.877 21.221 581 HB2 GLU 512 HB2 GLU 512 100.291 -8.096 21.173 582 HB3 GLU 512 HB3 GLU 512 99.121 -7.072 20.352 583 HG2 GLU 512 HG2 GLU 512 98.107 -8.309 22.797 584 HG3 GLU 512 HG3 GLU 512 99.472 -7.222 23.047 585 H ILE 513 H ILE 513 97.978 -8.011 18.245 586 HA ILE 513 HA ILE 513 95.553 -6.876 18.605 587 HB ILE 513 HB ILE 513 96.289 -8.446 16.132 588 HG12 ILE 513 HG12 ILE 513 98.059 -6.865 16.762 589 HG13 ILE 513 HG13 ILE 513 97.230 -6.333 15.302 590 HG21 ILE 513 HG21 ILE 513 93.917 -7.729 16.314 591 HG22 ILE 513 HG22 ILE 513 94.776 -6.996 14.961 592 HG23 ILE 513 HG23 ILE 513 94.473 -6.059 16.421 593 HD11 ILE 513 HD11 ILE 513 95.901 -4.773 16.680 594 HD12 ILE 513 HD12 ILE 513 97.635 -4.449 16.727 595 HD13 ILE 513 HD13 ILE 513 96.850 -5.257 18.085 596 H ASN 514 H ASN 514 96.093 -10.297 17.776 597 HA ASN 514 HA ASN 514 93.564 -11.202 17.417 598 HB2 ASN 514 HB2 ASN 514 95.491 -12.675 17.269 599 HB3 ASN 514 HB3 ASN 514 95.759 -12.548 19.005 600 HD21 ASN 514 HD21 ASN 514 92.851 -13.084 17.053 601 HD22 ASN 514 HD22 ASN 514 92.392 -14.557 17.830 602 H LYS 515 H LYS 515 95.019 -10.239 20.461 603 HA LYS 515 HA LYS 515 93.183 -11.340 22.245 604 HB2 LYS 515 HB2 LYS 515 94.880 -8.858 22.347 605 HB3 LYS 515 HB3 LYS 515 93.805 -9.281 23.673 606 HG2 LYS 515 HG2 LYS 515 95.433 -11.530 22.869 607 HG3 LYS 515 HG3 LYS 515 96.417 -10.131 23.308 608 HD2 LYS 515 HD2 LYS 515 96.158 -11.020 25.383 609 HD3 LYS 515 HD3 LYS 515 94.676 -10.062 25.330 610 HE2 LYS 515 HE2 LYS 515 93.677 -12.235 24.261 611 HE3 LYS 515 HE3 LYS 515 95.048 -13.010 25.054 612 HZ1 LYS 515 HZ1 LYS 515 93.931 -12.963 26.947 613 HZ2 LYS 515 HZ2 LYS 515 92.617 -12.220 26.185 614 HZ3 LYS 515 HZ3 LYS 515 93.833 -11.275 26.883 615 H LYS 516 H LYS 516 92.851 -8.748 20.020 616 HA LYS 516 HA LYS 516 90.255 -8.018 21.203 617 HB2 LYS 516 HB2 LYS 516 92.068 -6.229 21.016 618 HB3 LYS 516 HB3 LYS 516 91.841 -6.326 19.276 619 HG2 LYS 516 HG2 LYS 516 90.482 -4.561 19.833 620 HG3 LYS 516 HG3 LYS 516 89.341 -5.908 19.846 621 HD2 LYS 516 HD2 LYS 516 90.740 -5.306 22.386 622 HD3 LYS 516 HD3 LYS 516 89.522 -4.146 21.847 623 HE2 LYS 516 HE2 LYS 516 88.776 -7.001 21.712 624 HE3 LYS 516 HE3 LYS 516 88.953 -6.315 23.327 625 HZ1 LYS 516 HZ1 LYS 516 87.174 -4.957 23.045 626 HZ2 LYS 516 HZ2 LYS 516 86.695 -6.197 22.000 627 HZ3 LYS 516 HZ3 LYS 516 87.398 -4.792 21.376 628 H HIS 517 H HIS 517 91.953 -8.332 18.096 629 HA HIS 517 HA HIS 517 89.585 -9.574 16.945 630 HB2 HIS 517 HB2 HIS 517 90.831 -7.481 15.242 631 HB3 HIS 517 HB3 HIS 517 89.161 -8.030 15.309 632 HD1 HIS 517 HD1 HIS 517 87.612 -6.903 17.063 633 HD2 HIS 517 HD2 HIS 517 91.459 -5.341 16.914 634 HE1 HIS 517 HE1 HIS 517 87.508 -4.737 18.335 635 HE2 HIS 517 HE2 HIS 517 89.824 -3.763 18.149 636 H CYS 518 H CYS 518 90.104 -11.190 15.588 637 HA CYS 518 HA CYS 518 92.770 -12.052 15.331 638 HB2 CYS 518 HB2 CYS 518 90.439 -13.310 15.074 639 HB3 CYS 518 HB3 CYS 518 90.724 -12.981 13.368 640 HG CYS 518 HG CYS 518 93.066 -14.370 14.739 641 H TRP 519 H TRP 519 94.202 -10.758 14.299 642 HA TRP 519 HA TRP 519 93.471 -9.770 11.624 643 HB2 TRP 519 HB2 TRP 519 94.502 -8.375 13.752 644 HB3 TRP 519 HB3 TRP 519 95.933 -8.698 12.776 645 HD1 TRP 519 HD1 TRP 519 93.498 -8.561 10.224 646 HE1 TRP 519 HE1 TRP 519 93.201 -6.227 9.231 647 HE3 TRP 519 HE3 TRP 519 95.769 -5.839 13.906 648 HZ2 TRP 519 HZ2 TRP 519 93.847 -3.538 9.925 649 HZ3 TRP 519 HZ3 TRP 519 95.886 -3.395 13.664 650 HH2 TRP 519 HH2 TRP 519 94.946 -2.272 11.714 651 H LYS 520 H LYS 520 94.828 -10.000 9.906 652 HA LYS 520 HA LYS 520 96.794 -12.173 10.150 653 HB2 LYS 520 HB2 LYS 520 95.556 -11.259 7.590 654 HB3 LYS 520 HB3 LYS 520 96.219 -12.839 7.986 655 HG2 LYS 520 HG2 LYS 520 93.677 -11.678 9.114 656 HG3 LYS 520 HG3 LYS 520 93.772 -12.864 7.809 657 HD2 LYS 520 HD2 LYS 520 94.187 -14.567 9.222 658 HD3 LYS 520 HD3 LYS 520 95.249 -13.592 10.239 659 HE2 LYS 520 HE2 LYS 520 92.857 -14.473 11.050 660 HE3 LYS 520 HE3 LYS 520 93.573 -12.969 11.626 661 HZ1 LYS 520 HZ1 LYS 520 92.175 -11.706 10.339 662 HZ2 LYS 520 HZ2 LYS 520 91.154 -12.993 10.739 663 HZ3 LYS 520 HZ3 LYS 520 91.889 -12.940 9.216 664 H LEU 521 H LEU 521 98.863 -11.878 9.495 665 HA LEU 521 HA LEU 521 99.523 -9.425 8.027 666 HB2 LEU 521 HB2 LEU 521 101.167 -10.431 10.344 667 HB3 LEU 521 HB3 LEU 521 101.382 -8.936 9.453 668 HG LEU 521 HG LEU 521 100.430 -8.361 11.551 669 HD11 LEU 521 HD11 LEU 521 99.278 -6.880 10.348 670 HD12 LEU 521 HD12 LEU 521 97.890 -7.941 10.583 671 HD13 LEU 521 HD13 LEU 521 98.862 -8.071 9.118 672 HD21 LEU 521 HD21 LEU 521 97.921 -9.814 11.363 673 HD22 LEU 521 HD22 LEU 521 99.038 -9.652 12.719 674 HD23 LEU 521 HD23 LEU 521 99.318 -10.885 11.488 675 H GLU 522 H GLU 522 100.636 -9.880 6.261 676 HA GLU 522 HA GLU 522 102.556 -12.090 6.294 677 HB2 GLU 522 HB2 GLU 522 100.492 -12.999 5.337 678 HB3 GLU 522 HB3 GLU 522 100.446 -11.689 4.165 679 HG2 GLU 522 HG2 GLU 522 102.884 -13.369 4.250 680 HG3 GLU 522 HG3 GLU 522 101.415 -14.084 3.588 681 H ILE 523 H ILE 523 104.447 -11.517 5.444 682 HA ILE 523 HA ILE 523 104.677 -8.925 4.147 683 HB ILE 523 HB ILE 523 106.761 -10.894 5.081 684 HG12 ILE 523 HG12 ILE 523 107.057 -8.383 6.305 685 HG13 ILE 523 HG13 ILE 523 105.326 -8.706 6.310 686 HG21 ILE 523 HG21 ILE 523 108.418 -9.162 4.546 687 HG22 ILE 523 HG22 ILE 523 107.149 -8.191 3.801 688 HG23 ILE 523 HG23 ILE 523 107.587 -9.753 3.108 689 HD11 ILE 523 HD11 ILE 523 107.221 -10.820 7.214 690 HD12 ILE 523 HD12 ILE 523 105.540 -10.543 7.672 691 HD13 ILE 523 HD13 ILE 523 106.808 -9.484 8.290 692 H LEU 524 H LEU 524 104.635 -8.704 2.019 693 HA LEU 524 HA LEU 524 104.598 -10.892 0.232 694 HB2 LEU 524 HB2 LEU 524 104.720 -7.924 -0.056 695 HB3 LEU 524 HB3 LEU 524 105.043 -8.923 -1.456 696 HG LEU 524 HG LEU 524 102.663 -8.076 -1.168 697 HD11 LEU 524 HD11 LEU 524 102.262 -10.928 -1.320 698 HD12 LEU 524 HD12 LEU 524 103.694 -10.433 -2.224 699 HD13 LEU 524 HD13 LEU 524 102.129 -9.703 -2.581 700 HD21 LEU 524 HD21 LEU 524 102.086 -10.358 0.595 701 HD22 LEU 524 HD22 LEU 524 101.353 -8.755 0.531 702 HD23 LEU 524 HD23 LEU 524 102.891 -8.989 1.363 703 H SER 525 H SER 525 106.151 -11.724 -1.122 704 HA SER 525 HA SER 525 108.829 -10.573 -1.066 705 HB2 SER 525 HB2 SER 525 108.437 -12.405 0.776 706 HB3 SER 525 HB3 SER 525 108.600 -13.521 -0.580 707 HG SER 525 HG SER 525 110.633 -13.240 0.177 708 H GLY 526 H GLY 526 110.299 -11.577 -2.625 709 HA2 GLY 526 HA2 GLY 526 110.776 -12.127 -4.802 710 HA3 GLY 526 HA3 GLY 526 109.595 -13.408 -4.577 711 H ASP 527 H ASP 527 109.174 -13.061 -6.878 712 HA ASP 527 HA ASP 527 108.352 -10.858 -8.183 713 HB2 ASP 527 HB2 ASP 527 106.668 -13.348 -8.360 714 HB3 ASP 527 HB3 ASP 527 107.103 -12.223 -9.643 715 H HIS 528 H HIS 528 106.633 -12.478 -5.616 716 HA HIS 528 HA HIS 528 104.116 -11.256 -5.974 717 HB2 HIS 528 HB2 HIS 528 105.224 -13.112 -4.210 718 HB3 HIS 528 HB3 HIS 528 104.755 -11.759 -3.186 719 HD1 HIS 528 HD1 HIS 528 102.926 -13.396 -2.185 720 HD2 HIS 528 HD2 HIS 528 102.408 -12.361 -6.177 721 HE1 HIS 528 HE1 HIS 528 100.554 -14.021 -2.739 722 HE2 HIS 528 HE2 HIS 528 100.259 -13.378 -5.157 723 H GLU 529 H GLU 529 106.924 -10.349 -3.983 724 HA GLU 529 HA GLU 529 105.725 -8.027 -2.882 725 HB2 GLU 529 HB2 GLU 529 107.726 -7.688 -1.817 726 HB3 GLU 529 HB3 GLU 529 107.918 -9.382 -2.232 727 HG2 GLU 529 HG2 GLU 529 109.144 -8.646 -4.288 728 HG3 GLU 529 HG3 GLU 529 109.100 -7.006 -3.642 729 H GLN 530 H GLN 530 107.859 -8.571 -5.635 730 HA GLN 530 HA GLN 530 108.091 -5.867 -6.421 731 HB2 GLN 530 HB2 GLN 530 109.691 -7.310 -7.350 732 HB3 GLN 530 HB3 GLN 530 108.481 -8.491 -7.835 733 HG2 GLN 530 HG2 GLN 530 107.951 -6.023 -9.160 734 HG3 GLN 530 HG3 GLN 530 109.647 -6.449 -9.379 735 HE21 GLN 530 HE21 GLN 530 106.392 -7.830 -9.565 736 HE22 GLN 530 HE22 GLN 530 106.721 -8.868 -10.906 737 H ARG 531 H ARG 531 105.720 -8.350 -7.030 738 HA ARG 531 HA ARG 531 104.366 -7.160 -9.181 739 HB2 ARG 531 HB2 ARG 531 104.108 -9.526 -8.365 740 HB3 ARG 531 HB3 ARG 531 103.138 -8.899 -7.039 741 HG2 ARG 531 HG2 ARG 531 102.456 -8.421 -9.926 742 HG3 ARG 531 HG3 ARG 531 101.872 -9.813 -9.013 743 HD2 ARG 531 HD2 ARG 531 101.297 -7.721 -7.339 744 HD3 ARG 531 HD3 ARG 531 101.022 -7.017 -8.933 745 HE ARG 531 HE ARG 531 99.421 -8.989 -7.619 746 HH11 ARG 531 HH11 ARG 531 100.446 -7.803 -10.732 747 HH12 ARG 531 HH12 ARG 531 99.043 -8.392 -11.560 748 HH21 ARG 531 HH21 ARG 531 97.574 -9.766 -8.699 749 HH22 ARG 531 HH22 ARG 531 97.409 -9.508 -10.403 750 H TYR 532 H TYR 532 103.643 -7.044 -5.681 751 HA TYR 532 HA TYR 532 101.432 -5.337 -5.883 752 HB2 TYR 532 HB2 TYR 532 101.828 -6.515 -3.829 753 HB3 TYR 532 HB3 TYR 532 103.407 -5.761 -3.635 754 HD1 TYR 532 HD1 TYR 532 103.442 -3.200 -3.330 755 HD2 TYR 532 HD2 TYR 532 99.950 -5.573 -2.817 756 HE1 TYR 532 HE1 TYR 532 102.427 -1.407 -1.987 757 HE2 TYR 532 HE2 TYR 532 98.924 -3.782 -1.476 758 HH TYR 532 HH TYR 532 100.515 -0.658 -1.063 759 H TRP 533 H TRP 533 104.881 -4.619 -5.455 760 HA TRP 533 HA TRP 533 104.626 -1.833 -5.191 761 HB2 TRP 533 HB2 TRP 533 106.838 -3.684 -5.961 762 HB3 TRP 533 HB3 TRP 533 107.046 -1.964 -6.274 763 HD1 TRP 533 HD1 TRP 533 107.442 -4.482 -3.591 764 HE1 TRP 533 HE1 TRP 533 107.931 -3.330 -1.342 765 HE3 TRP 533 HE3 TRP 533 106.287 0.328 -4.875 766 HZ2 TRP 533 HZ2 TRP 533 107.838 -0.726 -0.257 767 HZ3 TRP 533 HZ3 TRP 533 106.514 2.092 -3.173 768 HH2 TRP 533 HH2 TRP 533 107.273 1.573 -0.911 769 H GLN 534 H GLN 534 104.753 -3.945 -7.987 770 HA GLN 534 HA GLN 534 105.142 -2.024 -9.991 771 HB2 GLN 534 HB2 GLN 534 103.746 -4.695 -9.973 772 HB3 GLN 534 HB3 GLN 534 103.839 -3.713 -11.428 773 HG2 GLN 534 HG2 GLN 534 106.379 -4.211 -10.012 774 HG3 GLN 534 HG3 GLN 534 105.626 -5.595 -10.804 775 HE21 GLN 534 HE21 GLN 534 108.039 -4.771 -11.668 776 HE22 GLN 534 HE22 GLN 534 107.906 -4.014 -13.216 777 H LYS 535 H LYS 535 102.217 -3.229 -8.421 778 HA LYS 535 HA LYS 535 100.360 -1.812 -9.989 779 HB2 LYS 535 HB2 LYS 535 98.797 -2.720 -8.620 780 HB3 LYS 535 HB3 LYS 535 100.148 -3.699 -8.071 781 HG2 LYS 535 HG2 LYS 535 100.500 -1.910 -6.287 782 HG3 LYS 535 HG3 LYS 535 98.894 -1.327 -6.734 783 HD2 LYS 535 HD2 LYS 535 97.930 -3.488 -6.214 784 HD3 LYS 535 HD3 LYS 535 99.530 -4.148 -5.870 785 HE2 LYS 535 HE2 LYS 535 98.559 -3.664 -3.776 786 HE3 LYS 535 HE3 LYS 535 99.731 -2.381 -4.075 787 HZ1 LYS 535 HZ1 LYS 535 97.861 -1.263 -3.330 788 HZ2 LYS 535 HZ2 LYS 535 96.785 -2.253 -4.181 789 HZ3 LYS 535 HZ3 LYS 535 97.726 -1.118 -5.010 790 H ILE 536 H ILE 536 102.149 -0.981 -7.070 791 HA ILE 536 HA ILE 536 100.861 1.393 -6.388 792 HB ILE 536 HB ILE 536 103.838 0.934 -6.183 793 HG12 ILE 536 HG12 ILE 536 101.600 0.012 -4.370 794 HG13 ILE 536 HG13 ILE 536 102.752 -1.000 -5.236 795 HG21 ILE 536 HG21 ILE 536 102.763 2.264 -3.938 796 HG22 ILE 536 HG22 ILE 536 102.112 3.052 -5.374 797 HG23 ILE 536 HG23 ILE 536 103.857 2.901 -5.166 798 HD11 ILE 536 HD11 ILE 536 104.359 0.642 -3.724 799 HD12 ILE 536 HD12 ILE 536 103.920 -1.023 -3.350 800 HD13 ILE 536 HD13 ILE 536 102.991 0.309 -2.664 801 H LEU 537 H LEU 537 103.846 1.059 -8.313 802 HA LEU 537 HA LEU 537 104.098 3.697 -9.107 803 HB2 LEU 537 HB2 LEU 537 105.190 1.142 -9.893 804 HB3 LEU 537 HB3 LEU 537 104.944 2.163 -11.297 805 HG LEU 537 HG LEU 537 106.290 3.938 -10.206 806 HD11 LEU 537 HD11 LEU 537 106.728 3.854 -8.036 807 HD12 LEU 537 HD12 LEU 537 107.658 2.376 -8.279 808 HD13 LEU 537 HD13 LEU 537 105.933 2.283 -7.927 809 HD21 LEU 537 HD21 LEU 537 107.796 1.335 -10.322 810 HD22 LEU 537 HD22 LEU 537 108.400 2.956 -10.665 811 HD23 LEU 537 HD23 LEU 537 107.241 2.197 -11.757 812 H VAL 538 H VAL 538 102.552 1.050 -10.934 813 HA VAL 538 HA VAL 538 101.670 2.523 -13.103 814 HB VAL 538 HB VAL 538 100.284 0.179 -11.794 815 HG11 VAL 538 HG11 VAL 538 99.580 -0.078 -14.328 816 HG12 VAL 538 HG12 VAL 538 99.785 1.674 -14.316 817 HG13 VAL 538 HG13 VAL 538 98.644 0.912 -13.208 818 HG21 VAL 538 HG21 VAL 538 102.149 -0.887 -12.429 819 HG22 VAL 538 HG22 VAL 538 102.669 0.444 -13.465 820 HG23 VAL 538 HG23 VAL 538 101.503 -0.735 -14.063 821 H ASP 539 H ASP 539 100.155 2.111 -9.931 822 HA ASP 539 HA ASP 539 97.709 3.373 -10.566 823 HB2 ASP 539 HB2 ASP 539 98.122 1.965 -8.534 824 HB3 ASP 539 HB3 ASP 539 99.067 3.291 -7.863 825 H ARG 540 H ARG 540 100.793 4.595 -9.377 826 HA ARG 540 HA ARG 540 99.967 7.236 -8.855 827 HB2 ARG 540 HB2 ARG 540 102.680 6.141 -9.613 828 HB3 ARG 540 HB3 ARG 540 102.397 7.789 -9.066 829 HG2 ARG 540 HG2 ARG 540 101.259 5.854 -7.243 830 HG3 ARG 540 HG3 ARG 540 102.986 5.591 -7.489 831 HD2 ARG 540 HD2 ARG 540 103.515 7.389 -6.290 832 HD3 ARG 540 HD3 ARG 540 102.374 8.399 -7.177 833 HE ARG 540 HE ARG 540 100.706 7.134 -5.574 834 HH11 ARG 540 HH11 ARG 540 103.826 8.514 -4.851 835 HH12 ARG 540 HH12 ARG 540 103.434 8.853 -3.199 836 HH21 ARG 540 HH21 ARG 540 100.185 7.582 -3.400 837 HH22 ARG 540 HH22 ARG 540 101.367 8.324 -2.375 838 H GLN 541 H GLN 541 101.198 5.653 -11.751 839 HA GLN 541 HA GLN 541 101.460 7.946 -13.357 840 HB2 GLN 541 HB2 GLN 541 101.060 5.029 -13.961 841 HB3 GLN 541 HB3 GLN 541 101.100 6.220 -15.254 842 HG2 GLN 541 HG2 GLN 541 103.282 5.473 -15.164 843 HG3 GLN 541 HG3 GLN 541 103.335 6.956 -14.211 844 HE21 GLN 541 HE21 GLN 541 104.002 6.862 -12.159 845 HE22 GLN 541 HE22 GLN 541 104.383 5.409 -11.307 846 H ALA 542 H ALA 542 98.755 5.737 -12.804 847 HA ALA 542 HA ALA 542 96.994 6.826 -14.700 848 HB1 ALA 542 HB1 ALA 542 95.427 5.927 -12.553 849 HB2 ALA 542 HB2 ALA 542 96.852 4.890 -12.585 850 HB3 ALA 542 HB3 ALA 542 95.845 5.048 -14.024 851 H LYS 543 H LYS 543 97.730 7.704 -11.376 852 HA LYS 543 HA LYS 543 95.629 9.507 -10.936 853 HB2 LYS 543 HB2 LYS 543 98.441 9.458 -9.832 854 HB3 LYS 543 HB3 LYS 543 97.179 10.531 -9.243 855 HG2 LYS 543 HG2 LYS 543 95.826 8.385 -8.842 856 HG3 LYS 543 HG3 LYS 543 97.372 7.553 -9.015 857 HD2 LYS 543 HD2 LYS 543 97.953 9.624 -7.288 858 HD3 LYS 543 HD3 LYS 543 96.333 9.126 -6.794 859 HE2 LYS 543 HE2 LYS 543 97.723 6.748 -7.211 860 HE3 LYS 543 HE3 LYS 543 98.871 7.806 -6.392 861 HZ1 LYS 543 HZ1 LYS 543 96.189 7.781 -5.291 862 HZ2 LYS 543 HZ2 LYS 543 97.684 7.770 -4.503 863 HZ3 LYS 543 HZ3 LYS 543 97.049 6.332 -5.128 864 H LEU 544 H LEU 544 98.729 9.873 -12.544 865 HA LEU 544 HA LEU 544 98.758 12.675 -12.746 866 HB2 LEU 544 HB2 LEU 544 100.654 11.065 -13.212 867 HB3 LEU 544 HB3 LEU 544 99.903 10.754 -14.766 868 HG LEU 544 HG LEU 544 100.526 12.771 -15.637 869 HD11 LEU 544 HD11 LEU 544 100.571 13.906 -12.844 870 HD12 LEU 544 HD12 LEU 544 99.312 14.148 -14.056 871 HD13 LEU 544 HD13 LEU 544 100.928 14.805 -14.319 872 HD21 LEU 544 HD21 LEU 544 102.635 11.940 -15.353 873 HD22 LEU 544 HD22 LEU 544 102.511 11.922 -13.594 874 HD23 LEU 544 HD23 LEU 544 102.777 13.444 -14.442 875 H ASN 545 H ASN 545 96.897 10.287 -14.367 876 HA ASN 545 HA ASN 545 95.397 10.352 -16.082 877 HB2 ASN 545 HB2 ASN 545 95.179 13.063 -14.824 878 HB3 ASN 545 HB3 ASN 545 94.251 12.706 -16.276 879 HD21 ASN 545 HD21 ASN 545 95.053 10.344 -13.828 880 HD22 ASN 545 HD22 ASN 545 93.442 10.114 -13.248 881 H GLN 546 H GLN 546 96.079 13.730 -16.624 882 HA GLN 546 HA GLN 546 96.781 14.839 -18.484 883 HB2 GLN 546 HB2 GLN 546 98.914 13.810 -17.435 884 HB3 GLN 546 HB3 GLN 546 98.870 12.703 -18.801 885 HG2 GLN 546 HG2 GLN 546 99.519 14.273 -20.274 886 HG3 GLN 546 HG3 GLN 546 98.628 15.560 -19.462 887 HE21 GLN 546 HE21 GLN 546 100.766 16.590 -20.115 888 HE22 GLN 546 HE22 GLN 546 102.017 16.565 -18.923 889 HA PRO 547 HA PRO 547 94.652 12.173 -21.525 890 HB2 PRO 547 HB2 PRO 547 93.300 14.194 -22.714 891 HB3 PRO 547 HB3 PRO 547 92.749 13.435 -21.215 892 HG2 PRO 547 HG2 PRO 547 94.236 16.004 -21.603 893 HG3 PRO 547 HG3 PRO 547 92.873 15.652 -20.524 894 HD2 PRO 547 HD2 PRO 547 95.452 15.739 -19.669 895 HD3 PRO 547 HD3 PRO 547 94.224 14.695 -18.926 896 H ARG 548 H ARG 548 96.793 11.855 -22.465 897 HA ARG 548 HA ARG 548 98.215 11.902 -24.242 898 HB2 ARG 548 HB2 ARG 548 96.513 13.946 -25.625 899 HB3 ARG 548 HB3 ARG 548 97.440 12.623 -26.319 900 HG2 ARG 548 HG2 ARG 548 94.999 12.194 -24.620 901 HG3 ARG 548 HG3 ARG 548 94.941 12.369 -26.375 902 HD2 ARG 548 HD2 ARG 548 96.908 10.426 -25.383 903 HD3 ARG 548 HD3 ARG 548 95.226 10.006 -25.063 904 HE ARG 548 HE ARG 548 96.552 10.026 -27.609 905 HH11 ARG 548 HH11 ARG 548 93.481 10.298 -25.991 906 HH12 ARG 548 HH12 ARG 548 92.564 9.777 -27.365 907 HH21 ARG 548 HH21 ARG 548 95.354 9.341 -29.427 908 HH22 ARG 548 HH22 ARG 548 93.629 9.231 -29.318 909 H GLU 549 H GLU 549 99.982 13.107 -24.981 910 HA GLU 549 HA GLU 549 100.903 15.146 -23.353 911 HB2 GLU 549 HB2 GLU 549 101.709 14.612 -26.218 912 HB3 GLU 549 HB3 GLU 549 102.647 15.509 -25.032 913 HG2 GLU 549 HG2 GLU 549 103.032 13.559 -23.736 914 HG3 GLU 549 HG3 GLU 549 101.868 12.629 -24.679 915 H LYS 550 H LYS 550 101.410 17.396 -23.903 916 HA LYS 550 HA LYS 550 99.078 18.731 -24.928 917 HB2 LYS 550 HB2 LYS 550 100.878 19.378 -23.013 918 HB3 LYS 550 HB3 LYS 550 101.509 20.316 -24.360 919 HG2 LYS 550 HG2 LYS 550 98.639 20.595 -24.103 920 HG3 LYS 550 HG3 LYS 550 99.489 21.064 -22.630 921 HD2 LYS 550 HD2 LYS 550 100.204 22.953 -23.567 922 HD3 LYS 550 HD3 LYS 550 100.844 22.081 -24.962 923 HE2 LYS 550 HE2 LYS 550 97.931 22.285 -24.941 924 HE3 LYS 550 HE3 LYS 550 98.744 23.847 -25.000 925 HZ1 LYS 550 HZ1 LYS 550 99.797 23.305 -26.990 926 HZ2 LYS 550 HZ2 LYS 550 98.229 22.703 -27.194 927 HZ3 LYS 550 HZ3 LYS 550 99.498 21.647 -26.824 928 H LYS 551 H LYS 551 99.807 17.412 -27.043 929 HA LYS 551 HA LYS 551 101.210 19.366 -28.744 930 HB2 LYS 551 HB2 LYS 551 101.550 16.445 -28.477 931 HB3 LYS 551 HB3 LYS 551 101.506 17.051 -30.127 932 HG2 LYS 551 HG2 LYS 551 103.212 18.789 -28.794 933 HG3 LYS 551 HG3 LYS 551 103.617 17.191 -28.166 934 HD2 LYS 551 HD2 LYS 551 103.433 17.905 -31.092 935 HD3 LYS 551 HD3 LYS 551 104.934 17.801 -30.169 936 HE2 LYS 551 HE2 LYS 551 105.019 15.610 -30.515 937 HE3 LYS 551 HE3 LYS 551 103.442 15.411 -29.752 938 HZ1 LYS 551 HZ1 LYS 551 102.782 14.734 -31.755 939 HZ2 LYS 551 HZ2 LYS 551 104.145 15.361 -32.536 940 HZ3 LYS 551 HZ3 LYS 551 102.823 16.363 -32.211 941 H ARG 552 H ARG 552 99.809 20.324 -30.053 942 HA ARG 552 HA ARG 552 97.353 18.954 -30.825 943 HB2 ARG 552 HB2 ARG 552 98.292 21.806 -31.032 944 HB3 ARG 552 HB3 ARG 552 96.853 21.246 -31.872 945 HG2 ARG 552 HG2 ARG 552 96.031 20.449 -29.601 946 HG3 ARG 552 HG3 ARG 552 97.342 21.413 -28.919 947 HD2 ARG 552 HD2 ARG 552 95.892 22.941 -30.873 948 HD3 ARG 552 HD3 ARG 552 94.782 22.284 -29.672 949 HE ARG 552 HE ARG 552 96.660 24.384 -29.288 950 HH11 ARG 552 HH11 ARG 552 95.133 21.694 -27.686 951 HH12 ARG 552 HH12 ARG 552 95.295 22.377 -26.103 952 HH21 ARG 552 HH21 ARG 552 96.876 25.294 -27.208 953 HH22 ARG 552 HH22 ARG 552 96.284 24.424 -25.832 954 H GLY 553 H GLY 553 99.113 21.292 -32.780 955 HA2 GLY 553 HA2 GLY 553 99.862 19.275 -34.731 956 HA3 GLY 553 HA3 GLY 553 98.609 20.392 -35.250 957 H THR 554 H THR 554 101.583 19.863 -35.925 958 HA THR 554 HA THR 554 102.996 22.232 -35.270 959 HB THR 554 HB THR 554 104.711 21.471 -36.632 960 HG1 THR 554 HG1 THR 554 103.952 21.268 -38.647 961 HG21 THR 554 HG21 THR 554 105.051 19.282 -36.023 962 HG22 THR 554 HG22 THR 554 103.391 18.810 -36.383 963 HG23 THR 554 HG23 THR 554 103.749 19.726 -34.918 964 H GLU 555 H GLU 555 100.499 21.593 -37.481 965 HA GLU 555 HA GLU 555 100.379 24.278 -38.367 966 HB2 GLU 555 HB2 GLU 555 102.283 23.447 -39.762 967 HB3 GLU 555 HB3 GLU 555 101.187 22.279 -40.485 968 HG2 GLU 555 HG2 GLU 555 100.890 23.846 -42.045 969 HG3 GLU 555 HG3 GLU 555 99.813 24.586 -40.861 970 H LYS 556 H LYS 556 98.362 23.347 -37.259 971 HA LYS 556 HA LYS 556 96.647 21.860 -39.090 972 HB2 LYS 556 HB2 LYS 556 96.861 21.438 -36.541 973 HB3 LYS 556 HB3 LYS 556 95.815 22.842 -36.377 974 HG2 LYS 556 HG2 LYS 556 93.995 21.719 -37.034 975 HG3 LYS 556 HG3 LYS 556 94.866 20.844 -38.295 976 HD2 LYS 556 HD2 LYS 556 95.067 20.216 -35.353 977 HD3 LYS 556 HD3 LYS 556 93.969 19.398 -36.467 978 HE2 LYS 556 HE2 LYS 556 96.891 19.548 -37.082 979 HE3 LYS 556 HE3 LYS 556 96.291 18.350 -35.934 980 HZ1 LYS 556 HZ1 LYS 556 95.098 17.265 -37.559 981 HZ2 LYS 556 HZ2 LYS 556 96.473 17.742 -38.420 982 HZ3 LYS 556 HZ3 LYS 556 95.031 18.610 -38.583 983 H LEU 557 H LEU 557 97.142 24.186 -40.249 984 HA LEU 557 HA LEU 557 96.329 26.253 -40.876 985 HB2 LEU 557 HB2 LEU 557 93.632 24.964 -40.748 986 HB3 LEU 557 HB3 LEU 557 94.291 26.029 -41.975 987 HG LEU 557 HG LEU 557 95.947 23.942 -42.298 988 HD11 LEU 557 HD11 LEU 557 94.281 21.937 -42.262 989 HD12 LEU 557 HD12 LEU 557 93.479 22.876 -41.003 990 HD13 LEU 557 HD13 LEU 557 95.160 22.383 -40.800 991 HD21 LEU 557 HD21 LEU 557 94.847 24.804 -44.162 992 HD22 LEU 557 HD22 LEU 557 93.250 24.506 -43.476 993 HD23 LEU 557 HD23 LEU 557 94.232 23.156 -44.045 994 H ILE 558 H ILE 558 96.588 26.104 -38.051 995 HA ILE 558 HA ILE 558 96.012 27.272 -36.184 996 HB ILE 558 HB ILE 558 94.368 28.840 -38.169 997 HG12 ILE 558 HG12 ILE 558 96.281 30.531 -37.416 998 HG13 ILE 558 HG13 ILE 558 97.137 29.030 -37.074 999 HG21 ILE 558 HG21 ILE 558 94.976 29.514 -35.294 1000 HG22 ILE 558 HG22 ILE 558 93.403 29.026 -35.927 1001 HG23 ILE 558 HG23 ILE 558 94.131 30.545 -36.449 1002 HD11 ILE 558 HD11 ILE 558 96.671 28.326 -39.421 1003 HD12 ILE 558 HD12 ILE 558 97.726 29.731 -39.264 1004 HD13 ILE 558 HD13 ILE 558 96.034 29.944 -39.715 1005 H THR 559 H THR 559 94.424 27.352 -34.556 1006 HA THR 559 HA THR 559 91.879 26.023 -35.212 1007 HB THR 559 HB THR 559 93.579 25.543 -32.759 1008 HG1 THR 559 HG1 THR 559 92.727 23.622 -34.667 1009 HG21 THR 559 HG21 THR 559 91.858 24.478 -31.760 1010 HG22 THR 559 HG22 THR 559 91.218 23.865 -33.284 1011 HG23 THR 559 HG23 THR 559 90.877 25.523 -32.788 1012 H LYS 560 H LYS 560 93.202 27.319 -32.194 1013 HA LYS 560 HA LYS 560 92.508 28.983 -30.804 1014 HB2 LYS 560 HB2 LYS 560 90.883 30.027 -33.125 1015 HB3 LYS 560 HB3 LYS 560 91.421 30.925 -31.712 1016 HG2 LYS 560 HG2 LYS 560 93.590 29.695 -33.241 1017 HG3 LYS 560 HG3 LYS 560 92.666 30.907 -34.130 1018 HD2 LYS 560 HD2 LYS 560 94.386 32.116 -33.087 1019 HD3 LYS 560 HD3 LYS 560 92.967 32.394 -32.077 1020 HE2 LYS 560 HE2 LYS 560 93.729 30.923 -30.412 1021 HE3 LYS 560 HE3 LYS 560 94.922 30.193 -31.486 1022 HZ1 LYS 560 HZ1 LYS 560 95.022 32.998 -30.518 1023 HZ2 LYS 560 HZ2 LYS 560 96.203 32.204 -31.433 1024 HZ3 LYS 560 HZ3 LYS 560 95.898 31.718 -29.843 1025 H ALA 561 H ALA 561 91.304 27.942 -29.316 1026 HA ALA 561 HA ALA 561 88.412 28.063 -29.623 1027 HB1 ALA 561 HB1 ALA 561 89.923 25.496 -29.246 1028 HB2 ALA 561 HB2 ALA 561 88.674 25.879 -30.431 1029 HB3 ALA 561 HB3 ALA 561 88.244 25.675 -28.733 Start of MODEL 6 1 H1 MET 437 HT1 MET 437 132.381 -4.445 -33.126 2 H2 MET 437 HT2 MET 437 133.554 -5.662 -32.825 3 H3 MET 437 HT3 MET 437 134.047 -4.043 -33.112 4 HA MET 437 HA MET 437 132.206 -4.496 -30.933 5 HB2 MET 437 HB2 MET 437 134.787 -5.840 -31.221 6 HB3 MET 437 HB3 MET 437 134.691 -4.855 -29.767 7 HG2 MET 437 HG2 MET 437 132.317 -6.143 -29.661 8 HG3 MET 437 HG3 MET 437 133.320 -7.357 -30.453 9 HE1 MET 437 HE1 MET 437 134.773 -9.122 -27.637 10 HE2 MET 437 HE2 MET 437 135.562 -8.538 -29.102 11 HE3 MET 437 HE3 MET 437 133.897 -9.116 -29.167 12 H HIS 438 H HIS 438 131.789 -2.342 -30.758 13 HA HIS 438 HA HIS 438 133.971 -0.654 -29.862 14 HB2 HIS 438 HB2 HIS 438 132.754 1.113 -31.561 15 HB3 HIS 438 HB3 HIS 438 134.259 0.265 -31.899 16 HD1 HIS 438 HD1 HIS 438 134.118 -1.786 -33.521 17 HD2 HIS 438 HD2 HIS 438 130.581 0.355 -33.107 18 HE1 HIS 438 HE1 HIS 438 132.647 -2.544 -35.415 19 HE2 HIS 438 HE2 HIS 438 130.488 -1.284 -35.107 20 H HIS 439 H HIS 439 130.799 0.262 -31.139 21 HA HIS 439 HA HIS 439 130.177 1.677 -28.721 22 HB2 HIS 439 HB2 HIS 439 128.835 1.281 -31.364 23 HB3 HIS 439 HB3 HIS 439 127.887 1.886 -30.008 24 HD1 HIS 439 HD1 HIS 439 128.841 4.160 -28.895 25 HD2 HIS 439 HD2 HIS 439 130.310 3.172 -32.654 26 HE1 HIS 439 HE1 HIS 439 129.852 6.277 -29.799 27 HE2 HIS 439 HE2 HIS 439 130.820 5.631 -32.033 28 H HIS 440 H HIS 440 127.711 1.408 -28.025 29 HA HIS 440 HA HIS 440 126.689 -1.249 -27.938 30 HB2 HIS 440 HB2 HIS 440 128.476 -0.326 -25.769 31 HB3 HIS 440 HB3 HIS 440 126.970 -1.074 -25.247 32 HD1 HIS 440 HD1 HIS 440 126.631 -3.589 -25.842 33 HD2 HIS 440 HD2 HIS 440 130.354 -2.054 -26.862 34 HE1 HIS 440 HE1 HIS 440 128.074 -5.592 -26.322 35 HE2 HIS 440 HE2 HIS 440 130.354 -4.640 -26.819 36 H HIS 441 H HIS 441 124.804 -0.155 -28.579 37 HA HIS 441 HA HIS 441 123.436 1.222 -26.375 38 HB2 HIS 441 HB2 HIS 441 124.175 2.971 -27.880 39 HB3 HIS 441 HB3 HIS 441 123.498 2.117 -29.262 40 HD1 HIS 441 HD1 HIS 441 121.072 2.517 -29.793 41 HD2 HIS 441 HD2 HIS 441 122.197 4.095 -26.119 42 HE1 HIS 441 HE1 HIS 441 119.112 3.894 -29.026 43 HE2 HIS 441 HE2 HIS 441 119.783 4.767 -26.759 44 H HIS 442 H HIS 442 123.138 -1.470 -26.973 45 HA HIS 442 HA HIS 442 120.556 -1.604 -28.373 46 HB2 HIS 442 HB2 HIS 442 122.761 -3.153 -28.757 47 HB3 HIS 442 HB3 HIS 442 121.872 -4.129 -27.592 48 HD1 HIS 442 HD1 HIS 442 122.292 -3.935 -31.044 49 HD2 HIS 442 HD2 HIS 442 118.931 -4.192 -28.614 50 HE1 HIS 442 HE1 HIS 442 120.460 -4.822 -32.522 51 HE2 HIS 442 HE2 HIS 442 118.440 -4.988 -31.025 52 H HIS 443 H HIS 443 122.128 -3.320 -25.664 53 HA HIS 443 HA HIS 443 119.559 -3.185 -24.224 54 HB2 HIS 443 HB2 HIS 443 121.370 -5.401 -24.746 55 HB3 HIS 443 HB3 HIS 443 121.066 -5.198 -23.024 56 HD1 HIS 443 HD1 HIS 443 119.770 -7.498 -23.151 57 HD2 HIS 443 HD2 HIS 443 118.061 -4.372 -25.289 58 HE1 HIS 443 HE1 HIS 443 117.423 -8.241 -23.667 59 HE2 HIS 443 HE2 HIS 443 116.384 -6.302 -24.895 60 H SER 444 H SER 444 119.636 -1.720 -22.658 61 HA SER 444 HA SER 444 121.838 -0.434 -21.642 62 HB2 SER 444 HB2 SER 444 119.269 -1.041 -20.159 63 HB3 SER 444 HB3 SER 444 120.426 0.222 -19.739 64 HG SER 444 HG SER 444 119.102 1.339 -20.977 65 H ASN 445 H ASN 445 123.352 -0.813 -20.125 66 HA ASN 445 HA ASN 445 123.226 -3.396 -18.716 67 HB2 ASN 445 HB2 ASN 445 125.318 -2.133 -20.271 68 HB3 ASN 445 HB3 ASN 445 125.874 -2.491 -18.639 69 HD21 ASN 445 HD21 ASN 445 127.267 -3.882 -20.130 70 HD22 ASN 445 HD22 ASN 445 126.709 -5.497 -20.391 71 H ALA 446 H ALA 446 123.760 0.034 -18.422 72 HA ALA 446 HA ALA 446 124.728 0.004 -15.746 73 HB1 ALA 446 HB1 ALA 446 123.870 2.063 -17.674 74 HB2 ALA 446 HB2 ALA 446 125.287 2.005 -16.625 75 HB3 ALA 446 HB3 ALA 446 123.724 2.487 -15.968 76 H THR 447 H THR 447 121.726 -0.715 -17.000 77 HA THR 447 HA THR 447 119.912 0.491 -15.270 78 HB THR 447 HB THR 447 119.249 -0.839 -17.250 79 HG1 THR 447 HG1 THR 447 117.377 -1.529 -16.337 80 HG21 THR 447 HG21 THR 447 119.143 -3.270 -17.108 81 HG22 THR 447 HG22 THR 447 119.905 -3.223 -15.517 82 HG23 THR 447 HG23 THR 447 120.808 -2.712 -16.944 83 H GLY 448 H GLY 448 119.117 0.012 -13.261 84 HA2 GLY 448 HA2 GLY 448 120.378 -2.231 -11.821 85 HA3 GLY 448 HA3 GLY 448 120.342 -0.623 -11.111 86 HA PRO 449 HA PRO 449 115.831 -2.452 -11.166 87 HB2 PRO 449 HB2 PRO 449 115.730 -5.157 -11.056 88 HB3 PRO 449 HB3 PRO 449 115.720 -4.264 -12.581 89 HG2 PRO 449 HG2 PRO 449 118.003 -5.625 -11.199 90 HG3 PRO 449 HG3 PRO 449 117.566 -5.643 -12.918 91 HD2 PRO 449 HD2 PRO 449 119.525 -4.054 -11.934 92 HD3 PRO 449 HD3 PRO 449 118.512 -3.576 -13.311 93 H GLN 450 H GLN 450 116.795 -1.482 -9.076 94 HA GLN 450 HA GLN 450 116.467 -3.473 -6.936 95 HB2 GLN 450 HB2 GLN 450 118.849 -2.171 -7.526 96 HB3 GLN 450 HB3 GLN 450 118.186 -1.248 -6.184 97 HG2 GLN 450 HG2 GLN 450 119.648 -2.975 -5.362 98 HG3 GLN 450 HG3 GLN 450 117.987 -3.311 -4.878 99 HE21 GLN 450 HE21 GLN 450 117.237 -5.277 -5.242 100 HE22 GLN 450 HE22 GLN 450 117.924 -6.439 -6.319 101 H PHE 451 H PHE 451 114.362 -1.994 -7.882 102 HA PHE 451 HA PHE 451 113.945 0.474 -6.601 103 HB2 PHE 451 HB2 PHE 451 111.674 0.280 -7.254 104 HB3 PHE 451 HB3 PHE 451 112.603 -0.518 -8.518 105 HD1 PHE 451 HD1 PHE 451 112.391 -2.862 -8.918 106 HD2 PHE 451 HD2 PHE 451 110.358 -1.037 -5.653 107 HE1 PHE 451 HE1 PHE 451 111.032 -4.893 -8.632 108 HE2 PHE 451 HE2 PHE 451 108.998 -3.066 -5.361 109 HZ PHE 451 HZ PHE 451 109.333 -4.999 -6.852 110 H VAL 452 H VAL 452 113.865 0.856 -4.485 111 HA VAL 452 HA VAL 452 113.755 -1.043 -2.470 112 HB VAL 452 HB VAL 452 114.430 1.332 -2.145 113 HG11 VAL 452 HG11 VAL 452 111.681 2.213 -1.611 114 HG12 VAL 452 HG12 VAL 452 112.067 1.967 -3.314 115 HG13 VAL 452 HG13 VAL 452 113.031 3.080 -2.343 116 HG21 VAL 452 HG21 VAL 452 112.390 1.123 -0.083 117 HG22 VAL 452 HG22 VAL 452 114.147 1.063 0.054 118 HG23 VAL 452 HG23 VAL 452 113.244 -0.396 -0.355 119 H SER 453 H SER 453 112.168 -2.551 -2.460 120 HA SER 453 HA SER 453 109.464 -1.987 -3.132 121 HB2 SER 453 HB2 SER 453 109.132 -4.242 -3.007 122 HB3 SER 453 HB3 SER 453 110.892 -4.240 -3.116 123 HG SER 453 HG SER 453 111.008 -4.500 -0.902 124 H GLY 454 H GLY 454 110.771 -0.630 -0.632 125 HA2 GLY 454 HA2 GLY 454 110.220 -0.277 1.609 126 HA3 GLY 454 HA3 GLY 454 108.719 0.148 0.808 127 H VAL 455 H VAL 455 109.931 -3.150 1.000 128 HA VAL 455 HA VAL 455 108.763 -5.023 1.677 129 HB VAL 455 HB VAL 455 108.279 -4.205 4.383 130 HG11 VAL 455 HG11 VAL 455 108.859 -6.461 3.584 131 HG12 VAL 455 HG12 VAL 455 109.924 -5.908 4.876 132 HG13 VAL 455 HG13 VAL 455 110.484 -5.891 3.203 133 HG21 VAL 455 HG21 VAL 455 109.826 -2.329 3.728 134 HG22 VAL 455 HG22 VAL 455 111.069 -3.549 3.456 135 HG23 VAL 455 HG23 VAL 455 110.381 -3.334 5.065 136 H ILE 456 H ILE 456 106.810 -4.804 0.525 137 HA ILE 456 HA ILE 456 104.619 -3.267 1.498 138 HB ILE 456 HB ILE 456 104.777 -5.458 -0.561 139 HG12 ILE 456 HG12 ILE 456 105.773 -3.552 -1.452 140 HG13 ILE 456 HG13 ILE 456 104.105 -3.401 -1.986 141 HG21 ILE 456 HG21 ILE 456 102.562 -5.533 0.432 142 HG22 ILE 456 HG22 ILE 456 102.479 -4.854 -1.194 143 HG23 ILE 456 HG23 ILE 456 102.385 -3.792 0.211 144 HD11 ILE 456 HD11 ILE 456 104.911 -1.274 -1.217 145 HD12 ILE 456 HD12 ILE 456 105.373 -1.976 0.334 146 HD13 ILE 456 HD13 ILE 456 103.671 -1.870 -0.114 147 H VAL 457 H VAL 457 104.253 -3.864 3.622 148 HA VAL 457 HA VAL 457 103.750 -6.585 4.365 149 HB VAL 457 HB VAL 457 103.246 -4.006 5.854 150 HG11 VAL 457 HG11 VAL 457 102.016 -6.390 6.380 151 HG12 VAL 457 HG12 VAL 457 102.332 -5.124 7.566 152 HG13 VAL 457 HG13 VAL 457 103.451 -6.478 7.401 153 HG21 VAL 457 HG21 VAL 457 105.612 -4.560 5.369 154 HG22 VAL 457 HG22 VAL 457 105.396 -6.086 6.227 155 HG23 VAL 457 HG23 VAL 457 105.238 -4.558 7.093 156 H LYS 458 H LYS 458 102.011 -7.607 3.662 157 HA LYS 458 HA LYS 458 99.556 -6.187 3.088 158 HB2 LYS 458 HB2 LYS 458 100.042 -7.836 1.495 159 HB3 LYS 458 HB3 LYS 458 100.475 -9.022 2.719 160 HG2 LYS 458 HG2 LYS 458 98.049 -8.980 3.429 161 HG3 LYS 458 HG3 LYS 458 97.736 -8.066 1.953 162 HD2 LYS 458 HD2 LYS 458 98.643 -9.888 0.613 163 HD3 LYS 458 HD3 LYS 458 99.014 -10.797 2.081 164 HE2 LYS 458 HE2 LYS 458 96.723 -11.085 2.593 165 HE3 LYS 458 HE3 LYS 458 96.231 -9.886 1.398 166 HZ1 LYS 458 HZ1 LYS 458 95.801 -11.834 0.303 167 HZ2 LYS 458 HZ2 LYS 458 97.107 -12.658 0.990 168 HZ3 LYS 458 HZ3 LYS 458 97.374 -11.528 -0.238 169 H ILE 459 H ILE 459 97.938 -5.930 4.445 170 HA ILE 459 HA ILE 459 97.760 -7.694 6.800 171 HB ILE 459 HB ILE 459 96.921 -4.807 6.522 172 HG12 ILE 459 HG12 ILE 459 98.890 -6.193 8.354 173 HG13 ILE 459 HG13 ILE 459 99.303 -5.153 6.994 174 HG21 ILE 459 HG21 ILE 459 95.758 -6.860 8.118 175 HG22 ILE 459 HG22 ILE 459 95.369 -5.140 8.074 176 HG23 ILE 459 HG23 ILE 459 96.606 -5.735 9.180 177 HD11 ILE 459 HD11 ILE 459 99.134 -3.340 8.248 178 HD12 ILE 459 HD12 ILE 459 98.970 -4.405 9.645 179 HD13 ILE 459 HD13 ILE 459 97.532 -3.806 8.819 180 H ILE 460 H ILE 460 95.963 -8.882 7.015 181 HA ILE 460 HA ILE 460 93.572 -8.050 5.520 182 HB ILE 460 HB ILE 460 94.807 -9.884 4.304 183 HG12 ILE 460 HG12 ILE 460 92.242 -9.353 4.321 184 HG13 ILE 460 HG13 ILE 460 92.828 -10.818 3.540 185 HG21 ILE 460 HG21 ILE 460 94.236 -12.202 5.317 186 HG22 ILE 460 HG22 ILE 460 94.153 -11.313 6.837 187 HG23 ILE 460 HG23 ILE 460 95.647 -11.318 5.899 188 HD11 ILE 460 HD11 ILE 460 91.948 -10.871 6.394 189 HD12 ILE 460 HD12 ILE 460 92.018 -12.185 5.221 190 HD13 ILE 460 HD13 ILE 460 90.771 -10.946 5.083 191 H SER 461 H SER 461 91.688 -8.239 6.582 192 HA SER 461 HA SER 461 91.736 -9.607 9.192 193 HB2 SER 461 HB2 SER 461 90.340 -7.877 10.123 194 HB3 SER 461 HB3 SER 461 91.731 -7.104 9.366 195 HG SER 461 HG SER 461 89.120 -7.351 8.284 196 H THR 462 H THR 462 89.093 -9.305 9.856 197 HA THR 462 HA THR 462 87.706 -10.803 7.723 198 HB THR 462 HB THR 462 86.652 -12.197 9.299 199 HG1 THR 462 HG1 THR 462 87.766 -11.067 11.584 200 HG21 THR 462 HG21 THR 462 89.258 -12.009 10.711 201 HG22 THR 462 HG22 THR 462 89.279 -12.344 8.980 202 HG23 THR 462 HG23 THR 462 88.414 -13.422 10.075 203 H GLU 463 H GLU 463 87.721 -7.999 9.534 204 HA GLU 463 HA GLU 463 85.670 -6.677 8.474 205 HB2 GLU 463 HB2 GLU 463 84.613 -8.762 10.263 206 HB3 GLU 463 HB3 GLU 463 83.947 -7.158 10.538 207 HG2 GLU 463 HG2 GLU 463 84.052 -7.923 7.723 208 HG3 GLU 463 HG3 GLU 463 83.033 -8.965 8.715 209 HA PRO 464 HA PRO 464 86.270 -5.398 13.308 210 HB2 PRO 464 HB2 PRO 464 89.003 -6.627 13.198 211 HB3 PRO 464 HB3 PRO 464 87.957 -6.344 14.596 212 HG2 PRO 464 HG2 PRO 464 88.122 -8.768 13.530 213 HG3 PRO 464 HG3 PRO 464 86.560 -8.132 14.079 214 HD2 PRO 464 HD2 PRO 464 87.587 -8.500 11.314 215 HD3 PRO 464 HD3 PRO 464 85.920 -8.565 11.918 216 H LEU 465 H LEU 465 88.455 -5.507 10.576 217 HA LEU 465 HA LEU 465 90.264 -3.549 11.006 218 HB2 LEU 465 HB2 LEU 465 89.184 -4.796 8.754 219 HB3 LEU 465 HB3 LEU 465 88.992 -3.081 8.445 220 HG LEU 465 HG LEU 465 91.655 -3.800 9.434 221 HD11 LEU 465 HD11 LEU 465 91.841 -5.663 8.191 222 HD12 LEU 465 HD12 LEU 465 92.040 -4.521 6.862 223 HD13 LEU 465 HD13 LEU 465 90.464 -5.249 7.171 224 HD21 LEU 465 HD21 LEU 465 90.564 -2.223 7.111 225 HD22 LEU 465 HD22 LEU 465 92.284 -2.399 7.460 226 HD23 LEU 465 HD23 LEU 465 91.225 -1.597 8.621 227 HA PRO 466 HA PRO 466 87.513 -0.172 12.197 228 HB2 PRO 466 HB2 PRO 466 89.499 1.433 13.116 229 HB3 PRO 466 HB3 PRO 466 88.832 0.093 14.054 230 HG2 PRO 466 HG2 PRO 466 91.336 0.189 12.409 231 HG3 PRO 466 HG3 PRO 466 91.085 -0.500 14.025 232 HD2 PRO 466 HD2 PRO 466 91.148 -2.027 11.801 233 HD3 PRO 466 HD3 PRO 466 90.116 -2.422 13.190 234 H GLY 467 H GLY 467 90.620 0.374 10.521 235 HA2 GLY 467 HA2 GLY 467 89.765 1.474 8.209 236 HA3 GLY 467 HA3 GLY 467 89.630 2.821 9.329 237 H ARG 468 H ARG 468 91.216 3.442 7.422 238 HA ARG 468 HA ARG 468 93.869 2.521 7.472 239 HB2 ARG 468 HB2 ARG 468 94.402 4.630 6.287 240 HB3 ARG 468 HB3 ARG 468 93.025 3.784 5.593 241 HG2 ARG 468 HG2 ARG 468 91.792 5.438 7.357 242 HG3 ARG 468 HG3 ARG 468 93.176 6.416 6.865 243 HD2 ARG 468 HD2 ARG 468 92.433 6.643 4.739 244 HD3 ARG 468 HD3 ARG 468 91.722 5.030 4.703 245 HE ARG 468 HE ARG 468 90.185 6.550 6.437 246 HH11 ARG 468 HH11 ARG 468 91.037 6.553 3.061 247 HH12 ARG 468 HH12 ARG 468 89.554 7.292 2.556 248 HH21 ARG 468 HH21 ARG 468 88.233 7.519 5.787 249 HH22 ARG 468 HH22 ARG 468 87.958 7.843 4.108 250 H LYS 469 H LYS 469 92.290 5.192 9.179 251 HA LYS 469 HA LYS 469 94.601 6.279 10.348 252 HB2 LYS 469 HB2 LYS 469 93.183 7.626 11.586 253 HB3 LYS 469 HB3 LYS 469 92.175 7.209 10.208 254 HG2 LYS 469 HG2 LYS 469 91.052 5.501 11.526 255 HG3 LYS 469 HG3 LYS 469 92.086 5.874 12.906 256 HD2 LYS 469 HD2 LYS 469 89.766 6.916 12.906 257 HD3 LYS 469 HD3 LYS 469 91.124 8.008 13.184 258 HE2 LYS 469 HE2 LYS 469 91.052 8.735 10.875 259 HE3 LYS 469 HE3 LYS 469 89.774 7.573 10.522 260 HZ1 LYS 469 HZ1 LYS 469 88.216 8.886 11.427 261 HZ2 LYS 469 HZ2 LYS 469 89.337 10.125 11.175 262 HZ3 LYS 469 HZ3 LYS 469 89.209 9.399 12.698 263 H GLN 470 H GLN 470 92.373 3.773 11.464 264 HA GLN 470 HA GLN 470 93.704 3.454 13.984 265 HB2 GLN 470 HB2 GLN 470 91.413 2.205 12.589 266 HB3 GLN 470 HB3 GLN 470 92.247 1.197 13.765 267 HG2 GLN 470 HG2 GLN 470 90.963 2.147 15.300 268 HG3 GLN 470 HG3 GLN 470 91.943 3.595 15.083 269 HE21 GLN 470 HE21 GLN 470 89.048 3.105 15.726 270 HE22 GLN 470 HE22 GLN 470 88.185 4.087 14.596 271 H VAL 471 H VAL 471 93.652 1.667 10.917 272 HA VAL 471 HA VAL 471 95.321 -0.447 11.775 273 HB VAL 471 HB VAL 471 94.813 0.634 9.001 274 HG11 VAL 471 HG11 VAL 471 96.929 -0.544 9.019 275 HG12 VAL 471 HG12 VAL 471 95.710 -1.511 8.192 276 HG13 VAL 471 HG13 VAL 471 96.187 -1.915 9.841 277 HG21 VAL 471 HG21 VAL 471 93.256 -1.168 8.769 278 HG22 VAL 471 HG22 VAL 471 92.868 -0.301 10.255 279 HG23 VAL 471 HG23 VAL 471 93.722 -1.839 10.331 280 H ARG 472 H ARG 472 95.988 2.623 10.147 281 HA ARG 472 HA ARG 472 98.760 2.243 9.807 282 HB2 ARG 472 HB2 ARG 472 98.861 4.495 9.198 283 HB3 ARG 472 HB3 ARG 472 97.208 4.049 8.792 284 HG2 ARG 472 HG2 ARG 472 96.531 4.979 11.030 285 HG3 ARG 472 HG3 ARG 472 98.163 5.635 11.155 286 HD2 ARG 472 HD2 ARG 472 96.132 6.237 9.010 287 HD3 ARG 472 HD3 ARG 472 96.661 7.325 10.293 288 HE ARG 472 HE ARG 472 98.870 6.465 8.746 289 HH11 ARG 472 HH11 ARG 472 96.109 8.582 8.643 290 HH12 ARG 472 HH12 ARG 472 96.840 9.696 7.537 291 HH21 ARG 472 HH21 ARG 472 99.842 7.921 7.285 292 HH22 ARG 472 HH22 ARG 472 98.964 9.319 6.764 293 H ASP 473 H ASP 473 96.846 3.713 12.399 294 HA ASP 473 HA ASP 473 98.973 4.588 14.002 295 HB2 ASP 473 HB2 ASP 473 96.100 3.925 14.482 296 HB3 ASP 473 HB3 ASP 473 97.153 4.120 15.880 297 H THR 474 H THR 474 97.335 1.477 13.761 298 HA THR 474 HA THR 474 98.568 0.252 15.986 299 HB THR 474 HB THR 474 98.103 -1.891 14.466 300 HG1 THR 474 HG1 THR 474 97.260 -1.279 12.618 301 HG21 THR 474 HG21 THR 474 95.713 -0.394 15.474 302 HG22 THR 474 HG22 THR 474 96.930 -1.016 16.589 303 HG23 THR 474 HG23 THR 474 96.051 -2.124 15.535 304 H LEU 475 H LEU 475 99.131 -0.939 12.705 305 HA LEU 475 HA LEU 475 101.549 -2.091 13.083 306 HB2 LEU 475 HB2 LEU 475 102.033 -1.654 10.684 307 HB3 LEU 475 HB3 LEU 475 100.431 -2.303 10.982 308 HG LEU 475 HG LEU 475 100.009 0.426 11.013 309 HD11 LEU 475 HD11 LEU 475 101.253 1.499 9.449 310 HD12 LEU 475 HD12 LEU 475 101.559 0.032 8.521 311 HD13 LEU 475 HD13 LEU 475 102.465 0.344 10.002 312 HD21 LEU 475 HD21 LEU 475 99.666 -1.683 8.907 313 HD22 LEU 475 HD22 LEU 475 99.103 -0.029 8.672 314 HD23 LEU 475 HD23 LEU 475 98.457 -1.001 9.994 315 H ALA 476 H ALA 476 101.001 1.350 12.414 316 HA ALA 476 HA ALA 476 103.759 2.021 12.286 317 HB1 ALA 476 HB1 ALA 476 101.950 3.406 11.301 318 HB2 ALA 476 HB2 ALA 476 103.060 4.316 12.326 319 HB3 ALA 476 HB3 ALA 476 101.467 3.865 12.933 320 H ALA 477 H ALA 477 101.504 1.593 14.877 321 HA ALA 477 HA ALA 477 102.963 3.059 16.843 322 HB1 ALA 477 HB1 ALA 477 100.829 2.848 17.577 323 HB2 ALA 477 HB2 ALA 477 101.509 1.426 18.370 324 HB3 ALA 477 HB3 ALA 477 100.621 1.252 16.857 325 H ILE 478 H ILE 478 103.105 -0.183 15.598 326 HA ILE 478 HA ILE 478 104.703 -1.201 17.776 327 HB ILE 478 HB ILE 478 103.995 -2.355 15.082 328 HG12 ILE 478 HG12 ILE 478 103.155 -3.934 17.295 329 HG13 ILE 478 HG13 ILE 478 102.695 -2.267 17.625 330 HG21 ILE 478 HG21 ILE 478 105.835 -3.610 15.310 331 HG22 ILE 478 HG22 ILE 478 104.922 -4.454 16.560 332 HG23 ILE 478 HG23 ILE 478 106.043 -3.167 17.005 333 HD11 ILE 478 HD11 ILE 478 100.852 -3.022 16.512 334 HD12 ILE 478 HD12 ILE 478 101.784 -4.098 15.471 335 HD13 ILE 478 HD13 ILE 478 101.790 -2.359 15.173 336 H SER 479 H SER 479 105.258 0.191 14.617 337 HA SER 479 HA SER 479 108.011 0.671 15.222 338 HB2 SER 479 HB2 SER 479 107.763 -0.925 12.727 339 HB3 SER 479 HB3 SER 479 109.095 -0.833 13.879 340 HG SER 479 HG SER 479 107.014 -2.586 13.764 341 H GLU 480 H GLU 480 109.082 1.942 13.556 342 HA GLU 480 HA GLU 480 107.325 3.858 12.412 343 HB2 GLU 480 HB2 GLU 480 109.347 4.788 13.041 344 HB3 GLU 480 HB3 GLU 480 110.281 3.428 12.439 345 HG2 GLU 480 HG2 GLU 480 108.830 5.022 10.423 346 HG3 GLU 480 HG3 GLU 480 110.190 5.806 11.227 347 H VAL 481 H VAL 481 106.111 3.435 10.696 348 HA VAL 481 HA VAL 481 107.231 1.806 8.513 349 HB VAL 481 HB VAL 481 104.940 1.448 7.764 350 HG11 VAL 481 HG11 VAL 481 106.037 0.521 10.230 351 HG12 VAL 481 HG12 VAL 481 104.993 -0.328 9.090 352 HG13 VAL 481 HG13 VAL 481 104.286 0.640 10.385 353 HG21 VAL 481 HG21 VAL 481 104.329 3.411 9.925 354 HG22 VAL 481 HG22 VAL 481 103.138 2.178 9.511 355 HG23 VAL 481 HG23 VAL 481 103.695 3.313 8.282 356 H LEU 482 H LEU 482 107.068 2.506 6.374 357 HA LEU 482 HA LEU 482 107.483 5.245 5.937 358 HB2 LEU 482 HB2 LEU 482 108.369 3.536 4.452 359 HB3 LEU 482 HB3 LEU 482 106.746 3.058 3.991 360 HG LEU 482 HG LEU 482 106.585 5.586 3.220 361 HD11 LEU 482 HD11 LEU 482 108.877 6.066 4.120 362 HD12 LEU 482 HD12 LEU 482 108.632 6.495 2.426 363 HD13 LEU 482 HD13 LEU 482 109.519 5.028 2.846 364 HD21 LEU 482 HD21 LEU 482 107.688 3.178 1.860 365 HD22 LEU 482 HD22 LEU 482 107.709 4.720 1.005 366 HD23 LEU 482 HD23 LEU 482 106.180 4.047 1.572 367 H TYR 483 H TYR 483 104.885 3.421 4.345 368 HA TYR 483 HA TYR 483 102.934 5.428 5.191 369 HB2 TYR 483 HB2 TYR 483 103.761 6.385 3.146 370 HB3 TYR 483 HB3 TYR 483 103.607 4.847 2.305 371 HD1 TYR 483 HD1 TYR 483 101.170 3.853 2.247 372 HD2 TYR 483 HD2 TYR 483 102.080 7.954 2.917 373 HE1 TYR 483 HE1 TYR 483 98.900 4.466 1.532 374 HE2 TYR 483 HE2 TYR 483 99.810 8.580 2.203 375 HH TYR 483 HH TYR 483 97.667 6.329 0.712 376 H VAL 484 H VAL 484 100.847 4.700 5.284 377 HA VAL 484 HA VAL 484 100.493 1.819 4.948 378 HB VAL 484 HB VAL 484 99.848 3.005 7.084 379 HG11 VAL 484 HG11 VAL 484 98.652 4.812 5.469 380 HG12 VAL 484 HG12 VAL 484 98.240 4.580 7.168 381 HG13 VAL 484 HG13 VAL 484 97.271 3.809 5.913 382 HG21 VAL 484 HG21 VAL 484 97.446 1.867 6.984 383 HG22 VAL 484 HG22 VAL 484 98.934 0.923 7.052 384 HG23 VAL 484 HG23 VAL 484 98.123 1.180 5.508 385 H ASP 485 H ASP 485 99.751 1.149 3.030 386 HA ASP 485 HA ASP 485 97.913 2.883 1.542 387 HB2 ASP 485 HB2 ASP 485 99.986 2.062 0.424 388 HB3 ASP 485 HB3 ASP 485 99.360 0.423 0.553 389 H LEU 486 H LEU 486 96.079 2.409 2.775 390 HA LEU 486 HA LEU 486 95.089 -0.331 2.826 391 HB2 LEU 486 HB2 LEU 486 94.883 1.154 4.808 392 HB3 LEU 486 HB3 LEU 486 93.826 2.200 3.878 393 HG LEU 486 HG LEU 486 92.967 -0.606 3.955 394 HD11 LEU 486 HD11 LEU 486 92.340 0.807 6.454 395 HD12 LEU 486 HD12 LEU 486 93.999 0.226 6.305 396 HD13 LEU 486 HD13 LEU 486 92.652 -0.903 6.159 397 HD21 LEU 486 HD21 LEU 486 91.059 0.399 3.439 398 HD22 LEU 486 HD22 LEU 486 91.876 1.959 3.528 399 HD23 LEU 486 HD23 LEU 486 91.088 1.295 4.958 400 H LEU 487 H LEU 487 93.696 -1.134 1.356 401 HA LEU 487 HA LEU 487 92.919 0.373 -0.898 402 HB2 LEU 487 HB2 LEU 487 92.777 -2.335 -0.060 403 HB3 LEU 487 HB3 LEU 487 91.169 -1.852 -0.563 404 HG LEU 487 HG LEU 487 92.092 -2.701 -2.518 405 HD11 LEU 487 HD11 LEU 487 91.600 -0.953 -3.792 406 HD12 LEU 487 HD12 LEU 487 93.096 -0.139 -3.336 407 HD13 LEU 487 HD13 LEU 487 91.648 0.059 -2.348 408 HD21 LEU 487 HD21 LEU 487 94.553 -1.334 -2.875 409 HD22 LEU 487 HD22 LEU 487 94.271 -3.065 -2.694 410 HD23 LEU 487 HD23 LEU 487 94.559 -2.065 -1.270 411 H GLU 488 H GLU 488 91.857 2.200 -0.242 412 HA GLU 488 HA GLU 488 89.970 2.741 1.540 413 HB2 GLU 488 HB2 GLU 488 89.394 3.592 -1.275 414 HB3 GLU 488 HB3 GLU 488 89.232 4.511 0.216 415 HG2 GLU 488 HG2 GLU 488 91.097 5.494 -0.606 416 HG3 GLU 488 HG3 GLU 488 91.855 4.171 0.278 417 H GLY 489 H GLY 489 88.051 2.020 2.155 418 HA2 GLY 489 HA2 GLY 489 85.939 1.110 2.069 419 HA3 GLY 489 HA3 GLY 489 86.035 1.173 0.317 420 H ASP 490 H ASP 490 88.659 -0.457 1.716 421 HA ASP 490 HA ASP 490 87.338 -3.053 1.266 422 HB2 ASP 490 HB2 ASP 490 89.171 -2.119 -0.421 423 HB3 ASP 490 HB3 ASP 490 90.267 -2.789 0.785 424 H THR 491 H THR 491 88.297 -4.870 2.405 425 HA THR 491 HA THR 491 89.125 -4.090 5.090 426 HB THR 491 HB THR 491 88.360 -6.139 5.846 427 HG1 THR 491 HG1 THR 491 89.320 -7.716 4.724 428 HG21 THR 491 HG21 THR 491 86.622 -6.190 3.440 429 HG22 THR 491 HG22 THR 491 86.643 -4.715 4.408 430 HG23 THR 491 HG23 THR 491 86.191 -6.250 5.149 431 H GLU 492 H GLU 492 90.809 -4.376 2.462 432 HA GLU 492 HA GLU 492 92.981 -5.921 3.716 433 HB2 GLU 492 HB2 GLU 492 92.751 -5.554 0.745 434 HB3 GLU 492 HB3 GLU 492 93.655 -6.769 1.639 435 HG2 GLU 492 HG2 GLU 492 91.398 -7.649 2.411 436 HG3 GLU 492 HG3 GLU 492 90.699 -6.620 1.163 437 H CYS 493 H CYS 493 94.541 -4.622 4.391 438 HA CYS 493 HA CYS 493 95.157 -2.219 2.801 439 HB2 CYS 493 HB2 CYS 493 94.353 -1.462 4.893 440 HB3 CYS 493 HB3 CYS 493 95.258 -2.686 5.775 441 HG CYS 493 HG CYS 493 96.361 -0.241 5.890 442 H HIS 494 H HIS 494 97.287 -1.763 2.350 443 HA HIS 494 HA HIS 494 99.266 -3.783 3.169 444 HB2 HIS 494 HB2 HIS 494 98.918 -2.564 0.424 445 HB3 HIS 494 HB3 HIS 494 100.296 -3.547 0.907 446 HD1 HIS 494 HD1 HIS 494 96.506 -3.979 1.025 447 HD2 HIS 494 HD2 HIS 494 99.960 -6.092 0.094 448 HE1 HIS 494 HE1 HIS 494 95.725 -6.254 0.296 449 HE2 HIS 494 HE2 HIS 494 97.838 -7.554 -0.138 450 H ALA 495 H ALA 495 100.410 -2.643 4.632 451 HA ALA 495 HA ALA 495 101.118 0.118 4.118 452 HB1 ALA 495 HB1 ALA 495 102.460 -0.614 6.403 453 HB2 ALA 495 HB2 ALA 495 101.008 -1.613 6.449 454 HB3 ALA 495 HB3 ALA 495 100.867 0.141 6.330 455 H ARG 496 H ARG 496 103.032 0.865 3.504 456 HA ARG 496 HA ARG 496 105.084 -1.038 2.697 457 HB2 ARG 496 HB2 ARG 496 105.366 1.900 2.269 458 HB3 ARG 496 HB3 ARG 496 105.817 0.565 1.216 459 HG2 ARG 496 HG2 ARG 496 103.320 0.182 0.900 460 HG3 ARG 496 HG3 ARG 496 103.101 1.765 1.645 461 HD2 ARG 496 HD2 ARG 496 105.107 1.718 -0.481 462 HD3 ARG 496 HD3 ARG 496 103.479 1.305 -1.024 463 HE ARG 496 HE ARG 496 103.552 3.644 0.630 464 HH11 ARG 496 HH11 ARG 496 103.974 2.452 -2.616 465 HH12 ARG 496 HH12 ARG 496 103.608 3.973 -3.359 466 HH21 ARG 496 HH21 ARG 496 103.066 5.645 -0.335 467 HH22 ARG 496 HH22 ARG 496 103.092 5.792 -2.060 468 H PHE 497 H PHE 497 106.791 -1.433 3.921 469 HA PHE 497 HA PHE 497 107.385 0.348 6.174 470 HB2 PHE 497 HB2 PHE 497 108.086 -2.530 5.606 471 HB3 PHE 497 HB3 PHE 497 108.834 -1.621 6.915 472 HD1 PHE 497 HD1 PHE 497 107.984 -2.267 8.945 473 HD2 PHE 497 HD2 PHE 497 105.346 -1.891 5.628 474 HE1 PHE 497 HE1 PHE 497 106.076 -2.807 10.406 475 HE2 PHE 497 HE2 PHE 497 103.436 -2.429 7.079 476 HZ PHE 497 HZ PHE 497 103.797 -2.888 9.473 477 H LYS 498 H LYS 498 109.493 1.056 6.615 478 HA LYS 498 HA LYS 498 111.042 1.606 4.253 479 HB2 LYS 498 HB2 LYS 498 110.558 3.153 6.298 480 HB3 LYS 498 HB3 LYS 498 111.924 2.319 7.027 481 HG2 LYS 498 HG2 LYS 498 113.280 3.728 5.999 482 HG3 LYS 498 HG3 LYS 498 112.749 3.069 4.451 483 HD2 LYS 498 HD2 LYS 498 111.262 4.779 4.078 484 HD3 LYS 498 HD3 LYS 498 111.040 5.104 5.798 485 HE2 LYS 498 HE2 LYS 498 113.763 5.591 5.129 486 HE3 LYS 498 HE3 LYS 498 112.744 6.423 3.955 487 HZ1 LYS 498 HZ1 LYS 498 111.562 7.477 5.779 488 HZ2 LYS 498 HZ2 LYS 498 113.216 7.821 5.868 489 HZ3 LYS 498 HZ3 LYS 498 112.534 6.675 6.908 490 H THR 499 H THR 499 111.070 -0.823 6.632 491 HA THR 499 HA THR 499 113.599 -1.826 5.583 492 HB THR 499 HB THR 499 113.944 -2.447 8.217 493 HG1 THR 499 HG1 THR 499 113.514 -0.656 9.446 494 HG21 THR 499 HG21 THR 499 115.291 0.004 7.797 495 HG22 THR 499 HG22 THR 499 115.194 -0.816 6.239 496 HG23 THR 499 HG23 THR 499 115.924 -1.633 7.622 497 HA PRO 500 HA PRO 500 111.519 -5.706 5.897 498 HB2 PRO 500 HB2 PRO 500 113.612 -7.404 5.988 499 HB3 PRO 500 HB3 PRO 500 113.215 -6.486 4.530 500 HG2 PRO 500 HG2 PRO 500 115.280 -5.908 6.624 501 HG3 PRO 500 HG3 PRO 500 115.431 -5.836 4.858 502 HD2 PRO 500 HD2 PRO 500 115.025 -3.632 6.386 503 HD3 PRO 500 HD3 PRO 500 114.403 -3.776 4.729 504 H GLU 501 H GLU 501 114.172 -5.179 8.190 505 HA GLU 501 HA GLU 501 113.424 -7.182 10.034 506 HB2 GLU 501 HB2 GLU 501 115.075 -6.321 11.432 507 HB3 GLU 501 HB3 GLU 501 115.639 -5.852 9.833 508 HG2 GLU 501 HG2 GLU 501 114.769 -3.612 10.156 509 HG3 GLU 501 HG3 GLU 501 114.132 -4.070 11.735 510 H ASP 502 H ASP 502 112.485 -3.822 9.638 511 HA ASP 502 HA ASP 502 111.192 -3.473 12.113 512 HB2 ASP 502 HB2 ASP 502 111.264 -2.076 9.516 513 HB3 ASP 502 HB3 ASP 502 109.788 -1.832 10.447 514 H ALA 503 H ALA 503 110.024 -4.626 8.980 515 HA ALA 503 HA ALA 503 107.303 -4.852 9.715 516 HB1 ALA 503 HB1 ALA 503 107.303 -6.536 7.743 517 HB2 ALA 503 HB2 ALA 503 108.960 -5.982 7.499 518 HB3 ALA 503 HB3 ALA 503 107.625 -4.831 7.426 519 H GLN 504 H GLN 504 110.018 -7.101 9.857 520 HA GLN 504 HA GLN 504 108.614 -9.434 10.466 521 HB2 GLN 504 HB2 GLN 504 110.984 -9.435 9.875 522 HB3 GLN 504 HB3 GLN 504 111.372 -8.584 11.364 523 HG2 GLN 504 HG2 GLN 504 111.756 -10.583 12.240 524 HG3 GLN 504 HG3 GLN 504 110.005 -10.795 12.253 525 HE21 GLN 504 HE21 GLN 504 112.225 -12.723 11.930 526 HE22 GLN 504 HE22 GLN 504 111.895 -13.558 10.455 527 H ALA 505 H ALA 505 109.832 -6.875 12.575 528 HA ALA 505 HA ALA 505 109.207 -8.135 15.018 529 HB1 ALA 505 HB1 ALA 505 109.240 -5.157 14.686 530 HB2 ALA 505 HB2 ALA 505 110.722 -6.110 14.600 531 HB3 ALA 505 HB3 ALA 505 109.745 -6.129 16.068 532 H VAL 506 H VAL 506 107.328 -5.931 12.965 533 HA VAL 506 HA VAL 506 105.197 -5.584 14.803 534 HB VAL 506 HB VAL 506 105.452 -3.977 13.056 535 HG11 VAL 506 HG11 VAL 506 105.062 -4.582 10.676 536 HG12 VAL 506 HG12 VAL 506 105.069 -6.281 11.151 537 HG13 VAL 506 HG13 VAL 506 106.518 -5.298 11.365 538 HG21 VAL 506 HG21 VAL 506 103.252 -3.707 13.202 539 HG22 VAL 506 HG22 VAL 506 103.006 -5.436 13.444 540 HG23 VAL 506 HG23 VAL 506 103.074 -4.776 11.810 541 H ILE 507 H ILE 507 105.640 -7.807 12.070 542 HA ILE 507 HA ILE 507 103.059 -8.944 12.204 543 HB ILE 507 HB ILE 507 104.090 -10.879 10.960 544 HG12 ILE 507 HG12 ILE 507 106.435 -9.849 10.002 545 HG13 ILE 507 HG13 ILE 507 106.508 -9.379 11.694 546 HG21 ILE 507 HG21 ILE 507 103.650 -9.759 9.077 547 HG22 ILE 507 HG22 ILE 507 104.927 -8.579 9.378 548 HG23 ILE 507 HG23 ILE 507 103.344 -8.376 10.129 549 HD11 ILE 507 HD11 ILE 507 106.671 -11.527 12.428 550 HD12 ILE 507 HD12 ILE 507 107.466 -11.674 10.860 551 HD13 ILE 507 HD13 ILE 507 105.788 -12.183 11.049 552 H ASN 508 H ASN 508 106.056 -9.695 13.833 553 HA ASN 508 HA ASN 508 105.187 -12.194 14.918 554 HB2 ASN 508 HB2 ASN 508 107.428 -10.309 15.647 555 HB3 ASN 508 HB3 ASN 508 107.120 -11.793 16.543 556 HD21 ASN 508 HD21 ASN 508 109.397 -10.916 14.860 557 HD22 ASN 508 HD22 ASN 508 109.608 -12.176 13.697 558 H ALA 509 H ALA 509 105.204 -8.863 16.014 559 HA ALA 509 HA ALA 509 104.167 -9.426 18.625 560 HB1 ALA 509 HB1 ALA 509 105.484 -7.318 17.596 561 HB2 ALA 509 HB2 ALA 509 104.520 -7.247 19.071 562 HB3 ALA 509 HB3 ALA 509 103.829 -6.710 17.539 563 H TYR 510 H TYR 510 102.789 -8.860 15.512 564 HA TYR 510 HA TYR 510 100.288 -7.848 16.254 565 HB2 TYR 510 HB2 TYR 510 101.539 -8.774 13.864 566 HB3 TYR 510 HB3 TYR 510 99.921 -9.466 13.976 567 HD1 TYR 510 HD1 TYR 510 98.875 -8.220 12.230 568 HD2 TYR 510 HD2 TYR 510 100.944 -6.205 15.353 569 HE1 TYR 510 HE1 TYR 510 97.918 -6.084 11.475 570 HE2 TYR 510 HE2 TYR 510 99.994 -4.060 14.605 571 HH TYR 510 HH TYR 510 98.253 -3.760 11.621 572 H THR 511 H THR 511 101.547 -10.950 16.821 573 HA THR 511 HA THR 511 99.324 -12.596 16.531 574 HB THR 511 HB THR 511 100.295 -14.060 18.173 575 HG1 THR 511 HG1 THR 511 101.122 -13.151 19.895 576 HG21 THR 511 HG21 THR 511 102.173 -12.639 16.348 577 HG22 THR 511 HG22 THR 511 101.608 -14.309 16.308 578 HG23 THR 511 HG23 THR 511 102.826 -13.820 17.486 579 H GLU 512 H GLU 512 100.191 -10.299 19.004 580 HA GLU 512 HA GLU 512 98.267 -10.942 20.938 581 HB2 GLU 512 HB2 GLU 512 99.751 -8.408 20.294 582 HB3 GLU 512 HB3 GLU 512 98.584 -8.476 21.606 583 HG2 GLU 512 HG2 GLU 512 100.505 -10.657 21.689 584 HG3 GLU 512 HG3 GLU 512 101.258 -9.065 21.782 585 H ILE 513 H ILE 513 98.089 -8.774 18.142 586 HA ILE 513 HA ILE 513 95.852 -7.338 18.540 587 HB ILE 513 HB ILE 513 96.252 -8.896 15.986 588 HG12 ILE 513 HG12 ILE 513 98.361 -7.848 16.537 589 HG13 ILE 513 HG13 ILE 513 97.595 -6.918 15.254 590 HG21 ILE 513 HG21 ILE 513 95.093 -6.148 16.397 591 HG22 ILE 513 HG22 ILE 513 94.119 -7.616 16.321 592 HG23 ILE 513 HG23 ILE 513 95.075 -7.118 14.927 593 HD11 ILE 513 HD11 ILE 513 97.926 -5.119 16.495 594 HD12 ILE 513 HD12 ILE 513 98.424 -6.092 17.878 595 HD13 ILE 513 HD13 ILE 513 96.715 -5.743 17.615 596 H ASN 514 H ASN 514 95.890 -10.781 17.665 597 HA ASN 514 HA ASN 514 93.220 -11.252 17.282 598 HB2 ASN 514 HB2 ASN 514 94.959 -12.959 16.987 599 HB3 ASN 514 HB3 ASN 514 95.186 -13.038 18.731 600 HD21 ASN 514 HD21 ASN 514 92.158 -12.774 16.952 601 HD22 ASN 514 HD22 ASN 514 91.513 -14.291 17.470 602 H LYS 515 H LYS 515 94.896 -10.697 20.298 603 HA LYS 515 HA LYS 515 93.121 -11.675 22.156 604 HB2 LYS 515 HB2 LYS 515 94.735 -9.122 22.253 605 HB3 LYS 515 HB3 LYS 515 93.910 -9.817 23.642 606 HG2 LYS 515 HG2 LYS 515 95.653 -11.698 22.246 607 HG3 LYS 515 HG3 LYS 515 96.495 -10.305 22.928 608 HD2 LYS 515 HD2 LYS 515 94.754 -11.048 24.936 609 HD3 LYS 515 HD3 LYS 515 95.278 -12.592 24.259 610 HE2 LYS 515 HE2 LYS 515 97.042 -12.353 25.624 611 HE3 LYS 515 HE3 LYS 515 97.630 -11.231 24.397 612 HZ1 LYS 515 HZ1 LYS 515 95.966 -9.735 25.976 613 HZ2 LYS 515 HZ2 LYS 515 97.656 -9.716 26.002 614 HZ3 LYS 515 HZ3 LYS 515 96.806 -10.709 27.075 615 H LYS 516 H LYS 516 92.902 -8.725 20.263 616 HA LYS 516 HA LYS 516 90.276 -8.172 21.472 617 HB2 LYS 516 HB2 LYS 516 92.314 -6.453 21.294 618 HB3 LYS 516 HB3 LYS 516 91.595 -6.168 19.715 619 HG2 LYS 516 HG2 LYS 516 90.389 -5.740 22.424 620 HG3 LYS 516 HG3 LYS 516 90.631 -4.571 21.124 621 HD2 LYS 516 HD2 LYS 516 88.418 -4.955 20.800 622 HD3 LYS 516 HD3 LYS 516 89.040 -6.307 19.851 623 HE2 LYS 516 HE2 LYS 516 87.986 -7.740 21.181 624 HE3 LYS 516 HE3 LYS 516 88.882 -7.123 22.569 625 HZ1 LYS 516 HZ1 LYS 516 87.173 -5.326 22.703 626 HZ2 LYS 516 HZ2 LYS 516 86.590 -6.878 23.039 627 HZ3 LYS 516 HZ3 LYS 516 86.272 -6.162 21.540 628 H HIS 517 H HIS 517 91.949 -8.017 18.329 629 HA HIS 517 HA HIS 517 89.500 -8.993 17.050 630 HB2 HIS 517 HB2 HIS 517 91.025 -6.851 15.639 631 HB3 HIS 517 HB3 HIS 517 89.318 -7.266 15.536 632 HD1 HIS 517 HD1 HIS 517 87.717 -6.051 17.091 633 HD2 HIS 517 HD2 HIS 517 91.710 -5.176 17.837 634 HE1 HIS 517 HE1 HIS 517 87.692 -4.110 18.689 635 HE2 HIS 517 HE2 HIS 517 90.119 -3.559 19.079 636 H CYS 518 H CYS 518 89.994 -10.745 15.904 637 HA CYS 518 HA CYS 518 92.541 -11.724 15.449 638 HB2 CYS 518 HB2 CYS 518 90.487 -13.077 15.227 639 HB3 CYS 518 HB3 CYS 518 90.079 -12.206 13.753 640 HG CYS 518 HG CYS 518 92.703 -13.408 13.244 641 H TRP 519 H TRP 519 94.152 -11.116 14.137 642 HA TRP 519 HA TRP 519 93.489 -9.760 11.626 643 HB2 TRP 519 HB2 TRP 519 94.263 -8.315 13.793 644 HB3 TRP 519 HB3 TRP 519 95.813 -8.620 13.014 645 HD1 TRP 519 HD1 TRP 519 93.447 -8.518 10.294 646 HE1 TRP 519 HE1 TRP 519 93.339 -6.216 9.202 647 HE3 TRP 519 HE3 TRP 519 95.841 -5.805 13.907 648 HZ2 TRP 519 HZ2 TRP 519 94.156 -3.554 9.796 649 HZ3 TRP 519 HZ3 TRP 519 96.135 -3.390 13.567 650 HH2 TRP 519 HH2 TRP 519 95.310 -2.292 11.553 651 H LYS 520 H LYS 520 94.925 -9.961 9.997 652 HA LYS 520 HA LYS 520 97.011 -11.996 10.379 653 HB2 LYS 520 HB2 LYS 520 95.884 -11.215 7.727 654 HB3 LYS 520 HB3 LYS 520 96.586 -12.753 8.217 655 HG2 LYS 520 HG2 LYS 520 93.935 -11.682 9.167 656 HG3 LYS 520 HG3 LYS 520 94.146 -12.857 7.866 657 HD2 LYS 520 HD2 LYS 520 94.368 -14.541 9.311 658 HD3 LYS 520 HD3 LYS 520 95.565 -13.655 10.259 659 HE2 LYS 520 HE2 LYS 520 93.302 -14.341 11.346 660 HE3 LYS 520 HE3 LYS 520 93.977 -12.742 11.660 661 HZ1 LYS 520 HZ1 LYS 520 92.419 -11.726 10.337 662 HZ2 LYS 520 HZ2 LYS 520 91.503 -12.989 10.989 663 HZ3 LYS 520 HZ3 LYS 520 92.113 -13.112 9.416 664 H LEU 521 H LEU 521 99.086 -11.529 9.884 665 HA LEU 521 HA LEU 521 99.641 -9.066 8.389 666 HB2 LEU 521 HB2 LEU 521 100.053 -9.384 11.146 667 HB3 LEU 521 HB3 LEU 521 101.642 -9.532 10.420 668 HG LEU 521 HG LEU 521 99.754 -7.191 10.220 669 HD11 LEU 521 HD11 LEU 521 102.531 -6.783 11.028 670 HD12 LEU 521 HD12 LEU 521 101.607 -7.800 12.134 671 HD13 LEU 521 HD13 LEU 521 101.038 -6.179 11.744 672 HD21 LEU 521 HD21 LEU 521 102.309 -6.679 9.058 673 HD22 LEU 521 HD22 LEU 521 100.712 -6.560 8.322 674 HD23 LEU 521 HD23 LEU 521 101.591 -8.087 8.276 675 H GLU 522 H GLU 522 100.795 -9.567 6.662 676 HA GLU 522 HA GLU 522 102.963 -11.523 6.906 677 HB2 GLU 522 HB2 GLU 522 100.864 -12.585 5.949 678 HB3 GLU 522 HB3 GLU 522 101.069 -11.529 4.558 679 HG2 GLU 522 HG2 GLU 522 102.614 -12.847 3.671 680 HG3 GLU 522 HG3 GLU 522 103.510 -12.943 5.187 681 H ILE 523 H ILE 523 104.745 -11.108 5.651 682 HA ILE 523 HA ILE 523 104.790 -8.482 4.361 683 HB ILE 523 HB ILE 523 107.003 -10.319 5.268 684 HG12 ILE 523 HG12 ILE 523 106.877 -7.518 6.169 685 HG13 ILE 523 HG13 ILE 523 105.519 -8.513 6.686 686 HG21 ILE 523 HG21 ILE 523 108.329 -9.392 3.747 687 HG22 ILE 523 HG22 ILE 523 108.103 -7.850 4.574 688 HG23 ILE 523 HG23 ILE 523 107.054 -8.290 3.226 689 HD11 ILE 523 HD11 ILE 523 107.136 -8.615 8.397 690 HD12 ILE 523 HD12 ILE 523 108.436 -8.936 7.248 691 HD13 ILE 523 HD13 ILE 523 107.204 -10.162 7.552 692 H LEU 524 H LEU 524 104.595 -8.342 2.227 693 HA LEU 524 HA LEU 524 104.479 -10.544 0.502 694 HB2 LEU 524 HB2 LEU 524 104.640 -7.594 0.152 695 HB3 LEU 524 HB3 LEU 524 104.969 -8.597 -1.248 696 HG LEU 524 HG LEU 524 102.616 -7.830 -1.116 697 HD11 LEU 524 HD11 LEU 524 101.624 -10.198 -1.288 698 HD12 LEU 524 HD12 LEU 524 103.280 -10.751 -1.040 699 HD13 LEU 524 HD13 LEU 524 102.887 -9.733 -2.426 700 HD21 LEU 524 HD21 LEU 524 102.232 -7.766 1.228 701 HD22 LEU 524 HD22 LEU 524 102.639 -9.473 1.406 702 HD23 LEU 524 HD23 LEU 524 101.163 -9.003 0.564 703 H SER 525 H SER 525 105.925 -11.479 -0.894 704 HA SER 525 HA SER 525 108.637 -10.439 -1.060 705 HB2 SER 525 HB2 SER 525 108.501 -11.981 0.949 706 HB3 SER 525 HB3 SER 525 108.177 -13.294 -0.185 707 HG SER 525 HG SER 525 110.529 -11.955 0.350 708 H GLY 526 H GLY 526 109.976 -11.653 -2.618 709 HA2 GLY 526 HA2 GLY 526 110.303 -12.441 -4.744 710 HA3 GLY 526 HA3 GLY 526 109.021 -13.580 -4.371 711 H ASP 527 H ASP 527 108.298 -13.523 -6.511 712 HA ASP 527 HA ASP 527 107.691 -11.310 -8.037 713 HB2 ASP 527 HB2 ASP 527 107.622 -13.721 -8.763 714 HB3 ASP 527 HB3 ASP 527 106.049 -13.845 -7.981 715 H HIS 528 H HIS 528 105.902 -12.690 -5.366 716 HA HIS 528 HA HIS 528 103.438 -11.413 -5.855 717 HB2 HIS 528 HB2 HIS 528 104.420 -13.175 -3.952 718 HB3 HIS 528 HB3 HIS 528 104.047 -11.726 -3.024 719 HD1 HIS 528 HD1 HIS 528 102.223 -13.596 -2.065 720 HD2 HIS 528 HD2 HIS 528 101.549 -11.946 -5.818 721 HE1 HIS 528 HE1 HIS 528 99.789 -14.002 -2.551 722 HE2 HIS 528 HE2 HIS 528 99.422 -13.061 -4.859 723 H GLU 529 H GLU 529 106.250 -10.444 -3.904 724 HA GLU 529 HA GLU 529 105.113 -7.999 -3.016 725 HB2 GLU 529 HB2 GLU 529 106.913 -8.713 -1.722 726 HB3 GLU 529 HB3 GLU 529 107.893 -9.116 -3.124 727 HG2 GLU 529 HG2 GLU 529 108.199 -6.743 -3.594 728 HG3 GLU 529 HG3 GLU 529 107.210 -6.336 -2.192 729 H GLN 530 H GLN 530 107.296 -8.832 -5.673 730 HA GLN 530 HA GLN 530 107.663 -6.216 -6.647 731 HB2 GLN 530 HB2 GLN 530 108.825 -7.177 -8.380 732 HB3 GLN 530 HB3 GLN 530 108.876 -8.488 -7.210 733 HG2 GLN 530 HG2 GLN 530 108.223 -9.691 -8.994 734 HG3 GLN 530 HG3 GLN 530 106.626 -9.151 -8.478 735 HE21 GLN 530 HE21 GLN 530 106.115 -9.607 -10.748 736 HE22 GLN 530 HE22 GLN 530 106.386 -8.367 -11.920 737 H ARG 531 H ARG 531 105.212 -8.645 -7.264 738 HA ARG 531 HA ARG 531 103.983 -7.457 -9.491 739 HB2 ARG 531 HB2 ARG 531 103.149 -9.551 -9.252 740 HB3 ARG 531 HB3 ARG 531 103.301 -9.524 -7.503 741 HG2 ARG 531 HG2 ARG 531 100.968 -9.735 -8.357 742 HG3 ARG 531 HG3 ARG 531 101.231 -8.383 -7.254 743 HD2 ARG 531 HD2 ARG 531 100.658 -6.885 -8.806 744 HD3 ARG 531 HD3 ARG 531 101.678 -7.647 -10.027 745 HE ARG 531 HE ARG 531 99.400 -9.232 -9.655 746 HH11 ARG 531 HH11 ARG 531 100.276 -6.102 -10.908 747 HH12 ARG 531 HH12 ARG 531 98.977 -6.055 -12.052 748 HH21 ARG 531 HH21 ARG 531 97.687 -9.177 -11.152 749 HH22 ARG 531 HH22 ARG 531 97.503 -7.803 -12.191 750 H TYR 532 H TYR 532 103.178 -7.229 -6.030 751 HA TYR 532 HA TYR 532 101.042 -5.458 -6.246 752 HB2 TYR 532 HB2 TYR 532 101.525 -6.611 -4.177 753 HB3 TYR 532 HB3 TYR 532 103.076 -5.791 -4.039 754 HD1 TYR 532 HD1 TYR 532 103.108 -3.329 -3.610 755 HD2 TYR 532 HD2 TYR 532 99.542 -5.622 -3.353 756 HE1 TYR 532 HE1 TYR 532 102.073 -1.549 -2.258 757 HE2 TYR 532 HE2 TYR 532 98.487 -3.847 -2.014 758 HH TYR 532 HH TYR 532 100.158 -1.430 -0.522 759 H TRP 533 H TRP 533 104.515 -4.808 -5.957 760 HA TRP 533 HA TRP 533 104.326 -2.006 -5.801 761 HB2 TRP 533 HB2 TRP 533 106.474 -3.946 -6.510 762 HB3 TRP 533 HB3 TRP 533 106.715 -2.256 -6.955 763 HD1 TRP 533 HD1 TRP 533 107.156 -4.572 -4.123 764 HE1 TRP 533 HE1 TRP 533 107.686 -3.277 -1.965 765 HE3 TRP 533 HE3 TRP 533 105.974 0.144 -5.696 766 HZ2 TRP 533 HZ2 TRP 533 107.610 -0.603 -1.048 767 HZ3 TRP 533 HZ3 TRP 533 106.231 2.015 -4.119 768 HH2 TRP 533 HH2 TRP 533 107.034 1.646 -1.843 769 H GLN 534 H GLN 534 104.575 -4.208 -8.551 770 HA GLN 534 HA GLN 534 104.905 -2.402 -10.616 771 HB2 GLN 534 HB2 GLN 534 103.390 -5.003 -10.460 772 HB3 GLN 534 HB3 GLN 534 103.509 -4.094 -11.960 773 HG2 GLN 534 HG2 GLN 534 105.978 -4.821 -10.445 774 HG3 GLN 534 HG3 GLN 534 105.183 -6.006 -11.481 775 HE21 GLN 534 HE21 GLN 534 107.799 -4.551 -11.638 776 HE22 GLN 534 HE22 GLN 534 107.818 -3.861 -13.222 777 H LYS 535 H LYS 535 101.939 -3.442 -9.001 778 HA LYS 535 HA LYS 535 100.146 -1.968 -10.590 779 HB2 LYS 535 HB2 LYS 535 98.665 -3.088 -9.351 780 HB3 LYS 535 HB3 LYS 535 99.995 -3.723 -8.397 781 HG2 LYS 535 HG2 LYS 535 99.741 -1.473 -7.086 782 HG3 LYS 535 HG3 LYS 535 98.122 -1.491 -7.789 783 HD2 LYS 535 HD2 LYS 535 97.503 -3.399 -6.649 784 HD3 LYS 535 HD3 LYS 535 99.169 -3.948 -6.458 785 HE2 LYS 535 HE2 LYS 535 99.502 -2.714 -4.584 786 HE3 LYS 535 HE3 LYS 535 98.463 -1.401 -5.136 787 HZ1 LYS 535 HZ1 LYS 535 96.561 -2.999 -4.711 788 HZ2 LYS 535 HZ2 LYS 535 97.338 -2.364 -3.350 789 HZ3 LYS 535 HZ3 LYS 535 97.671 -3.944 -3.852 790 H ILE 536 H ILE 536 101.936 -1.174 -7.649 791 HA ILE 536 HA ILE 536 100.731 1.321 -7.134 792 HB ILE 536 HB ILE 536 103.529 0.367 -6.515 793 HG12 ILE 536 HG12 ILE 536 101.025 0.527 -4.820 794 HG13 ILE 536 HG13 ILE 536 101.794 -0.946 -5.408 795 HG21 ILE 536 HG21 ILE 536 104.044 2.376 -5.731 796 HG22 ILE 536 HG22 ILE 536 102.568 2.433 -4.768 797 HG23 ILE 536 HG23 ILE 536 102.550 2.987 -6.442 798 HD11 ILE 536 HD11 ILE 536 103.623 0.737 -3.911 799 HD12 ILE 536 HD12 ILE 536 103.240 -0.973 -3.720 800 HD13 ILE 536 HD13 ILE 536 102.215 0.251 -2.967 801 H LEU 537 H LEU 537 103.966 0.744 -8.509 802 HA LEU 537 HA LEU 537 104.527 3.280 -9.376 803 HB2 LEU 537 HB2 LEU 537 105.404 0.574 -10.118 804 HB3 LEU 537 HB3 LEU 537 105.654 1.786 -11.361 805 HG LEU 537 HG LEU 537 106.549 2.733 -8.770 806 HD11 LEU 537 HD11 LEU 537 108.158 0.445 -9.829 807 HD12 LEU 537 HD12 LEU 537 106.872 0.172 -8.654 808 HD13 LEU 537 HD13 LEU 537 108.227 1.225 -8.248 809 HD21 LEU 537 HD21 LEU 537 108.540 3.277 -10.018 810 HD22 LEU 537 HD22 LEU 537 107.118 3.701 -10.973 811 HD23 LEU 537 HD23 LEU 537 108.029 2.239 -11.350 812 H VAL 538 H VAL 538 103.153 0.709 -11.445 813 HA VAL 538 HA VAL 538 102.690 2.183 -13.715 814 HB VAL 538 HB VAL 538 101.088 -0.082 -12.533 815 HG11 VAL 538 HG11 VAL 538 100.758 1.208 -15.241 816 HG12 VAL 538 HG12 VAL 538 99.574 1.188 -13.933 817 HG13 VAL 538 HG13 VAL 538 100.019 -0.314 -14.743 818 HG21 VAL 538 HG21 VAL 538 103.475 -0.394 -13.354 819 HG22 VAL 538 HG22 VAL 538 102.846 -0.087 -14.972 820 HG23 VAL 538 HG23 VAL 538 102.254 -1.464 -14.043 821 H ASP 539 H ASP 539 100.688 1.986 -10.807 822 HA ASP 539 HA ASP 539 98.486 3.438 -11.807 823 HB2 ASP 539 HB2 ASP 539 98.674 2.026 -9.646 824 HB3 ASP 539 HB3 ASP 539 99.323 3.492 -8.917 825 H ARG 540 H ARG 540 101.486 4.414 -10.244 826 HA ARG 540 HA ARG 540 100.845 7.115 -9.809 827 HB2 ARG 540 HB2 ARG 540 102.852 5.781 -8.930 828 HB3 ARG 540 HB3 ARG 540 103.610 6.122 -10.480 829 HG2 ARG 540 HG2 ARG 540 104.218 7.669 -8.600 830 HG3 ARG 540 HG3 ARG 540 103.626 8.447 -10.069 831 HD2 ARG 540 HD2 ARG 540 101.606 9.025 -9.108 832 HD3 ARG 540 HD3 ARG 540 101.712 7.757 -7.889 833 HE ARG 540 HE ARG 540 103.603 9.986 -7.761 834 HH11 ARG 540 HH11 ARG 540 100.814 8.347 -6.431 835 HH12 ARG 540 HH12 ARG 540 100.900 9.177 -4.916 836 HH21 ARG 540 HH21 ARG 540 103.705 11.075 -5.772 837 HH22 ARG 540 HH22 ARG 540 102.537 10.726 -4.541 838 H GLN 541 H GLN 541 102.265 5.446 -12.584 839 HA GLN 541 HA GLN 541 102.822 7.740 -14.120 840 HB2 GLN 541 HB2 GLN 541 102.340 4.853 -14.815 841 HB3 GLN 541 HB3 GLN 541 102.593 6.057 -16.072 842 HG2 GLN 541 HG2 GLN 541 104.697 5.127 -15.718 843 HG3 GLN 541 HG3 GLN 541 104.738 6.654 -14.837 844 HE21 GLN 541 HE21 GLN 541 104.417 3.177 -14.520 845 HE22 GLN 541 HE22 GLN 541 104.903 3.092 -12.865 846 H ALA 542 H ALA 542 99.982 5.656 -13.880 847 HA ALA 542 HA ALA 542 98.450 6.776 -15.927 848 HB1 ALA 542 HB1 ALA 542 97.541 5.547 -13.327 849 HB2 ALA 542 HB2 ALA 542 97.783 4.714 -14.862 850 HB3 ALA 542 HB3 ALA 542 96.490 5.902 -14.698 851 H LYS 543 H LYS 543 98.953 7.774 -12.595 852 HA LYS 543 HA LYS 543 96.944 9.723 -12.424 853 HB2 LYS 543 HB2 LYS 543 99.289 8.934 -10.903 854 HB3 LYS 543 HB3 LYS 543 99.075 10.679 -10.896 855 HG2 LYS 543 HG2 LYS 543 96.867 10.468 -9.990 856 HG3 LYS 543 HG3 LYS 543 96.919 8.712 -10.162 857 HD2 LYS 543 HD2 LYS 543 98.974 10.135 -8.513 858 HD3 LYS 543 HD3 LYS 543 97.381 9.780 -7.842 859 HE2 LYS 543 HE2 LYS 543 99.079 7.670 -9.141 860 HE3 LYS 543 HE3 LYS 543 99.233 8.073 -7.432 861 HZ1 LYS 543 HZ1 LYS 543 96.648 7.312 -8.662 862 HZ2 LYS 543 HZ2 LYS 543 97.039 7.381 -7.017 863 HZ3 LYS 543 HZ3 LYS 543 97.708 6.172 -7.994 864 H LEU 544 H LEU 544 99.836 9.650 -14.226 865 HA LEU 544 HA LEU 544 100.505 12.371 -14.352 866 HB2 LEU 544 HB2 LEU 544 101.953 10.563 -15.173 867 HB3 LEU 544 HB3 LEU 544 100.819 10.242 -16.469 868 HG LEU 544 HG LEU 544 102.939 11.615 -16.987 869 HD11 LEU 544 HD11 LEU 544 100.751 13.221 -18.015 870 HD12 LEU 544 HD12 LEU 544 100.427 11.490 -18.123 871 HD13 LEU 544 HD13 LEU 544 101.877 12.163 -18.866 872 HD21 LEU 544 HD21 LEU 544 102.567 13.133 -15.011 873 HD22 LEU 544 HD22 LEU 544 101.234 13.851 -15.917 874 HD23 LEU 544 HD23 LEU 544 102.879 13.941 -16.547 875 H ASN 545 H ASN 545 98.139 10.461 -16.116 876 HA ASN 545 HA ASN 545 96.816 12.893 -16.976 877 HB2 ASN 545 HB2 ASN 545 98.527 11.469 -18.750 878 HB3 ASN 545 HB3 ASN 545 96.868 11.196 -19.275 879 HD21 ASN 545 HD21 ASN 545 98.455 13.994 -17.787 880 HD22 ASN 545 HD22 ASN 545 98.058 15.105 -19.049 881 H GLN 546 H GLN 546 94.628 12.612 -17.405 882 HA GLN 546 HA GLN 546 92.608 11.668 -16.829 883 HB2 GLN 546 HB2 GLN 546 93.413 10.822 -19.210 884 HB3 GLN 546 HB3 GLN 546 93.418 9.262 -18.397 885 HG2 GLN 546 HG2 GLN 546 91.295 9.234 -19.162 886 HG3 GLN 546 HG3 GLN 546 91.010 10.085 -17.643 887 HE21 GLN 546 HE21 GLN 546 91.125 12.485 -17.780 888 HE22 GLN 546 HE22 GLN 546 90.461 13.238 -19.185 889 HA PRO 547 HA PRO 547 94.098 9.018 -13.407 890 HB2 PRO 547 HB2 PRO 547 92.154 9.837 -11.679 891 HB3 PRO 547 HB3 PRO 547 93.672 10.709 -11.922 892 HG2 PRO 547 HG2 PRO 547 90.969 11.246 -13.091 893 HG3 PRO 547 HG3 PRO 547 92.154 12.392 -12.438 894 HD2 PRO 547 HD2 PRO 547 91.848 11.996 -15.088 895 HD3 PRO 547 HD3 PRO 547 93.426 12.370 -14.366 896 H ARG 548 H ARG 548 93.346 7.236 -14.796 897 HA ARG 548 HA ARG 548 90.566 6.442 -14.500 898 HB2 ARG 548 HB2 ARG 548 91.290 4.492 -15.925 899 HB3 ARG 548 HB3 ARG 548 91.474 6.073 -16.671 900 HG2 ARG 548 HG2 ARG 548 93.893 5.510 -15.340 901 HG3 ARG 548 HG3 ARG 548 93.437 4.057 -16.232 902 HD2 ARG 548 HD2 ARG 548 92.912 6.015 -18.053 903 HD3 ARG 548 HD3 ARG 548 94.310 6.680 -17.210 904 HE ARG 548 HE ARG 548 94.559 3.925 -18.074 905 HH11 ARG 548 HH11 ARG 548 95.136 7.282 -18.795 906 HH12 ARG 548 HH12 ARG 548 96.397 6.956 -19.937 907 HH21 ARG 548 HH21 ARG 548 96.219 3.481 -19.572 908 HH22 ARG 548 HH22 ARG 548 97.013 4.791 -20.379 909 H GLU 549 H GLU 549 89.843 5.063 -13.010 910 HA GLU 549 HA GLU 549 91.824 3.658 -11.357 911 HB2 GLU 549 HB2 GLU 549 89.849 3.438 -9.755 912 HB3 GLU 549 HB3 GLU 549 90.518 5.049 -9.980 913 HG2 GLU 549 HG2 GLU 549 87.943 4.670 -9.984 914 HG3 GLU 549 HG3 GLU 549 88.682 5.809 -11.109 915 H LYS 550 H LYS 550 90.653 1.634 -10.258 916 HA LYS 550 HA LYS 550 89.069 0.119 -12.157 917 HB2 LYS 550 HB2 LYS 550 91.078 -1.703 -11.466 918 HB3 LYS 550 HB3 LYS 550 90.786 -0.997 -13.049 919 HG2 LYS 550 HG2 LYS 550 92.280 0.889 -12.413 920 HG3 LYS 550 HG3 LYS 550 92.655 0.023 -10.922 921 HD2 LYS 550 HD2 LYS 550 92.948 -1.601 -13.338 922 HD3 LYS 550 HD3 LYS 550 94.028 -0.207 -13.282 923 HE2 LYS 550 HE2 LYS 550 95.347 -1.271 -11.851 924 HE3 LYS 550 HE3 LYS 550 94.009 -1.422 -10.713 925 HZ1 LYS 550 HZ1 LYS 550 93.426 -3.371 -12.427 926 HZ2 LYS 550 HZ2 LYS 550 94.368 -3.602 -11.042 927 HZ3 LYS 550 HZ3 LYS 550 95.114 -3.383 -12.545 928 H LYS 551 H LYS 551 88.232 -1.868 -11.258 929 HA LYS 551 HA LYS 551 88.618 -2.331 -8.419 930 HB2 LYS 551 HB2 LYS 551 86.681 -0.576 -9.015 931 HB3 LYS 551 HB3 LYS 551 85.771 -2.066 -9.227 932 HG2 LYS 551 HG2 LYS 551 86.452 -2.740 -6.936 933 HG3 LYS 551 HG3 LYS 551 87.202 -1.155 -6.741 934 HD2 LYS 551 HD2 LYS 551 85.038 -1.042 -5.753 935 HD3 LYS 551 HD3 LYS 551 84.969 -0.139 -7.267 936 HE2 LYS 551 HE2 LYS 551 83.420 -1.500 -8.115 937 HE3 LYS 551 HE3 LYS 551 84.320 -2.940 -7.636 938 HZ1 LYS 551 HZ1 LYS 551 82.001 -2.448 -6.610 939 HZ2 LYS 551 HZ2 LYS 551 82.863 -1.409 -5.592 940 HZ3 LYS 551 HZ3 LYS 551 83.241 -3.057 -5.632 941 H ARG 552 H ARG 552 89.201 -3.858 -10.756 942 HA ARG 552 HA ARG 552 87.167 -5.871 -11.055 943 HB2 ARG 552 HB2 ARG 552 89.752 -5.235 -12.293 944 HB3 ARG 552 HB3 ARG 552 89.434 -6.958 -12.145 945 HG2 ARG 552 HG2 ARG 552 88.178 -6.856 -13.959 946 HG3 ARG 552 HG3 ARG 552 87.068 -5.774 -13.114 947 HD2 ARG 552 HD2 ARG 552 89.181 -4.137 -13.818 948 HD3 ARG 552 HD3 ARG 552 88.999 -5.203 -15.209 949 HE ARG 552 HE ARG 552 86.484 -4.193 -14.385 950 HH11 ARG 552 HH11 ARG 552 89.414 -3.275 -16.027 951 HH12 ARG 552 HH12 ARG 552 88.648 -2.060 -16.994 952 HH21 ARG 552 HH21 ARG 552 85.462 -2.593 -15.654 953 HH22 ARG 552 HH22 ARG 552 86.401 -1.672 -16.782 954 H GLY 553 H GLY 553 87.695 -8.200 -10.742 955 HA2 GLY 553 HA2 GLY 553 89.665 -9.290 -9.205 956 HA3 GLY 553 HA3 GLY 553 88.545 -8.617 -8.027 957 H THR 554 H THR 554 89.330 -11.435 -8.800 958 HA THR 554 HA THR 554 86.586 -12.454 -8.964 959 HB THR 554 HB THR 554 88.557 -14.116 -10.379 960 HG1 THR 554 HG1 THR 554 87.557 -11.966 -11.881 961 HG21 THR 554 HG21 THR 554 86.739 -14.587 -11.804 962 HG22 THR 554 HG22 THR 554 85.883 -13.121 -11.327 963 HG23 THR 554 HG23 THR 554 86.044 -14.459 -10.189 964 H GLU 555 H GLU 555 86.170 -14.146 -7.651 965 HA GLU 555 HA GLU 555 88.416 -15.589 -6.448 966 HB2 GLU 555 HB2 GLU 555 86.386 -13.932 -5.026 967 HB3 GLU 555 HB3 GLU 555 86.901 -15.433 -4.268 968 HG2 GLU 555 HG2 GLU 555 88.837 -14.558 -3.629 969 HG3 GLU 555 HG3 GLU 555 89.150 -13.889 -5.230 970 H LYS 556 H LYS 556 87.975 -17.705 -5.870 971 HA LYS 556 HA LYS 556 85.462 -18.759 -6.949 972 HB2 LYS 556 HB2 LYS 556 87.951 -20.292 -6.191 973 HB3 LYS 556 HB3 LYS 556 86.587 -20.882 -7.132 974 HG2 LYS 556 HG2 LYS 556 87.278 -18.830 -8.678 975 HG3 LYS 556 HG3 LYS 556 88.848 -19.154 -7.939 976 HD2 LYS 556 HD2 LYS 556 89.151 -20.937 -9.235 977 HD3 LYS 556 HD3 LYS 556 87.600 -21.617 -8.738 978 HE2 LYS 556 HE2 LYS 556 87.617 -19.389 -10.714 979 HE3 LYS 556 HE3 LYS 556 88.091 -20.999 -11.255 980 HZ1 LYS 556 HZ1 LYS 556 85.933 -21.409 -11.475 981 HZ2 LYS 556 HZ2 LYS 556 85.493 -19.984 -10.678 982 HZ3 LYS 556 HZ3 LYS 556 85.807 -21.388 -9.789 983 H LEU 557 H LEU 557 84.039 -19.919 -5.759 984 HA LEU 557 HA LEU 557 84.682 -20.860 -3.111 985 HB2 LEU 557 HB2 LEU 557 83.525 -18.277 -3.447 986 HB3 LEU 557 HB3 LEU 557 82.308 -19.330 -2.750 987 HG LEU 557 HG LEU 557 84.902 -19.592 -1.439 988 HD11 LEU 557 HD11 LEU 557 83.489 -16.968 -1.067 989 HD12 LEU 557 HD12 LEU 557 84.863 -17.157 -2.156 990 HD13 LEU 557 HD13 LEU 557 85.054 -17.475 -0.432 991 HD21 LEU 557 HD21 LEU 557 82.854 -20.532 -0.541 992 HD22 LEU 557 HD22 LEU 557 82.122 -18.928 -0.475 993 HD23 LEU 557 HD23 LEU 557 83.498 -19.313 0.558 994 H ILE 558 H ILE 558 83.908 -22.188 -5.440 995 HA ILE 558 HA ILE 558 81.098 -22.731 -5.434 996 HB ILE 558 HB ILE 558 83.357 -24.288 -6.697 997 HG12 ILE 558 HG12 ILE 558 82.789 -21.794 -7.357 998 HG13 ILE 558 HG13 ILE 558 83.129 -22.998 -8.596 999 HG21 ILE 558 HG21 ILE 558 81.538 -25.197 -8.146 1000 HG22 ILE 558 HG22 ILE 558 80.372 -24.461 -7.047 1001 HG23 ILE 558 HG23 ILE 558 81.463 -25.718 -6.464 1002 HD11 ILE 558 HD11 ILE 558 80.362 -22.240 -7.694 1003 HD12 ILE 558 HD12 ILE 558 80.800 -23.266 -9.060 1004 HD13 ILE 558 HD13 ILE 558 81.185 -21.545 -9.091 1005 H THR 559 H THR 559 80.217 -23.671 -3.695 1006 HA THR 559 HA THR 559 81.097 -26.326 -2.960 1007 HB THR 559 HB THR 559 80.761 -25.179 -0.438 1008 HG1 THR 559 HG1 THR 559 82.501 -23.592 -2.049 1009 HG21 THR 559 HG21 THR 559 83.320 -25.569 -0.367 1010 HG22 THR 559 HG22 THR 559 83.102 -26.198 -2.001 1011 HG23 THR 559 HG23 THR 559 82.254 -26.945 -0.648 1012 H LYS 560 H LYS 560 79.607 -27.296 -1.298 1013 HA LYS 560 HA LYS 560 76.883 -26.245 -1.693 1014 HB2 LYS 560 HB2 LYS 560 77.602 -28.532 -2.686 1015 HB3 LYS 560 HB3 LYS 560 77.493 -29.110 -1.029 1016 HG2 LYS 560 HG2 LYS 560 75.301 -29.336 -1.214 1017 HG3 LYS 560 HG3 LYS 560 75.131 -27.638 -1.663 1018 HD2 LYS 560 HD2 LYS 560 76.060 -28.642 -3.981 1019 HD3 LYS 560 HD3 LYS 560 75.203 -30.053 -3.358 1020 HE2 LYS 560 HE2 LYS 560 73.976 -27.310 -3.544 1021 HE3 LYS 560 HE3 LYS 560 73.846 -28.520 -4.820 1022 HZ1 LYS 560 HZ1 LYS 560 73.005 -29.069 -2.036 1023 HZ2 LYS 560 HZ2 LYS 560 72.612 -29.932 -3.437 1024 HZ3 LYS 560 HZ3 LYS 560 71.953 -28.396 -3.178 1025 H ALA 561 H ALA 561 75.909 -25.493 0.063 1026 HA ALA 561 HA ALA 561 77.034 -25.662 2.644 1027 HB1 ALA 561 HB1 ALA 561 75.019 -24.162 1.435 1028 HB2 ALA 561 HB2 ALA 561 75.605 -24.020 3.091 1029 HB3 ALA 561 HB3 ALA 561 74.219 -25.050 2.732 Start of MODEL 7 1 H1 MET 437 HT1 MET 437 131.257 9.863 -30.749 2 H2 MET 437 HT2 MET 437 129.965 10.992 -30.768 3 H3 MET 437 HT3 MET 437 130.141 9.911 -29.448 4 HA MET 437 HA MET 437 132.513 11.333 -29.813 5 HB2 MET 437 HB2 MET 437 129.975 12.817 -30.128 6 HB3 MET 437 HB3 MET 437 131.116 13.507 -28.982 7 HG2 MET 437 HG2 MET 437 131.542 14.539 -31.052 8 HG3 MET 437 HG3 MET 437 132.850 13.385 -30.794 9 HE1 MET 437 HE1 MET 437 129.421 13.953 -32.929 10 HE2 MET 437 HE2 MET 437 130.367 13.808 -34.412 11 HE3 MET 437 HE3 MET 437 130.855 14.954 -33.164 12 H HIS 438 H HIS 438 131.916 9.338 -28.165 13 HA HIS 438 HA HIS 438 132.354 8.876 -25.945 14 HB2 HIS 438 HB2 HIS 438 131.442 11.661 -25.224 15 HB3 HIS 438 HB3 HIS 438 132.421 10.558 -24.264 16 HD1 HIS 438 HD1 HIS 438 132.879 13.556 -25.880 17 HD2 HIS 438 HD2 HIS 438 134.900 9.934 -26.123 18 HE1 HIS 438 HE1 HIS 438 135.159 14.118 -26.779 19 HE2 HIS 438 HE2 HIS 438 136.396 11.925 -26.822 20 H HIS 439 H HIS 439 131.048 7.919 -24.438 21 HA HIS 439 HA HIS 439 128.169 8.518 -24.618 22 HB2 HIS 439 HB2 HIS 439 129.121 5.765 -23.940 23 HB3 HIS 439 HB3 HIS 439 127.612 6.272 -24.689 24 HD1 HIS 439 HD1 HIS 439 127.768 6.945 -27.261 25 HD2 HIS 439 HD2 HIS 439 131.106 5.038 -25.687 26 HE1 HIS 439 HE1 HIS 439 129.092 6.162 -29.248 27 HE2 HIS 439 HE2 HIS 439 131.060 4.928 -28.271 28 H HIS 440 H HIS 440 130.395 6.622 -22.577 29 HA HIS 440 HA HIS 440 130.762 6.623 -20.330 30 HB2 HIS 440 HB2 HIS 440 130.860 9.101 -20.593 31 HB3 HIS 440 HB3 HIS 440 129.131 9.169 -20.271 32 HD1 HIS 440 HD1 HIS 440 132.157 7.662 -18.501 33 HD2 HIS 440 HD2 HIS 440 128.668 9.769 -17.686 34 HE1 HIS 440 HE1 HIS 440 132.161 8.034 -16.014 35 HE2 HIS 440 HE2 HIS 440 130.083 9.383 -15.556 36 H HIS 441 H HIS 441 129.245 4.742 -20.635 37 HA HIS 441 HA HIS 441 126.863 5.148 -18.953 38 HB2 HIS 441 HB2 HIS 441 125.971 3.111 -20.371 39 HB3 HIS 441 HB3 HIS 441 125.805 4.760 -20.963 40 HD1 HIS 441 HD1 HIS 441 128.284 1.891 -21.308 41 HD2 HIS 441 HD2 HIS 441 126.721 5.064 -23.489 42 HE1 HIS 441 HE1 HIS 441 129.280 1.683 -23.608 43 HE2 HIS 441 HE2 HIS 441 128.313 3.606 -24.915 44 H HIS 442 H HIS 442 129.354 2.910 -20.078 45 HA HIS 442 HA HIS 442 130.517 1.325 -18.892 46 HB2 HIS 442 HB2 HIS 442 129.573 2.828 -16.861 47 HB3 HIS 442 HB3 HIS 442 128.704 1.330 -16.547 48 HD1 HIS 442 HD1 HIS 442 130.457 -0.870 -16.600 49 HD2 HIS 442 HD2 HIS 442 131.979 2.877 -15.644 50 HE1 HIS 442 HE1 HIS 442 132.621 -1.310 -15.396 51 HE2 HIS 442 HE2 HIS 442 133.552 0.974 -14.877 52 H HIS 443 H HIS 443 130.352 -0.803 -19.238 53 HA HIS 443 HA HIS 443 127.739 -1.907 -19.849 54 HB2 HIS 443 HB2 HIS 443 130.112 -2.258 -21.054 55 HB3 HIS 443 HB3 HIS 443 130.166 -3.618 -19.939 56 HD1 HIS 443 HD1 HIS 443 130.125 -4.664 -22.587 57 HD2 HIS 443 HD2 HIS 443 126.583 -3.355 -20.850 58 HE1 HIS 443 HE1 HIS 443 128.284 -5.797 -23.875 59 HE2 HIS 443 HE2 HIS 443 126.150 -4.925 -22.858 60 H SER 444 H SER 444 127.127 -1.681 -17.511 61 HA SER 444 HA SER 444 127.983 -4.070 -16.013 62 HB2 SER 444 HB2 SER 444 127.512 -1.259 -15.109 63 HB3 SER 444 HB3 SER 444 127.137 -2.576 -13.998 64 HG SER 444 HG SER 444 129.410 -1.574 -14.160 65 H ASN 445 H ASN 445 125.313 -1.822 -16.631 66 HA ASN 445 HA ASN 445 123.336 -3.629 -17.107 67 HB2 ASN 445 HB2 ASN 445 124.097 -3.832 -14.388 68 HB3 ASN 445 HB3 ASN 445 122.524 -3.043 -14.414 69 HD21 ASN 445 HD21 ASN 445 120.740 -4.170 -15.060 70 HD22 ASN 445 HD22 ASN 445 120.748 -5.875 -15.347 71 H ALA 446 H ALA 446 121.135 -2.728 -16.926 72 HA ALA 446 HA ALA 446 120.967 0.108 -16.300 73 HB1 ALA 446 HB1 ALA 446 120.252 -0.904 -19.049 74 HB2 ALA 446 HB2 ALA 446 121.696 0.029 -18.658 75 HB3 ALA 446 HB3 ALA 446 120.100 0.751 -18.459 76 H THR 447 H THR 447 119.829 -2.082 -15.000 77 HA THR 447 HA THR 447 117.099 -1.311 -14.949 78 HB THR 447 HB THR 447 117.507 -4.148 -15.878 79 HG1 THR 447 HG1 THR 447 116.400 -2.959 -17.847 80 HG21 THR 447 HG21 THR 447 115.322 -4.353 -15.521 81 HG22 THR 447 HG22 THR 447 114.989 -2.946 -16.530 82 HG23 THR 447 HG23 THR 447 115.320 -2.739 -14.811 83 H GLY 448 H GLY 448 116.045 -2.048 -13.116 84 HA2 GLY 448 HA2 GLY 448 116.232 -4.115 -11.507 85 HA3 GLY 448 HA3 GLY 448 117.790 -3.372 -11.171 86 HA PRO 449 HA PRO 449 113.876 -0.746 -9.537 87 HB2 PRO 449 HB2 PRO 449 112.926 -3.141 -8.043 88 HB3 PRO 449 HB3 PRO 449 111.995 -1.833 -8.779 89 HG2 PRO 449 HG2 PRO 449 112.113 -4.231 -9.930 90 HG3 PRO 449 HG3 PRO 449 112.137 -2.749 -10.905 91 HD2 PRO 449 HD2 PRO 449 114.377 -4.592 -10.198 92 HD3 PRO 449 HD3 PRO 449 114.085 -3.693 -11.700 93 H GLN 450 H GLN 450 114.302 0.354 -7.691 94 HA GLN 450 HA GLN 450 116.085 -0.946 -5.741 95 HB2 GLN 450 HB2 GLN 450 116.878 1.084 -7.148 96 HB3 GLN 450 HB3 GLN 450 115.856 2.030 -6.074 97 HG2 GLN 450 HG2 GLN 450 117.987 2.157 -5.139 98 HG3 GLN 450 HG3 GLN 450 117.142 0.956 -4.163 99 HE21 GLN 450 HE21 GLN 450 118.797 -0.275 -3.495 100 HE22 GLN 450 HE22 GLN 450 119.869 -1.137 -4.541 101 H PHE 451 H PHE 451 113.073 -0.784 -5.882 102 HA PHE 451 HA PHE 451 112.308 0.900 -3.679 103 HB2 PHE 451 HB2 PHE 451 110.091 -0.071 -3.964 104 HB3 PHE 451 HB3 PHE 451 110.752 0.386 -5.530 105 HD1 PHE 451 HD1 PHE 451 110.951 -1.180 -7.248 106 HD2 PHE 451 HD2 PHE 451 110.214 -2.503 -3.272 107 HE1 PHE 451 HE1 PHE 451 110.556 -3.459 -8.085 108 HE2 PHE 451 HE2 PHE 451 109.816 -4.785 -4.100 109 HZ PHE 451 HZ PHE 451 109.987 -5.266 -6.509 110 H VAL 452 H VAL 452 112.189 0.385 -1.575 111 HA VAL 452 HA VAL 452 113.522 -1.740 -0.461 112 HB VAL 452 HB VAL 452 112.769 0.278 0.770 113 HG11 VAL 452 HG11 VAL 452 110.126 -1.092 1.106 114 HG12 VAL 452 HG12 VAL 452 110.405 0.120 -0.140 115 HG13 VAL 452 HG13 VAL 452 110.577 0.547 1.562 116 HG21 VAL 452 HG21 VAL 452 112.265 -2.458 1.886 117 HG22 VAL 452 HG22 VAL 452 112.103 -1.011 2.882 118 HG23 VAL 452 HG23 VAL 452 113.650 -1.395 2.131 119 H SER 453 H SER 453 113.154 -3.707 -1.238 120 HA SER 453 HA SER 453 110.622 -4.827 -1.805 121 HB2 SER 453 HB2 SER 453 111.842 -6.384 -2.839 122 HB3 SER 453 HB3 SER 453 113.266 -5.465 -2.354 123 HG SER 453 HG SER 453 112.484 -7.897 -1.549 124 H GLY 454 H GLY 454 109.434 -6.400 -0.814 125 HA2 GLY 454 HA2 GLY 454 108.534 -7.649 0.874 126 HA3 GLY 454 HA3 GLY 454 110.143 -7.746 1.555 127 H VAL 455 H VAL 455 108.421 -4.712 1.090 128 HA VAL 455 HA VAL 455 108.279 -4.475 4.021 129 HB VAL 455 HB VAL 455 108.406 -2.102 3.798 130 HG11 VAL 455 HG11 VAL 455 110.464 -3.738 3.276 131 HG12 VAL 455 HG12 VAL 455 110.613 -1.983 3.353 132 HG13 VAL 455 HG13 VAL 455 110.453 -2.787 1.791 133 HG21 VAL 455 HG21 VAL 455 108.217 -0.886 1.832 134 HG22 VAL 455 HG22 VAL 455 107.038 -2.174 1.597 135 HG23 VAL 455 HG23 VAL 455 108.614 -2.273 0.819 136 H ILE 456 H ILE 456 106.439 -4.827 1.218 137 HA ILE 456 HA ILE 456 104.112 -3.377 2.096 138 HB ILE 456 HB ILE 456 104.431 -5.396 -0.124 139 HG12 ILE 456 HG12 ILE 456 105.704 -3.560 -0.782 140 HG13 ILE 456 HG13 ILE 456 104.126 -3.201 -1.470 141 HG21 ILE 456 HG21 ILE 456 102.086 -4.666 1.049 142 HG22 ILE 456 HG22 ILE 456 102.255 -5.202 -0.622 143 HG23 ILE 456 HG23 ILE 456 102.225 -3.479 -0.247 144 HD11 ILE 456 HD11 ILE 456 105.064 -1.222 -0.479 145 HD12 ILE 456 HD12 ILE 456 105.271 -2.056 1.060 146 HD13 ILE 456 HD13 ILE 456 103.651 -1.735 0.443 147 H VAL 457 H VAL 457 103.480 -4.188 4.045 148 HA VAL 457 HA VAL 457 103.031 -7.027 4.396 149 HB VAL 457 HB VAL 457 102.334 -4.805 6.313 150 HG11 VAL 457 HG11 VAL 457 102.984 -7.684 6.896 151 HG12 VAL 457 HG12 VAL 457 101.340 -7.094 6.652 152 HG13 VAL 457 HG13 VAL 457 102.310 -6.479 7.993 153 HG21 VAL 457 HG21 VAL 457 104.793 -6.378 6.731 154 HG22 VAL 457 HG22 VAL 457 104.464 -4.677 7.053 155 HG23 VAL 457 HG23 VAL 457 104.839 -5.207 5.413 156 H LYS 458 H LYS 458 101.281 -7.874 3.492 157 HA LYS 458 HA LYS 458 98.868 -6.406 3.017 158 HB2 LYS 458 HB2 LYS 458 99.514 -8.178 1.491 159 HB3 LYS 458 HB3 LYS 458 99.500 -9.355 2.798 160 HG2 LYS 458 HG2 LYS 458 96.980 -8.458 2.978 161 HG3 LYS 458 HG3 LYS 458 97.269 -8.207 1.255 162 HD2 LYS 458 HD2 LYS 458 98.106 -10.596 1.187 163 HD3 LYS 458 HD3 LYS 458 97.446 -10.775 2.814 164 HE2 LYS 458 HE2 LYS 458 95.711 -11.537 1.487 165 HE3 LYS 458 HE3 LYS 458 95.265 -9.854 1.763 166 HZ1 LYS 458 HZ1 LYS 458 96.573 -10.960 -0.663 167 HZ2 LYS 458 HZ2 LYS 458 96.278 -9.316 -0.398 168 HZ3 LYS 458 HZ3 LYS 458 94.982 -10.393 -0.542 169 H ILE 459 H ILE 459 97.247 -6.097 4.390 170 HA ILE 459 HA ILE 459 97.076 -7.826 6.768 171 HB ILE 459 HB ILE 459 96.034 -5.004 6.578 172 HG12 ILE 459 HG12 ILE 459 98.672 -6.053 7.611 173 HG13 ILE 459 HG13 ILE 459 98.411 -4.829 6.372 174 HG21 ILE 459 HG21 ILE 459 95.639 -5.143 8.881 175 HG22 ILE 459 HG22 ILE 459 96.650 -6.578 9.058 176 HG23 ILE 459 HG23 ILE 459 95.086 -6.695 8.249 177 HD11 ILE 459 HD11 ILE 459 97.843 -3.206 7.920 178 HD12 ILE 459 HD12 ILE 459 99.137 -4.094 8.724 179 HD13 ILE 459 HD13 ILE 459 97.457 -4.392 9.168 180 H ILE 460 H ILE 460 95.283 -8.973 7.058 181 HA ILE 460 HA ILE 460 92.824 -8.115 5.703 182 HB ILE 460 HB ILE 460 93.917 -9.992 4.424 183 HG12 ILE 460 HG12 ILE 460 91.838 -11.177 4.054 184 HG13 ILE 460 HG13 ILE 460 91.226 -10.671 5.626 185 HG21 ILE 460 HG21 ILE 460 93.377 -12.288 5.526 186 HG22 ILE 460 HG22 ILE 460 93.479 -11.377 7.031 187 HG23 ILE 460 HG23 ILE 460 94.864 -11.438 5.942 188 HD11 ILE 460 HD11 ILE 460 91.863 -8.812 3.347 189 HD12 ILE 460 HD12 ILE 460 91.132 -8.378 4.893 190 HD13 ILE 460 HD13 ILE 460 90.255 -9.407 3.760 191 H SER 461 H SER 461 91.035 -8.196 6.935 192 HA SER 461 HA SER 461 91.239 -9.610 9.509 193 HB2 SER 461 HB2 SER 461 90.391 -7.808 10.703 194 HB3 SER 461 HB3 SER 461 91.395 -6.996 9.505 195 HG SER 461 HG SER 461 89.509 -6.647 8.269 196 H THR 462 H THR 462 88.690 -8.984 10.420 197 HA THR 462 HA THR 462 86.942 -10.280 8.432 198 HB THR 462 HB THR 462 85.953 -11.676 10.105 199 HG1 THR 462 HG1 THR 462 86.023 -10.381 11.941 200 HG21 THR 462 HG21 THR 462 88.571 -11.942 9.279 201 HG22 THR 462 HG22 THR 462 87.595 -13.192 10.051 202 HG23 THR 462 HG23 THR 462 88.666 -12.184 11.024 203 H GLU 463 H GLU 463 87.443 -7.552 10.142 204 HA GLU 463 HA GLU 463 85.181 -6.216 9.570 205 HB2 GLU 463 HB2 GLU 463 84.616 -8.187 11.608 206 HB3 GLU 463 HB3 GLU 463 84.301 -6.566 12.208 207 HG2 GLU 463 HG2 GLU 463 83.104 -7.887 9.791 208 HG3 GLU 463 HG3 GLU 463 82.286 -7.411 11.278 209 HA PRO 464 HA PRO 464 87.169 -4.545 13.890 210 HB2 PRO 464 HB2 PRO 464 89.732 -5.891 13.112 211 HB3 PRO 464 HB3 PRO 464 89.144 -5.442 14.718 212 HG2 PRO 464 HG2 PRO 464 88.968 -7.961 13.840 213 HG3 PRO 464 HG3 PRO 464 87.695 -7.240 14.840 214 HD2 PRO 464 HD2 PRO 464 87.670 -7.918 11.964 215 HD3 PRO 464 HD3 PRO 464 86.314 -7.739 13.093 216 H LEU 465 H LEU 465 88.757 -5.108 10.770 217 HA LEU 465 HA LEU 465 90.490 -3.044 10.547 218 HB2 LEU 465 HB2 LEU 465 89.056 -4.684 8.733 219 HB3 LEU 465 HB3 LEU 465 88.940 -3.035 8.145 220 HG LEU 465 HG LEU 465 91.649 -3.842 8.959 221 HD11 LEU 465 HD11 LEU 465 91.462 -5.885 8.001 222 HD12 LEU 465 HD12 LEU 465 91.732 -4.948 6.532 223 HD13 LEU 465 HD13 LEU 465 90.094 -5.413 6.994 224 HD21 LEU 465 HD21 LEU 465 90.367 -2.405 6.654 225 HD22 LEU 465 HD22 LEU 465 92.078 -2.834 6.654 226 HD23 LEU 465 HD23 LEU 465 91.437 -1.761 7.899 227 HA PRO 466 HA PRO 466 87.617 0.336 11.451 228 HB2 PRO 466 HB2 PRO 466 89.496 2.025 12.377 229 HB3 PRO 466 HB3 PRO 466 88.873 0.688 13.351 230 HG2 PRO 466 HG2 PRO 466 91.415 0.856 11.773 231 HG3 PRO 466 HG3 PRO 466 91.152 0.209 13.402 232 HD2 PRO 466 HD2 PRO 466 91.339 -1.353 11.178 233 HD3 PRO 466 HD3 PRO 466 90.394 -1.805 12.610 234 H GLY 467 H GLY 467 90.770 0.709 9.838 235 HA2 GLY 467 HA2 GLY 467 90.013 1.682 7.440 236 HA3 GLY 467 HA3 GLY 467 89.896 3.105 8.464 237 H ARG 468 H ARG 468 91.581 3.530 6.557 238 HA ARG 468 HA ARG 468 94.184 2.503 6.805 239 HB2 ARG 468 HB2 ARG 468 94.871 4.453 5.467 240 HB3 ARG 468 HB3 ARG 468 93.448 3.665 4.800 241 HG2 ARG 468 HG2 ARG 468 92.196 5.477 6.258 242 HG3 ARG 468 HG3 ARG 468 93.724 6.337 6.055 243 HD2 ARG 468 HD2 ARG 468 92.993 7.003 4.063 244 HD3 ARG 468 HD3 ARG 468 93.118 5.329 3.529 245 HE ARG 468 HE ARG 468 90.835 5.179 3.576 246 HH11 ARG 468 HH11 ARG 468 91.830 8.006 5.351 247 HH12 ARG 468 HH12 ARG 468 90.218 8.608 5.550 248 HH21 ARG 468 HH21 ARG 468 88.707 5.963 3.832 249 HH22 ARG 468 HH22 ARG 468 88.442 7.447 4.687 250 H LYS 469 H LYS 469 92.653 5.375 8.211 251 HA LYS 469 HA LYS 469 94.958 6.418 9.446 252 HB2 LYS 469 HB2 LYS 469 93.473 7.817 10.708 253 HB3 LYS 469 HB3 LYS 469 92.824 7.662 9.081 254 HG2 LYS 469 HG2 LYS 469 91.329 5.838 9.988 255 HG3 LYS 469 HG3 LYS 469 91.847 6.346 11.598 256 HD2 LYS 469 HD2 LYS 469 90.751 8.331 9.637 257 HD3 LYS 469 HD3 LYS 469 89.670 7.336 10.616 258 HE2 LYS 469 HE2 LYS 469 90.653 8.195 12.647 259 HE3 LYS 469 HE3 LYS 469 91.853 9.097 11.723 260 HZ1 LYS 469 HZ1 LYS 469 88.920 9.561 11.709 261 HZ2 LYS 469 HZ2 LYS 469 90.036 10.396 10.751 262 HZ3 LYS 469 HZ3 LYS 469 90.086 10.549 12.434 263 H GLN 470 H GLN 470 92.425 4.254 10.674 264 HA GLN 470 HA GLN 470 93.617 4.045 13.268 265 HB2 GLN 470 HB2 GLN 470 91.338 2.701 11.868 266 HB3 GLN 470 HB3 GLN 470 91.953 2.031 13.373 267 HG2 GLN 470 HG2 GLN 470 91.314 4.925 13.292 268 HG3 GLN 470 HG3 GLN 470 89.978 3.775 13.318 269 HE21 GLN 470 HE21 GLN 470 91.117 5.742 15.305 270 HE22 GLN 470 HE22 GLN 470 91.312 4.818 16.752 271 H VAL 471 H VAL 471 93.489 1.949 10.402 272 HA VAL 471 HA VAL 471 94.890 -0.214 11.558 273 HB VAL 471 HB VAL 471 94.539 0.614 8.678 274 HG11 VAL 471 HG11 VAL 471 95.533 -1.415 7.963 275 HG12 VAL 471 HG12 VAL 471 95.673 -2.008 9.618 276 HG13 VAL 471 HG13 VAL 471 96.675 -0.663 9.076 277 HG21 VAL 471 HG21 VAL 471 93.177 -1.255 10.551 278 HG22 VAL 471 HG22 VAL 471 93.231 -1.662 8.837 279 HG23 VAL 471 HG23 VAL 471 92.488 -0.152 9.361 280 H ARG 472 H ARG 472 95.960 2.642 9.760 281 HA ARG 472 HA ARG 472 98.684 1.933 9.592 282 HB2 ARG 472 HB2 ARG 472 99.095 4.136 8.892 283 HB3 ARG 472 HB3 ARG 472 97.460 3.803 8.340 284 HG2 ARG 472 HG2 ARG 472 96.508 5.125 10.045 285 HG3 ARG 472 HG3 ARG 472 98.034 5.214 10.927 286 HD2 ARG 472 HD2 ARG 472 98.749 6.249 8.520 287 HD3 ARG 472 HD3 ARG 472 97.075 6.790 8.643 288 HE ARG 472 HE ARG 472 97.799 8.337 10.140 289 HH11 ARG 472 HH11 ARG 472 99.956 5.604 10.271 290 HH12 ARG 472 HH12 ARG 472 100.991 6.313 11.466 291 HH21 ARG 472 HH21 ARG 472 99.155 9.280 11.714 292 HH22 ARG 472 HH22 ARG 472 100.536 8.402 12.286 293 H ASP 473 H ASP 473 96.832 3.747 12.007 294 HA ASP 473 HA ASP 473 99.021 4.488 13.622 295 HB2 ASP 473 HB2 ASP 473 96.065 4.285 14.035 296 HB3 ASP 473 HB3 ASP 473 97.106 4.520 15.436 297 H THR 474 H THR 474 97.031 1.593 13.516 298 HA THR 474 HA THR 474 97.907 0.453 15.956 299 HB THR 474 HB THR 474 97.244 -1.750 14.695 300 HG1 THR 474 HG1 THR 474 96.281 -1.505 12.800 301 HG21 THR 474 HG21 THR 474 94.945 -1.409 15.253 302 HG22 THR 474 HG22 THR 474 95.124 0.343 15.150 303 HG23 THR 474 HG23 THR 474 95.918 -0.549 16.448 304 H LEU 475 H LEU 475 98.811 -0.319 12.600 305 HA LEU 475 HA LEU 475 100.943 -2.035 13.266 306 HB2 LEU 475 HB2 LEU 475 101.683 -1.603 10.903 307 HB3 LEU 475 HB3 LEU 475 100.035 -2.178 11.079 308 HG LEU 475 HG LEU 475 99.524 0.438 11.043 309 HD11 LEU 475 HD11 LEU 475 101.233 1.710 10.433 310 HD12 LEU 475 HD12 LEU 475 101.361 0.806 8.925 311 HD13 LEU 475 HD13 LEU 475 102.278 0.292 10.341 312 HD21 LEU 475 HD21 LEU 475 98.991 -1.617 9.430 313 HD22 LEU 475 HD22 LEU 475 100.073 -0.713 8.370 314 HD23 LEU 475 HD23 LEU 475 98.614 0.051 9.001 315 H ALA 476 H ALA 476 100.751 1.424 12.620 316 HA ALA 476 HA ALA 476 103.548 1.906 12.720 317 HB1 ALA 476 HB1 ALA 476 101.148 3.694 12.972 318 HB2 ALA 476 HB2 ALA 476 102.297 3.571 11.640 319 HB3 ALA 476 HB3 ALA 476 102.790 4.306 13.166 320 H ALA 477 H ALA 477 101.081 1.467 15.095 321 HA ALA 477 HA ALA 477 102.446 2.744 17.258 322 HB1 ALA 477 HB1 ALA 477 100.303 2.599 17.922 323 HB2 ALA 477 HB2 ALA 477 100.772 0.996 18.491 324 HB3 ALA 477 HB3 ALA 477 99.983 1.180 16.924 325 H ILE 478 H ILE 478 102.456 -0.422 15.807 326 HA ILE 478 HA ILE 478 103.892 -1.663 17.989 327 HB ILE 478 HB ILE 478 103.240 -2.595 15.195 328 HG12 ILE 478 HG12 ILE 478 102.241 -4.327 17.177 329 HG13 ILE 478 HG13 ILE 478 101.914 -2.697 17.755 330 HG21 ILE 478 HG21 ILE 478 105.211 -3.739 15.524 331 HG22 ILE 478 HG22 ILE 478 104.040 -4.856 16.222 332 HG23 ILE 478 HG23 ILE 478 105.001 -3.816 17.273 333 HD11 ILE 478 HD11 ILE 478 100.121 -2.693 16.462 334 HD12 ILE 478 HD12 ILE 478 100.601 -4.208 15.698 335 HD13 ILE 478 HD13 ILE 478 101.195 -2.674 15.065 336 H SER 479 H SER 479 104.627 -0.137 14.935 337 HA SER 479 HA SER 479 107.380 0.190 15.671 338 HB2 SER 479 HB2 SER 479 106.830 -2.165 14.347 339 HB3 SER 479 HB3 SER 479 107.298 -1.088 13.032 340 HG SER 479 HG SER 479 109.185 -0.589 14.353 341 H GLU 480 H GLU 480 108.563 1.525 14.116 342 HA GLU 480 HA GLU 480 106.900 3.601 13.080 343 HB2 GLU 480 HB2 GLU 480 109.138 4.000 14.080 344 HB3 GLU 480 HB3 GLU 480 109.871 3.186 12.705 345 HG2 GLU 480 HG2 GLU 480 109.210 4.890 11.217 346 HG3 GLU 480 HG3 GLU 480 108.115 5.601 12.401 347 H VAL 481 H VAL 481 105.739 3.257 11.294 348 HA VAL 481 HA VAL 481 106.947 1.784 9.058 349 HB VAL 481 HB VAL 481 104.619 1.747 8.135 350 HG11 VAL 481 HG11 VAL 481 104.166 -0.190 9.217 351 HG12 VAL 481 HG12 VAL 481 104.386 0.521 10.815 352 HG13 VAL 481 HG13 VAL 481 105.791 0.064 9.853 353 HG21 VAL 481 HG21 VAL 481 103.428 2.330 10.750 354 HG22 VAL 481 HG22 VAL 481 102.877 2.756 9.129 355 HG23 VAL 481 HG23 VAL 481 104.113 3.731 9.926 356 H LEU 482 H LEU 482 106.420 2.575 6.857 357 HA LEU 482 HA LEU 482 107.021 5.405 6.692 358 HB2 LEU 482 HB2 LEU 482 107.958 3.364 5.276 359 HB3 LEU 482 HB3 LEU 482 106.571 3.734 4.269 360 HG LEU 482 HG LEU 482 108.778 4.799 3.606 361 HD11 LEU 482 HD11 LEU 482 107.563 6.294 2.489 362 HD12 LEU 482 HD12 LEU 482 107.040 7.097 3.971 363 HD13 LEU 482 HD13 LEU 482 106.176 5.675 3.386 364 HD21 LEU 482 HD21 LEU 482 108.910 5.517 6.234 365 HD22 LEU 482 HD22 LEU 482 108.335 7.004 5.477 366 HD23 LEU 482 HD23 LEU 482 109.838 6.261 4.931 367 H TYR 483 H TYR 483 104.785 3.388 4.787 368 HA TYR 483 HA TYR 483 102.637 5.306 5.291 369 HB2 TYR 483 HB2 TYR 483 103.644 6.225 3.311 370 HB3 TYR 483 HB3 TYR 483 103.694 4.643 2.541 371 HD1 TYR 483 HD1 TYR 483 101.327 3.477 2.302 372 HD2 TYR 483 HD2 TYR 483 101.932 7.662 2.738 373 HE1 TYR 483 HE1 TYR 483 99.127 3.893 1.286 374 HE2 TYR 483 HE2 TYR 483 99.731 8.093 1.723 375 HH TYR 483 HH TYR 483 97.818 7.172 1.009 376 H VAL 484 H VAL 484 100.615 4.434 5.244 377 HA VAL 484 HA VAL 484 100.475 1.545 4.730 378 HB VAL 484 HB VAL 484 98.602 3.245 6.379 379 HG11 VAL 484 HG11 VAL 484 97.322 1.443 5.656 380 HG12 VAL 484 HG12 VAL 484 97.949 0.889 7.209 381 HG13 VAL 484 HG13 VAL 484 98.687 0.326 5.709 382 HG21 VAL 484 HG21 VAL 484 100.320 3.173 7.836 383 HG22 VAL 484 HG22 VAL 484 101.097 1.821 7.011 384 HG23 VAL 484 HG23 VAL 484 99.759 1.525 8.119 385 H ASP 485 H ASP 485 99.586 0.987 2.860 386 HA ASP 485 HA ASP 485 97.656 2.801 1.602 387 HB2 ASP 485 HB2 ASP 485 99.507 2.245 0.177 388 HB3 ASP 485 HB3 ASP 485 99.300 0.526 0.490 389 H LEU 486 H LEU 486 95.828 2.246 2.808 390 HA LEU 486 HA LEU 486 94.902 -0.511 2.796 391 HB2 LEU 486 HB2 LEU 486 94.458 0.561 4.831 392 HB3 LEU 486 HB3 LEU 486 93.927 2.034 4.043 393 HG LEU 486 HG LEU 486 92.184 -0.091 3.261 394 HD11 LEU 486 HD11 LEU 486 91.625 0.158 6.066 395 HD12 LEU 486 HD12 LEU 486 93.226 -0.541 5.817 396 HD13 LEU 486 HD13 LEU 486 91.810 -1.296 5.083 397 HD21 LEU 486 HD21 LEU 486 90.533 1.392 4.472 398 HD22 LEU 486 HD22 LEU 486 91.465 2.156 3.184 399 HD23 LEU 486 HD23 LEU 486 91.900 2.433 4.870 400 H LEU 487 H LEU 487 93.493 -1.338 1.363 401 HA LEU 487 HA LEU 487 92.727 0.098 -0.931 402 HB2 LEU 487 HB2 LEU 487 91.780 -2.511 0.233 403 HB3 LEU 487 HB3 LEU 487 91.138 -1.872 -1.266 404 HG LEU 487 HG LEU 487 93.391 -1.929 -2.258 405 HD11 LEU 487 HD11 LEU 487 95.231 -2.993 -1.125 406 HD12 LEU 487 HD12 LEU 487 94.229 -3.298 0.293 407 HD13 LEU 487 HD13 LEU 487 94.651 -1.645 -0.149 408 HD21 LEU 487 HD21 LEU 487 91.729 -4.112 -1.637 409 HD22 LEU 487 HD22 LEU 487 93.390 -4.665 -1.427 410 HD23 LEU 487 HD23 LEU 487 92.880 -3.968 -2.965 411 H GLU 488 H GLU 488 91.812 1.997 0.049 412 HA GLU 488 HA GLU 488 89.816 2.431 1.725 413 HB2 GLU 488 HB2 GLU 488 90.892 4.081 0.104 414 HB3 GLU 488 HB3 GLU 488 89.638 3.619 -1.038 415 HG2 GLU 488 HG2 GLU 488 88.993 4.623 1.713 416 HG3 GLU 488 HG3 GLU 488 89.251 5.711 0.351 417 H GLY 489 H GLY 489 87.791 1.826 2.088 418 HA2 GLY 489 HA2 GLY 489 85.648 1.059 1.717 419 HA3 GLY 489 HA3 GLY 489 85.933 1.244 -0.006 420 H ASP 490 H ASP 490 88.331 -0.624 1.473 421 HA ASP 490 HA ASP 490 86.952 -3.090 0.634 422 HB2 ASP 490 HB2 ASP 490 89.131 -2.116 -0.594 423 HB3 ASP 490 HB3 ASP 490 89.921 -3.043 0.679 424 H THR 491 H THR 491 88.248 -5.069 1.610 425 HA THR 491 HA THR 491 88.284 -4.616 4.512 426 HB THR 491 HB THR 491 88.361 -7.370 4.072 427 HG1 THR 491 HG1 THR 491 86.562 -7.669 2.648 428 HG21 THR 491 HG21 THR 491 86.774 -5.477 5.392 429 HG22 THR 491 HG22 THR 491 86.728 -7.230 5.574 430 HG23 THR 491 HG23 THR 491 85.666 -6.436 4.412 431 H GLU 492 H GLU 492 90.475 -4.660 2.138 432 HA GLU 492 HA GLU 492 92.505 -5.906 3.863 433 HB2 GLU 492 HB2 GLU 492 93.566 -6.975 2.053 434 HB3 GLU 492 HB3 GLU 492 91.853 -7.312 1.842 435 HG2 GLU 492 HG2 GLU 492 91.699 -5.561 0.163 436 HG3 GLU 492 HG3 GLU 492 93.406 -5.179 0.392 437 H CYS 493 H CYS 493 94.390 -4.830 4.093 438 HA CYS 493 HA CYS 493 94.843 -2.450 2.430 439 HB2 CYS 493 HB2 CYS 493 94.100 -1.390 4.348 440 HB3 CYS 493 HB3 CYS 493 94.699 -2.655 5.411 441 HG CYS 493 HG CYS 493 96.832 -0.868 4.091 442 H HIS 494 H HIS 494 97.004 -1.979 1.995 443 HA HIS 494 HA HIS 494 98.930 -4.020 2.892 444 HB2 HIS 494 HB2 HIS 494 98.713 -2.631 0.220 445 HB3 HIS 494 HB3 HIS 494 100.108 -3.588 0.707 446 HD1 HIS 494 HD1 HIS 494 96.348 -4.237 0.761 447 HD2 HIS 494 HD2 HIS 494 99.908 -6.024 -0.415 448 HE1 HIS 494 HE1 HIS 494 95.695 -6.472 -0.186 449 HE2 HIS 494 HE2 HIS 494 97.859 -7.504 -0.965 450 H ALA 495 H ALA 495 99.939 -2.960 4.538 451 HA ALA 495 HA ALA 495 100.726 -0.204 4.280 452 HB1 ALA 495 HB1 ALA 495 101.699 -0.485 6.513 453 HB2 ALA 495 HB2 ALA 495 101.354 -2.213 6.437 454 HB3 ALA 495 HB3 ALA 495 100.029 -1.049 6.449 455 H ARG 496 H ARG 496 102.638 0.583 3.649 456 HA ARG 496 HA ARG 496 104.723 -1.331 2.892 457 HB2 ARG 496 HB2 ARG 496 105.048 1.511 2.168 458 HB3 ARG 496 HB3 ARG 496 105.292 0.065 1.197 459 HG2 ARG 496 HG2 ARG 496 102.669 -0.051 1.297 460 HG3 ARG 496 HG3 ARG 496 102.831 1.677 1.620 461 HD2 ARG 496 HD2 ARG 496 104.528 1.410 -0.460 462 HD3 ARG 496 HD3 ARG 496 103.361 0.145 -0.843 463 HE ARG 496 HE ARG 496 101.899 1.779 -1.449 464 HH11 ARG 496 HH11 ARG 496 104.238 3.156 0.735 465 HH12 ARG 496 HH12 ARG 496 103.618 4.767 0.589 466 HH21 ARG 496 HH21 ARG 496 101.078 3.898 -1.650 467 HH22 ARG 496 HH22 ARG 496 101.822 5.188 -0.766 468 H PHE 497 H PHE 497 106.705 -1.347 3.796 469 HA PHE 497 HA PHE 497 107.207 0.606 5.945 470 HB2 PHE 497 HB2 PHE 497 108.146 -2.251 5.639 471 HB3 PHE 497 HB3 PHE 497 108.747 -1.155 6.878 472 HD1 PHE 497 HD1 PHE 497 105.347 -1.933 5.548 473 HD2 PHE 497 HD2 PHE 497 107.910 -1.708 8.937 474 HE1 PHE 497 HE1 PHE 497 103.468 -2.555 7.003 475 HE2 PHE 497 HE2 PHE 497 106.033 -2.331 10.401 476 HZ PHE 497 HZ PHE 497 103.807 -2.756 9.435 477 H LYS 498 H LYS 498 109.273 1.509 6.174 478 HA LYS 498 HA LYS 498 110.622 2.052 3.742 479 HB2 LYS 498 HB2 LYS 498 112.124 3.394 5.053 480 HB3 LYS 498 HB3 LYS 498 110.497 3.618 5.681 481 HG2 LYS 498 HG2 LYS 498 111.465 3.290 7.669 482 HG3 LYS 498 HG3 LYS 498 111.373 1.581 7.239 483 HD2 LYS 498 HD2 LYS 498 113.609 1.442 6.750 484 HD3 LYS 498 HD3 LYS 498 113.730 3.150 6.320 485 HE2 LYS 498 HE2 LYS 498 113.417 3.689 8.746 486 HE3 LYS 498 HE3 LYS 498 113.539 1.964 9.083 487 HZ1 LYS 498 HZ1 LYS 498 115.621 3.642 9.051 488 HZ2 LYS 498 HZ2 LYS 498 115.682 3.047 7.468 489 HZ3 LYS 498 HZ3 LYS 498 115.746 1.977 8.775 490 H THR 499 H THR 499 110.912 -0.467 6.028 491 HA THR 499 HA THR 499 113.227 -1.518 4.588 492 HB THR 499 HB THR 499 113.878 -2.312 7.107 493 HG1 THR 499 HG1 THR 499 112.214 -0.460 7.648 494 HG21 THR 499 HG21 THR 499 114.911 -0.549 5.109 495 HG22 THR 499 HG22 THR 499 115.786 -1.501 6.309 496 HG23 THR 499 HG23 THR 499 115.236 0.127 6.706 497 HA PRO 500 HA PRO 500 111.024 -5.321 4.928 498 HB2 PRO 500 HB2 PRO 500 113.034 -7.110 4.703 499 HB3 PRO 500 HB3 PRO 500 112.502 -6.110 3.345 500 HG2 PRO 500 HG2 PRO 500 114.845 -5.738 5.169 501 HG3 PRO 500 HG3 PRO 500 114.757 -5.547 3.409 502 HD2 PRO 500 HD2 PRO 500 114.662 -3.446 5.139 503 HD3 PRO 500 HD3 PRO 500 113.854 -3.436 3.559 504 H GLU 501 H GLU 501 113.907 -5.014 6.970 505 HA GLU 501 HA GLU 501 113.296 -7.121 8.738 506 HB2 GLU 501 HB2 GLU 501 114.824 -4.652 9.533 507 HB3 GLU 501 HB3 GLU 501 115.033 -6.299 10.111 508 HG2 GLU 501 HG2 GLU 501 115.650 -6.799 7.633 509 HG3 GLU 501 HG3 GLU 501 115.938 -5.061 7.556 510 H ASP 502 H ASP 502 112.455 -3.695 8.744 511 HA ASP 502 HA ASP 502 111.403 -3.492 11.316 512 HB2 ASP 502 HB2 ASP 502 111.440 -1.902 8.944 513 HB3 ASP 502 HB3 ASP 502 109.793 -1.922 9.566 514 H ALA 503 H ALA 503 109.878 -4.551 8.306 515 HA ALA 503 HA ALA 503 107.268 -4.836 9.351 516 HB1 ALA 503 HB1 ALA 503 106.687 -5.814 7.324 517 HB2 ALA 503 HB2 ALA 503 108.294 -6.496 7.079 518 HB3 ALA 503 HB3 ALA 503 108.035 -4.762 6.892 519 H GLN 504 H GLN 504 110.010 -7.036 9.095 520 HA GLN 504 HA GLN 504 108.693 -9.400 9.836 521 HB2 GLN 504 HB2 GLN 504 110.766 -9.870 8.994 522 HB3 GLN 504 HB3 GLN 504 111.510 -8.463 9.740 523 HG2 GLN 504 HG2 GLN 504 111.463 -9.620 11.911 524 HG3 GLN 504 HG3 GLN 504 110.782 -11.040 11.118 525 HE21 GLN 504 HE21 GLN 504 112.272 -11.027 8.778 526 HE22 GLN 504 HE22 GLN 504 113.920 -11.379 9.160 527 H ALA 505 H ALA 505 110.332 -6.944 11.795 528 HA ALA 505 HA ALA 505 110.068 -8.290 14.257 529 HB1 ALA 505 HB1 ALA 505 111.466 -6.160 13.541 530 HB2 ALA 505 HB2 ALA 505 111.011 -6.459 15.218 531 HB3 ALA 505 HB3 ALA 505 110.080 -5.325 14.240 532 H VAL 506 H VAL 506 107.971 -5.957 12.616 533 HA VAL 506 HA VAL 506 106.167 -5.609 14.771 534 HB VAL 506 HB VAL 506 106.249 -3.968 13.013 535 HG11 VAL 506 HG11 VAL 506 106.858 -5.254 11.117 536 HG12 VAL 506 HG12 VAL 506 105.290 -4.533 10.758 537 HG13 VAL 506 HG13 VAL 506 105.394 -6.231 11.224 538 HG21 VAL 506 HG21 VAL 506 103.576 -4.852 12.349 539 HG22 VAL 506 HG22 VAL 506 104.099 -3.469 13.312 540 HG23 VAL 506 HG23 VAL 506 103.919 -5.052 14.067 541 H ILE 507 H ILE 507 106.129 -7.789 11.966 542 HA ILE 507 HA ILE 507 103.547 -8.820 12.356 543 HB ILE 507 HB ILE 507 104.283 -10.739 11.015 544 HG12 ILE 507 HG12 ILE 507 106.951 -9.646 10.480 545 HG13 ILE 507 HG13 ILE 507 106.744 -10.271 12.113 546 HG21 ILE 507 HG21 ILE 507 103.669 -9.210 9.483 547 HG22 ILE 507 HG22 ILE 507 105.399 -9.103 9.156 548 HG23 ILE 507 HG23 ILE 507 104.629 -7.934 10.229 549 HD11 ILE 507 HD11 ILE 507 107.628 -11.880 10.399 550 HD12 ILE 507 HD12 ILE 507 106.018 -11.854 9.677 551 HD13 ILE 507 HD13 ILE 507 106.234 -12.423 11.334 552 H ASN 508 H ASN 508 106.596 -9.587 13.833 553 HA ASN 508 HA ASN 508 105.807 -12.079 14.978 554 HB2 ASN 508 HB2 ASN 508 108.016 -10.139 15.689 555 HB3 ASN 508 HB3 ASN 508 107.790 -11.690 16.493 556 HD21 ASN 508 HD21 ASN 508 109.677 -10.276 14.372 557 HD22 ASN 508 HD22 ASN 508 110.011 -11.580 13.288 558 H ALA 509 H ALA 509 105.788 -8.734 16.001 559 HA ALA 509 HA ALA 509 104.847 -9.250 18.660 560 HB1 ALA 509 HB1 ALA 509 106.176 -7.228 17.943 561 HB2 ALA 509 HB2 ALA 509 104.754 -6.900 18.934 562 HB3 ALA 509 HB3 ALA 509 104.698 -6.627 17.192 563 H TYR 510 H TYR 510 103.400 -8.814 15.564 564 HA TYR 510 HA TYR 510 100.915 -7.803 16.163 565 HB2 TYR 510 HB2 TYR 510 102.101 -9.270 13.980 566 HB3 TYR 510 HB3 TYR 510 100.424 -9.753 14.228 567 HD1 TYR 510 HD1 TYR 510 99.438 -8.770 12.309 568 HD2 TYR 510 HD2 TYR 510 101.837 -6.412 14.909 569 HE1 TYR 510 HE1 TYR 510 98.688 -6.736 11.141 570 HE2 TYR 510 HE2 TYR 510 101.095 -4.369 13.751 571 HH TYR 510 HH TYR 510 98.471 -4.278 11.685 572 H THR 511 H THR 511 102.190 -10.821 17.167 573 HA THR 511 HA THR 511 99.995 -12.478 17.302 574 HB THR 511 HB THR 511 100.978 -13.395 19.413 575 HG1 THR 511 HG1 THR 511 102.836 -11.260 19.060 576 HG21 THR 511 HG21 THR 511 103.275 -12.968 17.566 577 HG22 THR 511 HG22 THR 511 101.833 -13.778 16.950 578 HG23 THR 511 HG23 THR 511 102.703 -14.449 18.331 579 H GLU 512 H GLU 512 100.838 -9.711 19.245 580 HA GLU 512 HA GLU 512 98.940 -9.964 21.290 581 HB2 GLU 512 HB2 GLU 512 99.422 -7.710 21.833 582 HB3 GLU 512 HB3 GLU 512 100.917 -8.385 21.196 583 HG2 GLU 512 HG2 GLU 512 100.289 -7.382 18.975 584 HG3 GLU 512 HG3 GLU 512 98.997 -6.529 19.819 585 H ILE 513 H ILE 513 98.560 -9.027 17.987 586 HA ILE 513 HA ILE 513 96.278 -7.402 18.213 587 HB ILE 513 HB ILE 513 96.917 -9.241 15.908 588 HG12 ILE 513 HG12 ILE 513 98.810 -7.711 16.671 589 HG13 ILE 513 HG13 ILE 513 98.306 -7.552 14.992 590 HG21 ILE 513 HG21 ILE 513 94.797 -8.420 15.504 591 HG22 ILE 513 HG22 ILE 513 95.814 -7.232 14.688 592 HG23 ILE 513 HG23 ILE 513 95.135 -6.870 16.275 593 HD11 ILE 513 HD11 ILE 513 96.756 -5.740 16.487 594 HD12 ILE 513 HD12 ILE 513 98.028 -5.388 15.317 595 HD13 ILE 513 HD13 ILE 513 98.426 -5.569 17.026 596 H ASN 514 H ASN 514 96.565 -10.921 17.688 597 HA ASN 514 HA ASN 514 93.872 -11.513 17.426 598 HB2 ASN 514 HB2 ASN 514 95.554 -13.176 16.961 599 HB3 ASN 514 HB3 ASN 514 96.108 -13.150 18.632 600 HD21 ASN 514 HD21 ASN 514 92.747 -13.038 17.698 601 HD22 ASN 514 HD22 ASN 514 92.328 -14.603 18.296 602 H LYS 515 H LYS 515 95.731 -10.808 20.294 603 HA LYS 515 HA LYS 515 94.041 -11.870 22.244 604 HB2 LYS 515 HB2 LYS 515 95.697 -9.348 22.438 605 HB3 LYS 515 HB3 LYS 515 95.082 -10.291 23.788 606 HG2 LYS 515 HG2 LYS 515 96.471 -12.186 23.085 607 HG3 LYS 515 HG3 LYS 515 97.104 -11.214 21.755 608 HD2 LYS 515 HD2 LYS 515 98.728 -10.642 23.191 609 HD3 LYS 515 HD3 LYS 515 97.516 -9.582 23.912 610 HE2 LYS 515 HE2 LYS 515 96.861 -11.622 25.325 611 HE3 LYS 515 HE3 LYS 515 98.398 -12.310 24.803 612 HZ1 LYS 515 HZ1 LYS 515 98.713 -11.224 26.888 613 HZ2 LYS 515 HZ2 LYS 515 97.999 -9.796 26.329 614 HZ3 LYS 515 HZ3 LYS 515 99.489 -10.296 25.704 615 H LYS 516 H LYS 516 93.809 -8.920 20.380 616 HA LYS 516 HA LYS 516 91.435 -8.117 21.908 617 HB2 LYS 516 HB2 LYS 516 93.435 -6.537 21.334 618 HB3 LYS 516 HB3 LYS 516 92.673 -6.447 19.752 619 HG2 LYS 516 HG2 LYS 516 91.899 -4.593 20.995 620 HG3 LYS 516 HG3 LYS 516 90.562 -5.743 20.915 621 HD2 LYS 516 HD2 LYS 516 92.416 -5.912 23.233 622 HD3 LYS 516 HD3 LYS 516 91.271 -4.571 23.186 623 HE2 LYS 516 HE2 LYS 516 89.925 -6.995 22.483 624 HE3 LYS 516 HE3 LYS 516 90.804 -7.236 23.992 625 HZ1 LYS 516 HZ1 LYS 516 89.686 -4.857 24.429 626 HZ2 LYS 516 HZ2 LYS 516 88.965 -6.323 24.868 627 HZ3 LYS 516 HZ3 LYS 516 88.508 -5.554 23.433 628 H HIS 517 H HIS 517 92.535 -8.438 18.540 629 HA HIS 517 HA HIS 517 89.925 -9.467 17.795 630 HB2 HIS 517 HB2 HIS 517 90.922 -7.308 16.014 631 HB3 HIS 517 HB3 HIS 517 89.270 -7.796 16.372 632 HD1 HIS 517 HD1 HIS 517 88.082 -6.620 18.301 633 HD2 HIS 517 HD2 HIS 517 92.040 -5.446 17.827 634 HE1 HIS 517 HE1 HIS 517 88.360 -4.588 19.758 635 HE2 HIS 517 HE2 HIS 517 90.780 -3.933 19.505 636 H CYS 518 H CYS 518 90.087 -11.003 16.276 637 HA CYS 518 HA CYS 518 92.555 -12.025 15.483 638 HB2 CYS 518 HB2 CYS 518 89.850 -12.753 15.201 639 HB3 CYS 518 HB3 CYS 518 90.508 -12.710 13.570 640 HG CYS 518 HG CYS 518 90.782 -15.060 14.995 641 H TRP 519 H TRP 519 93.990 -10.893 14.333 642 HA TRP 519 HA TRP 519 93.076 -9.712 11.792 643 HB2 TRP 519 HB2 TRP 519 93.840 -8.165 13.850 644 HB3 TRP 519 HB3 TRP 519 95.418 -8.476 13.128 645 HD1 TRP 519 HD1 TRP 519 93.171 -8.525 10.327 646 HE1 TRP 519 HE1 TRP 519 93.057 -6.264 9.146 647 HE3 TRP 519 HE3 TRP 519 95.316 -5.621 13.943 648 HZ2 TRP 519 HZ2 TRP 519 93.783 -3.553 9.675 649 HZ3 TRP 519 HZ3 TRP 519 95.570 -3.213 13.530 650 HH2 TRP 519 HH2 TRP 519 94.820 -2.204 11.440 651 H LYS 520 H LYS 520 94.306 -10.043 10.042 652 HA LYS 520 HA LYS 520 96.601 -11.852 10.367 653 HB2 LYS 520 HB2 LYS 520 95.256 -11.482 7.754 654 HB3 LYS 520 HB3 LYS 520 95.962 -12.934 8.450 655 HG2 LYS 520 HG2 LYS 520 93.430 -11.718 9.510 656 HG3 LYS 520 HG3 LYS 520 93.436 -12.883 8.183 657 HD2 LYS 520 HD2 LYS 520 93.835 -14.614 9.555 658 HD3 LYS 520 HD3 LYS 520 95.032 -13.715 10.490 659 HE2 LYS 520 HE2 LYS 520 93.547 -13.185 12.077 660 HE3 LYS 520 HE3 LYS 520 92.312 -12.754 10.895 661 HZ1 LYS 520 HZ1 LYS 520 92.349 -15.415 10.669 662 HZ2 LYS 520 HZ2 LYS 520 91.304 -14.573 11.698 663 HZ3 LYS 520 HZ3 LYS 520 92.731 -15.246 12.309 664 H LEU 521 H LEU 521 98.570 -11.244 9.675 665 HA LEU 521 HA LEU 521 98.780 -9.052 7.752 666 HB2 LEU 521 HB2 LEU 521 99.668 -7.603 9.177 667 HB3 LEU 521 HB3 LEU 521 99.247 -8.699 10.474 668 HG LEU 521 HG LEU 521 101.860 -8.991 9.032 669 HD11 LEU 521 HD11 LEU 521 102.788 -7.206 9.986 670 HD12 LEU 521 HD12 LEU 521 101.998 -7.516 11.531 671 HD13 LEU 521 HD13 LEU 521 101.141 -6.638 10.263 672 HD21 LEU 521 HD21 LEU 521 101.437 -9.463 11.935 673 HD22 LEU 521 HD22 LEU 521 102.477 -10.308 10.789 674 HD23 LEU 521 HD23 LEU 521 100.741 -10.615 10.795 675 H GLU 522 H GLU 522 99.783 -9.960 6.077 676 HA GLU 522 HA GLU 522 102.074 -11.736 6.619 677 HB2 GLU 522 HB2 GLU 522 100.503 -13.088 5.535 678 HB3 GLU 522 HB3 GLU 522 99.978 -11.790 4.472 679 HG2 GLU 522 HG2 GLU 522 101.877 -11.984 3.112 680 HG3 GLU 522 HG3 GLU 522 102.737 -12.951 4.310 681 H ILE 523 H ILE 523 103.997 -11.358 5.589 682 HA ILE 523 HA ILE 523 104.258 -8.757 4.303 683 HB ILE 523 HB ILE 523 106.469 -10.686 4.987 684 HG12 ILE 523 HG12 ILE 523 105.757 -8.319 6.681 685 HG13 ILE 523 HG13 ILE 523 104.888 -9.835 6.902 686 HG21 ILE 523 HG21 ILE 523 107.319 -8.030 5.169 687 HG22 ILE 523 HG22 ILE 523 106.351 -8.119 3.698 688 HG23 ILE 523 HG23 ILE 523 107.725 -9.202 3.916 689 HD11 ILE 523 HD11 ILE 523 107.139 -9.177 8.214 690 HD12 ILE 523 HD12 ILE 523 107.817 -10.056 6.844 691 HD13 ILE 523 HD13 ILE 523 106.634 -10.835 7.893 692 H LEU 524 H LEU 524 104.248 -8.542 2.168 693 HA LEU 524 HA LEU 524 104.209 -10.720 0.376 694 HB2 LEU 524 HB2 LEU 524 104.486 -7.754 0.063 695 HB3 LEU 524 HB3 LEU 524 104.734 -8.800 -1.323 696 HG LEU 524 HG LEU 524 102.517 -8.271 -1.574 697 HD11 LEU 524 HD11 LEU 524 102.903 -10.775 -1.256 698 HD12 LEU 524 HD12 LEU 524 101.244 -10.186 -1.160 699 HD13 LEU 524 HD13 LEU 524 102.130 -10.567 0.315 700 HD21 LEU 524 HD21 LEU 524 100.927 -8.016 0.282 701 HD22 LEU 524 HD22 LEU 524 102.304 -6.924 0.426 702 HD23 LEU 524 HD23 LEU 524 102.221 -8.377 1.425 703 H SER 525 H SER 525 105.781 -11.664 -0.854 704 HA SER 525 HA SER 525 108.492 -10.578 -0.741 705 HB2 SER 525 HB2 SER 525 107.858 -12.473 1.052 706 HB3 SER 525 HB3 SER 525 108.270 -13.512 -0.313 707 HG SER 525 HG SER 525 109.895 -12.078 1.315 708 H GLY 526 H GLY 526 109.975 -11.624 -2.256 709 HA2 GLY 526 HA2 GLY 526 110.482 -12.161 -4.431 710 HA3 GLY 526 HA3 GLY 526 109.335 -13.472 -4.191 711 H ASP 527 H ASP 527 108.672 -13.348 -6.366 712 HA ASP 527 HA ASP 527 107.920 -11.220 -7.859 713 HB2 ASP 527 HB2 ASP 527 107.172 -14.030 -7.755 714 HB3 ASP 527 HB3 ASP 527 105.849 -13.024 -8.337 715 H HIS 528 H HIS 528 106.237 -12.527 -5.089 716 HA HIS 528 HA HIS 528 103.770 -11.204 -5.466 717 HB2 HIS 528 HB2 HIS 528 104.664 -13.064 -3.713 718 HB3 HIS 528 HB3 HIS 528 104.681 -11.635 -2.685 719 HD1 HIS 528 HD1 HIS 528 102.750 -13.586 -1.745 720 HD2 HIS 528 HD2 HIS 528 101.772 -10.953 -4.807 721 HE1 HIS 528 HE1 HIS 528 100.238 -13.491 -1.774 722 HE2 HIS 528 HE2 HIS 528 99.667 -11.952 -3.684 723 H GLU 529 H GLU 529 106.680 -10.309 -3.610 724 HA GLU 529 HA GLU 529 105.626 -7.857 -2.654 725 HB2 GLU 529 HB2 GLU 529 107.715 -7.496 -1.723 726 HB3 GLU 529 HB3 GLU 529 107.702 -9.245 -1.874 727 HG2 GLU 529 HG2 GLU 529 108.949 -9.016 -4.004 728 HG3 GLU 529 HG3 GLU 529 109.053 -7.282 -3.708 729 H GLN 530 H GLN 530 107.724 -8.686 -5.382 730 HA GLN 530 HA GLN 530 108.057 -6.053 -6.337 731 HB2 GLN 530 HB2 GLN 530 109.275 -6.998 -8.006 732 HB3 GLN 530 HB3 GLN 530 109.192 -8.409 -6.964 733 HG2 GLN 530 HG2 GLN 530 108.641 -9.279 -9.021 734 HG3 GLN 530 HG3 GLN 530 107.056 -8.979 -8.308 735 HE21 GLN 530 HE21 GLN 530 105.942 -8.712 -10.184 736 HE22 GLN 530 HE22 GLN 530 106.204 -7.401 -11.279 737 H ARG 531 H ARG 531 105.617 -8.500 -6.879 738 HA ARG 531 HA ARG 531 104.305 -7.399 -9.078 739 HB2 ARG 531 HB2 ARG 531 103.796 -9.634 -8.335 740 HB3 ARG 531 HB3 ARG 531 103.237 -9.039 -6.777 741 HG2 ARG 531 HG2 ARG 531 101.741 -7.730 -8.801 742 HG3 ARG 531 HG3 ARG 531 101.750 -9.459 -9.151 743 HD2 ARG 531 HD2 ARG 531 101.290 -8.696 -6.336 744 HD3 ARG 531 HD3 ARG 531 100.006 -8.287 -7.473 745 HE ARG 531 HE ARG 531 100.768 -10.947 -7.904 746 HH11 ARG 531 HH11 ARG 531 99.197 -8.982 -5.498 747 HH12 ARG 531 HH12 ARG 531 98.229 -10.280 -4.883 748 HH21 ARG 531 HH21 ARG 531 99.504 -12.665 -7.100 749 HH22 ARG 531 HH22 ARG 531 98.404 -12.375 -5.794 750 H TYR 532 H TYR 532 103.475 -7.031 -5.617 751 HA TYR 532 HA TYR 532 101.428 -5.157 -6.046 752 HB2 TYR 532 HB2 TYR 532 101.665 -6.374 -3.935 753 HB3 TYR 532 HB3 TYR 532 103.173 -5.527 -3.602 754 HD1 TYR 532 HD1 TYR 532 103.091 -3.012 -3.291 755 HD2 TYR 532 HD2 TYR 532 99.596 -5.437 -3.327 756 HE1 TYR 532 HE1 TYR 532 101.838 -1.212 -2.180 757 HE2 TYR 532 HE2 TYR 532 98.333 -3.644 -2.214 758 HH TYR 532 HH TYR 532 98.562 -1.056 -2.061 759 H TRP 533 H TRP 533 104.880 -4.724 -5.364 760 HA TRP 533 HA TRP 533 104.851 -1.923 -5.167 761 HB2 TRP 533 HB2 TRP 533 106.920 -3.997 -5.649 762 HB3 TRP 533 HB3 TRP 533 107.329 -2.349 -6.114 763 HD1 TRP 533 HD1 TRP 533 107.608 -4.563 -3.258 764 HE1 TRP 533 HE1 TRP 533 107.944 -3.255 -1.069 765 HE3 TRP 533 HE3 TRP 533 106.287 0.099 -4.888 766 HZ2 TRP 533 HZ2 TRP 533 107.678 -0.601 -0.154 767 HZ3 TRP 533 HZ3 TRP 533 106.356 1.969 -3.291 768 HH2 TRP 533 HH2 TRP 533 107.040 1.624 -0.972 769 H GLN 534 H GLN 534 105.190 -4.087 -7.930 770 HA GLN 534 HA GLN 534 105.826 -2.210 -9.897 771 HB2 GLN 534 HB2 GLN 534 104.438 -4.866 -9.925 772 HB3 GLN 534 HB3 GLN 534 104.488 -3.899 -11.393 773 HG2 GLN 534 HG2 GLN 534 106.840 -4.936 -9.831 774 HG3 GLN 534 HG3 GLN 534 106.287 -5.485 -11.412 775 HE21 GLN 534 HE21 GLN 534 108.349 -3.423 -9.769 776 HE22 GLN 534 HE22 GLN 534 108.836 -2.429 -11.096 777 H LYS 535 H LYS 535 102.698 -3.301 -8.670 778 HA LYS 535 HA LYS 535 101.084 -1.804 -10.424 779 HB2 LYS 535 HB2 LYS 535 99.728 -3.289 -9.387 780 HB3 LYS 535 HB3 LYS 535 100.732 -3.345 -7.948 781 HG2 LYS 535 HG2 LYS 535 99.007 -0.962 -8.460 782 HG3 LYS 535 HG3 LYS 535 98.303 -2.444 -7.809 783 HD2 LYS 535 HD2 LYS 535 100.762 -1.694 -6.453 784 HD3 LYS 535 HD3 LYS 535 99.529 -0.434 -6.355 785 HE2 LYS 535 HE2 LYS 535 99.316 -3.308 -5.476 786 HE3 LYS 535 HE3 LYS 535 99.239 -1.861 -4.471 787 HZ1 LYS 535 HZ1 LYS 535 97.155 -3.177 -5.887 788 HZ2 LYS 535 HZ2 LYS 535 97.251 -1.550 -6.338 789 HZ3 LYS 535 HZ3 LYS 535 97.052 -1.965 -4.711 790 H ILE 536 H ILE 536 102.628 -1.044 -7.362 791 HA ILE 536 HA ILE 536 101.341 1.357 -6.756 792 HB ILE 536 HB ILE 536 104.203 0.552 -6.218 793 HG12 ILE 536 HG12 ILE 536 101.701 0.400 -4.523 794 HG13 ILE 536 HG13 ILE 536 102.582 -0.962 -5.207 795 HG21 ILE 536 HG21 ILE 536 103.890 2.987 -6.103 796 HG22 ILE 536 HG22 ILE 536 104.242 2.283 -4.525 797 HG23 ILE 536 HG23 ILE 536 102.591 2.752 -4.933 798 HD11 ILE 536 HD11 ILE 536 104.350 0.655 -3.639 799 HD12 ILE 536 HD12 ILE 536 103.912 -1.041 -3.444 800 HD13 ILE 536 HD13 ILE 536 102.926 0.215 -2.697 801 H LEU 537 H LEU 537 104.534 0.976 -8.314 802 HA LEU 537 HA LEU 537 104.961 3.593 -9.034 803 HB2 LEU 537 HB2 LEU 537 105.750 1.011 -10.345 804 HB3 LEU 537 HB3 LEU 537 106.207 2.551 -11.048 805 HG LEU 537 HG LEU 537 108.041 1.724 -9.736 806 HD11 LEU 537 HD11 LEU 537 108.362 3.572 -8.190 807 HD12 LEU 537 HD12 LEU 537 106.640 3.946 -8.257 808 HD13 LEU 537 HD13 LEU 537 107.641 4.139 -9.697 809 HD21 LEU 537 HD21 LEU 537 107.824 1.303 -7.331 810 HD22 LEU 537 HD22 LEU 537 106.805 0.218 -8.278 811 HD23 LEU 537 HD23 LEU 537 106.088 1.595 -7.441 812 H VAL 538 H VAL 538 103.316 1.089 -10.960 813 HA VAL 538 HA VAL 538 102.691 2.662 -13.176 814 HB VAL 538 HB VAL 538 101.048 0.412 -12.001 815 HG11 VAL 538 HG11 VAL 538 99.718 1.630 -13.572 816 HG12 VAL 538 HG12 VAL 538 100.260 0.146 -14.356 817 HG13 VAL 538 HG13 VAL 538 101.044 1.680 -14.735 818 HG21 VAL 538 HG21 VAL 538 103.578 0.130 -12.715 819 HG22 VAL 538 HG22 VAL 538 102.864 0.050 -14.326 820 HG23 VAL 538 HG23 VAL 538 102.371 -1.102 -13.084 821 H ASP 539 H ASP 539 101.009 2.233 -10.105 822 HA ASP 539 HA ASP 539 98.690 3.704 -10.766 823 HB2 ASP 539 HB2 ASP 539 99.225 2.135 -8.723 824 HB3 ASP 539 HB3 ASP 539 99.767 3.632 -7.970 825 H ARG 540 H ARG 540 101.821 4.587 -9.430 826 HA ARG 540 HA ARG 540 101.230 7.251 -8.749 827 HB2 ARG 540 HB2 ARG 540 103.840 5.955 -9.551 828 HB3 ARG 540 HB3 ARG 540 103.709 7.587 -8.911 829 HG2 ARG 540 HG2 ARG 540 102.357 5.726 -7.189 830 HG3 ARG 540 HG3 ARG 540 104.020 5.214 -7.478 831 HD2 ARG 540 HD2 ARG 540 104.112 7.991 -7.061 832 HD3 ARG 540 HD3 ARG 540 103.032 7.344 -5.825 833 HE ARG 540 HE ARG 540 104.832 6.347 -4.822 834 HH11 ARG 540 HH11 ARG 540 105.718 7.322 -8.046 835 HH12 ARG 540 HH12 ARG 540 107.397 6.957 -7.835 836 HH21 ARG 540 HH21 ARG 540 107.042 5.870 -4.528 837 HH22 ARG 540 HH22 ARG 540 108.151 6.130 -5.832 838 H GLN 541 H GLN 541 102.407 5.774 -11.738 839 HA GLN 541 HA GLN 541 102.870 8.160 -13.158 840 HB2 GLN 541 HB2 GLN 541 101.918 5.678 -14.538 841 HB3 GLN 541 HB3 GLN 541 103.147 6.830 -15.045 842 HG2 GLN 541 HG2 GLN 541 103.355 4.607 -13.059 843 HG3 GLN 541 HG3 GLN 541 104.358 4.939 -14.470 844 HE21 GLN 541 HE21 GLN 541 105.757 4.423 -12.357 845 HE22 GLN 541 HE22 GLN 541 106.405 5.840 -11.611 846 H ALA 542 H ALA 542 100.019 6.108 -12.820 847 HA ALA 542 HA ALA 542 98.367 7.423 -14.663 848 HB1 ALA 542 HB1 ALA 542 98.097 5.253 -12.995 849 HB2 ALA 542 HB2 ALA 542 96.835 5.926 -14.027 850 HB3 ALA 542 HB3 ALA 542 96.942 6.410 -12.334 851 H LYS 543 H LYS 543 99.100 8.075 -11.285 852 HA LYS 543 HA LYS 543 97.213 9.780 -10.435 853 HB2 LYS 543 HB2 LYS 543 98.731 10.578 -8.927 854 HB3 LYS 543 HB3 LYS 543 99.652 9.207 -9.527 855 HG2 LYS 543 HG2 LYS 543 100.934 10.636 -10.977 856 HG3 LYS 543 HG3 LYS 543 99.932 12.024 -10.553 857 HD2 LYS 543 HD2 LYS 543 101.316 12.469 -8.871 858 HD3 LYS 543 HD3 LYS 543 100.870 10.931 -8.130 859 HE2 LYS 543 HE2 LYS 543 102.927 10.176 -8.474 860 HE3 LYS 543 HE3 LYS 543 102.702 10.371 -10.211 861 HZ1 LYS 543 HZ1 LYS 543 104.580 11.636 -9.678 862 HZ2 LYS 543 HZ2 LYS 543 103.870 12.295 -8.291 863 HZ3 LYS 543 HZ3 LYS 543 103.339 12.777 -9.822 864 H LEU 544 H LEU 544 99.536 10.440 -12.973 865 HA LEU 544 HA LEU 544 99.468 13.121 -13.317 866 HB2 LEU 544 HB2 LEU 544 100.682 11.656 -14.818 867 HB3 LEU 544 HB3 LEU 544 99.181 11.017 -15.462 868 HG LEU 544 HG LEU 544 98.655 13.237 -16.406 869 HD11 LEU 544 HD11 LEU 544 100.928 13.998 -14.773 870 HD12 LEU 544 HD12 LEU 544 99.667 14.997 -15.492 871 HD13 LEU 544 HD13 LEU 544 101.085 14.549 -16.440 872 HD21 LEU 544 HD21 LEU 544 100.266 11.346 -17.428 873 HD22 LEU 544 HD22 LEU 544 101.366 12.724 -17.448 874 HD23 LEU 544 HD23 LEU 544 99.821 12.819 -18.293 875 H ASN 545 H ASN 545 96.862 10.871 -14.014 876 HA ASN 545 HA ASN 545 95.180 12.917 -15.172 877 HB2 ASN 545 HB2 ASN 545 94.433 10.108 -14.338 878 HB3 ASN 545 HB3 ASN 545 93.529 11.166 -15.417 879 HD21 ASN 545 HD21 ASN 545 95.431 12.151 -17.057 880 HD22 ASN 545 HD22 ASN 545 96.160 10.876 -17.968 881 H GLN 546 H GLN 546 94.882 14.450 -13.568 882 HA GLN 546 HA GLN 546 94.308 14.050 -10.900 883 HB2 GLN 546 HB2 GLN 546 94.003 16.226 -12.820 884 HB3 GLN 546 HB3 GLN 546 92.784 16.266 -11.554 885 HG2 GLN 546 HG2 GLN 546 94.609 16.148 -9.874 886 HG3 GLN 546 HG3 GLN 546 95.770 16.282 -11.195 887 HE21 GLN 546 HE21 GLN 546 96.344 18.175 -9.778 888 HE22 GLN 546 HE22 GLN 546 95.568 19.677 -10.133 889 HA PRO 547 HA PRO 547 90.255 12.209 -11.163 890 HB2 PRO 547 HB2 PRO 547 89.926 11.726 -8.549 891 HB3 PRO 547 HB3 PRO 547 91.091 10.810 -9.515 892 HG2 PRO 547 HG2 PRO 547 91.564 13.094 -7.641 893 HG3 PRO 547 HG3 PRO 547 92.504 11.606 -7.853 894 HD2 PRO 547 HD2 PRO 547 93.170 14.037 -8.965 895 HD3 PRO 547 HD3 PRO 547 93.686 12.467 -9.609 896 H ARG 548 H ARG 548 88.236 12.469 -9.485 897 HA ARG 548 HA ARG 548 87.746 15.370 -9.337 898 HB2 ARG 548 HB2 ARG 548 85.500 13.407 -9.420 899 HB3 ARG 548 HB3 ARG 548 85.565 15.058 -10.021 900 HG2 ARG 548 HG2 ARG 548 86.739 14.422 -11.955 901 HG3 ARG 548 HG3 ARG 548 87.122 12.831 -11.293 902 HD2 ARG 548 HD2 ARG 548 84.995 12.018 -11.656 903 HD3 ARG 548 HD3 ARG 548 84.266 13.623 -11.639 904 HE ARG 548 HE ARG 548 85.440 12.266 -13.900 905 HH11 ARG 548 HH11 ARG 548 84.430 15.312 -12.549 906 HH12 ARG 548 HH12 ARG 548 84.259 16.087 -14.088 907 HH21 ARG 548 HH21 ARG 548 85.216 13.274 -15.933 908 HH22 ARG 548 HH22 ARG 548 84.705 14.926 -16.014 909 H GLU 549 H GLU 549 85.414 15.343 -7.861 910 HA GLU 549 HA GLU 549 84.540 15.134 -5.755 911 HB2 GLU 549 HB2 GLU 549 85.362 12.715 -5.984 912 HB3 GLU 549 HB3 GLU 549 86.765 13.227 -5.055 913 HG2 GLU 549 HG2 GLU 549 85.647 12.986 -3.166 914 HG3 GLU 549 HG3 GLU 549 84.399 14.100 -3.723 915 H LYS 550 H LYS 550 85.244 17.333 -5.544 916 HA LYS 550 HA LYS 550 87.775 17.793 -4.173 917 HB2 LYS 550 HB2 LYS 550 85.890 20.029 -4.680 918 HB3 LYS 550 HB3 LYS 550 87.638 19.968 -4.860 919 HG2 LYS 550 HG2 LYS 550 87.315 18.589 -6.904 920 HG3 LYS 550 HG3 LYS 550 85.577 18.851 -6.746 921 HD2 LYS 550 HD2 LYS 550 86.005 20.604 -8.106 922 HD3 LYS 550 HD3 LYS 550 86.446 21.391 -6.589 923 HE2 LYS 550 HE2 LYS 550 88.652 21.396 -7.082 924 HE3 LYS 550 HE3 LYS 550 88.580 19.831 -7.891 925 HZ1 LYS 550 HZ1 LYS 550 88.564 20.871 -9.828 926 HZ2 LYS 550 HZ2 LYS 550 88.645 22.371 -9.052 927 HZ3 LYS 550 HZ3 LYS 550 87.142 21.688 -9.417 928 H LYS 551 H LYS 551 87.766 19.340 -2.311 929 HA LYS 551 HA LYS 551 87.313 19.483 -0.063 930 HB2 LYS 551 HB2 LYS 551 84.636 20.236 -1.251 931 HB3 LYS 551 HB3 LYS 551 85.171 20.623 0.379 932 HG2 LYS 551 HG2 LYS 551 86.776 22.143 -0.382 933 HG3 LYS 551 HG3 LYS 551 86.712 21.517 -2.030 934 HD2 LYS 551 HD2 LYS 551 84.100 22.337 -1.395 935 HD3 LYS 551 HD3 LYS 551 85.173 23.616 -0.824 936 HE2 LYS 551 HE2 LYS 551 85.747 24.232 -2.905 937 HE3 LYS 551 HE3 LYS 551 85.851 22.565 -3.472 938 HZ1 LYS 551 HZ1 LYS 551 84.072 23.387 -4.650 939 HZ2 LYS 551 HZ2 LYS 551 83.509 24.345 -3.375 940 HZ3 LYS 551 HZ3 LYS 551 83.289 22.668 -3.333 941 H ARG 552 H ARG 552 87.448 17.452 0.804 942 HA ARG 552 HA ARG 552 85.046 15.772 0.777 943 HB2 ARG 552 HB2 ARG 552 87.698 15.129 0.435 944 HB3 ARG 552 HB3 ARG 552 87.428 14.715 2.122 945 HG2 ARG 552 HG2 ARG 552 85.227 13.665 0.806 946 HG3 ARG 552 HG3 ARG 552 86.583 13.345 -0.278 947 HD2 ARG 552 HD2 ARG 552 87.313 12.805 2.454 948 HD3 ARG 552 HD3 ARG 552 85.856 11.913 2.015 949 HE ARG 552 HE ARG 552 87.903 11.702 0.033 950 HH11 ARG 552 HH11 ARG 552 86.805 10.456 3.095 951 HH12 ARG 552 HH12 ARG 552 87.587 8.923 2.898 952 HH21 ARG 552 HH21 ARG 552 88.938 9.687 -0.235 953 HH22 ARG 552 HH22 ARG 552 88.800 8.486 1.005 954 H GLY 553 H GLY 553 87.092 17.652 2.878 955 HA2 GLY 553 HA2 GLY 553 85.401 18.261 4.849 956 HA3 GLY 553 HA3 GLY 553 85.833 16.616 5.289 957 H THR 554 H THR 554 88.300 16.231 5.265 958 HA THR 554 HA THR 554 89.600 18.547 6.546 959 HB THR 554 HB THR 554 90.886 16.961 7.918 960 HG1 THR 554 HG1 THR 554 89.196 14.986 6.743 961 HG21 THR 554 HG21 THR 554 89.297 16.890 9.509 962 HG22 THR 554 HG22 THR 554 88.163 16.015 8.479 963 HG23 THR 554 HG23 THR 554 88.323 17.764 8.326 964 H GLU 555 H GLU 555 90.376 19.102 4.386 965 HA GLU 555 HA GLU 555 91.817 17.635 2.626 966 HB2 GLU 555 HB2 GLU 555 91.316 20.199 2.714 967 HB3 GLU 555 HB3 GLU 555 92.912 20.303 3.443 968 HG2 GLU 555 HG2 GLU 555 92.854 18.682 1.024 969 HG3 GLU 555 HG3 GLU 555 92.362 20.356 0.764 970 H LYS 556 H LYS 556 93.947 16.974 2.349 971 HA LYS 556 HA LYS 556 95.687 17.136 4.713 972 HB2 LYS 556 HB2 LYS 556 94.450 14.909 4.458 973 HB3 LYS 556 HB3 LYS 556 95.451 14.644 3.037 974 HG2 LYS 556 HG2 LYS 556 97.389 15.203 4.750 975 HG3 LYS 556 HG3 LYS 556 96.185 14.633 5.908 976 HD2 LYS 556 HD2 LYS 556 96.970 12.588 5.428 977 HD3 LYS 556 HD3 LYS 556 96.034 12.739 3.940 978 HE2 LYS 556 HE2 LYS 556 98.936 13.486 4.290 979 HE3 LYS 556 HE3 LYS 556 98.334 12.033 3.491 980 HZ1 LYS 556 HZ1 LYS 556 98.760 13.502 1.763 981 HZ2 LYS 556 HZ2 LYS 556 98.143 14.840 2.594 982 HZ3 LYS 556 HZ3 LYS 556 97.090 13.661 1.991 983 H LEU 557 H LEU 557 97.579 18.005 4.207 984 HA LEU 557 HA LEU 557 98.466 17.941 1.412 985 HB2 LEU 557 HB2 LEU 557 98.275 20.033 3.146 986 HB3 LEU 557 HB3 LEU 557 99.959 19.584 3.343 987 HG LEU 557 HG LEU 557 99.171 19.752 0.542 988 HD11 LEU 557 HD11 LEU 557 97.684 21.487 1.567 989 HD12 LEU 557 HD12 LEU 557 98.850 22.104 0.396 990 HD13 LEU 557 HD13 LEU 557 99.140 22.312 2.123 991 HD21 LEU 557 HD21 LEU 557 101.386 19.941 0.529 992 HD22 LEU 557 HD22 LEU 557 101.433 20.261 2.262 993 HD23 LEU 557 HD23 LEU 557 101.179 21.587 1.128 994 H ILE 558 H ILE 558 100.684 17.501 0.908 995 HA ILE 558 HA ILE 558 101.751 15.327 2.459 996 HB ILE 558 HB ILE 558 103.627 15.472 0.701 997 HG12 ILE 558 HG12 ILE 558 101.787 16.839 -1.127 998 HG13 ILE 558 HG13 ILE 558 102.434 17.888 0.131 999 HG21 ILE 558 HG21 ILE 558 102.417 14.114 -0.758 1000 HG22 ILE 558 HG22 ILE 558 100.910 14.982 -0.468 1001 HG23 ILE 558 HG23 ILE 558 101.578 13.933 0.783 1002 HD11 ILE 558 HD11 ILE 558 104.486 16.239 -1.077 1003 HD12 ILE 558 HD12 ILE 558 104.418 17.987 -0.856 1004 HD13 ILE 558 HD13 ILE 558 103.646 17.244 -2.257 1005 H THR 559 H THR 559 104.400 15.457 2.402 1006 HA THR 559 HA THR 559 105.257 16.718 4.598 1007 HB THR 559 HB THR 559 107.425 17.130 2.877 1008 HG1 THR 559 HG1 THR 559 106.601 16.037 1.162 1009 HG21 THR 559 HG21 THR 559 107.977 14.721 3.804 1010 HG22 THR 559 HG22 THR 559 106.563 15.038 4.808 1011 HG23 THR 559 HG23 THR 559 107.949 16.128 4.867 1012 H LYS 560 H LYS 560 106.532 18.652 5.014 1013 HA LYS 560 HA LYS 560 105.859 20.901 3.239 1014 HB2 LYS 560 HB2 LYS 560 105.762 22.230 5.485 1015 HB3 LYS 560 HB3 LYS 560 104.361 21.309 4.955 1016 HG2 LYS 560 HG2 LYS 560 104.654 19.682 6.563 1017 HG3 LYS 560 HG3 LYS 560 106.371 20.044 6.765 1018 HD2 LYS 560 HD2 LYS 560 105.656 22.274 7.718 1019 HD3 LYS 560 HD3 LYS 560 104.011 21.636 7.748 1020 HE2 LYS 560 HE2 LYS 560 104.560 20.942 9.813 1021 HE3 LYS 560 HE3 LYS 560 105.369 19.628 8.961 1022 HZ1 LYS 560 HZ1 LYS 560 107.107 20.334 10.182 1023 HZ2 LYS 560 HZ2 LYS 560 106.505 21.903 10.369 1024 HZ3 LYS 560 HZ3 LYS 560 107.283 21.461 8.934 1025 H ALA 561 H ALA 561 107.943 20.874 2.364 1026 HA ALA 561 HA ALA 561 109.978 22.026 4.128 1027 HB1 ALA 561 HB1 ALA 561 110.192 19.432 3.612 1028 HB2 ALA 561 HB2 ALA 561 111.602 20.487 3.708 1029 HB3 ALA 561 HB3 ALA 561 110.938 20.047 2.136 Start of MODEL 8 1 H1 MET 437 HT1 MET 437 117.127 -25.459 -17.332 2 H2 MET 437 HT2 MET 437 118.826 -25.231 -17.238 3 H3 MET 437 HT3 MET 437 117.762 -23.931 -16.884 4 HA MET 437 HA MET 437 117.199 -24.720 -14.884 5 HB2 MET 437 HB2 MET 437 117.049 -27.005 -14.316 6 HB3 MET 437 HB3 MET 437 116.526 -26.922 -15.993 7 HG2 MET 437 HG2 MET 437 119.006 -27.461 -16.525 8 HG3 MET 437 HG3 MET 437 119.054 -28.022 -14.854 9 HE1 MET 437 HE1 MET 437 117.748 -29.676 -18.580 10 HE2 MET 437 HE2 MET 437 119.018 -30.608 -17.785 11 HE3 MET 437 HE3 MET 437 119.191 -28.864 -17.973 12 H HIS 438 H HIS 438 118.484 -24.505 -13.114 13 HA HIS 438 HA HIS 438 120.928 -25.606 -12.577 14 HB2 HIS 438 HB2 HIS 438 121.123 -23.495 -14.586 15 HB3 HIS 438 HB3 HIS 438 122.143 -23.194 -13.183 16 HD1 HIS 438 HD1 HIS 438 123.004 -24.074 -16.188 17 HD2 HIS 438 HD2 HIS 438 122.997 -26.415 -12.754 18 HE1 HIS 438 HE1 HIS 438 124.661 -25.916 -16.626 19 HE2 HIS 438 HE2 HIS 438 124.701 -27.272 -14.502 20 H HIS 439 H HIS 439 120.463 -22.097 -12.618 21 HA HIS 439 HA HIS 439 120.069 -20.583 -10.962 22 HB2 HIS 439 HB2 HIS 439 118.186 -22.323 -10.467 23 HB3 HIS 439 HB3 HIS 439 119.200 -22.770 -9.099 24 HD1 HIS 439 HD1 HIS 439 118.217 -21.735 -7.084 25 HD2 HIS 439 HD2 HIS 439 118.113 -19.161 -10.345 26 HE1 HIS 439 HE1 HIS 439 117.265 -19.578 -6.208 27 HE2 HIS 439 HE2 HIS 439 117.170 -18.049 -8.210 28 H HIS 440 H HIS 440 122.619 -21.287 -11.242 29 HA HIS 440 HA HIS 440 123.674 -20.940 -8.583 30 HB2 HIS 440 HB2 HIS 440 123.413 -23.492 -9.079 31 HB3 HIS 440 HB3 HIS 440 124.824 -23.255 -10.106 32 HD1 HIS 440 HD1 HIS 440 123.991 -22.103 -6.565 33 HD2 HIS 440 HD2 HIS 440 126.992 -24.023 -8.705 34 HE1 HIS 440 HE1 HIS 440 125.814 -22.569 -4.897 35 HE2 HIS 440 HE2 HIS 440 127.585 -23.803 -6.196 36 H HIS 441 H HIS 441 123.688 -19.186 -10.672 37 HA HIS 441 HA HIS 441 126.429 -18.572 -10.934 38 HB2 HIS 441 HB2 HIS 441 125.746 -20.500 -12.720 39 HB3 HIS 441 HB3 HIS 441 125.404 -19.052 -13.661 40 HD1 HIS 441 HD1 HIS 441 127.365 -19.337 -15.260 41 HD2 HIS 441 HD2 HIS 441 128.501 -19.212 -11.265 42 HE1 HIS 441 HE1 HIS 441 129.870 -19.121 -15.281 43 HE2 HIS 441 HE2 HIS 441 130.528 -18.968 -12.853 44 H HIS 442 H HIS 442 126.621 -16.875 -12.919 45 HA HIS 442 HA HIS 442 124.299 -15.077 -12.662 46 HB2 HIS 442 HB2 HIS 442 127.218 -14.303 -12.881 47 HB3 HIS 442 HB3 HIS 442 125.864 -13.185 -12.771 48 HD1 HIS 442 HD1 HIS 442 126.620 -16.247 -10.644 49 HD2 HIS 442 HD2 HIS 442 126.102 -12.140 -10.284 50 HE1 HIS 442 HE1 HIS 442 126.722 -15.771 -8.178 51 HE2 HIS 442 HE2 HIS 442 126.502 -13.268 -7.991 52 H HIS 443 H HIS 443 123.273 -14.848 -14.530 53 HA HIS 443 HA HIS 443 124.780 -14.353 -16.961 54 HB2 HIS 443 HB2 HIS 443 123.292 -16.856 -16.442 55 HB3 HIS 443 HB3 HIS 443 123.002 -16.106 -18.008 56 HD1 HIS 443 HD1 HIS 443 124.473 -18.831 -17.689 57 HD2 HIS 443 HD2 HIS 443 126.349 -15.145 -18.082 58 HE1 HIS 443 HE1 HIS 443 126.771 -19.339 -18.576 59 HE2 HIS 443 HE2 HIS 443 127.859 -17.087 -18.882 60 H SER 444 H SER 444 121.579 -14.812 -15.502 61 HA SER 444 HA SER 444 120.586 -12.638 -17.226 62 HB2 SER 444 HB2 SER 444 118.368 -13.631 -17.089 63 HB3 SER 444 HB3 SER 444 119.516 -14.832 -17.677 64 HG SER 444 HG SER 444 118.011 -14.826 -15.402 65 H ASN 445 H ASN 445 121.395 -11.153 -15.607 66 HA ASN 445 HA ASN 445 119.811 -11.100 -13.130 67 HB2 ASN 445 HB2 ASN 445 122.577 -10.385 -13.784 68 HB3 ASN 445 HB3 ASN 445 121.741 -9.152 -12.847 69 HD21 ASN 445 HD21 ASN 445 123.465 -11.999 -12.715 70 HD22 ASN 445 HD22 ASN 445 123.112 -12.451 -11.086 71 H ALA 446 H ALA 446 118.107 -10.332 -14.777 72 HA ALA 446 HA ALA 446 118.253 -7.394 -14.934 73 HB1 ALA 446 HB1 ALA 446 116.779 -7.566 -16.952 74 HB2 ALA 446 HB2 ALA 446 117.074 -9.305 -16.940 75 HB3 ALA 446 HB3 ALA 446 118.415 -8.184 -17.172 76 H THR 447 H THR 447 117.255 -8.593 -12.683 77 HA THR 447 HA THR 447 114.334 -8.361 -12.979 78 HB THR 447 HB THR 447 114.065 -9.684 -11.004 79 HG1 THR 447 HG1 THR 447 116.874 -9.382 -10.732 80 HG21 THR 447 HG21 THR 447 115.609 -10.652 -13.253 81 HG22 THR 447 HG22 THR 447 114.288 -11.427 -12.377 82 HG23 THR 447 HG23 THR 447 115.945 -11.577 -11.790 83 H GLY 448 H GLY 448 115.594 -5.980 -12.954 84 HA2 GLY 448 HA2 GLY 448 115.722 -3.962 -11.863 85 HA3 GLY 448 HA3 GLY 448 114.394 -4.574 -10.888 86 HA PRO 449 HA PRO 449 118.717 -5.126 -8.676 87 HB2 PRO 449 HB2 PRO 449 120.127 -2.810 -8.820 88 HB3 PRO 449 HB3 PRO 449 120.340 -4.138 -9.966 89 HG2 PRO 449 HG2 PRO 449 118.748 -1.619 -10.260 90 HG3 PRO 449 HG3 PRO 449 119.821 -2.406 -11.432 91 HD2 PRO 449 HD2 PRO 449 117.132 -2.657 -11.538 92 HD3 PRO 449 HD3 PRO 449 118.228 -3.961 -12.037 93 H GLN 450 H GLN 450 117.722 -5.074 -6.737 94 HA GLN 450 HA GLN 450 116.539 -4.252 -4.933 95 HB2 GLN 450 HB2 GLN 450 118.984 -2.508 -5.170 96 HB3 GLN 450 HB3 GLN 450 117.907 -2.434 -3.783 97 HG2 GLN 450 HG2 GLN 450 118.510 -5.149 -4.175 98 HG3 GLN 450 HG3 GLN 450 120.029 -4.266 -4.333 99 HE21 GLN 450 HE21 GLN 450 117.132 -3.954 -2.301 100 HE22 GLN 450 HE22 GLN 450 117.984 -3.890 -0.800 101 H PHE 451 H PHE 451 114.697 -3.515 -6.226 102 HA PHE 451 HA PHE 451 114.570 -0.657 -6.768 103 HB2 PHE 451 HB2 PHE 451 112.500 -1.103 -7.891 104 HB3 PHE 451 HB3 PHE 451 113.644 -2.350 -8.375 105 HD1 PHE 451 HD1 PHE 451 110.865 -2.807 -8.876 106 HD2 PHE 451 HD2 PHE 451 113.074 -3.469 -5.298 107 HE1 PHE 451 HE1 PHE 451 109.254 -4.541 -8.207 108 HE2 PHE 451 HE2 PHE 451 111.468 -5.205 -4.624 109 HZ PHE 451 HZ PHE 451 109.555 -5.745 -6.079 110 H VAL 452 H VAL 452 114.913 -0.880 -4.159 111 HA VAL 452 HA VAL 452 113.905 -0.884 -2.033 112 HB VAL 452 HB VAL 452 114.320 1.409 -2.531 113 HG11 VAL 452 HG11 VAL 452 112.547 2.787 -3.689 114 HG12 VAL 452 HG12 VAL 452 111.804 1.263 -4.172 115 HG13 VAL 452 HG13 VAL 452 113.437 1.658 -4.710 116 HG21 VAL 452 HG21 VAL 452 113.027 2.254 -0.895 117 HG22 VAL 452 HG22 VAL 452 112.416 0.605 -0.767 118 HG23 VAL 452 HG23 VAL 452 111.528 1.803 -1.709 119 H SER 453 H SER 453 112.549 -2.777 -2.143 120 HA SER 453 HA SER 453 109.870 -2.626 -3.091 121 HB2 SER 453 HB2 SER 453 109.823 -4.854 -2.733 122 HB3 SER 453 HB3 SER 453 111.558 -4.671 -2.477 123 HG SER 453 HG SER 453 111.294 -4.953 -0.387 124 H GLY 454 H GLY 454 110.820 -0.748 -0.777 125 HA2 GLY 454 HA2 GLY 454 110.058 -0.097 1.330 126 HA3 GLY 454 HA3 GLY 454 108.586 0.011 0.383 127 H VAL 455 H VAL 455 110.120 -3.042 1.193 128 HA VAL 455 HA VAL 455 109.083 -4.915 2.072 129 HB VAL 455 HB VAL 455 108.600 -3.432 4.584 130 HG11 VAL 455 HG11 VAL 455 108.775 -5.998 4.084 131 HG12 VAL 455 HG12 VAL 455 109.432 -5.329 5.577 132 HG13 VAL 455 HG13 VAL 455 110.506 -5.697 4.228 133 HG21 VAL 455 HG21 VAL 455 111.312 -3.631 4.688 134 HG22 VAL 455 HG22 VAL 455 110.426 -2.143 4.354 135 HG23 VAL 455 HG23 VAL 455 111.062 -3.108 3.023 136 H ILE 456 H ILE 456 107.128 -5.068 0.923 137 HA ILE 456 HA ILE 456 104.786 -3.630 1.677 138 HB ILE 456 HB ILE 456 104.865 -6.219 0.136 139 HG12 ILE 456 HG12 ILE 456 106.439 -4.611 -0.857 140 HG13 ILE 456 HG13 ILE 456 105.040 -4.862 -1.897 141 HG21 ILE 456 HG21 ILE 456 102.938 -3.993 -0.330 142 HG22 ILE 456 HG22 ILE 456 102.693 -5.074 1.042 143 HG23 ILE 456 HG23 ILE 456 102.744 -5.726 -0.597 144 HD11 ILE 456 HD11 ILE 456 104.211 -2.728 -0.479 145 HD12 ILE 456 HD12 ILE 456 105.070 -2.625 -2.016 146 HD13 ILE 456 HD13 ILE 456 105.952 -2.447 -0.499 147 H VAL 457 H VAL 457 103.425 -4.007 3.288 148 HA VAL 457 HA VAL 457 103.507 -6.640 4.612 149 HB VAL 457 HB VAL 457 102.847 -3.935 5.781 150 HG11 VAL 457 HG11 VAL 457 101.395 -5.816 6.605 151 HG12 VAL 457 HG12 VAL 457 102.349 -5.002 7.845 152 HG13 VAL 457 HG13 VAL 457 102.859 -6.575 7.229 153 HG21 VAL 457 HG21 VAL 457 105.091 -5.884 6.299 154 HG22 VAL 457 HG22 VAL 457 104.776 -4.436 7.256 155 HG23 VAL 457 HG23 VAL 457 105.221 -4.289 5.555 156 H LYS 458 H LYS 458 101.862 -7.681 3.508 157 HA LYS 458 HA LYS 458 99.381 -6.400 2.913 158 HB2 LYS 458 HB2 LYS 458 100.248 -8.280 1.569 159 HB3 LYS 458 HB3 LYS 458 100.027 -9.352 2.946 160 HG2 LYS 458 HG2 LYS 458 97.599 -8.811 2.896 161 HG3 LYS 458 HG3 LYS 458 97.883 -7.905 1.411 162 HD2 LYS 458 HD2 LYS 458 98.854 -10.017 0.440 163 HD3 LYS 458 HD3 LYS 458 98.253 -10.857 1.872 164 HE2 LYS 458 HE2 LYS 458 96.046 -9.469 1.070 165 HE3 LYS 458 HE3 LYS 458 96.809 -9.851 -0.474 166 HZ1 LYS 458 HZ1 LYS 458 96.074 -11.917 -0.312 167 HZ2 LYS 458 HZ2 LYS 458 95.274 -11.527 1.126 168 HZ3 LYS 458 HZ3 LYS 458 96.853 -12.131 1.177 169 H ILE 459 H ILE 459 97.888 -5.898 4.337 170 HA ILE 459 HA ILE 459 97.530 -7.628 6.693 171 HB ILE 459 HB ILE 459 96.847 -4.701 6.403 172 HG12 ILE 459 HG12 ILE 459 98.970 -6.152 7.994 173 HG13 ILE 459 HG13 ILE 459 99.228 -5.016 6.673 174 HG21 ILE 459 HG21 ILE 459 96.390 -4.938 8.898 175 HG22 ILE 459 HG22 ILE 459 96.343 -6.679 8.613 176 HG23 ILE 459 HG23 ILE 459 95.192 -5.621 7.800 177 HD11 ILE 459 HD11 ILE 459 97.774 -3.518 8.421 178 HD12 ILE 459 HD12 ILE 459 99.534 -3.522 8.299 179 HD13 ILE 459 HD13 ILE 459 98.732 -4.527 9.505 180 H ILE 460 H ILE 460 95.706 -8.734 6.810 181 HA ILE 460 HA ILE 460 93.330 -7.698 5.420 182 HB ILE 460 HB ILE 460 94.408 -9.518 4.072 183 HG12 ILE 460 HG12 ILE 460 91.815 -8.943 4.382 184 HG13 ILE 460 HG13 ILE 460 92.372 -10.230 3.318 185 HG21 ILE 460 HG21 ILE 460 93.817 -11.867 5.017 186 HG22 ILE 460 HG22 ILE 460 93.874 -11.044 6.574 187 HG23 ILE 460 HG23 ILE 460 95.295 -11.055 5.533 188 HD11 ILE 460 HD11 ILE 460 91.316 -10.532 6.117 189 HD12 ILE 460 HD12 ILE 460 91.985 -11.845 5.148 190 HD13 ILE 460 HD13 ILE 460 90.522 -11.015 4.619 191 H SER 461 H SER 461 91.492 -7.777 6.589 192 HA SER 461 HA SER 461 91.616 -9.209 9.162 193 HB2 SER 461 HB2 SER 461 90.068 -7.488 10.037 194 HB3 SER 461 HB3 SER 461 91.587 -6.791 9.478 195 HG SER 461 HG SER 461 89.875 -6.853 7.437 196 H THR 462 H THR 462 89.106 -9.120 10.006 197 HA THR 462 HA THR 462 87.628 -10.654 7.970 198 HB THR 462 HB THR 462 86.728 -12.020 9.620 199 HG1 THR 462 HG1 THR 462 87.618 -10.350 11.731 200 HG21 THR 462 HG21 THR 462 88.591 -13.056 10.294 201 HG22 THR 462 HG22 THR 462 89.097 -11.680 11.275 202 HG23 THR 462 HG23 THR 462 89.465 -11.717 9.551 203 H GLU 463 H GLU 463 87.644 -7.824 9.821 204 HA GLU 463 HA GLU 463 85.654 -6.449 8.721 205 HB2 GLU 463 HB2 GLU 463 84.506 -8.579 10.392 206 HB3 GLU 463 HB3 GLU 463 83.851 -6.978 10.710 207 HG2 GLU 463 HG2 GLU 463 84.057 -7.702 7.871 208 HG3 GLU 463 HG3 GLU 463 82.924 -8.666 8.819 209 HA PRO 464 HA PRO 464 86.091 -5.320 13.608 210 HB2 PRO 464 HB2 PRO 464 88.796 -6.611 13.602 211 HB3 PRO 464 HB3 PRO 464 87.677 -6.358 14.948 212 HG2 PRO 464 HG2 PRO 464 87.867 -8.744 13.796 213 HG3 PRO 464 HG3 PRO 464 86.291 -8.106 14.301 214 HD2 PRO 464 HD2 PRO 464 87.432 -8.389 11.574 215 HD3 PRO 464 HD3 PRO 464 85.740 -8.443 12.102 216 H LEU 465 H LEU 465 88.435 -5.420 10.993 217 HA LEU 465 HA LEU 465 90.270 -3.541 11.557 218 HB2 LEU 465 HB2 LEU 465 89.341 -4.669 9.235 219 HB3 LEU 465 HB3 LEU 465 88.991 -2.970 8.982 220 HG LEU 465 HG LEU 465 91.714 -3.612 9.953 221 HD11 LEU 465 HD11 LEU 465 92.267 -3.929 7.408 222 HD12 LEU 465 HD12 LEU 465 90.623 -4.564 7.353 223 HD13 LEU 465 HD13 LEU 465 91.820 -5.304 8.416 224 HD21 LEU 465 HD21 LEU 465 90.451 -1.678 8.035 225 HD22 LEU 465 HD22 LEU 465 92.200 -1.884 8.141 226 HD23 LEU 465 HD23 LEU 465 91.287 -1.342 9.550 227 HA PRO 466 HA PRO 466 87.650 -0.151 12.959 228 HB2 PRO 466 HB2 PRO 466 89.772 1.432 13.677 229 HB3 PRO 466 HB3 PRO 466 89.071 0.184 14.711 230 HG2 PRO 466 HG2 PRO 466 91.502 0.057 12.967 231 HG3 PRO 466 HG3 PRO 466 91.265 -0.577 14.607 232 HD2 PRO 466 HD2 PRO 466 91.164 -2.174 12.455 233 HD3 PRO 466 HD3 PRO 466 90.101 -2.435 13.854 234 H GLY 467 H GLY 467 90.596 0.338 11.010 235 HA2 GLY 467 HA2 GLY 467 89.655 1.423 8.770 236 HA3 GLY 467 HA3 GLY 467 89.479 2.778 9.876 237 H ARG 468 H ARG 468 90.985 3.586 8.048 238 HA ARG 468 HA ARG 468 93.677 2.762 7.969 239 HB2 ARG 468 HB2 ARG 468 94.084 4.690 6.669 240 HB3 ARG 468 HB3 ARG 468 92.436 4.211 6.284 241 HG2 ARG 468 HG2 ARG 468 91.580 5.923 7.802 242 HG3 ARG 468 HG3 ARG 468 93.235 6.404 8.188 243 HD2 ARG 468 HD2 ARG 468 93.539 7.455 6.199 244 HD3 ARG 468 HD3 ARG 468 92.503 6.329 5.324 245 HE ARG 468 HE ARG 468 90.701 7.693 5.745 246 HH11 ARG 468 HH11 ARG 468 93.412 8.695 7.690 247 HH12 ARG 468 HH12 ARG 468 92.662 10.167 8.209 248 HH21 ARG 468 HH21 ARG 468 89.705 9.630 6.423 249 HH22 ARG 468 HH22 ARG 468 90.554 10.698 7.490 250 H LYS 469 H LYS 469 92.003 5.225 9.864 251 HA LYS 469 HA LYS 469 94.249 6.414 11.037 252 HB2 LYS 469 HB2 LYS 469 92.689 7.248 12.746 253 HB3 LYS 469 HB3 LYS 469 92.051 7.450 11.120 254 HG2 LYS 469 HG2 LYS 469 90.504 5.702 11.394 255 HG3 LYS 469 HG3 LYS 469 91.316 5.108 12.844 256 HD2 LYS 469 HD2 LYS 469 89.240 6.311 13.376 257 HD3 LYS 469 HD3 LYS 469 90.661 7.103 14.062 258 HE2 LYS 469 HE2 LYS 469 90.420 8.284 11.588 259 HE3 LYS 469 HE3 LYS 469 88.744 8.068 12.088 260 HZ1 LYS 469 HZ1 LYS 469 90.257 10.145 12.803 261 HZ2 LYS 469 HZ2 LYS 469 90.520 9.120 14.122 262 HZ3 LYS 469 HZ3 LYS 469 88.946 9.583 13.713 263 H GLN 470 H GLN 470 92.259 3.684 12.121 264 HA GLN 470 HA GLN 470 93.779 3.345 14.534 265 HB2 GLN 470 HB2 GLN 470 91.501 1.941 13.228 266 HB3 GLN 470 HB3 GLN 470 92.434 1.059 14.428 267 HG2 GLN 470 HG2 GLN 470 91.548 3.785 15.155 268 HG3 GLN 470 HG3 GLN 470 90.309 2.538 15.048 269 HE21 GLN 470 HE21 GLN 470 90.391 3.412 17.414 270 HE22 GLN 470 HE22 GLN 470 91.309 2.438 18.505 271 H VAL 471 H VAL 471 93.592 1.662 11.408 272 HA VAL 471 HA VAL 471 95.418 -0.393 12.056 273 HB VAL 471 HB VAL 471 94.889 0.787 9.324 274 HG11 VAL 471 HG11 VAL 471 95.364 -2.017 9.305 275 HG12 VAL 471 HG12 VAL 471 96.670 -1.233 10.195 276 HG13 VAL 471 HG13 VAL 471 96.303 -0.734 8.543 277 HG21 VAL 471 HG21 VAL 471 92.945 -0.162 10.870 278 HG22 VAL 471 HG22 VAL 471 93.544 -1.692 10.232 279 HG23 VAL 471 HG23 VAL 471 92.984 -0.436 9.128 280 H ARG 472 H ARG 472 95.835 2.780 10.537 281 HA ARG 472 HA ARG 472 98.607 2.561 10.060 282 HB2 ARG 472 HB2 ARG 472 98.571 4.856 9.550 283 HB3 ARG 472 HB3 ARG 472 96.970 4.283 9.108 284 HG2 ARG 472 HG2 ARG 472 96.065 5.170 11.189 285 HG3 ARG 472 HG3 ARG 472 97.674 5.722 11.659 286 HD2 ARG 472 HD2 ARG 472 97.732 7.150 9.643 287 HD3 ARG 472 HD3 ARG 472 96.087 6.643 9.264 288 HE ARG 472 HE ARG 472 95.972 7.641 11.820 289 HH11 ARG 472 HH11 ARG 472 96.925 8.842 8.693 290 HH12 ARG 472 HH12 ARG 472 96.494 10.481 9.046 291 HH21 ARG 472 HH21 ARG 472 95.399 9.802 12.295 292 HH22 ARG 472 HH22 ARG 472 95.628 11.026 11.092 293 H ASP 473 H ASP 473 96.737 3.858 12.766 294 HA ASP 473 HA ASP 473 98.895 4.811 14.293 295 HB2 ASP 473 HB2 ASP 473 96.046 4.240 14.729 296 HB3 ASP 473 HB3 ASP 473 97.037 4.063 16.173 297 H THR 474 H THR 474 97.364 1.641 14.086 298 HA THR 474 HA THR 474 98.711 0.452 16.263 299 HB THR 474 HB THR 474 98.226 -1.725 14.958 300 HG1 THR 474 HG1 THR 474 96.607 0.054 13.435 301 HG21 THR 474 HG21 THR 474 95.608 -1.088 15.235 302 HG22 THR 474 HG22 THR 474 96.363 0.166 16.221 303 HG23 THR 474 HG23 THR 474 96.668 -1.535 16.573 304 H LEU 475 H LEU 475 99.220 -0.592 12.913 305 HA LEU 475 HA LEU 475 101.670 -1.711 13.194 306 HB2 LEU 475 HB2 LEU 475 102.105 -1.014 10.791 307 HB3 LEU 475 HB3 LEU 475 100.640 -1.928 11.100 308 HG LEU 475 HG LEU 475 99.887 0.765 11.309 309 HD11 LEU 475 HD11 LEU 475 101.957 0.307 9.221 310 HD12 LEU 475 HD12 LEU 475 101.634 1.740 10.197 311 HD13 LEU 475 HD13 LEU 475 100.580 1.342 8.840 312 HD21 LEU 475 HD21 LEU 475 99.518 -0.901 8.847 313 HD22 LEU 475 HD22 LEU 475 98.393 0.224 9.608 314 HD23 LEU 475 HD23 LEU 475 98.732 -1.332 10.365 315 H ALA 476 H ALA 476 101.019 1.745 12.720 316 HA ALA 476 HA ALA 476 103.758 2.499 12.570 317 HB1 ALA 476 HB1 ALA 476 101.818 3.866 11.743 318 HB2 ALA 476 HB2 ALA 476 103.010 4.750 12.696 319 HB3 ALA 476 HB3 ALA 476 101.477 4.268 13.426 320 H ALA 477 H ALA 477 101.553 1.891 15.172 321 HA ALA 477 HA ALA 477 102.975 3.262 17.209 322 HB1 ALA 477 HB1 ALA 477 100.713 2.766 17.665 323 HB2 ALA 477 HB2 ALA 477 101.656 1.754 18.758 324 HB3 ALA 477 HB3 ALA 477 100.936 1.054 17.308 325 H ILE 478 H ILE 478 103.291 0.128 15.734 326 HA ILE 478 HA ILE 478 105.025 -0.910 17.798 327 HB ILE 478 HB ILE 478 104.188 -1.947 15.101 328 HG12 ILE 478 HG12 ILE 478 103.536 -3.879 16.790 329 HG13 ILE 478 HG13 ILE 478 103.605 -2.570 17.965 330 HG21 ILE 478 HG21 ILE 478 105.462 -4.061 15.910 331 HG22 ILE 478 HG22 ILE 478 106.394 -2.913 16.873 332 HG23 ILE 478 HG23 ILE 478 106.353 -2.763 15.116 333 HD11 ILE 478 HD11 ILE 478 101.732 -1.597 17.183 334 HD12 ILE 478 HD12 ILE 478 101.398 -3.233 16.621 335 HD13 ILE 478 HD13 ILE 478 102.067 -2.038 15.509 336 H SER 479 H SER 479 105.378 0.723 14.725 337 HA SER 479 HA SER 479 108.083 1.413 15.268 338 HB2 SER 479 HB2 SER 479 108.148 -1.042 14.415 339 HB3 SER 479 HB3 SER 479 107.812 -0.333 12.836 340 HG SER 479 HG SER 479 109.827 0.908 14.243 341 H GLU 480 H GLU 480 109.093 2.471 13.218 342 HA GLU 480 HA GLU 480 107.121 4.333 12.218 343 HB2 GLU 480 HB2 GLU 480 109.424 5.003 12.989 344 HB3 GLU 480 HB3 GLU 480 110.064 4.216 11.553 345 HG2 GLU 480 HG2 GLU 480 107.927 6.124 10.996 346 HG3 GLU 480 HG3 GLU 480 109.354 6.841 11.741 347 H VAL 481 H VAL 481 105.927 3.830 10.507 348 HA VAL 481 HA VAL 481 106.942 1.987 8.494 349 HB VAL 481 HB VAL 481 104.666 2.086 7.546 350 HG11 VAL 481 HG11 VAL 481 103.873 1.569 10.267 351 HG12 VAL 481 HG12 VAL 481 105.479 0.913 9.946 352 HG13 VAL 481 HG13 VAL 481 104.114 0.439 8.935 353 HG21 VAL 481 HG21 VAL 481 104.181 4.419 8.219 354 HG22 VAL 481 HG22 VAL 481 104.017 3.871 9.889 355 HG23 VAL 481 HG23 VAL 481 102.897 3.291 8.655 356 H LEU 482 H LEU 482 106.676 2.482 6.192 357 HA LEU 482 HA LEU 482 107.632 5.159 5.616 358 HB2 LEU 482 HB2 LEU 482 108.851 3.504 4.495 359 HB3 LEU 482 HB3 LEU 482 107.409 2.614 4.045 360 HG LEU 482 HG LEU 482 106.823 4.332 2.413 361 HD11 LEU 482 HD11 LEU 482 108.995 5.915 2.041 362 HD12 LEU 482 HD12 LEU 482 108.951 5.798 3.800 363 HD13 LEU 482 HD13 LEU 482 107.543 6.394 2.921 364 HD21 LEU 482 HD21 LEU 482 108.160 2.543 1.581 365 HD22 LEU 482 HD22 LEU 482 109.634 3.264 2.229 366 HD23 LEU 482 HD23 LEU 482 108.788 4.038 0.888 367 H TYR 483 H TYR 483 104.766 3.235 5.189 368 HA TYR 483 HA TYR 483 102.995 5.305 4.892 369 HB2 TYR 483 HB2 TYR 483 104.126 5.923 2.817 370 HB3 TYR 483 HB3 TYR 483 103.897 4.296 2.185 371 HD1 TYR 483 HD1 TYR 483 101.356 3.498 2.173 372 HD2 TYR 483 HD2 TYR 483 102.636 7.555 2.162 373 HE1 TYR 483 HE1 TYR 483 99.189 4.172 1.225 374 HE2 TYR 483 HE2 TYR 483 100.473 8.242 1.214 375 HH TYR 483 HH TYR 483 98.464 7.584 0.544 376 H VAL 484 H VAL 484 101.069 4.449 5.322 377 HA VAL 484 HA VAL 484 100.671 1.596 4.761 378 HB VAL 484 HB VAL 484 100.437 2.006 7.078 379 HG11 VAL 484 HG11 VAL 484 98.480 3.734 7.666 380 HG12 VAL 484 HG12 VAL 484 99.076 4.470 6.178 381 HG13 VAL 484 HG13 VAL 484 100.174 4.208 7.533 382 HG21 VAL 484 HG21 VAL 484 97.555 2.102 6.386 383 HG22 VAL 484 HG22 VAL 484 98.431 0.997 7.444 384 HG23 VAL 484 HG23 VAL 484 98.518 0.798 5.694 385 H ASP 485 H ASP 485 99.542 1.185 2.989 386 HA ASP 485 HA ASP 485 97.504 3.084 2.087 387 HB2 ASP 485 HB2 ASP 485 99.108 2.476 0.390 388 HB3 ASP 485 HB3 ASP 485 98.846 0.761 0.693 389 H LEU 486 H LEU 486 95.380 2.642 2.157 390 HA LEU 486 HA LEU 486 94.543 -0.117 2.760 391 HB2 LEU 486 HB2 LEU 486 93.673 2.445 4.072 392 HB3 LEU 486 HB3 LEU 486 92.683 0.999 4.124 393 HG LEU 486 HG LEU 486 95.271 0.235 4.963 394 HD11 LEU 486 HD11 LEU 486 94.343 2.848 6.105 395 HD12 LEU 486 HD12 LEU 486 95.937 2.416 5.488 396 HD13 LEU 486 HD13 LEU 486 95.371 1.741 7.016 397 HD21 LEU 486 HD21 LEU 486 92.886 0.753 6.718 398 HD22 LEU 486 HD22 LEU 486 94.144 -0.468 6.911 399 HD23 LEU 486 HD23 LEU 486 92.968 -0.613 5.605 400 H LEU 487 H LEU 487 92.950 -0.883 1.457 401 HA LEU 487 HA LEU 487 91.990 0.706 -0.692 402 HB2 LEU 487 HB2 LEU 487 91.550 -2.059 0.298 403 HB3 LEU 487 HB3 LEU 487 90.322 -1.383 -0.755 404 HG LEU 487 HG LEU 487 92.237 -2.778 -1.792 405 HD11 LEU 487 HD11 LEU 487 90.508 -1.314 -2.945 406 HD12 LEU 487 HD12 LEU 487 92.001 -1.638 -3.828 407 HD13 LEU 487 HD13 LEU 487 91.769 -0.084 -3.029 408 HD21 LEU 487 HD21 LEU 487 93.733 -0.245 -2.045 409 HD22 LEU 487 HD22 LEU 487 94.315 -1.909 -1.978 410 HD23 LEU 487 HD23 LEU 487 93.855 -1.075 -0.493 411 H GLU 488 H GLU 488 91.040 2.493 0.385 412 HA GLU 488 HA GLU 488 89.276 2.832 2.301 413 HB2 GLU 488 HB2 GLU 488 88.081 4.522 0.929 414 HB3 GLU 488 HB3 GLU 488 89.830 4.647 0.820 415 HG2 GLU 488 HG2 GLU 488 89.561 3.181 -1.293 416 HG3 GLU 488 HG3 GLU 488 87.875 3.695 -1.226 417 H GLY 489 H GLY 489 87.487 1.907 3.030 418 HA2 GLY 489 HA2 GLY 489 85.347 1.022 3.010 419 HA3 GLY 489 HA3 GLY 489 85.335 1.178 1.261 420 H ASP 490 H ASP 490 88.122 -0.398 1.964 421 HA ASP 490 HA ASP 490 86.830 -3.024 1.644 422 HB2 ASP 490 HB2 ASP 490 88.444 -1.910 -0.165 423 HB3 ASP 490 HB3 ASP 490 89.676 -2.635 0.864 424 H THR 491 H THR 491 87.933 -4.861 2.555 425 HA THR 491 HA THR 491 89.055 -4.233 5.172 426 HB THR 491 HB THR 491 88.528 -6.429 5.840 427 HG1 THR 491 HG1 THR 491 89.265 -7.710 4.186 428 HG21 THR 491 HG21 THR 491 86.510 -5.223 5.717 429 HG22 THR 491 HG22 THR 491 86.164 -6.776 4.955 430 HG23 THR 491 HG23 THR 491 86.447 -5.349 3.959 431 H GLU 492 H GLU 492 90.472 -4.288 2.385 432 HA GLU 492 HA GLU 492 92.737 -5.952 3.273 433 HB2 GLU 492 HB2 GLU 492 91.734 -5.381 0.489 434 HB3 GLU 492 HB3 GLU 492 93.333 -6.041 0.807 435 HG2 GLU 492 HG2 GLU 492 91.406 -7.577 2.233 436 HG3 GLU 492 HG3 GLU 492 90.888 -7.418 0.556 437 H CYS 493 H CYS 493 94.388 -4.773 3.947 438 HA CYS 493 HA CYS 493 94.994 -2.261 2.541 439 HB2 CYS 493 HB2 CYS 493 95.981 -1.678 4.936 440 HB3 CYS 493 HB3 CYS 493 94.300 -1.363 4.525 441 HG CYS 493 HG CYS 493 94.343 -2.557 6.819 442 H HIS 494 H HIS 494 97.164 -1.792 2.215 443 HA HIS 494 HA HIS 494 99.087 -3.879 3.006 444 HB2 HIS 494 HB2 HIS 494 98.814 -2.514 0.325 445 HB3 HIS 494 HB3 HIS 494 100.219 -3.466 0.791 446 HD1 HIS 494 HD1 HIS 494 96.451 -4.051 0.777 447 HD2 HIS 494 HD2 HIS 494 100.009 -5.971 -0.178 448 HE1 HIS 494 HE1 HIS 494 95.781 -6.310 -0.102 449 HE2 HIS 494 HE2 HIS 494 97.948 -7.443 -0.706 450 H ALA 495 H ALA 495 100.337 -2.900 4.493 451 HA ALA 495 HA ALA 495 101.042 -0.094 4.136 452 HB1 ALA 495 HB1 ALA 495 101.721 -1.820 6.501 453 HB2 ALA 495 HB2 ALA 495 100.184 -0.972 6.332 454 HB3 ALA 495 HB3 ALA 495 101.692 -0.059 6.409 455 H ARG 496 H ARG 496 102.883 0.512 3.284 456 HA ARG 496 HA ARG 496 105.033 -1.411 2.862 457 HB2 ARG 496 HB2 ARG 496 105.206 1.459 2.039 458 HB3 ARG 496 HB3 ARG 496 105.831 0.028 1.232 459 HG2 ARG 496 HG2 ARG 496 103.416 -0.586 0.764 460 HG3 ARG 496 HG3 ARG 496 103.010 1.050 1.283 461 HD2 ARG 496 HD2 ARG 496 105.171 0.758 -0.722 462 HD3 ARG 496 HD3 ARG 496 103.525 0.427 -1.259 463 HE ARG 496 HE ARG 496 104.657 2.976 -0.704 464 HH11 ARG 496 HH11 ARG 496 101.692 1.154 -0.537 465 HH12 ARG 496 HH12 ARG 496 100.676 2.552 -0.651 466 HH21 ARG 496 HH21 ARG 496 103.328 4.822 -0.850 467 HH22 ARG 496 HH22 ARG 496 101.606 4.638 -0.829 468 H PHE 497 H PHE 497 107.082 -1.224 3.722 469 HA PHE 497 HA PHE 497 107.429 0.821 5.813 470 HB2 PHE 497 HB2 PHE 497 108.310 -2.070 5.883 471 HB3 PHE 497 HB3 PHE 497 108.755 -0.860 7.083 472 HD1 PHE 497 HD1 PHE 497 107.588 -1.017 9.044 473 HD2 PHE 497 HD2 PHE 497 105.614 -1.955 5.393 474 HE1 PHE 497 HE1 PHE 497 105.519 -1.491 10.289 475 HE2 PHE 497 HE2 PHE 497 103.545 -2.430 6.627 476 HZ PHE 497 HZ PHE 497 103.492 -2.199 9.081 477 H LYS 498 H LYS 498 109.604 1.492 6.238 478 HA LYS 498 HA LYS 498 111.164 1.668 3.820 479 HB2 LYS 498 HB2 LYS 498 110.776 3.302 6.038 480 HB3 LYS 498 HB3 LYS 498 112.435 2.744 6.204 481 HG2 LYS 498 HG2 LYS 498 111.324 4.005 3.708 482 HG3 LYS 498 HG3 LYS 498 112.188 4.886 4.970 483 HD2 LYS 498 HD2 LYS 498 114.126 3.373 4.625 484 HD3 LYS 498 HD3 LYS 498 113.261 2.632 3.276 485 HE2 LYS 498 HE2 LYS 498 114.437 4.166 2.094 486 HE3 LYS 498 HE3 LYS 498 113.070 5.188 2.537 487 HZ1 LYS 498 HZ1 LYS 498 115.826 5.319 3.394 488 HZ2 LYS 498 HZ2 LYS 498 114.700 5.500 4.643 489 HZ3 LYS 498 HZ3 LYS 498 114.657 6.541 3.310 490 H THR 499 H THR 499 111.147 -0.286 6.632 491 HA THR 499 HA THR 499 113.684 -1.495 5.781 492 HB THR 499 HB THR 499 113.823 -1.955 8.438 493 HG1 THR 499 HG1 THR 499 113.109 -0.260 9.593 494 HG21 THR 499 HG21 THR 499 115.795 -1.197 7.642 495 HG22 THR 499 HG22 THR 499 115.244 0.335 8.320 496 HG23 THR 499 HG23 THR 499 115.033 0.006 6.600 497 HA PRO 500 HA PRO 500 111.500 -5.307 6.102 498 HB2 PRO 500 HB2 PRO 500 113.548 -7.014 6.568 499 HB3 PRO 500 HB3 PRO 500 113.285 -6.245 4.998 500 HG2 PRO 500 HG2 PRO 500 115.205 -5.518 7.171 501 HG3 PRO 500 HG3 PRO 500 115.459 -5.549 5.415 502 HD2 PRO 500 HD2 PRO 500 114.980 -3.262 6.813 503 HD3 PRO 500 HD3 PRO 500 114.505 -3.482 5.117 504 H GLU 501 H GLU 501 113.796 -4.545 8.670 505 HA GLU 501 HA GLU 501 112.933 -6.490 10.518 506 HB2 GLU 501 HB2 GLU 501 114.075 -3.809 11.279 507 HB3 GLU 501 HB3 GLU 501 114.228 -5.339 12.132 508 HG2 GLU 501 HG2 GLU 501 115.501 -4.601 9.508 509 HG3 GLU 501 HG3 GLU 501 116.308 -4.791 11.064 510 H ASP 502 H ASP 502 111.900 -3.160 9.925 511 HA ASP 502 HA ASP 502 110.239 -2.871 12.166 512 HB2 ASP 502 HB2 ASP 502 110.048 -1.612 9.423 513 HB3 ASP 502 HB3 ASP 502 109.100 -1.101 10.816 514 H ALA 503 H ALA 503 109.530 -4.051 8.894 515 HA ALA 503 HA ALA 503 106.765 -4.476 9.350 516 HB1 ALA 503 HB1 ALA 503 107.572 -6.272 7.361 517 HB2 ALA 503 HB2 ALA 503 108.613 -4.859 7.186 518 HB3 ALA 503 HB3 ALA 503 106.860 -4.673 7.142 519 H GLN 504 H GLN 504 109.604 -6.567 9.554 520 HA GLN 504 HA GLN 504 108.261 -8.978 10.074 521 HB2 GLN 504 HB2 GLN 504 110.743 -8.550 9.488 522 HB3 GLN 504 HB3 GLN 504 110.963 -8.314 11.216 523 HG2 GLN 504 HG2 GLN 504 110.403 -10.531 11.705 524 HG3 GLN 504 HG3 GLN 504 109.686 -10.791 10.115 525 HE21 GLN 504 HE21 GLN 504 112.700 -9.112 10.546 526 HE22 GLN 504 HE22 GLN 504 113.713 -10.337 9.871 527 H ALA 505 H ALA 505 109.494 -6.467 12.241 528 HA ALA 505 HA ALA 505 108.940 -7.831 14.648 529 HB1 ALA 505 HB1 ALA 505 108.900 -5.345 15.526 530 HB2 ALA 505 HB2 ALA 505 109.568 -5.019 13.926 531 HB3 ALA 505 HB3 ALA 505 110.401 -6.122 15.021 532 H VAL 506 H VAL 506 107.023 -5.539 12.731 533 HA VAL 506 HA VAL 506 104.914 -5.306 14.612 534 HB VAL 506 HB VAL 506 104.754 -4.884 11.625 535 HG11 VAL 506 HG11 VAL 506 103.122 -3.546 13.762 536 HG12 VAL 506 HG12 VAL 506 102.616 -5.053 12.997 537 HG13 VAL 506 HG13 VAL 506 102.828 -3.597 12.024 538 HG21 VAL 506 HG21 VAL 506 105.897 -2.980 11.824 539 HG22 VAL 506 HG22 VAL 506 106.402 -3.558 13.412 540 HG23 VAL 506 HG23 VAL 506 104.996 -2.504 13.264 541 H ILE 507 H ILE 507 105.347 -7.374 11.758 542 HA ILE 507 HA ILE 507 102.779 -8.554 11.882 543 HB ILE 507 HB ILE 507 103.933 -10.456 10.575 544 HG12 ILE 507 HG12 ILE 507 106.041 -8.781 9.613 545 HG13 ILE 507 HG13 ILE 507 106.203 -8.947 11.356 546 HG21 ILE 507 HG21 ILE 507 103.094 -7.808 9.841 547 HG22 ILE 507 HG22 ILE 507 102.879 -9.332 8.978 548 HG23 ILE 507 HG23 ILE 507 104.347 -8.384 8.743 549 HD11 ILE 507 HD11 ILE 507 106.349 -11.033 9.239 550 HD12 ILE 507 HD12 ILE 507 105.882 -11.476 10.881 551 HD13 ILE 507 HD13 ILE 507 107.445 -10.715 10.584 552 H ASN 508 H ASN 508 105.867 -9.392 13.321 553 HA ASN 508 HA ASN 508 105.024 -11.928 14.340 554 HB2 ASN 508 HB2 ASN 508 107.343 -10.120 15.026 555 HB3 ASN 508 HB3 ASN 508 107.072 -11.664 15.828 556 HD21 ASN 508 HD21 ASN 508 109.023 -10.397 13.743 557 HD22 ASN 508 HD22 ASN 508 109.222 -11.679 12.601 558 H ALA 509 H ALA 509 105.227 -8.664 15.650 559 HA ALA 509 HA ALA 509 104.333 -9.409 18.269 560 HB1 ALA 509 HB1 ALA 509 103.949 -6.624 17.787 561 HB2 ALA 509 HB2 ALA 509 105.495 -7.127 17.105 562 HB3 ALA 509 HB3 ALA 509 105.144 -7.424 18.807 563 H TYR 510 H TYR 510 102.796 -8.464 15.319 564 HA TYR 510 HA TYR 510 100.394 -7.442 16.315 565 HB2 TYR 510 HB2 TYR 510 101.439 -8.257 13.760 566 HB3 TYR 510 HB3 TYR 510 99.762 -8.766 13.936 567 HD1 TYR 510 HD1 TYR 510 98.741 -7.276 12.398 568 HD2 TYR 510 HD2 TYR 510 101.270 -5.764 15.461 569 HE1 TYR 510 HE1 TYR 510 98.000 -4.991 11.868 570 HE2 TYR 510 HE2 TYR 510 100.538 -3.471 14.942 571 HH TYR 510 HH TYR 510 99.007 -2.613 12.163 572 H THR 511 H THR 511 101.554 -10.615 16.543 573 HA THR 511 HA THR 511 99.285 -12.175 16.204 574 HB THR 511 HB THR 511 100.251 -13.762 17.758 575 HG1 THR 511 HG1 THR 511 100.913 -12.028 19.309 576 HG21 THR 511 HG21 THR 511 102.840 -13.092 16.854 577 HG22 THR 511 HG22 THR 511 101.706 -12.576 15.606 578 HG23 THR 511 HG23 THR 511 101.711 -14.252 16.154 579 H GLU 512 H GLU 512 100.259 -10.080 18.817 580 HA GLU 512 HA GLU 512 98.426 -10.802 20.778 581 HB2 GLU 512 HB2 GLU 512 100.362 -9.202 21.010 582 HB3 GLU 512 HB3 GLU 512 99.357 -7.980 20.242 583 HG2 GLU 512 HG2 GLU 512 97.993 -7.757 22.058 584 HG3 GLU 512 HG3 GLU 512 98.282 -9.404 22.618 585 H ILE 513 H ILE 513 97.984 -8.854 17.903 586 HA ILE 513 HA ILE 513 95.695 -7.452 18.451 587 HB ILE 513 HB ILE 513 96.229 -8.938 15.875 588 HG12 ILE 513 HG12 ILE 513 98.039 -7.343 16.806 589 HG13 ILE 513 HG13 ILE 513 97.510 -7.115 15.143 590 HG21 ILE 513 HG21 ILE 513 94.239 -6.911 16.709 591 HG22 ILE 513 HG22 ILE 513 94.108 -8.212 15.527 592 HG23 ILE 513 HG23 ILE 513 94.954 -6.725 15.109 593 HD11 ILE 513 HD11 ILE 513 97.746 -5.001 16.341 594 HD12 ILE 513 HD12 ILE 513 96.539 -5.534 17.511 595 HD13 ILE 513 HD13 ILE 513 96.083 -5.282 15.826 596 H ASN 514 H ASN 514 95.919 -10.854 17.438 597 HA ASN 514 HA ASN 514 93.287 -11.510 17.149 598 HB2 ASN 514 HB2 ASN 514 95.105 -13.094 16.756 599 HB3 ASN 514 HB3 ASN 514 95.435 -13.172 18.485 600 HD21 ASN 514 HD21 ASN 514 92.320 -13.131 16.832 601 HD22 ASN 514 HD22 ASN 514 91.807 -14.686 17.381 602 H LYS 515 H LYS 515 95.009 -10.888 20.131 603 HA LYS 515 HA LYS 515 93.383 -12.010 22.034 604 HB2 LYS 515 HB2 LYS 515 94.873 -9.393 22.015 605 HB3 LYS 515 HB3 LYS 515 93.996 -9.946 23.435 606 HG2 LYS 515 HG2 LYS 515 95.651 -12.066 22.488 607 HG3 LYS 515 HG3 LYS 515 96.616 -10.596 22.639 608 HD2 LYS 515 HD2 LYS 515 96.763 -11.078 24.813 609 HD3 LYS 515 HD3 LYS 515 95.070 -10.592 24.927 610 HE2 LYS 515 HE2 LYS 515 95.513 -13.347 24.011 611 HE3 LYS 515 HE3 LYS 515 96.039 -13.022 25.663 612 HZ1 LYS 515 HZ1 LYS 515 93.328 -12.812 24.515 613 HZ2 LYS 515 HZ2 LYS 515 93.737 -11.967 25.922 614 HZ3 LYS 515 HZ3 LYS 515 93.835 -13.655 25.893 615 H LYS 516 H LYS 516 92.739 -9.292 19.977 616 HA LYS 516 HA LYS 516 90.113 -8.955 21.273 617 HB2 LYS 516 HB2 LYS 516 91.680 -6.993 21.481 618 HB3 LYS 516 HB3 LYS 516 91.616 -6.834 19.731 619 HG2 LYS 516 HG2 LYS 516 90.035 -5.311 20.374 620 HG3 LYS 516 HG3 LYS 516 89.037 -6.745 20.124 621 HD2 LYS 516 HD2 LYS 516 90.195 -6.286 22.826 622 HD3 LYS 516 HD3 LYS 516 88.838 -5.279 22.317 623 HE2 LYS 516 HE2 LYS 516 87.368 -6.979 22.441 624 HE3 LYS 516 HE3 LYS 516 88.515 -8.148 21.786 625 HZ1 LYS 516 HZ1 LYS 516 88.574 -8.930 23.861 626 HZ2 LYS 516 HZ2 LYS 516 87.882 -7.537 24.526 627 HZ3 LYS 516 HZ3 LYS 516 89.545 -7.593 24.222 628 H HIS 517 H HIS 517 91.913 -8.943 18.246 629 HA HIS 517 HA HIS 517 89.591 -9.977 16.849 630 HB2 HIS 517 HB2 HIS 517 90.957 -7.590 15.635 631 HB3 HIS 517 HB3 HIS 517 89.386 -8.282 15.244 632 HD1 HIS 517 HD1 HIS 517 87.379 -7.535 16.654 633 HD2 HIS 517 HD2 HIS 517 90.986 -5.866 17.867 634 HE1 HIS 517 HE1 HIS 517 86.764 -5.703 18.264 635 HE2 HIS 517 HE2 HIS 517 88.958 -4.648 18.913 636 H CYS 518 H CYS 518 90.173 -11.424 15.332 637 HA CYS 518 HA CYS 518 92.895 -12.188 15.089 638 HB2 CYS 518 HB2 CYS 518 90.379 -13.313 14.479 639 HB3 CYS 518 HB3 CYS 518 91.289 -13.283 12.972 640 HG CYS 518 HG CYS 518 93.012 -14.478 15.092 641 H TRP 519 H TRP 519 94.279 -10.834 14.104 642 HA TRP 519 HA TRP 519 93.511 -9.712 11.491 643 HB2 TRP 519 HB2 TRP 519 94.499 -8.391 13.667 644 HB3 TRP 519 HB3 TRP 519 95.969 -8.698 12.746 645 HD1 TRP 519 HD1 TRP 519 93.476 -8.409 10.184 646 HE1 TRP 519 HE1 TRP 519 93.325 -6.045 9.234 647 HE3 TRP 519 HE3 TRP 519 96.035 -5.922 13.842 648 HZ2 TRP 519 HZ2 TRP 519 94.178 -3.421 9.952 649 HZ3 TRP 519 HZ3 TRP 519 96.323 -3.488 13.637 650 HH2 TRP 519 HH2 TRP 519 95.415 -2.266 11.731 651 H LYS 520 H LYS 520 94.844 -9.872 9.749 652 HA LYS 520 HA LYS 520 96.850 -12.013 9.907 653 HB2 LYS 520 HB2 LYS 520 95.598 -11.052 7.373 654 HB3 LYS 520 HB3 LYS 520 96.262 -12.640 7.742 655 HG2 LYS 520 HG2 LYS 520 93.735 -11.513 8.937 656 HG3 LYS 520 HG3 LYS 520 93.795 -12.615 7.558 657 HD2 LYS 520 HD2 LYS 520 93.961 -14.374 8.908 658 HD3 LYS 520 HD3 LYS 520 95.363 -13.670 9.715 659 HE2 LYS 520 HE2 LYS 520 93.208 -14.207 11.078 660 HE3 LYS 520 HE3 LYS 520 94.095 -12.713 11.381 661 HZ1 LYS 520 HZ1 LYS 520 92.480 -11.448 10.411 662 HZ2 LYS 520 HZ2 LYS 520 91.523 -12.693 11.039 663 HZ3 LYS 520 HZ3 LYS 520 91.934 -12.689 9.398 664 H LEU 521 H LEU 521 98.905 -11.641 9.325 665 HA LEU 521 HA LEU 521 99.547 -9.191 7.850 666 HB2 LEU 521 HB2 LEU 521 101.235 -10.042 10.179 667 HB3 LEU 521 HB3 LEU 521 101.190 -8.489 9.363 668 HG LEU 521 HG LEU 521 100.182 -8.193 11.499 669 HD11 LEU 521 HD11 LEU 521 97.595 -8.253 10.364 670 HD12 LEU 521 HD12 LEU 521 98.727 -7.852 9.073 671 HD13 LEU 521 HD13 LEU 521 98.679 -6.873 10.539 672 HD21 LEU 521 HD21 LEU 521 99.524 -10.836 11.351 673 HD22 LEU 521 HD22 LEU 521 97.954 -10.059 11.145 674 HD23 LEU 521 HD23 LEU 521 98.929 -9.712 12.572 675 H GLU 522 H GLU 522 100.735 -9.677 6.138 676 HA GLU 522 HA GLU 522 102.726 -11.818 6.337 677 HB2 GLU 522 HB2 GLU 522 100.360 -12.348 5.160 678 HB3 GLU 522 HB3 GLU 522 101.226 -11.678 3.786 679 HG2 GLU 522 HG2 GLU 522 103.043 -13.322 4.214 680 HG3 GLU 522 HG3 GLU 522 102.023 -14.049 5.455 681 H ILE 523 H ILE 523 104.586 -11.446 5.236 682 HA ILE 523 HA ILE 523 104.843 -8.823 3.974 683 HB ILE 523 HB ILE 523 106.863 -10.781 5.045 684 HG12 ILE 523 HG12 ILE 523 106.325 -7.872 5.673 685 HG13 ILE 523 HG13 ILE 523 105.705 -9.231 6.606 686 HG21 ILE 523 HG21 ILE 523 107.957 -10.064 3.109 687 HG22 ILE 523 HG22 ILE 523 108.544 -8.967 4.359 688 HG23 ILE 523 HG23 ILE 523 107.299 -8.432 3.231 689 HD11 ILE 523 HD11 ILE 523 108.065 -9.908 7.032 690 HD12 ILE 523 HD12 ILE 523 107.601 -8.359 7.737 691 HD13 ILE 523 HD13 ILE 523 108.572 -8.404 6.265 692 H LEU 524 H LEU 524 104.633 -8.699 1.850 693 HA LEU 524 HA LEU 524 104.506 -10.869 0.104 694 HB2 LEU 524 HB2 LEU 524 104.379 -8.009 -0.070 695 HB3 LEU 524 HB3 LEU 524 105.349 -8.632 -1.390 696 HG LEU 524 HG LEU 524 103.570 -9.841 -2.302 697 HD11 LEU 524 HD11 LEU 524 102.670 -11.081 -0.570 698 HD12 LEU 524 HD12 LEU 524 101.358 -9.970 -0.963 699 HD13 LEU 524 HD13 LEU 524 102.385 -9.661 0.437 700 HD21 LEU 524 HD21 LEU 524 101.702 -7.824 -1.408 701 HD22 LEU 524 HD22 LEU 524 102.409 -8.082 -3.002 702 HD23 LEU 524 HD23 LEU 524 103.275 -7.127 -1.799 703 H SER 525 H SER 525 105.934 -11.855 -1.253 704 HA SER 525 HA SER 525 108.702 -10.947 -1.328 705 HB2 SER 525 HB2 SER 525 108.275 -12.639 0.600 706 HB3 SER 525 HB3 SER 525 108.167 -13.836 -0.690 707 HG SER 525 HG SER 525 110.257 -13.507 -1.192 708 H GLY 526 H GLY 526 110.009 -12.144 -2.921 709 HA2 GLY 526 HA2 GLY 526 110.297 -12.725 -5.126 710 HA3 GLY 526 HA3 GLY 526 109.119 -13.974 -4.754 711 H ASP 527 H ASP 527 108.339 -13.842 -6.905 712 HA ASP 527 HA ASP 527 107.530 -11.700 -8.347 713 HB2 ASP 527 HB2 ASP 527 106.307 -14.426 -8.042 714 HB3 ASP 527 HB3 ASP 527 105.570 -13.232 -9.106 715 H HIS 528 H HIS 528 105.997 -12.964 -5.470 716 HA HIS 528 HA HIS 528 103.515 -11.647 -5.716 717 HB2 HIS 528 HB2 HIS 528 104.622 -13.410 -3.927 718 HB3 HIS 528 HB3 HIS 528 104.557 -11.928 -2.980 719 HD1 HIS 528 HD1 HIS 528 102.783 -13.453 -1.588 720 HD2 HIS 528 HD2 HIS 528 101.576 -12.100 -5.327 721 HE1 HIS 528 HE1 HIS 528 100.279 -13.681 -1.609 722 HE2 HIS 528 HE2 HIS 528 99.582 -12.952 -3.917 723 H GLU 529 H GLU 529 106.530 -10.715 -4.076 724 HA GLU 529 HA GLU 529 105.567 -8.198 -3.184 725 HB2 GLU 529 HB2 GLU 529 107.404 -8.907 -1.970 726 HB3 GLU 529 HB3 GLU 529 108.245 -9.507 -3.392 727 HG2 GLU 529 HG2 GLU 529 108.999 -7.389 -3.991 728 HG3 GLU 529 HG3 GLU 529 107.800 -6.576 -2.988 729 H GLN 530 H GLN 530 107.512 -9.222 -5.948 730 HA GLN 530 HA GLN 530 107.967 -6.669 -7.028 731 HB2 GLN 530 HB2 GLN 530 109.296 -8.522 -7.767 732 HB3 GLN 530 HB3 GLN 530 107.873 -9.392 -8.323 733 HG2 GLN 530 HG2 GLN 530 107.807 -6.978 -9.699 734 HG3 GLN 530 HG3 GLN 530 109.503 -7.457 -9.698 735 HE21 GLN 530 HE21 GLN 530 106.351 -8.119 -10.891 736 HE22 GLN 530 HE22 GLN 530 106.785 -9.407 -11.958 737 H ARG 531 H ARG 531 105.355 -8.995 -7.550 738 HA ARG 531 HA ARG 531 104.085 -7.686 -9.673 739 HB2 ARG 531 HB2 ARG 531 103.648 -10.026 -8.712 740 HB3 ARG 531 HB3 ARG 531 102.611 -9.218 -7.543 741 HG2 ARG 531 HG2 ARG 531 102.176 -8.621 -10.414 742 HG3 ARG 531 HG3 ARG 531 101.678 -10.203 -9.811 743 HD2 ARG 531 HD2 ARG 531 100.885 -8.048 -8.037 744 HD3 ARG 531 HD3 ARG 531 100.229 -7.847 -9.661 745 HE ARG 531 HE ARG 531 99.342 -9.683 -7.727 746 HH11 ARG 531 HH11 ARG 531 100.057 -9.497 -11.129 747 HH12 ARG 531 HH12 ARG 531 98.922 -10.730 -11.568 748 HH21 ARG 531 HH21 ARG 531 97.844 -11.307 -8.293 749 HH22 ARG 531 HH22 ARG 531 97.663 -11.759 -9.954 750 H TYR 532 H TYR 532 103.341 -7.539 -6.184 751 HA TYR 532 HA TYR 532 101.301 -5.655 -6.314 752 HB2 TYR 532 HB2 TYR 532 101.792 -6.900 -4.288 753 HB3 TYR 532 HB3 TYR 532 103.356 -6.108 -4.142 754 HD1 TYR 532 HD1 TYR 532 103.417 -3.640 -3.661 755 HD2 TYR 532 HD2 TYR 532 99.844 -5.924 -3.395 756 HE1 TYR 532 HE1 TYR 532 102.402 -1.883 -2.269 757 HE2 TYR 532 HE2 TYR 532 98.814 -4.168 -2.014 758 HH TYR 532 HH TYR 532 99.032 -1.911 -1.439 759 H TRP 533 H TRP 533 104.800 -5.154 -6.025 760 HA TRP 533 HA TRP 533 104.700 -2.352 -5.805 761 HB2 TRP 533 HB2 TRP 533 106.798 -4.351 -6.467 762 HB3 TRP 533 HB3 TRP 533 107.109 -2.674 -6.913 763 HD1 TRP 533 HD1 TRP 533 107.522 -4.962 -4.088 764 HE1 TRP 533 HE1 TRP 533 107.957 -3.672 -1.906 765 HE3 TRP 533 HE3 TRP 533 106.206 -0.275 -5.640 766 HZ2 TRP 533 HZ2 TRP 533 107.762 -1.011 -0.963 767 HZ3 TRP 533 HZ3 TRP 533 106.359 1.588 -4.039 768 HH2 TRP 533 HH2 TRP 533 107.122 1.224 -1.750 769 H GLN 534 H GLN 534 104.887 -4.502 -8.597 770 HA GLN 534 HA GLN 534 105.334 -2.673 -10.615 771 HB2 GLN 534 HB2 GLN 534 103.652 -5.173 -10.537 772 HB3 GLN 534 HB3 GLN 534 103.845 -4.235 -12.011 773 HG2 GLN 534 HG2 GLN 534 106.226 -5.204 -10.481 774 HG3 GLN 534 HG3 GLN 534 105.379 -6.254 -11.617 775 HE21 GLN 534 HE21 GLN 534 105.199 -5.517 -13.830 776 HE22 GLN 534 HE22 GLN 534 106.444 -4.524 -14.498 777 H LYS 535 H LYS 535 102.293 -3.559 -9.042 778 HA LYS 535 HA LYS 535 100.611 -1.920 -10.594 779 HB2 LYS 535 HB2 LYS 535 99.280 -3.324 -9.419 780 HB3 LYS 535 HB3 LYS 535 100.414 -3.443 -8.083 781 HG2 LYS 535 HG2 LYS 535 98.812 -0.951 -8.454 782 HG3 LYS 535 HG3 LYS 535 98.081 -2.377 -7.714 783 HD2 LYS 535 HD2 LYS 535 100.645 -1.957 -6.546 784 HD3 LYS 535 HD3 LYS 535 99.754 -0.433 -6.511 785 HE2 LYS 535 HE2 LYS 535 98.285 -2.882 -5.721 786 HE3 LYS 535 HE3 LYS 535 99.520 -2.293 -4.609 787 HZ1 LYS 535 HZ1 LYS 535 98.422 -0.143 -4.581 788 HZ2 LYS 535 HZ2 LYS 535 97.348 -1.360 -4.107 789 HZ3 LYS 535 HZ3 LYS 535 97.243 -0.699 -5.660 790 H ILE 536 H ILE 536 102.449 -1.327 -7.621 791 HA ILE 536 HA ILE 536 101.415 1.250 -7.086 792 HB ILE 536 HB ILE 536 104.156 0.172 -6.413 793 HG12 ILE 536 HG12 ILE 536 101.599 0.185 -4.796 794 HG13 ILE 536 HG13 ILE 536 102.374 -1.235 -5.494 795 HG21 ILE 536 HG21 ILE 536 103.645 2.716 -6.327 796 HG22 ILE 536 HG22 ILE 536 104.458 1.944 -4.966 797 HG23 ILE 536 HG23 ILE 536 102.733 2.301 -4.876 798 HD11 ILE 536 HD11 ILE 536 102.793 -0.096 -2.960 799 HD12 ILE 536 HD12 ILE 536 104.268 0.168 -3.890 800 HD13 ILE 536 HD13 ILE 536 103.632 -1.464 -3.694 801 H LEU 537 H LEU 537 104.653 0.446 -8.328 802 HA LEU 537 HA LEU 537 105.432 2.945 -9.138 803 HB2 LEU 537 HB2 LEU 537 106.106 0.186 -10.004 804 HB3 LEU 537 HB3 LEU 537 106.635 1.500 -11.036 805 HG LEU 537 HG LEU 537 107.257 1.548 -8.105 806 HD11 LEU 537 HD11 LEU 537 108.474 -0.304 -8.291 807 HD12 LEU 537 HD12 LEU 537 109.535 0.605 -9.367 808 HD13 LEU 537 HD13 LEU 537 108.231 -0.377 -10.036 809 HD21 LEU 537 HD21 LEU 537 108.418 3.360 -8.647 810 HD22 LEU 537 HD22 LEU 537 107.736 3.255 -10.269 811 HD23 LEU 537 HD23 LEU 537 109.283 2.488 -9.913 812 H VAL 538 H VAL 538 103.651 0.542 -11.057 813 HA VAL 538 HA VAL 538 103.502 2.081 -13.410 814 HB VAL 538 HB VAL 538 101.680 -0.107 -12.406 815 HG11 VAL 538 HG11 VAL 538 100.580 1.369 -14.064 816 HG12 VAL 538 HG12 VAL 538 100.815 -0.279 -14.646 817 HG13 VAL 538 HG13 VAL 538 101.882 1.012 -15.198 818 HG21 VAL 538 HG21 VAL 538 103.005 -1.617 -13.527 819 HG22 VAL 538 HG22 VAL 538 104.213 -0.461 -12.964 820 HG23 VAL 538 HG23 VAL 538 103.644 -0.401 -14.632 821 H ASP 539 H ASP 539 101.361 1.845 -10.599 822 HA ASP 539 HA ASP 539 99.256 3.397 -11.666 823 HB2 ASP 539 HB2 ASP 539 98.796 2.054 -9.747 824 HB3 ASP 539 HB3 ASP 539 100.100 2.803 -8.827 825 H ARG 540 H ARG 540 102.161 4.229 -9.841 826 HA ARG 540 HA ARG 540 101.549 6.940 -9.400 827 HB2 ARG 540 HB2 ARG 540 104.307 5.761 -9.745 828 HB3 ARG 540 HB3 ARG 540 103.879 7.222 -8.865 829 HG2 ARG 540 HG2 ARG 540 102.353 5.164 -7.729 830 HG3 ARG 540 HG3 ARG 540 103.977 4.510 -7.949 831 HD2 ARG 540 HD2 ARG 540 103.667 7.240 -6.795 832 HD3 ARG 540 HD3 ARG 540 103.324 5.843 -5.775 833 HE ARG 540 HE ARG 540 105.839 5.647 -7.133 834 HH11 ARG 540 HH11 ARG 540 104.210 6.972 -4.354 835 HH12 ARG 540 HH12 ARG 540 105.646 7.054 -3.389 836 HH21 ARG 540 HH21 ARG 540 107.737 5.752 -5.871 837 HH22 ARG 540 HH22 ARG 540 107.652 6.362 -4.252 838 H GLN 541 H GLN 541 103.214 5.285 -12.037 839 HA GLN 541 HA GLN 541 104.031 7.579 -13.450 840 HB2 GLN 541 HB2 GLN 541 103.737 4.692 -14.039 841 HB3 GLN 541 HB3 GLN 541 103.730 5.766 -15.431 842 HG2 GLN 541 HG2 GLN 541 105.956 5.265 -15.252 843 HG3 GLN 541 HG3 GLN 541 105.864 6.765 -14.332 844 HE21 GLN 541 HE21 GLN 541 106.958 3.635 -14.322 845 HE22 GLN 541 HE22 GLN 541 107.236 3.443 -12.628 846 H ALA 542 H ALA 542 101.090 5.620 -13.616 847 HA ALA 542 HA ALA 542 99.924 6.923 -15.817 848 HB1 ALA 542 HB1 ALA 542 97.738 6.068 -14.675 849 HB2 ALA 542 HB2 ALA 542 98.859 5.221 -13.609 850 HB3 ALA 542 HB3 ALA 542 98.895 4.919 -15.347 851 H LYS 543 H LYS 543 99.967 7.649 -12.390 852 HA LYS 543 HA LYS 543 97.913 9.560 -12.327 853 HB2 LYS 543 HB2 LYS 543 100.200 8.823 -10.609 854 HB3 LYS 543 HB3 LYS 543 99.596 10.461 -10.406 855 HG2 LYS 543 HG2 LYS 543 98.613 8.719 -8.882 856 HG3 LYS 543 HG3 LYS 543 97.454 9.702 -9.780 857 HD2 LYS 543 HD2 LYS 543 98.173 7.371 -11.302 858 HD3 LYS 543 HD3 LYS 543 97.620 6.903 -9.693 859 HE2 LYS 543 HE2 LYS 543 95.961 8.975 -10.865 860 HE3 LYS 543 HE3 LYS 543 96.027 7.528 -11.871 861 HZ1 LYS 543 HZ1 LYS 543 94.502 7.928 -9.598 862 HZ2 LYS 543 HZ2 LYS 543 95.695 6.813 -9.156 863 HZ3 LYS 543 HZ3 LYS 543 94.683 6.489 -10.471 864 H LEU 544 H LEU 544 101.073 9.694 -13.658 865 HA LEU 544 HA LEU 544 101.713 12.390 -13.454 866 HB2 LEU 544 HB2 LEU 544 103.219 10.648 -14.337 867 HB3 LEU 544 HB3 LEU 544 102.240 10.550 -15.788 868 HG LEU 544 HG LEU 544 102.793 13.120 -15.964 869 HD11 LEU 544 HD11 LEU 544 104.958 12.041 -14.178 870 HD12 LEU 544 HD12 LEU 544 103.938 13.458 -13.927 871 HD13 LEU 544 HD13 LEU 544 105.170 13.471 -15.188 872 HD21 LEU 544 HD21 LEU 544 105.184 11.601 -16.675 873 HD22 LEU 544 HD22 LEU 544 104.060 12.497 -17.698 874 HD23 LEU 544 HD23 LEU 544 103.680 10.847 -17.203 875 H ASN 545 H ASN 545 99.414 10.784 -15.545 876 HA ASN 545 HA ASN 545 98.744 13.401 -16.724 877 HB2 ASN 545 HB2 ASN 545 99.194 10.801 -17.962 878 HB3 ASN 545 HB3 ASN 545 97.639 11.496 -18.409 879 HD21 ASN 545 HD21 ASN 545 100.518 13.319 -17.597 880 HD22 ASN 545 HD22 ASN 545 100.764 13.991 -19.169 881 H GLN 546 H GLN 546 96.459 13.646 -17.358 882 HA GLN 546 HA GLN 546 94.449 11.941 -16.322 883 HB2 GLN 546 HB2 GLN 546 95.583 13.418 -14.338 884 HB3 GLN 546 HB3 GLN 546 94.286 14.490 -14.849 885 HG2 GLN 546 HG2 GLN 546 92.630 12.890 -14.345 886 HG3 GLN 546 HG3 GLN 546 93.821 11.602 -14.174 887 HE21 GLN 546 HE21 GLN 546 93.624 14.895 -12.875 888 HE22 GLN 546 HE22 GLN 546 93.760 14.435 -11.216 889 HA PRO 547 HA PRO 547 93.255 14.888 -19.713 890 HB2 PRO 547 HB2 PRO 547 91.719 12.986 -20.972 891 HB3 PRO 547 HB3 PRO 547 93.427 13.272 -21.316 892 HG2 PRO 547 HG2 PRO 547 92.169 11.188 -19.576 893 HG3 PRO 547 HG3 PRO 547 93.521 11.031 -20.714 894 HD2 PRO 547 HD2 PRO 547 93.930 11.210 -18.069 895 HD3 PRO 547 HD3 PRO 547 95.039 11.969 -19.231 896 H ARG 548 H ARG 548 92.111 15.720 -17.694 897 HA ARG 548 HA ARG 548 89.353 14.795 -17.453 898 HB2 ARG 548 HB2 ARG 548 91.229 15.911 -15.654 899 HB3 ARG 548 HB3 ARG 548 89.926 17.081 -15.815 900 HG2 ARG 548 HG2 ARG 548 89.596 15.493 -13.956 901 HG3 ARG 548 HG3 ARG 548 88.298 15.446 -15.152 902 HD2 ARG 548 HD2 ARG 548 88.680 13.299 -15.598 903 HD3 ARG 548 HD3 ARG 548 90.405 13.588 -15.820 904 HE ARG 548 HE ARG 548 89.520 13.485 -13.069 905 HH11 ARG 548 HH11 ARG 548 90.784 11.715 -15.790 906 HH12 ARG 548 HH12 ARG 548 91.431 10.433 -14.821 907 HH21 ARG 548 HH21 ARG 548 90.369 11.805 -11.784 908 HH22 ARG 548 HH22 ARG 548 91.193 10.484 -12.541 909 H GLU 549 H GLU 549 88.835 15.554 -19.633 910 HA GLU 549 HA GLU 549 88.534 18.471 -19.825 911 HB2 GLU 549 HB2 GLU 549 89.072 16.338 -21.758 912 HB3 GLU 549 HB3 GLU 549 87.814 17.450 -22.281 913 HG2 GLU 549 HG2 GLU 549 89.265 19.099 -22.660 914 HG3 GLU 549 HG3 GLU 549 90.160 18.782 -21.174 915 H LYS 550 H LYS 550 86.750 17.858 -18.149 916 HA LYS 550 HA LYS 550 84.270 17.182 -19.579 917 HB2 LYS 550 HB2 LYS 550 85.087 15.896 -17.464 918 HB3 LYS 550 HB3 LYS 550 84.490 17.300 -16.591 919 HG2 LYS 550 HG2 LYS 550 82.463 16.423 -16.628 920 HG3 LYS 550 HG3 LYS 550 82.460 16.554 -18.388 921 HD2 LYS 550 HD2 LYS 550 83.972 14.269 -17.346 922 HD3 LYS 550 HD3 LYS 550 82.244 14.221 -16.988 923 HE2 LYS 550 HE2 LYS 550 82.001 13.365 -19.037 924 HE3 LYS 550 HE3 LYS 550 82.307 14.999 -19.624 925 HZ1 LYS 550 HZ1 LYS 550 84.512 14.503 -20.087 926 HZ2 LYS 550 HZ2 LYS 550 83.705 13.095 -20.562 927 HZ3 LYS 550 HZ3 LYS 550 84.535 13.137 -19.090 928 H LYS 551 H LYS 551 85.691 19.812 -19.471 929 HA LYS 551 HA LYS 551 85.262 22.027 -19.092 930 HB2 LYS 551 HB2 LYS 551 82.536 20.919 -19.737 931 HB3 LYS 551 HB3 LYS 551 82.851 22.642 -19.588 932 HG2 LYS 551 HG2 LYS 551 84.574 22.406 -21.375 933 HG3 LYS 551 HG3 LYS 551 84.039 20.739 -21.591 934 HD2 LYS 551 HD2 LYS 551 82.135 23.059 -21.743 935 HD3 LYS 551 HD3 LYS 551 83.044 22.502 -23.149 936 HE2 LYS 551 HE2 LYS 551 82.096 20.219 -22.743 937 HE3 LYS 551 HE3 LYS 551 81.061 20.935 -21.508 938 HZ1 LYS 551 HZ1 LYS 551 79.968 22.246 -23.120 939 HZ2 LYS 551 HZ2 LYS 551 80.034 20.681 -23.758 940 HZ3 LYS 551 HZ3 LYS 551 81.099 21.868 -24.321 941 H ARG 552 H ARG 552 82.109 21.166 -17.890 942 HA ARG 552 HA ARG 552 82.488 22.688 -15.508 943 HB2 ARG 552 HB2 ARG 552 80.221 20.787 -15.630 944 HB3 ARG 552 HB3 ARG 552 80.239 22.495 -15.211 945 HG2 ARG 552 HG2 ARG 552 80.843 22.547 -17.878 946 HG3 ARG 552 HG3 ARG 552 79.715 21.195 -17.768 947 HD2 ARG 552 HD2 ARG 552 78.210 22.880 -18.011 948 HD3 ARG 552 HD3 ARG 552 78.389 22.936 -16.257 949 HE ARG 552 HE ARG 552 80.303 24.627 -17.394 950 HH11 ARG 552 HH11 ARG 552 76.846 24.402 -17.027 951 HH12 ARG 552 HH12 ARG 552 76.600 26.117 -17.074 952 HH21 ARG 552 HH21 ARG 552 79.990 26.885 -17.458 953 HH22 ARG 552 HH22 ARG 552 78.387 27.527 -17.320 954 H GLY 553 H GLY 553 83.128 22.057 -13.536 955 HA2 GLY 553 HA2 GLY 553 82.711 19.878 -12.070 956 HA3 GLY 553 HA3 GLY 553 83.926 19.275 -13.188 957 H THR 554 H THR 554 86.026 19.658 -12.769 958 HA THR 554 HA THR 554 86.659 21.594 -10.639 959 HB THR 554 HB THR 554 88.682 19.676 -10.557 960 HG1 THR 554 HG1 THR 554 87.727 17.908 -11.245 961 HG21 THR 554 HG21 THR 554 88.006 19.357 -8.331 962 HG22 THR 554 HG22 THR 554 86.316 19.695 -8.707 963 HG23 THR 554 HG23 THR 554 87.501 21.001 -8.721 964 H GLU 555 H GLU 555 89.272 21.727 -10.624 965 HA GLU 555 HA GLU 555 90.140 22.141 -13.405 966 HB2 GLU 555 HB2 GLU 555 90.770 24.039 -11.143 967 HB3 GLU 555 HB3 GLU 555 91.113 24.261 -12.853 968 HG2 GLU 555 HG2 GLU 555 88.933 24.771 -13.367 969 HG3 GLU 555 HG3 GLU 555 88.292 23.921 -11.961 970 H LYS 556 H LYS 556 92.685 23.141 -12.809 971 HA LYS 556 HA LYS 556 93.933 21.020 -11.209 972 HB2 LYS 556 HB2 LYS 556 95.509 20.473 -12.891 973 HB3 LYS 556 HB3 LYS 556 93.939 20.469 -13.683 974 HG2 LYS 556 HG2 LYS 556 94.389 22.715 -14.561 975 HG3 LYS 556 HG3 LYS 556 95.979 22.681 -13.795 976 HD2 LYS 556 HD2 LYS 556 96.784 21.699 -15.621 977 HD3 LYS 556 HD3 LYS 556 95.767 20.300 -15.273 978 HE2 LYS 556 HE2 LYS 556 95.276 20.988 -17.496 979 HE3 LYS 556 HE3 LYS 556 93.910 21.466 -16.489 980 HZ1 LYS 556 HZ1 LYS 556 95.217 23.090 -18.197 981 HZ2 LYS 556 HZ2 LYS 556 95.949 23.486 -16.725 982 HZ3 LYS 556 HZ3 LYS 556 94.272 23.617 -16.896 983 H LEU 557 H LEU 557 93.429 24.073 -11.169 984 HA LEU 557 HA LEU 557 95.812 25.470 -11.379 985 HB2 LEU 557 HB2 LEU 557 94.798 27.174 -10.169 986 HB3 LEU 557 HB3 LEU 557 93.440 26.321 -10.879 987 HG LEU 557 HG LEU 557 94.269 25.504 -8.144 988 HD11 LEU 557 HD11 LEU 557 93.360 27.319 -7.035 989 HD12 LEU 557 HD12 LEU 557 92.515 27.903 -8.469 990 HD13 LEU 557 HD13 LEU 557 94.265 28.081 -8.342 991 HD21 LEU 557 HD21 LEU 557 91.995 25.267 -9.904 992 HD22 LEU 557 HD22 LEU 557 91.524 25.909 -8.331 993 HD23 LEU 557 HD23 LEU 557 92.381 24.371 -8.435 994 H ILE 558 H ILE 558 97.085 26.393 -9.524 995 HA ILE 558 HA ILE 558 97.565 24.350 -7.455 996 HB ILE 558 HB ILE 558 100.005 25.503 -7.678 997 HG12 ILE 558 HG12 ILE 558 98.982 26.688 -9.767 998 HG13 ILE 558 HG13 ILE 558 100.603 26.007 -9.868 999 HG21 ILE 558 HG21 ILE 558 99.000 23.126 -9.237 1000 HG22 ILE 558 HG22 ILE 558 99.550 23.117 -7.562 1001 HG23 ILE 558 HG23 ILE 558 100.688 23.469 -8.861 1002 HD11 ILE 558 HD11 ILE 558 100.002 24.655 -11.513 1003 HD12 ILE 558 HD12 ILE 558 98.467 25.521 -11.569 1004 HD13 ILE 558 HD13 ILE 558 98.618 24.055 -10.600 1005 H THR 559 H THR 559 98.975 25.319 -5.637 1006 HA THR 559 HA THR 559 98.887 26.690 -3.803 1007 HB THR 559 HB THR 559 100.508 27.861 -5.272 1008 HG1 THR 559 HG1 THR 559 99.836 28.726 -3.145 1009 HG21 THR 559 HG21 THR 559 99.233 28.479 -7.158 1010 HG22 THR 559 HG22 THR 559 99.650 29.992 -6.355 1011 HG23 THR 559 HG23 THR 559 98.032 29.314 -6.171 1012 H LYS 560 H LYS 560 97.960 29.137 -3.230 1013 HA LYS 560 HA LYS 560 95.102 28.745 -3.269 1014 HB2 LYS 560 HB2 LYS 560 96.991 30.596 -1.881 1015 HB3 LYS 560 HB3 LYS 560 95.302 31.061 -1.997 1016 HG2 LYS 560 HG2 LYS 560 96.468 29.456 -0.059 1017 HG3 LYS 560 HG3 LYS 560 94.744 29.711 -0.329 1018 HD2 LYS 560 HD2 LYS 560 94.506 27.720 -1.501 1019 HD3 LYS 560 HD3 LYS 560 96.223 27.632 -1.898 1020 HE2 LYS 560 HE2 LYS 560 95.598 27.578 0.974 1021 HE3 LYS 560 HE3 LYS 560 95.017 26.188 0.057 1022 HZ1 LYS 560 HZ1 LYS 560 97.819 27.173 0.152 1023 HZ2 LYS 560 HZ2 LYS 560 97.277 25.871 -0.784 1024 HZ3 LYS 560 HZ3 LYS 560 97.224 25.779 0.905 1025 H ALA 561 H ALA 561 95.438 28.999 -5.778 1026 HA ALA 561 HA ALA 561 94.818 30.143 -7.640 1027 HB1 ALA 561 HB1 ALA 561 93.933 32.488 -6.015 1028 HB2 ALA 561 HB2 ALA 561 93.033 30.973 -5.935 1029 HB3 ALA 561 HB3 ALA 561 93.227 31.804 -7.479 Start of MODEL 9 1 H1 MET 437 HT1 MET 437 122.382 -9.686 -39.568 2 H2 MET 437 HT2 MET 437 123.015 -11.260 -39.826 3 H3 MET 437 HT3 MET 437 124.002 -10.038 -39.134 4 HA MET 437 HA MET 437 121.518 -10.983 -37.891 5 HB2 MET 437 HB2 MET 437 123.105 -12.329 -36.440 6 HB3 MET 437 HB3 MET 437 122.873 -12.927 -38.078 7 HG2 MET 437 HG2 MET 437 125.160 -11.115 -37.440 8 HG3 MET 437 HG3 MET 437 125.249 -12.838 -37.074 9 HE1 MET 437 HE1 MET 437 127.580 -12.164 -39.794 10 HE2 MET 437 HE2 MET 437 126.972 -11.006 -38.612 11 HE3 MET 437 HE3 MET 437 126.668 -10.755 -40.330 12 H HIS 438 H HIS 438 121.016 -9.061 -36.929 13 HA HIS 438 HA HIS 438 122.757 -8.195 -34.785 14 HB2 HIS 438 HB2 HIS 438 122.465 -6.682 -37.279 15 HB3 HIS 438 HB3 HIS 438 122.118 -5.736 -35.834 16 HD1 HIS 438 HD1 HIS 438 124.865 -6.942 -37.878 17 HD2 HIS 438 HD2 HIS 438 124.352 -5.763 -33.926 18 HE1 HIS 438 HE1 HIS 438 127.179 -6.485 -37.006 19 HE2 HIS 438 HE2 HIS 438 126.847 -5.792 -34.607 20 H HIS 439 H HIS 439 119.844 -7.306 -36.634 21 HA HIS 439 HA HIS 439 117.745 -6.727 -35.982 22 HB2 HIS 439 HB2 HIS 439 118.622 -8.785 -34.095 23 HB3 HIS 439 HB3 HIS 439 117.363 -7.740 -33.445 24 HD1 HIS 439 HD1 HIS 439 117.141 -10.834 -34.377 25 HD2 HIS 439 HD2 HIS 439 115.710 -7.478 -36.367 26 HE1 HIS 439 HE1 HIS 439 115.286 -11.669 -35.857 27 HE2 HIS 439 HE2 HIS 439 114.492 -9.634 -37.112 28 H HIS 440 H HIS 440 116.477 -5.762 -33.958 29 HA HIS 440 HA HIS 440 118.235 -3.784 -32.667 30 HB2 HIS 440 HB2 HIS 440 116.222 -2.202 -32.896 31 HB3 HIS 440 HB3 HIS 440 117.179 -2.517 -34.339 32 HD1 HIS 440 HD1 HIS 440 113.845 -3.291 -32.788 33 HD2 HIS 440 HD2 HIS 440 115.835 -3.801 -36.400 34 HE1 HIS 440 HE1 HIS 440 112.095 -4.071 -34.416 35 HE2 HIS 440 HE2 HIS 440 113.306 -4.297 -36.614 36 H HIS 441 H HIS 441 117.661 -6.015 -31.290 37 HA HIS 441 HA HIS 441 115.412 -5.310 -29.532 38 HB2 HIS 441 HB2 HIS 441 116.227 -7.779 -30.641 39 HB3 HIS 441 HB3 HIS 441 116.550 -7.875 -28.914 40 HD1 HIS 441 HD1 HIS 441 114.639 -8.750 -27.628 41 HD2 HIS 441 HD2 HIS 441 113.396 -6.735 -31.042 42 HE1 HIS 441 HE1 HIS 441 112.131 -8.940 -27.646 43 HE2 HIS 441 HE2 HIS 441 111.405 -7.771 -29.757 44 H HIS 442 H HIS 442 116.286 -6.881 -27.325 45 HA HIS 442 HA HIS 442 118.871 -5.907 -26.501 46 HB2 HIS 442 HB2 HIS 442 116.605 -5.016 -24.758 47 HB3 HIS 442 HB3 HIS 442 118.241 -4.374 -24.875 48 HD1 HIS 442 HD1 HIS 442 118.713 -2.667 -26.766 49 HD2 HIS 442 HD2 HIS 442 114.766 -3.955 -26.577 50 HE1 HIS 442 HE1 HIS 442 117.417 -1.079 -28.223 51 HE2 HIS 442 HE2 HIS 442 115.021 -1.835 -28.037 52 H HIS 443 H HIS 443 119.187 -6.443 -24.065 53 HA HIS 443 HA HIS 443 117.751 -8.917 -23.386 54 HB2 HIS 443 HB2 HIS 443 120.472 -8.719 -24.204 55 HB3 HIS 443 HB3 HIS 443 120.454 -9.131 -22.493 56 HD1 HIS 443 HD1 HIS 443 121.552 -11.357 -23.822 57 HD2 HIS 443 HD2 HIS 443 117.437 -10.787 -23.929 58 HE1 HIS 443 HE1 HIS 443 120.578 -13.602 -24.394 59 HE2 HIS 443 HE2 HIS 443 118.094 -13.212 -24.545 60 H SER 444 H SER 444 117.321 -9.222 -21.249 61 HA SER 444 HA SER 444 116.872 -8.595 -19.105 62 HB2 SER 444 HB2 SER 444 119.032 -9.363 -18.570 63 HB3 SER 444 HB3 SER 444 119.812 -8.002 -19.377 64 HG SER 444 HG SER 444 118.109 -7.517 -17.203 65 H ASN 445 H ASN 445 119.262 -6.051 -19.349 66 HA ASN 445 HA ASN 445 119.051 -3.767 -19.566 67 HB2 ASN 445 HB2 ASN 445 116.055 -4.054 -19.665 68 HB3 ASN 445 HB3 ASN 445 117.051 -2.746 -20.299 69 HD21 ASN 445 HD21 ASN 445 115.299 -5.405 -21.109 70 HD22 ASN 445 HD22 ASN 445 115.998 -5.752 -22.651 71 H ALA 446 H ALA 446 116.127 -4.859 -17.839 72 HA ALA 446 HA ALA 446 115.475 -4.620 -15.668 73 HB1 ALA 446 HB1 ALA 446 118.362 -4.480 -15.492 74 HB2 ALA 446 HB2 ALA 446 117.196 -5.211 -14.388 75 HB3 ALA 446 HB3 ALA 446 117.577 -3.494 -14.258 76 H THR 447 H THR 447 114.079 -3.076 -15.187 77 HA THR 447 HA THR 447 114.756 -0.292 -15.792 78 HB THR 447 HB THR 447 112.034 -1.135 -14.877 79 HG1 THR 447 HG1 THR 447 113.060 -1.482 -17.517 80 HG21 THR 447 HG21 THR 447 113.180 1.231 -15.802 81 HG22 THR 447 HG22 THR 447 111.463 0.901 -15.574 82 HG23 THR 447 HG23 THR 447 112.210 0.636 -17.150 83 H GLY 448 H GLY 448 115.910 -1.580 -13.490 84 HA2 GLY 448 HA2 GLY 448 115.918 0.300 -11.578 85 HA3 GLY 448 HA3 GLY 448 114.456 -0.589 -11.182 86 HA PRO 449 HA PRO 449 118.463 -3.536 -10.814 87 HB2 PRO 449 HB2 PRO 449 120.118 -1.303 -9.725 88 HB3 PRO 449 HB3 PRO 449 120.613 -2.710 -10.676 89 HG2 PRO 449 HG2 PRO 449 120.427 -0.311 -11.811 90 HG3 PRO 449 HG3 PRO 449 119.909 -1.769 -12.678 91 HD2 PRO 449 HD2 PRO 449 118.263 0.350 -11.377 92 HD3 PRO 449 HD3 PRO 449 117.934 -0.598 -12.841 93 H GLN 450 H GLN 450 117.105 -4.337 -9.206 94 HA GLN 450 HA GLN 450 116.494 -4.883 -7.085 95 HB2 GLN 450 HB2 GLN 450 119.174 -4.243 -6.911 96 HB3 GLN 450 HB3 GLN 450 118.449 -3.237 -5.664 97 HG2 GLN 450 HG2 GLN 450 119.244 -5.471 -4.894 98 HG3 GLN 450 HG3 GLN 450 117.552 -5.121 -4.543 99 HE21 GLN 450 HE21 GLN 450 115.959 -6.306 -5.522 100 HE22 GLN 450 HE22 GLN 450 116.273 -7.728 -6.450 101 H PHE 451 H PHE 451 114.706 -3.343 -7.803 102 HA PHE 451 HA PHE 451 114.586 -0.725 -6.733 103 HB2 PHE 451 HB2 PHE 451 112.284 -0.724 -7.393 104 HB3 PHE 451 HB3 PHE 451 113.185 -1.599 -8.626 105 HD1 PHE 451 HD1 PHE 451 110.813 -1.914 -5.844 106 HD2 PHE 451 HD2 PHE 451 112.822 -3.929 -9.010 107 HE1 PHE 451 HE1 PHE 451 109.290 -3.830 -5.587 108 HE2 PHE 451 HE2 PHE 451 111.304 -5.848 -8.758 109 HZ PHE 451 HZ PHE 451 109.534 -5.799 -7.046 110 H VAL 452 H VAL 452 114.502 -0.196 -4.659 111 HA VAL 452 HA VAL 452 114.112 -1.937 -2.533 112 HB VAL 452 HB VAL 452 113.683 0.101 -1.152 113 HG11 VAL 452 HG11 VAL 452 115.889 1.040 -1.430 114 HG12 VAL 452 HG12 VAL 452 116.003 0.370 -3.058 115 HG13 VAL 452 HG13 VAL 452 115.960 -0.707 -1.662 116 HG21 VAL 452 HG21 VAL 452 112.593 1.709 -2.320 117 HG22 VAL 452 HG22 VAL 452 113.364 1.277 -3.846 118 HG23 VAL 452 HG23 VAL 452 114.238 2.246 -2.660 119 H SER 453 H SER 453 112.337 -3.175 -2.356 120 HA SER 453 HA SER 453 109.739 -2.325 -3.141 121 HB2 SER 453 HB2 SER 453 109.257 -4.508 -3.019 122 HB3 SER 453 HB3 SER 453 110.957 -4.758 -2.620 123 HG SER 453 HG SER 453 108.715 -4.709 -0.947 124 H GLY 454 H GLY 454 111.182 -0.869 -0.785 125 HA2 GLY 454 HA2 GLY 454 110.661 -0.182 1.382 126 HA3 GLY 454 HA3 GLY 454 109.184 0.254 0.539 127 H VAL 455 H VAL 455 110.156 -3.068 1.065 128 HA VAL 455 HA VAL 455 108.959 -4.793 1.978 129 HB VAL 455 HB VAL 455 108.537 -3.411 4.523 130 HG11 VAL 455 HG11 VAL 455 109.959 -5.325 5.298 131 HG12 VAL 455 HG12 VAL 455 110.044 -5.853 3.618 132 HG13 VAL 455 HG13 VAL 455 108.488 -5.786 4.444 133 HG21 VAL 455 HG21 VAL 455 111.129 -3.179 3.083 134 HG22 VAL 455 HG22 VAL 455 111.163 -3.515 4.814 135 HG23 VAL 455 HG23 VAL 455 110.360 -2.065 4.214 136 H ILE 456 H ILE 456 106.989 -5.115 1.132 137 HA ILE 456 HA ILE 456 104.760 -3.383 1.887 138 HB ILE 456 HB ILE 456 104.680 -5.750 0.016 139 HG12 ILE 456 HG12 ILE 456 106.343 -4.121 -0.777 140 HG13 ILE 456 HG13 ILE 456 104.924 -4.145 -1.822 141 HG21 ILE 456 HG21 ILE 456 102.736 -4.370 -0.907 142 HG22 ILE 456 HG22 ILE 456 102.833 -3.456 0.597 143 HG23 ILE 456 HG23 ILE 456 102.492 -5.186 0.638 144 HD11 ILE 456 HD11 ILE 456 105.123 -2.148 0.386 145 HD12 ILE 456 HD12 ILE 456 104.216 -2.064 -1.125 146 HD13 ILE 456 HD13 ILE 456 105.971 -1.886 -1.137 147 H VAL 457 H VAL 457 103.342 -3.924 3.447 148 HA VAL 457 HA VAL 457 103.369 -6.705 4.418 149 HB VAL 457 HB VAL 457 102.643 -4.214 5.965 150 HG11 VAL 457 HG11 VAL 457 102.835 -5.868 7.905 151 HG12 VAL 457 HG12 VAL 457 102.710 -7.130 6.680 152 HG13 VAL 457 HG13 VAL 457 101.397 -5.972 6.890 153 HG21 VAL 457 HG21 VAL 457 104.912 -4.014 5.902 154 HG22 VAL 457 HG22 VAL 457 105.169 -5.741 5.650 155 HG23 VAL 457 HG23 VAL 457 104.770 -5.133 7.258 156 H LYS 458 H LYS 458 101.589 -7.826 3.959 157 HA LYS 458 HA LYS 458 99.162 -6.425 3.188 158 HB2 LYS 458 HB2 LYS 458 100.040 -8.348 1.864 159 HB3 LYS 458 HB3 LYS 458 99.713 -9.395 3.239 160 HG2 LYS 458 HG2 LYS 458 97.295 -8.498 3.041 161 HG3 LYS 458 HG3 LYS 458 97.789 -8.018 1.417 162 HD2 LYS 458 HD2 LYS 458 98.512 -10.364 1.009 163 HD3 LYS 458 HD3 LYS 458 97.841 -10.797 2.583 164 HE2 LYS 458 HE2 LYS 458 95.795 -9.410 1.330 165 HE3 LYS 458 HE3 LYS 458 96.504 -10.385 0.044 166 HZ1 LYS 458 HZ1 LYS 458 96.356 -12.148 2.060 167 HZ2 LYS 458 HZ2 LYS 458 95.178 -11.973 0.860 168 HZ3 LYS 458 HZ3 LYS 458 94.980 -11.208 2.355 169 H ILE 459 H ILE 459 97.678 -5.925 4.646 170 HA ILE 459 HA ILE 459 97.402 -7.643 7.023 171 HB ILE 459 HB ILE 459 96.557 -4.755 6.787 172 HG12 ILE 459 HG12 ILE 459 99.015 -6.011 8.015 173 HG13 ILE 459 HG13 ILE 459 98.957 -4.807 6.732 174 HG21 ILE 459 HG21 ILE 459 95.418 -6.442 8.411 175 HG22 ILE 459 HG22 ILE 459 95.907 -4.854 9.003 176 HG23 ILE 459 HG23 ILE 459 96.905 -6.267 9.341 177 HD11 ILE 459 HD11 ILE 459 98.556 -3.090 8.177 178 HD12 ILE 459 HD12 ILE 459 99.521 -4.148 9.207 179 HD13 ILE 459 HD13 ILE 459 97.764 -4.125 9.364 180 H ILE 460 H ILE 460 95.616 -8.809 7.133 181 HA ILE 460 HA ILE 460 93.178 -7.770 5.873 182 HB ILE 460 HB ILE 460 94.354 -9.589 4.500 183 HG12 ILE 460 HG12 ILE 460 91.946 -8.792 4.329 184 HG13 ILE 460 HG13 ILE 460 92.288 -10.393 3.682 185 HG21 ILE 460 HG21 ILE 460 93.585 -11.145 6.911 186 HG22 ILE 460 HG22 ILE 460 94.989 -11.296 5.855 187 HG23 ILE 460 HG23 ILE 460 93.423 -11.909 5.331 188 HD11 ILE 460 HD11 ILE 460 90.622 -11.159 4.910 189 HD12 ILE 460 HD12 ILE 460 90.442 -9.605 5.722 190 HD13 ILE 460 HD13 ILE 460 91.576 -10.801 6.349 191 H SER 461 H SER 461 91.373 -7.927 7.087 192 HA SER 461 HA SER 461 91.671 -9.223 9.704 193 HB2 SER 461 HB2 SER 461 90.171 -7.670 10.596 194 HB3 SER 461 HB3 SER 461 91.077 -6.712 9.426 195 HG SER 461 HG SER 461 89.228 -7.468 7.964 196 H THR 462 H THR 462 89.415 -9.833 10.638 197 HA THR 462 HA THR 462 88.318 -11.819 8.809 198 HB THR 462 HB THR 462 86.976 -12.331 11.056 199 HG1 THR 462 HG1 THR 462 88.318 -11.873 12.858 200 HG21 THR 462 HG21 THR 462 88.258 -14.074 10.289 201 HG22 THR 462 HG22 THR 462 89.141 -13.652 11.757 202 HG23 THR 462 HG23 THR 462 89.723 -13.096 10.188 203 H GLU 463 H GLU 463 87.583 -8.715 9.931 204 HA GLU 463 HA GLU 463 85.449 -8.149 8.412 205 HB2 GLU 463 HB2 GLU 463 84.667 -9.975 10.569 206 HB3 GLU 463 HB3 GLU 463 83.664 -8.534 10.461 207 HG2 GLU 463 HG2 GLU 463 84.171 -9.787 7.878 208 HG3 GLU 463 HG3 GLU 463 83.331 -10.836 9.019 209 HA PRO 464 HA PRO 464 85.293 -5.283 12.231 210 HB2 PRO 464 HB2 PRO 464 86.502 -5.975 14.508 211 HB3 PRO 464 HB3 PRO 464 84.928 -6.650 14.066 212 HG2 PRO 464 HG2 PRO 464 87.644 -7.881 13.861 213 HG3 PRO 464 HG3 PRO 464 86.111 -8.621 14.360 214 HD2 PRO 464 HD2 PRO 464 87.232 -8.838 11.833 215 HD3 PRO 464 HD3 PRO 464 85.517 -9.093 12.209 216 H LEU 465 H LEU 465 87.109 -4.963 10.303 217 HA LEU 465 HA LEU 465 89.772 -4.577 11.327 218 HB2 LEU 465 HB2 LEU 465 89.034 -5.106 8.898 219 HB3 LEU 465 HB3 LEU 465 88.721 -3.387 8.779 220 HG LEU 465 HG LEU 465 91.390 -3.973 9.823 221 HD11 LEU 465 HD11 LEU 465 92.161 -5.411 8.311 222 HD12 LEU 465 HD12 LEU 465 91.504 -4.447 6.990 223 HD13 LEU 465 HD13 LEU 465 90.502 -5.668 7.773 224 HD21 LEU 465 HD21 LEU 465 90.011 -2.085 8.079 225 HD22 LEU 465 HD22 LEU 465 91.617 -2.529 7.501 226 HD23 LEU 465 HD23 LEU 465 91.417 -1.854 9.119 227 HA PRO 466 HA PRO 466 89.040 -0.706 13.395 228 HB2 PRO 466 HB2 PRO 466 91.862 -0.295 12.501 229 HB3 PRO 466 HB3 PRO 466 91.139 -0.045 14.095 230 HG2 PRO 466 HG2 PRO 466 92.639 -2.197 13.580 231 HG3 PRO 466 HG3 PRO 466 91.217 -2.291 14.633 232 HD2 PRO 466 HD2 PRO 466 91.588 -3.288 11.865 233 HD3 PRO 466 HD3 PRO 466 90.524 -3.889 13.151 234 H GLY 467 H GLY 467 91.157 -0.509 10.523 235 HA2 GLY 467 HA2 GLY 467 90.060 0.575 8.526 236 HA3 GLY 467 HA3 GLY 467 89.588 1.839 9.652 237 H ARG 468 H ARG 468 91.369 1.747 7.196 238 HA ARG 468 HA ARG 468 93.977 1.947 7.404 239 HB2 ARG 468 HB2 ARG 468 93.778 4.256 6.152 240 HB3 ARG 468 HB3 ARG 468 93.256 2.762 5.389 241 HG2 ARG 468 HG2 ARG 468 90.934 3.314 6.292 242 HG3 ARG 468 HG3 ARG 468 91.576 4.928 6.602 243 HD2 ARG 468 HD2 ARG 468 92.257 5.028 4.199 244 HD3 ARG 468 HD3 ARG 468 91.399 3.508 3.949 245 HE ARG 468 HE ARG 468 89.444 4.682 3.925 246 HH11 ARG 468 HH11 ARG 468 91.882 6.617 5.485 247 HH12 ARG 468 HH12 ARG 468 90.874 8.020 5.609 248 HH21 ARG 468 HH21 ARG 468 88.109 6.523 4.078 249 HH22 ARG 468 HH22 ARG 468 88.728 7.967 4.809 250 H LYS 469 H LYS 469 91.847 4.395 8.872 251 HA LYS 469 HA LYS 469 93.918 6.061 9.821 252 HB2 LYS 469 HB2 LYS 469 92.152 6.848 11.465 253 HB3 LYS 469 HB3 LYS 469 91.740 6.986 9.761 254 HG2 LYS 469 HG2 LYS 469 90.792 4.494 10.425 255 HG3 LYS 469 HG3 LYS 469 90.466 5.448 11.873 256 HD2 LYS 469 HD2 LYS 469 89.743 6.412 9.119 257 HD3 LYS 469 HD3 LYS 469 88.656 5.405 10.078 258 HE2 LYS 469 HE2 LYS 469 88.816 7.099 11.902 259 HE3 LYS 469 HE3 LYS 469 89.738 8.125 10.803 260 HZ1 LYS 469 HZ1 LYS 469 87.125 7.112 9.933 261 HZ2 LYS 469 HZ2 LYS 469 87.910 8.552 9.523 262 HZ3 LYS 469 HZ3 LYS 469 87.170 8.395 11.035 263 H GLN 470 H GLN 470 92.127 3.415 11.356 264 HA GLN 470 HA GLN 470 93.692 3.555 13.771 265 HB2 GLN 470 HB2 GLN 470 91.493 1.783 12.766 266 HB3 GLN 470 HB3 GLN 470 92.448 1.285 14.157 267 HG2 GLN 470 HG2 GLN 470 91.696 3.051 15.464 268 HG3 GLN 470 HG3 GLN 470 91.161 3.983 14.068 269 HE21 GLN 470 HE21 GLN 470 89.764 3.085 16.534 270 HE22 GLN 470 HE22 GLN 470 88.353 2.258 15.974 271 H VAL 471 H VAL 471 93.473 1.408 10.954 272 HA VAL 471 HA VAL 471 95.304 -0.529 11.782 273 HB VAL 471 HB VAL 471 94.788 0.458 8.973 274 HG11 VAL 471 HG11 VAL 471 96.377 -1.811 10.069 275 HG12 VAL 471 HG12 VAL 471 96.722 -0.749 8.703 276 HG13 VAL 471 HG13 VAL 471 95.516 -2.027 8.545 277 HG21 VAL 471 HG21 VAL 471 92.761 -0.418 9.343 278 HG22 VAL 471 HG22 VAL 471 93.283 -1.234 10.817 279 HG23 VAL 471 HG23 VAL 471 93.571 -1.981 9.246 280 H ARG 472 H ARG 472 95.780 2.508 10.019 281 HA ARG 472 HA ARG 472 98.570 2.264 9.674 282 HB2 ARG 472 HB2 ARG 472 98.544 4.487 8.929 283 HB3 ARG 472 HB3 ARG 472 96.953 3.875 8.504 284 HG2 ARG 472 HG2 ARG 472 95.930 5.039 10.298 285 HG3 ARG 472 HG3 ARG 472 97.494 5.440 11.011 286 HD2 ARG 472 HD2 ARG 472 97.980 6.676 8.837 287 HD3 ARG 472 HD3 ARG 472 96.257 6.518 8.497 288 HE ARG 472 HE ARG 472 96.179 7.624 10.906 289 HH11 ARG 472 HH11 ARG 472 98.163 8.400 8.152 290 HH12 ARG 472 HH12 ARG 472 98.281 10.082 8.547 291 HH21 ARG 472 HH21 ARG 472 96.329 9.838 11.438 292 HH22 ARG 472 HH22 ARG 472 97.239 10.899 10.416 293 H ASP 473 H ASP 473 96.604 3.852 12.170 294 HA ASP 473 HA ASP 473 98.748 4.929 13.647 295 HB2 ASP 473 HB2 ASP 473 95.908 4.726 13.912 296 HB3 ASP 473 HB3 ASP 473 96.646 4.237 15.434 297 H THR 474 H THR 474 97.122 1.805 13.767 298 HA THR 474 HA THR 474 98.338 0.808 16.097 299 HB THR 474 HB THR 474 97.959 -1.465 14.727 300 HG1 THR 474 HG1 THR 474 95.828 -0.716 13.540 301 HG21 THR 474 HG21 THR 474 96.597 -1.451 16.513 302 HG22 THR 474 HG22 THR 474 95.371 -0.920 15.360 303 HG23 THR 474 HG23 THR 474 96.230 0.266 16.345 304 H LEU 475 H LEU 475 99.020 -0.532 12.890 305 HA LEU 475 HA LEU 475 101.381 -1.726 13.367 306 HB2 LEU 475 HB2 LEU 475 101.962 -1.390 11.010 307 HB3 LEU 475 HB3 LEU 475 100.281 -1.845 11.215 308 HG LEU 475 HG LEU 475 99.962 0.804 11.159 309 HD11 LEU 475 HD11 LEU 475 101.543 2.001 10.075 310 HD12 LEU 475 HD12 LEU 475 102.069 0.631 9.096 311 HD13 LEU 475 HD13 LEU 475 102.604 0.775 10.770 312 HD21 LEU 475 HD21 LEU 475 100.382 -0.697 8.592 313 HD22 LEU 475 HD22 LEU 475 99.209 0.570 8.947 314 HD23 LEU 475 HD23 LEU 475 99.023 -1.030 9.665 315 H ALA 476 H ALA 476 100.971 1.742 12.707 316 HA ALA 476 HA ALA 476 103.753 2.310 12.664 317 HB1 ALA 476 HB1 ALA 476 102.907 4.703 13.141 318 HB2 ALA 476 HB2 ALA 476 101.301 4.005 12.929 319 HB3 ALA 476 HB3 ALA 476 102.473 3.934 11.614 320 H ALA 477 H ALA 477 101.406 1.969 15.197 321 HA ALA 477 HA ALA 477 102.904 3.320 17.214 322 HB1 ALA 477 HB1 ALA 477 101.081 1.281 18.208 323 HB2 ALA 477 HB2 ALA 477 100.332 2.365 17.035 324 HB3 ALA 477 HB3 ALA 477 101.093 3.023 18.483 325 H ILE 478 H ILE 478 102.845 0.071 15.956 326 HA ILE 478 HA ILE 478 104.367 -1.021 18.156 327 HB ILE 478 HB ILE 478 103.384 -2.148 15.551 328 HG12 ILE 478 HG12 ILE 478 102.736 -3.859 17.605 329 HG13 ILE 478 HG13 ILE 478 102.692 -2.289 18.401 330 HG21 ILE 478 HG21 ILE 478 105.342 -3.450 17.439 331 HG22 ILE 478 HG22 ILE 478 105.603 -3.056 15.740 332 HG23 ILE 478 HG23 ILE 478 104.442 -4.307 16.187 333 HD11 ILE 478 HD11 ILE 478 100.844 -3.476 16.505 334 HD12 ILE 478 HD12 ILE 478 101.319 -1.834 16.069 335 HD13 ILE 478 HD13 ILE 478 100.607 -2.157 17.650 336 H SER 479 H SER 479 104.992 0.280 14.972 337 HA SER 479 HA SER 479 107.792 0.517 15.574 338 HB2 SER 479 HB2 SER 479 108.693 -1.065 14.220 339 HB3 SER 479 HB3 SER 479 107.129 -1.856 14.411 340 HG SER 479 HG SER 479 108.039 -0.250 12.270 341 H GLU 480 H GLU 480 108.937 1.828 14.041 342 HA GLU 480 HA GLU 480 107.326 3.907 12.960 343 HB2 GLU 480 HB2 GLU 480 109.459 4.519 13.805 344 HB3 GLU 480 HB3 GLU 480 110.276 3.305 12.831 345 HG2 GLU 480 HG2 GLU 480 110.746 5.007 11.471 346 HG3 GLU 480 HG3 GLU 480 109.084 4.820 10.914 347 H VAL 481 H VAL 481 106.107 3.551 11.217 348 HA VAL 481 HA VAL 481 107.201 1.965 8.999 349 HB VAL 481 HB VAL 481 104.819 2.051 8.142 350 HG11 VAL 481 HG11 VAL 481 104.847 0.755 10.828 351 HG12 VAL 481 HG12 VAL 481 105.994 0.225 9.598 352 HG13 VAL 481 HG13 VAL 481 104.260 0.135 9.283 353 HG21 VAL 481 HG21 VAL 481 103.622 2.474 10.716 354 HG22 VAL 481 HG22 VAL 481 103.275 3.269 9.180 355 HG23 VAL 481 HG23 VAL 481 104.541 3.900 10.233 356 H LEU 482 H LEU 482 106.596 2.711 6.783 357 HA LEU 482 HA LEU 482 107.278 5.519 6.526 358 HB2 LEU 482 HB2 LEU 482 108.111 3.394 5.136 359 HB3 LEU 482 HB3 LEU 482 106.739 3.835 4.140 360 HG LEU 482 HG LEU 482 109.358 5.123 4.401 361 HD11 LEU 482 HD11 LEU 482 108.216 6.071 2.149 362 HD12 LEU 482 HD12 LEU 482 107.295 4.584 2.378 363 HD13 LEU 482 HD13 LEU 482 109.054 4.523 2.258 364 HD21 LEU 482 HD21 LEU 482 108.272 7.380 3.806 365 HD22 LEU 482 HD22 LEU 482 108.335 6.903 5.502 366 HD23 LEU 482 HD23 LEU 482 106.834 6.729 4.593 367 H TYR 483 H TYR 483 104.927 3.474 4.783 368 HA TYR 483 HA TYR 483 102.823 5.413 5.317 369 HB2 TYR 483 HB2 TYR 483 103.800 6.413 3.365 370 HB3 TYR 483 HB3 TYR 483 103.853 4.864 2.531 371 HD1 TYR 483 HD1 TYR 483 101.929 7.813 3.173 372 HD2 TYR 483 HD2 TYR 483 101.636 3.750 1.941 373 HE1 TYR 483 HE1 TYR 483 99.723 8.277 2.189 374 HE2 TYR 483 HE2 TYR 483 99.431 4.203 0.952 375 HH TYR 483 HH TYR 483 97.555 6.593 1.658 376 H VAL 484 H VAL 484 100.785 4.577 5.197 377 HA VAL 484 HA VAL 484 100.611 1.688 4.696 378 HB VAL 484 HB VAL 484 98.562 3.395 6.103 379 HG11 VAL 484 HG11 VAL 484 97.452 1.458 5.694 380 HG12 VAL 484 HG12 VAL 484 98.293 0.965 7.165 381 HG13 VAL 484 HG13 VAL 484 98.931 0.503 5.587 382 HG21 VAL 484 HG21 VAL 484 101.126 2.981 7.017 383 HG22 VAL 484 HG22 VAL 484 100.207 1.696 7.800 384 HG23 VAL 484 HG23 VAL 484 99.726 3.379 8.011 385 H ASP 485 H ASP 485 99.745 1.067 2.808 386 HA ASP 485 HA ASP 485 97.940 2.919 1.422 387 HB2 ASP 485 HB2 ASP 485 99.926 2.226 0.167 388 HB3 ASP 485 HB3 ASP 485 99.458 0.537 0.343 389 H LEU 486 H LEU 486 96.057 2.409 2.565 390 HA LEU 486 HA LEU 486 95.096 -0.348 2.453 391 HB2 LEU 486 HB2 LEU 486 94.863 0.835 4.567 392 HB3 LEU 486 HB3 LEU 486 93.940 2.100 3.778 393 HG LEU 486 HG LEU 486 92.917 -0.692 3.608 394 HD11 LEU 486 HD11 LEU 486 91.635 0.152 5.807 395 HD12 LEU 486 HD12 LEU 486 93.222 0.865 6.090 396 HD13 LEU 486 HD13 LEU 486 93.069 -0.874 5.849 397 HD21 LEU 486 HD21 LEU 486 91.198 1.612 4.234 398 HD22 LEU 486 HD22 LEU 486 90.975 0.306 3.070 399 HD23 LEU 486 HD23 LEU 486 92.021 1.669 2.675 400 H LEU 487 H LEU 487 93.587 -1.047 1.043 401 HA LEU 487 HA LEU 487 92.856 0.502 -1.177 402 HB2 LEU 487 HB2 LEU 487 92.017 -2.130 -0.065 403 HB3 LEU 487 HB3 LEU 487 91.014 -1.405 -1.307 404 HG LEU 487 HG LEU 487 93.495 -1.189 -2.427 405 HD11 LEU 487 HD11 LEU 487 94.853 -2.969 -1.958 406 HD12 LEU 487 HD12 LEU 487 93.527 -3.967 -1.362 407 HD13 LEU 487 HD13 LEU 487 94.172 -2.668 -0.359 408 HD21 LEU 487 HD21 LEU 487 91.127 -2.845 -2.732 409 HD22 LEU 487 HD22 LEU 487 92.591 -3.639 -3.311 410 HD23 LEU 487 HD23 LEU 487 92.129 -2.065 -3.956 411 H GLU 488 H GLU 488 91.805 2.374 -0.781 412 HA GLU 488 HA GLU 488 90.065 3.168 1.078 413 HB2 GLU 488 HB2 GLU 488 90.732 4.047 -1.478 414 HB3 GLU 488 HB3 GLU 488 88.980 3.906 -1.515 415 HG2 GLU 488 HG2 GLU 488 90.457 5.389 0.637 416 HG3 GLU 488 HG3 GLU 488 89.900 6.149 -0.853 417 H GLY 489 H GLY 489 88.366 2.221 1.989 418 HA2 GLY 489 HA2 GLY 489 86.208 1.402 2.140 419 HA3 GLY 489 HA3 GLY 489 86.107 1.434 0.388 420 H ASP 490 H ASP 490 88.850 -0.207 1.535 421 HA ASP 490 HA ASP 490 87.478 -2.783 1.126 422 HB2 ASP 490 HB2 ASP 490 89.400 -1.835 -0.478 423 HB3 ASP 490 HB3 ASP 490 90.416 -2.604 0.738 424 H THR 491 H THR 491 88.116 -4.563 2.369 425 HA THR 491 HA THR 491 88.954 -3.867 5.049 426 HB THR 491 HB THR 491 88.198 -5.969 5.736 427 HG1 THR 491 HG1 THR 491 88.306 -6.859 3.029 428 HG21 THR 491 HG21 THR 491 86.312 -4.677 5.050 429 HG22 THR 491 HG22 THR 491 86.035 -6.339 4.525 430 HG23 THR 491 HG23 THR 491 86.551 -5.119 3.361 431 H GLU 492 H GLU 492 90.787 -4.109 2.528 432 HA GLU 492 HA GLU 492 92.874 -5.660 3.906 433 HB2 GLU 492 HB2 GLU 492 93.751 -6.286 1.655 434 HB3 GLU 492 HB3 GLU 492 92.179 -6.980 2.024 435 HG2 GLU 492 HG2 GLU 492 91.141 -5.129 0.710 436 HG3 GLU 492 HG3 GLU 492 92.765 -4.646 0.224 437 H CYS 493 H CYS 493 94.749 -4.627 4.219 438 HA CYS 493 HA CYS 493 95.273 -2.188 2.664 439 HB2 CYS 493 HB2 CYS 493 96.434 -1.591 5.047 440 HB3 CYS 493 HB3 CYS 493 94.819 -1.070 4.578 441 HG CYS 493 HG CYS 493 93.880 -3.108 5.975 442 H HIS 494 H HIS 494 97.433 -1.702 2.257 443 HA HIS 494 HA HIS 494 99.374 -3.789 2.994 444 HB2 HIS 494 HB2 HIS 494 99.084 -2.423 0.310 445 HB3 HIS 494 HB3 HIS 494 100.418 -3.484 0.754 446 HD1 HIS 494 HD1 HIS 494 96.624 -3.847 0.970 447 HD2 HIS 494 HD2 HIS 494 99.985 -5.897 -0.362 448 HE1 HIS 494 HE1 HIS 494 95.764 -6.027 0.061 449 HE2 HIS 494 HE2 HIS 494 97.807 -7.221 -0.806 450 H ALA 495 H ALA 495 100.524 -2.720 4.524 451 HA ALA 495 HA ALA 495 101.269 0.052 4.118 452 HB1 ALA 495 HB1 ALA 495 101.957 -1.765 6.421 453 HB2 ALA 495 HB2 ALA 495 100.529 -0.733 6.334 454 HB3 ALA 495 HB3 ALA 495 102.138 -0.012 6.365 455 H ARG 496 H ARG 496 103.213 0.819 3.616 456 HA ARG 496 HA ARG 496 105.301 -1.100 2.877 457 HB2 ARG 496 HB2 ARG 496 105.389 1.837 2.262 458 HB3 ARG 496 HB3 ARG 496 106.125 0.503 1.387 459 HG2 ARG 496 HG2 ARG 496 103.711 -0.223 0.880 460 HG3 ARG 496 HG3 ARG 496 103.275 1.414 1.374 461 HD2 ARG 496 HD2 ARG 496 105.420 0.914 -0.663 462 HD3 ARG 496 HD3 ARG 496 103.720 0.963 -1.121 463 HE ARG 496 HE ARG 496 105.360 3.195 -0.235 464 HH11 ARG 496 HH11 ARG 496 102.184 2.000 -1.036 465 HH12 ARG 496 HH12 ARG 496 101.515 3.577 -1.284 466 HH21 ARG 496 HH21 ARG 496 104.484 5.272 -0.551 467 HH22 ARG 496 HH22 ARG 496 102.822 5.438 -1.009 468 H PHE 497 H PHE 497 107.219 -1.181 3.914 469 HA PHE 497 HA PHE 497 107.658 0.752 6.094 470 HB2 PHE 497 HB2 PHE 497 108.521 -2.135 5.865 471 HB3 PHE 497 HB3 PHE 497 109.035 -1.051 7.151 472 HD1 PHE 497 HD1 PHE 497 108.026 -1.601 9.125 473 HD2 PHE 497 HD2 PHE 497 105.732 -1.755 5.542 474 HE1 PHE 497 HE1 PHE 497 106.029 -2.198 10.431 475 HE2 PHE 497 HE2 PHE 497 103.732 -2.349 6.843 476 HZ PHE 497 HZ PHE 497 103.878 -2.572 9.292 477 H LYS 498 H LYS 498 109.877 1.312 6.584 478 HA LYS 498 HA LYS 498 111.396 1.762 4.170 479 HB2 LYS 498 HB2 LYS 498 111.003 3.360 6.219 480 HB3 LYS 498 HB3 LYS 498 112.389 2.511 6.890 481 HG2 LYS 498 HG2 LYS 498 112.731 3.469 4.135 482 HG3 LYS 498 HG3 LYS 498 112.547 4.728 5.358 483 HD2 LYS 498 HD2 LYS 498 114.296 3.053 6.587 484 HD3 LYS 498 HD3 LYS 498 114.758 2.848 4.896 485 HE2 LYS 498 HE2 LYS 498 115.945 4.719 5.098 486 HE3 LYS 498 HE3 LYS 498 114.413 5.586 5.194 487 HZ1 LYS 498 HZ1 LYS 498 114.572 4.951 7.687 488 HZ2 LYS 498 HZ2 LYS 498 115.464 6.262 7.101 489 HZ3 LYS 498 HZ3 LYS 498 116.223 4.773 7.362 490 H THR 499 H THR 499 111.423 -0.513 6.743 491 HA THR 499 HA THR 499 113.915 -1.632 5.682 492 HB THR 499 HB THR 499 114.267 -2.298 8.253 493 HG1 THR 499 HG1 THR 499 112.372 -0.558 8.505 494 HG21 THR 499 HG21 THR 499 115.745 -1.021 6.552 495 HG22 THR 499 HG22 THR 499 116.054 -0.816 8.277 496 HG23 THR 499 HG23 THR 499 115.169 0.422 7.386 497 HA PRO 500 HA PRO 500 111.737 -5.453 5.814 498 HB2 PRO 500 HB2 PRO 500 113.793 -7.202 6.025 499 HB3 PRO 500 HB3 PRO 500 113.452 -6.301 4.544 500 HG2 PRO 500 HG2 PRO 500 115.481 -5.748 6.673 501 HG3 PRO 500 HG3 PRO 500 115.655 -5.656 4.910 502 HD2 PRO 500 HD2 PRO 500 115.260 -3.467 6.467 503 HD3 PRO 500 HD3 PRO 500 114.674 -3.578 4.796 504 H GLU 501 H GLU 501 114.256 -5.064 8.291 505 HA GLU 501 HA GLU 501 113.341 -7.093 10.014 506 HB2 GLU 501 HB2 GLU 501 114.632 -4.658 11.152 507 HB3 GLU 501 HB3 GLU 501 114.933 -6.354 11.504 508 HG2 GLU 501 HG2 GLU 501 115.765 -6.245 8.947 509 HG3 GLU 501 HG3 GLU 501 116.121 -4.599 9.466 510 H ASP 502 H ASP 502 112.491 -3.696 9.698 511 HA ASP 502 HA ASP 502 110.999 -3.442 12.065 512 HB2 ASP 502 HB2 ASP 502 111.616 -1.825 9.812 513 HB3 ASP 502 HB3 ASP 502 109.868 -1.795 10.020 514 H ALA 503 H ALA 503 110.062 -4.445 8.800 515 HA ALA 503 HA ALA 503 107.282 -4.569 9.299 516 HB1 ALA 503 HB1 ALA 503 107.059 -5.474 7.194 517 HB2 ALA 503 HB2 ALA 503 108.566 -6.382 7.306 518 HB3 ALA 503 HB3 ALA 503 108.605 -4.637 7.045 519 H GLN 504 H GLN 504 109.850 -6.994 9.485 520 HA GLN 504 HA GLN 504 108.209 -9.201 10.065 521 HB2 GLN 504 HB2 GLN 504 110.821 -8.932 9.521 522 HB3 GLN 504 HB3 GLN 504 110.922 -9.097 11.269 523 HG2 GLN 504 HG2 GLN 504 109.327 -11.151 10.808 524 HG3 GLN 504 HG3 GLN 504 110.084 -11.069 9.219 525 HE21 GLN 504 HE21 GLN 504 112.066 -11.885 8.957 526 HE22 GLN 504 HE22 GLN 504 113.055 -12.511 10.228 527 H ALA 505 H ALA 505 109.731 -6.787 12.135 528 HA ALA 505 HA ALA 505 109.177 -8.041 14.597 529 HB1 ALA 505 HB1 ALA 505 110.556 -6.419 15.215 530 HB2 ALA 505 HB2 ALA 505 109.194 -5.303 15.104 531 HB3 ALA 505 HB3 ALA 505 110.267 -5.525 13.722 532 H VAL 506 H VAL 506 107.326 -5.681 12.694 533 HA VAL 506 HA VAL 506 105.315 -5.286 14.661 534 HB VAL 506 HB VAL 506 105.621 -3.630 12.936 535 HG11 VAL 506 HG11 VAL 506 104.818 -5.806 11.012 536 HG12 VAL 506 HG12 VAL 506 106.386 -5.006 11.117 537 HG13 VAL 506 HG13 VAL 506 104.967 -4.100 10.592 538 HG21 VAL 506 HG21 VAL 506 102.958 -5.028 12.725 539 HG22 VAL 506 HG22 VAL 506 103.283 -3.393 12.146 540 HG23 VAL 506 HG23 VAL 506 103.403 -3.760 13.867 541 H ILE 507 H ILE 507 105.490 -7.397 11.811 542 HA ILE 507 HA ILE 507 102.858 -8.409 12.058 543 HB ILE 507 HB ILE 507 103.779 -10.348 10.674 544 HG12 ILE 507 HG12 ILE 507 106.039 -8.964 9.661 545 HG13 ILE 507 HG13 ILE 507 106.222 -9.057 11.409 546 HG21 ILE 507 HG21 ILE 507 104.362 -7.804 9.266 547 HG22 ILE 507 HG22 ILE 507 102.756 -8.007 9.964 548 HG23 ILE 507 HG23 ILE 507 103.354 -9.166 8.777 549 HD11 ILE 507 HD11 ILE 507 107.165 -11.032 10.918 550 HD12 ILE 507 HD12 ILE 507 106.313 -11.179 9.381 551 HD13 ILE 507 HD13 ILE 507 105.491 -11.584 10.887 552 H ASN 508 H ASN 508 105.956 -9.448 13.338 553 HA ASN 508 HA ASN 508 105.017 -11.924 14.404 554 HB2 ASN 508 HB2 ASN 508 107.445 -10.257 15.098 555 HB3 ASN 508 HB3 ASN 508 107.141 -11.874 15.722 556 HD21 ASN 508 HD21 ASN 508 109.276 -10.739 13.982 557 HD22 ASN 508 HD22 ASN 508 109.307 -11.765 12.592 558 H ALA 509 H ALA 509 105.444 -8.673 15.678 559 HA ALA 509 HA ALA 509 104.634 -9.348 18.342 560 HB1 ALA 509 HB1 ALA 509 106.070 -7.315 17.387 561 HB2 ALA 509 HB2 ALA 509 105.188 -7.227 18.910 562 HB3 ALA 509 HB3 ALA 509 104.491 -6.533 17.447 563 H TYR 510 H TYR 510 103.023 -8.497 15.435 564 HA TYR 510 HA TYR 510 100.711 -7.281 16.402 565 HB2 TYR 510 HB2 TYR 510 101.607 -8.436 13.917 566 HB3 TYR 510 HB3 TYR 510 99.911 -8.813 14.209 567 HD1 TYR 510 HD1 TYR 510 98.954 -7.433 12.511 568 HD2 TYR 510 HD2 TYR 510 101.625 -5.770 15.368 569 HE1 TYR 510 HE1 TYR 510 98.337 -5.175 11.756 570 HE2 TYR 510 HE2 TYR 510 101.018 -3.501 14.623 571 HH TYR 510 HH TYR 510 98.369 -2.778 12.913 572 H THR 511 H THR 511 101.734 -10.486 16.894 573 HA THR 511 HA THR 511 99.415 -11.976 16.822 574 HB THR 511 HB THR 511 100.350 -13.313 18.696 575 HG1 THR 511 HG1 THR 511 102.253 -12.671 19.682 576 HG21 THR 511 HG21 THR 511 101.862 -12.595 16.266 577 HG22 THR 511 HG22 THR 511 101.296 -14.167 16.829 578 HG23 THR 511 HG23 THR 511 102.764 -13.464 17.508 579 H GLU 512 H GLU 512 100.515 -9.647 19.183 580 HA GLU 512 HA GLU 512 98.697 -10.073 21.234 581 HB2 GLU 512 HB2 GLU 512 100.598 -8.562 21.452 582 HB3 GLU 512 HB3 GLU 512 99.876 -7.455 20.292 583 HG2 GLU 512 HG2 GLU 512 98.071 -6.967 21.798 584 HG3 GLU 512 HG3 GLU 512 98.640 -8.187 22.935 585 H ILE 513 H ILE 513 98.210 -8.578 18.131 586 HA ILE 513 HA ILE 513 95.974 -7.016 18.592 587 HB ILE 513 HB ILE 513 96.465 -8.732 16.155 588 HG12 ILE 513 HG12 ILE 513 98.295 -7.076 16.960 589 HG13 ILE 513 HG13 ILE 513 97.790 -7.018 15.274 590 HG21 ILE 513 HG21 ILE 513 94.764 -6.280 16.578 591 HG22 ILE 513 HG22 ILE 513 94.205 -7.909 16.196 592 HG23 ILE 513 HG23 ILE 513 95.125 -6.990 15.005 593 HD11 ILE 513 HD11 ILE 513 97.170 -4.905 15.472 594 HD12 ILE 513 HD12 ILE 513 97.883 -4.911 17.084 595 HD13 ILE 513 HD13 ILE 513 96.169 -5.269 16.877 596 H ASN 514 H ASN 514 96.100 -10.502 17.857 597 HA ASN 514 HA ASN 514 93.478 -11.139 17.624 598 HB2 ASN 514 HB2 ASN 514 95.328 -12.775 17.519 599 HB3 ASN 514 HB3 ASN 514 95.493 -12.686 19.269 600 HD21 ASN 514 HD21 ASN 514 92.523 -12.722 17.375 601 HD22 ASN 514 HD22 ASN 514 91.926 -14.215 18.006 602 H LYS 515 H LYS 515 95.141 -10.203 20.558 603 HA LYS 515 HA LYS 515 93.454 -11.036 22.539 604 HB2 LYS 515 HB2 LYS 515 94.831 -8.360 22.263 605 HB3 LYS 515 HB3 LYS 515 94.074 -8.924 23.747 606 HG2 LYS 515 HG2 LYS 515 95.814 -10.968 22.874 607 HG3 LYS 515 HG3 LYS 515 96.693 -9.441 22.762 608 HD2 LYS 515 HD2 LYS 515 95.900 -8.958 25.112 609 HD3 LYS 515 HD3 LYS 515 95.349 -10.634 25.178 610 HE2 LYS 515 HE2 LYS 515 98.134 -10.164 24.288 611 HE3 LYS 515 HE3 LYS 515 97.778 -9.868 25.990 612 HZ1 LYS 515 HZ1 LYS 515 97.235 -12.397 24.528 613 HZ2 LYS 515 HZ2 LYS 515 96.902 -12.111 26.162 614 HZ3 LYS 515 HZ3 LYS 515 98.503 -12.140 25.619 615 H LYS 516 H LYS 516 92.863 -8.679 20.081 616 HA LYS 516 HA LYS 516 90.201 -8.174 21.229 617 HB2 LYS 516 HB2 LYS 516 91.677 -6.170 21.269 618 HB3 LYS 516 HB3 LYS 516 91.810 -6.271 19.518 619 HG2 LYS 516 HG2 LYS 516 90.165 -4.695 19.757 620 HG3 LYS 516 HG3 LYS 516 89.207 -6.169 19.603 621 HD2 LYS 516 HD2 LYS 516 90.032 -5.376 22.334 622 HD3 LYS 516 HD3 LYS 516 88.801 -4.386 21.545 623 HE2 LYS 516 HE2 LYS 516 88.568 -7.370 21.579 624 HE3 LYS 516 HE3 LYS 516 88.067 -6.418 22.977 625 HZ1 LYS 516 HZ1 LYS 516 86.143 -6.597 21.742 626 HZ2 LYS 516 HZ2 LYS 516 86.938 -6.450 20.256 627 HZ3 LYS 516 HZ3 LYS 516 86.733 -5.091 21.242 628 H HIS 517 H HIS 517 92.109 -8.509 18.279 629 HA HIS 517 HA HIS 517 89.843 -9.765 16.963 630 HB2 HIS 517 HB2 HIS 517 91.222 -7.787 15.249 631 HB3 HIS 517 HB3 HIS 517 89.534 -8.277 15.269 632 HD1 HIS 517 HD1 HIS 517 87.937 -6.959 16.808 633 HD2 HIS 517 HD2 HIS 517 91.861 -5.594 16.858 634 HE1 HIS 517 HE1 HIS 517 87.851 -4.710 17.924 635 HE2 HIS 517 HE2 HIS 517 90.222 -3.860 17.856 636 H CYS 518 H CYS 518 90.475 -11.421 15.693 637 HA CYS 518 HA CYS 518 93.225 -12.170 15.629 638 HB2 CYS 518 HB2 CYS 518 90.946 -13.584 15.476 639 HB3 CYS 518 HB3 CYS 518 91.307 -13.459 13.758 640 HG CYS 518 HG CYS 518 93.715 -14.473 15.243 641 H TRP 519 H TRP 519 94.348 -10.545 14.560 642 HA TRP 519 HA TRP 519 93.586 -9.824 11.856 643 HB2 TRP 519 HB2 TRP 519 94.866 -8.475 13.896 644 HB3 TRP 519 HB3 TRP 519 96.172 -8.839 12.770 645 HD1 TRP 519 HD1 TRP 519 93.467 -8.588 10.499 646 HE1 TRP 519 HE1 TRP 519 93.166 -6.241 9.556 647 HE3 TRP 519 HE3 TRP 519 96.252 -5.995 13.914 648 HZ2 TRP 519 HZ2 TRP 519 93.999 -3.593 10.174 649 HZ3 TRP 519 HZ3 TRP 519 96.450 -3.557 13.663 650 HH2 TRP 519 HH2 TRP 519 95.346 -2.384 11.830 651 H LYS 520 H LYS 520 94.829 -10.049 10.055 652 HA LYS 520 HA LYS 520 96.715 -12.306 10.106 653 HB2 LYS 520 HB2 LYS 520 95.363 -11.245 7.658 654 HB3 LYS 520 HB3 LYS 520 95.989 -12.862 7.949 655 HG2 LYS 520 HG2 LYS 520 93.566 -11.675 9.290 656 HG3 LYS 520 HG3 LYS 520 93.527 -12.769 7.905 657 HD2 LYS 520 HD2 LYS 520 93.889 -14.576 9.183 658 HD3 LYS 520 HD3 LYS 520 95.136 -13.765 10.131 659 HE2 LYS 520 HE2 LYS 520 93.643 -12.998 11.691 660 HE3 LYS 520 HE3 LYS 520 92.299 -12.969 10.549 661 HZ1 LYS 520 HZ1 LYS 520 91.991 -15.262 10.752 662 HZ2 LYS 520 HZ2 LYS 520 92.263 -14.744 12.339 663 HZ3 LYS 520 HZ3 LYS 520 93.501 -15.507 11.476 664 H LEU 521 H LEU 521 98.798 -11.917 9.562 665 HA LEU 521 HA LEU 521 99.384 -9.485 8.021 666 HB2 LEU 521 HB2 LEU 521 101.083 -10.401 10.331 667 HB3 LEU 521 HB3 LEU 521 101.220 -8.908 9.425 668 HG LEU 521 HG LEU 521 100.244 -8.213 11.405 669 HD11 LEU 521 HD11 LEU 521 97.586 -8.649 10.340 670 HD12 LEU 521 HD12 LEU 521 98.721 -8.108 9.102 671 HD13 LEU 521 HD13 LEU 521 98.483 -7.148 10.562 672 HD21 LEU 521 HD21 LEU 521 99.720 -9.996 12.701 673 HD22 LEU 521 HD22 LEU 521 98.988 -10.890 11.368 674 HD23 LEU 521 HD23 LEU 521 98.089 -9.595 12.161 675 H GLU 522 H GLU 522 100.565 -9.866 6.296 676 HA GLU 522 HA GLU 522 102.540 -12.022 6.326 677 HB2 GLU 522 HB2 GLU 522 100.177 -12.583 5.231 678 HB3 GLU 522 HB3 GLU 522 100.892 -11.747 3.860 679 HG2 GLU 522 HG2 GLU 522 101.254 -14.114 3.654 680 HG3 GLU 522 HG3 GLU 522 102.791 -13.297 3.925 681 H ILE 523 H ILE 523 104.377 -11.544 5.235 682 HA ILE 523 HA ILE 523 104.548 -8.866 4.082 683 HB ILE 523 HB ILE 523 106.634 -10.826 5.015 684 HG12 ILE 523 HG12 ILE 523 106.904 -8.084 5.874 685 HG13 ILE 523 HG13 ILE 523 105.276 -8.671 6.202 686 HG21 ILE 523 HG21 ILE 523 108.034 -10.078 3.451 687 HG22 ILE 523 HG22 ILE 523 107.989 -8.524 4.283 688 HG23 ILE 523 HG23 ILE 523 106.899 -8.832 2.931 689 HD11 ILE 523 HD11 ILE 523 107.083 -8.958 7.999 690 HD12 ILE 523 HD12 ILE 523 107.672 -10.278 6.988 691 HD13 ILE 523 HD13 ILE 523 106.032 -10.326 7.637 692 H LEU 524 H LEU 524 104.380 -8.594 1.967 693 HA LEU 524 HA LEU 524 104.122 -10.643 0.105 694 HB2 LEU 524 HB2 LEU 524 104.966 -7.782 -0.361 695 HB3 LEU 524 HB3 LEU 524 104.428 -8.892 -1.606 696 HG LEU 524 HG LEU 524 102.818 -7.610 0.575 697 HD11 LEU 524 HD11 LEU 524 103.131 -7.305 -2.268 698 HD12 LEU 524 HD12 LEU 524 102.248 -6.298 -1.121 699 HD13 LEU 524 HD13 LEU 524 101.458 -7.689 -1.863 700 HD21 LEU 524 HD21 LEU 524 100.936 -9.085 -0.184 701 HD22 LEU 524 HD22 LEU 524 102.192 -9.901 0.748 702 HD23 LEU 524 HD23 LEU 524 102.137 -10.081 -1.006 703 H SER 525 H SER 525 105.487 -11.735 -1.194 704 HA SER 525 HA SER 525 108.298 -10.956 -1.318 705 HB2 SER 525 HB2 SER 525 109.107 -12.702 -0.144 706 HB3 SER 525 HB3 SER 525 107.466 -12.901 0.471 707 HG SER 525 HG SER 525 107.151 -14.560 -0.843 708 H GLY 526 H GLY 526 109.513 -12.193 -2.952 709 HA2 GLY 526 HA2 GLY 526 109.744 -12.819 -5.148 710 HA3 GLY 526 HA3 GLY 526 108.442 -13.943 -4.795 711 H ASP 527 H ASP 527 107.369 -13.804 -6.711 712 HA ASP 527 HA ASP 527 106.878 -11.530 -8.213 713 HB2 ASP 527 HB2 ASP 527 105.925 -14.256 -8.141 714 HB3 ASP 527 HB3 ASP 527 104.608 -13.155 -8.529 715 H HIS 528 H HIS 528 105.263 -12.691 -5.339 716 HA HIS 528 HA HIS 528 102.905 -11.165 -5.561 717 HB2 HIS 528 HB2 HIS 528 103.699 -13.079 -3.859 718 HB3 HIS 528 HB3 HIS 528 104.020 -11.670 -2.854 719 HD1 HIS 528 HD1 HIS 528 102.043 -12.876 -1.402 720 HD2 HIS 528 HD2 HIS 528 100.935 -11.046 -4.965 721 HE1 HIS 528 HE1 HIS 528 99.555 -12.544 -1.241 722 HE2 HIS 528 HE2 HIS 528 98.896 -11.507 -3.441 723 H GLU 529 H GLU 529 105.998 -10.476 -3.928 724 HA GLU 529 HA GLU 529 105.205 -7.924 -2.968 725 HB2 GLU 529 HB2 GLU 529 107.033 -8.829 -1.838 726 HB3 GLU 529 HB3 GLU 529 107.834 -9.319 -3.325 727 HG2 GLU 529 HG2 GLU 529 108.480 -7.088 -3.813 728 HG3 GLU 529 HG3 GLU 529 107.465 -6.448 -2.519 729 H GLN 530 H GLN 530 107.045 -8.968 -5.805 730 HA GLN 530 HA GLN 530 107.557 -6.395 -6.830 731 HB2 GLN 530 HB2 GLN 530 108.790 -8.346 -7.604 732 HB3 GLN 530 HB3 GLN 530 107.319 -9.045 -8.267 733 HG2 GLN 530 HG2 GLN 530 107.646 -6.447 -9.369 734 HG3 GLN 530 HG3 GLN 530 109.175 -7.314 -9.515 735 HE21 GLN 530 HE21 GLN 530 105.763 -8.271 -9.719 736 HE22 GLN 530 HE22 GLN 530 105.889 -9.028 -11.267 737 H ARG 531 H ARG 531 104.891 -8.649 -7.305 738 HA ARG 531 HA ARG 531 103.554 -7.366 -9.378 739 HB2 ARG 531 HB2 ARG 531 102.941 -9.592 -8.582 740 HB3 ARG 531 HB3 ARG 531 102.402 -8.916 -7.051 741 HG2 ARG 531 HG2 ARG 531 100.929 -7.486 -8.849 742 HG3 ARG 531 HG3 ARG 531 101.035 -9.068 -9.625 743 HD2 ARG 531 HD2 ARG 531 100.387 -9.994 -7.305 744 HD3 ARG 531 HD3 ARG 531 99.870 -8.345 -6.959 745 HE ARG 531 HE ARG 531 98.021 -8.722 -8.235 746 HH11 ARG 531 HH11 ARG 531 100.474 -11.025 -9.132 747 HH12 ARG 531 HH12 ARG 531 99.441 -11.901 -10.212 748 HH21 ARG 531 HH21 ARG 531 96.650 -9.869 -9.656 749 HH22 ARG 531 HH22 ARG 531 97.267 -11.244 -10.510 750 H TYR 532 H TYR 532 102.953 -7.041 -5.873 751 HA TYR 532 HA TYR 532 101.032 -5.042 -6.003 752 HB2 TYR 532 HB2 TYR 532 101.543 -6.242 -3.945 753 HB3 TYR 532 HB3 TYR 532 103.143 -5.510 -3.890 754 HD1 TYR 532 HD1 TYR 532 103.348 -3.064 -3.463 755 HD2 TYR 532 HD2 TYR 532 99.644 -5.108 -3.098 756 HE1 TYR 532 HE1 TYR 532 102.461 -1.199 -2.126 757 HE2 TYR 532 HE2 TYR 532 98.739 -3.249 -1.766 758 HH TYR 532 HH TYR 532 100.555 -0.272 -1.292 759 H TRP 533 H TRP 533 104.562 -4.755 -5.869 760 HA TRP 533 HA TRP 533 104.639 -1.946 -5.758 761 HB2 TRP 533 HB2 TRP 533 106.587 -4.093 -6.404 762 HB3 TRP 533 HB3 TRP 533 106.986 -2.455 -6.924 763 HD1 TRP 533 HD1 TRP 533 107.243 -4.665 -3.990 764 HE1 TRP 533 HE1 TRP 533 107.852 -3.321 -1.885 765 HE3 TRP 533 HE3 TRP 533 106.401 0.050 -5.770 766 HZ2 TRP 533 HZ2 TRP 533 107.959 -0.605 -1.082 767 HZ3 TRP 533 HZ3 TRP 533 106.780 1.965 -4.273 768 HH2 TRP 533 HH2 TRP 533 107.544 1.642 -1.977 769 H GLN 534 H GLN 534 104.560 -4.202 -8.468 770 HA GLN 534 HA GLN 534 105.053 -2.471 -10.571 771 HB2 GLN 534 HB2 GLN 534 103.010 -4.704 -10.505 772 HB3 GLN 534 HB3 GLN 534 103.704 -3.987 -11.953 773 HG2 GLN 534 HG2 GLN 534 105.924 -4.764 -10.549 774 HG3 GLN 534 HG3 GLN 534 104.764 -6.040 -10.185 775 HE21 GLN 534 HE21 GLN 534 107.223 -5.448 -12.088 776 HE22 GLN 534 HE22 GLN 534 106.748 -6.265 -13.534 777 H LYS 535 H LYS 535 102.050 -3.122 -8.837 778 HA LYS 535 HA LYS 535 100.388 -1.439 -10.363 779 HB2 LYS 535 HB2 LYS 535 99.036 -2.727 -9.088 780 HB3 LYS 535 HB3 LYS 535 100.232 -2.894 -7.813 781 HG2 LYS 535 HG2 LYS 535 98.839 -0.285 -8.110 782 HG3 LYS 535 HG3 LYS 535 97.958 -1.645 -7.411 783 HD2 LYS 535 HD2 LYS 535 100.650 -1.335 -6.331 784 HD3 LYS 535 HD3 LYS 535 99.619 0.068 -6.045 785 HE2 LYS 535 HE2 LYS 535 98.804 -2.765 -5.424 786 HE3 LYS 535 HE3 LYS 535 99.552 -1.683 -4.250 787 HZ1 LYS 535 HZ1 LYS 535 97.649 -0.110 -4.844 788 HZ2 LYS 535 HZ2 LYS 535 97.288 -1.448 -3.877 789 HZ3 LYS 535 HZ3 LYS 535 96.897 -1.466 -5.523 790 H ILE 536 H ILE 536 102.409 -0.879 -7.512 791 HA ILE 536 HA ILE 536 101.552 1.751 -6.966 792 HB ILE 536 HB ILE 536 104.291 0.573 -6.470 793 HG12 ILE 536 HG12 ILE 536 101.759 0.538 -4.824 794 HG13 ILE 536 HG13 ILE 536 102.703 -0.841 -5.382 795 HG21 ILE 536 HG21 ILE 536 103.541 3.180 -6.263 796 HG22 ILE 536 HG22 ILE 536 104.835 2.424 -5.333 797 HG23 ILE 536 HG23 ILE 536 103.224 2.587 -4.633 798 HD11 ILE 536 HD11 ILE 536 104.369 0.860 -3.810 799 HD12 ILE 536 HD12 ILE 536 103.894 -0.814 -3.521 800 HD13 ILE 536 HD13 ILE 536 102.886 0.506 -2.925 801 H LEU 537 H LEU 537 104.662 0.789 -8.431 802 HA LEU 537 HA LEU 537 105.401 3.284 -9.359 803 HB2 LEU 537 HB2 LEU 537 106.159 0.510 -9.933 804 HB3 LEU 537 HB3 LEU 537 106.454 1.616 -11.261 805 HG LEU 537 HG LEU 537 107.393 2.487 -8.590 806 HD11 LEU 537 HD11 LEU 537 109.265 1.092 -8.493 807 HD12 LEU 537 HD12 LEU 537 109.011 0.487 -10.131 808 HD13 LEU 537 HD13 LEU 537 107.922 0.000 -8.832 809 HD21 LEU 537 HD21 LEU 537 108.040 2.877 -11.434 810 HD22 LEU 537 HD22 LEU 537 109.421 2.840 -10.337 811 HD23 LEU 537 HD23 LEU 537 108.122 4.007 -10.082 812 H VAL 538 H VAL 538 103.759 0.716 -11.218 813 HA VAL 538 HA VAL 538 103.449 2.084 -13.604 814 HB VAL 538 HB VAL 538 101.653 0.033 -12.310 815 HG11 VAL 538 HG11 VAL 538 101.529 1.067 -15.141 816 HG12 VAL 538 HG12 VAL 538 100.349 1.404 -13.873 817 HG13 VAL 538 HG13 VAL 538 100.563 -0.243 -14.464 818 HG21 VAL 538 HG21 VAL 538 103.923 -0.698 -12.924 819 HG22 VAL 538 HG22 VAL 538 103.623 -0.185 -14.585 820 HG23 VAL 538 HG23 VAL 538 102.681 -1.501 -13.885 821 H ASP 539 H ASP 539 101.462 2.193 -10.685 822 HA ASP 539 HA ASP 539 99.358 3.738 -11.751 823 HB2 ASP 539 HB2 ASP 539 99.226 2.485 -9.606 824 HB3 ASP 539 HB3 ASP 539 100.330 3.654 -8.886 825 H ARG 540 H ARG 540 102.434 4.584 -10.263 826 HA ARG 540 HA ARG 540 101.986 7.348 -10.001 827 HB2 ARG 540 HB2 ARG 540 104.581 5.860 -10.445 828 HB3 ARG 540 HB3 ARG 540 104.452 7.533 -9.919 829 HG2 ARG 540 HG2 ARG 540 103.506 5.101 -8.419 830 HG3 ARG 540 HG3 ARG 540 104.895 6.115 -8.025 831 HD2 ARG 540 HD2 ARG 540 103.365 8.025 -7.700 832 HD3 ARG 540 HD3 ARG 540 101.998 6.957 -8.017 833 HE ARG 540 HE ARG 540 103.396 5.773 -5.969 834 HH11 ARG 540 HH11 ARG 540 101.837 8.841 -6.504 835 HH12 ARG 540 HH12 ARG 540 101.432 9.073 -4.835 836 HH21 ARG 540 HH21 ARG 540 102.870 6.071 -3.768 837 HH22 ARG 540 HH22 ARG 540 102.020 7.499 -3.280 838 H GLN 541 H GLN 541 103.250 5.394 -12.660 839 HA GLN 541 HA GLN 541 103.998 7.515 -14.353 840 HB2 GLN 541 HB2 GLN 541 103.254 4.643 -14.831 841 HB3 GLN 541 HB3 GLN 541 103.573 5.723 -16.181 842 HG2 GLN 541 HG2 GLN 541 105.741 5.391 -15.953 843 HG3 GLN 541 HG3 GLN 541 105.679 6.012 -14.304 844 HE21 GLN 541 HE21 GLN 541 106.984 4.634 -13.265 845 HE22 GLN 541 HE22 GLN 541 106.750 2.925 -13.179 846 H ALA 542 H ALA 542 100.970 5.721 -13.995 847 HA ALA 542 HA ALA 542 99.584 6.935 -16.122 848 HB1 ALA 542 HB1 ALA 542 98.622 4.971 -15.305 849 HB2 ALA 542 HB2 ALA 542 97.525 6.240 -14.762 850 HB3 ALA 542 HB3 ALA 542 98.677 5.529 -13.632 851 H LYS 543 H LYS 543 100.171 7.910 -12.820 852 HA LYS 543 HA LYS 543 98.216 9.932 -12.631 853 HB2 LYS 543 HB2 LYS 543 100.859 9.535 -11.230 854 HB3 LYS 543 HB3 LYS 543 99.759 10.849 -10.836 855 HG2 LYS 543 HG2 LYS 543 99.163 7.906 -10.627 856 HG3 LYS 543 HG3 LYS 543 99.482 9.011 -9.289 857 HD2 LYS 543 HD2 LYS 543 97.337 9.590 -9.223 858 HD3 LYS 543 HD3 LYS 543 97.401 10.097 -10.912 859 HE2 LYS 543 HE2 LYS 543 96.790 7.946 -11.680 860 HE3 LYS 543 HE3 LYS 543 97.064 7.224 -10.096 861 HZ1 LYS 543 HZ1 LYS 543 94.703 8.367 -11.125 862 HZ2 LYS 543 HZ2 LYS 543 95.181 9.234 -9.754 863 HZ3 LYS 543 HZ3 LYS 543 94.936 7.562 -9.654 864 H LEU 544 H LEU 544 101.470 9.877 -13.939 865 HA LEU 544 HA LEU 544 102.128 12.516 -14.133 866 HB2 LEU 544 HB2 LEU 544 102.938 10.117 -15.369 867 HB3 LEU 544 HB3 LEU 544 102.657 11.262 -16.667 868 HG LEU 544 HG LEU 544 104.326 12.721 -15.913 869 HD11 LEU 544 HD11 LEU 544 103.750 11.508 -13.300 870 HD12 LEU 544 HD12 LEU 544 104.210 13.159 -13.713 871 HD13 LEU 544 HD13 LEU 544 105.444 11.906 -13.586 872 HD21 LEU 544 HD21 LEU 544 105.874 10.450 -14.987 873 HD22 LEU 544 HD22 LEU 544 106.059 11.425 -16.444 874 HD23 LEU 544 HD23 LEU 544 104.930 10.071 -16.428 875 H ASN 545 H ASN 545 99.553 10.879 -15.758 876 HA ASN 545 HA ASN 545 97.869 11.618 -17.100 877 HB2 ASN 545 HB2 ASN 545 98.837 14.082 -15.779 878 HB3 ASN 545 HB3 ASN 545 97.898 14.324 -17.249 879 HD21 ASN 545 HD21 ASN 545 97.641 11.888 -14.692 880 HD22 ASN 545 HD22 ASN 545 96.010 12.263 -14.262 881 H GLN 546 H GLN 546 98.576 10.828 -19.046 882 HA GLN 546 HA GLN 546 100.046 12.726 -20.755 883 HB2 GLN 546 HB2 GLN 546 100.981 10.284 -19.982 884 HB3 GLN 546 HB3 GLN 546 100.172 9.873 -21.488 885 HG2 GLN 546 HG2 GLN 546 102.641 10.458 -21.599 886 HG3 GLN 546 HG3 GLN 546 101.568 11.249 -22.752 887 HE21 GLN 546 HE21 GLN 546 102.423 13.178 -23.109 888 HE22 GLN 546 HE22 GLN 546 102.889 14.313 -21.894 889 HA PRO 547 HA PRO 547 95.833 12.239 -22.588 890 HB2 PRO 547 HB2 PRO 547 96.772 14.742 -23.880 891 HB3 PRO 547 HB3 PRO 547 95.235 14.397 -23.080 892 HG2 PRO 547 HG2 PRO 547 97.082 15.925 -21.908 893 HG3 PRO 547 HG3 PRO 547 96.094 14.791 -20.967 894 HD2 PRO 547 HD2 PRO 547 98.936 14.543 -21.860 895 HD3 PRO 547 HD3 PRO 547 98.185 14.037 -20.333 896 H ARG 548 H ARG 548 95.729 13.463 -25.193 897 HA ARG 548 HA ARG 548 96.406 13.189 -27.380 898 HB2 ARG 548 HB2 ARG 548 98.760 12.760 -26.139 899 HB3 ARG 548 HB3 ARG 548 98.470 11.150 -26.781 900 HG2 ARG 548 HG2 ARG 548 98.999 11.775 -28.846 901 HG3 ARG 548 HG3 ARG 548 97.989 13.218 -28.756 902 HD2 ARG 548 HD2 ARG 548 99.905 14.366 -28.769 903 HD3 ARG 548 HD3 ARG 548 100.085 13.841 -27.096 904 HE ARG 548 HE ARG 548 101.174 11.801 -28.483 905 HH11 ARG 548 HH11 ARG 548 101.650 15.249 -28.569 906 HH12 ARG 548 HH12 ARG 548 103.311 15.139 -29.050 907 HH21 ARG 548 HH21 ARG 548 103.361 11.642 -29.113 908 HH22 ARG 548 HH22 ARG 548 104.284 13.087 -29.360 909 H GLU 549 H GLU 549 95.064 12.048 -28.591 910 HA GLU 549 HA GLU 549 94.714 9.183 -28.004 911 HB2 GLU 549 HB2 GLU 549 92.753 11.279 -27.988 912 HB3 GLU 549 HB3 GLU 549 92.377 10.143 -29.277 913 HG2 GLU 549 HG2 GLU 549 92.071 8.379 -27.815 914 HG3 GLU 549 HG3 GLU 549 93.010 9.145 -26.535 915 H LYS 550 H LYS 550 95.092 7.859 -29.660 916 HA LYS 550 HA LYS 550 96.050 8.808 -32.130 917 HB2 LYS 550 HB2 LYS 550 96.482 6.608 -32.645 918 HB3 LYS 550 HB3 LYS 550 96.376 6.509 -30.893 919 HG2 LYS 550 HG2 LYS 550 93.885 5.951 -31.317 920 HG3 LYS 550 HG3 LYS 550 94.424 5.589 -32.957 921 HD2 LYS 550 HD2 LYS 550 96.215 4.134 -31.826 922 HD3 LYS 550 HD3 LYS 550 95.209 4.266 -30.382 923 HE2 LYS 550 HE2 LYS 550 94.359 2.347 -31.298 924 HE3 LYS 550 HE3 LYS 550 93.304 3.548 -32.044 925 HZ1 LYS 550 HZ1 LYS 550 95.769 2.549 -33.348 926 HZ2 LYS 550 HZ2 LYS 550 94.511 3.434 -34.049 927 HZ3 LYS 550 HZ3 LYS 550 94.256 1.829 -33.578 928 H LYS 551 H LYS 551 95.162 8.803 -34.188 929 HA LYS 551 HA LYS 551 92.250 8.411 -34.352 930 HB2 LYS 551 HB2 LYS 551 93.795 10.632 -35.702 931 HB3 LYS 551 HB3 LYS 551 92.059 10.367 -35.785 932 HG2 LYS 551 HG2 LYS 551 93.414 10.837 -33.159 933 HG3 LYS 551 HG3 LYS 551 92.963 12.182 -34.209 934 HD2 LYS 551 HD2 LYS 551 90.745 10.420 -34.046 935 HD3 LYS 551 HD3 LYS 551 91.329 10.708 -32.405 936 HE2 LYS 551 HE2 LYS 551 89.648 12.356 -33.028 937 HE3 LYS 551 HE3 LYS 551 91.219 13.122 -32.790 938 HZ1 LYS 551 HZ1 LYS 551 89.984 13.888 -34.789 939 HZ2 LYS 551 HZ2 LYS 551 90.160 12.341 -35.450 940 HZ3 LYS 551 HZ3 LYS 551 91.527 13.283 -35.127 941 H ARG 552 H ARG 552 91.628 8.538 -36.840 942 HA ARG 552 HA ARG 552 93.406 6.620 -38.180 943 HB2 ARG 552 HB2 ARG 552 90.507 7.228 -38.783 944 HB3 ARG 552 HB3 ARG 552 91.473 5.933 -39.477 945 HG2 ARG 552 HG2 ARG 552 91.046 4.580 -37.771 946 HG3 ARG 552 HG3 ARG 552 91.463 5.822 -36.587 947 HD2 ARG 552 HD2 ARG 552 89.152 6.827 -37.219 948 HD3 ARG 552 HD3 ARG 552 88.818 5.213 -37.848 949 HE ARG 552 HE ARG 552 89.821 5.264 -35.144 950 HH11 ARG 552 HH11 ARG 552 87.003 5.361 -37.186 951 HH12 ARG 552 HH12 ARG 552 85.928 4.795 -35.951 952 HH21 ARG 552 HH21 ARG 552 88.419 4.522 -33.509 953 HH22 ARG 552 HH22 ARG 552 86.734 4.318 -33.858 954 H GLY 553 H GLY 553 92.476 9.849 -38.255 955 HA2 GLY 553 HA2 GLY 553 94.082 10.803 -40.157 956 HA3 GLY 553 HA3 GLY 553 92.771 10.163 -41.135 957 H THR 554 H THR 554 90.853 11.262 -41.265 958 HA THR 554 HA THR 554 90.561 13.688 -39.633 959 HB THR 554 HB THR 554 91.185 14.883 -41.445 960 HG1 THR 554 HG1 THR 554 89.428 15.475 -42.702 961 HG21 THR 554 HG21 THR 554 91.887 12.779 -42.623 962 HG22 THR 554 HG22 THR 554 91.346 14.081 -43.683 963 HG23 THR 554 HG23 THR 554 90.276 12.723 -43.339 964 H GLU 555 H GLU 555 88.965 12.504 -38.474 965 HA GLU 555 HA GLU 555 86.425 12.248 -39.944 966 HB2 GLU 555 HB2 GLU 555 87.592 10.065 -39.181 967 HB3 GLU 555 HB3 GLU 555 87.091 10.537 -37.564 968 HG2 GLU 555 HG2 GLU 555 85.301 9.280 -38.097 969 HG3 GLU 555 HG3 GLU 555 84.751 10.801 -38.800 970 H LYS 556 H LYS 556 87.351 14.566 -38.575 971 HA LYS 556 HA LYS 556 85.698 14.611 -36.149 972 HB2 LYS 556 HB2 LYS 556 86.897 16.994 -36.061 973 HB3 LYS 556 HB3 LYS 556 87.660 15.534 -35.448 974 HG2 LYS 556 HG2 LYS 556 89.024 15.324 -37.360 975 HG3 LYS 556 HG3 LYS 556 88.079 16.517 -38.255 976 HD2 LYS 556 HD2 LYS 556 88.966 17.771 -35.886 977 HD3 LYS 556 HD3 LYS 556 90.352 16.919 -36.571 978 HE2 LYS 556 HE2 LYS 556 89.703 17.991 -38.790 979 HE3 LYS 556 HE3 LYS 556 88.641 19.035 -37.847 980 HZ1 LYS 556 HZ1 LYS 556 91.162 19.026 -36.634 981 HZ2 LYS 556 HZ2 LYS 556 90.371 20.314 -37.392 982 HZ3 LYS 556 HZ3 LYS 556 91.391 19.305 -38.288 983 H LEU 557 H LEU 557 84.225 16.348 -35.791 984 HA LEU 557 HA LEU 557 82.300 17.387 -36.530 985 HB2 LEU 557 HB2 LEU 557 83.993 19.129 -38.234 986 HB3 LEU 557 HB3 LEU 557 82.773 19.562 -37.049 987 HG LEU 557 HG LEU 557 85.457 18.461 -36.244 988 HD11 LEU 557 HD11 LEU 557 86.474 20.422 -36.535 989 HD12 LEU 557 HD12 LEU 557 85.096 21.324 -35.906 990 HD13 LEU 557 HD13 LEU 557 85.129 20.834 -37.600 991 HD21 LEU 557 HD21 LEU 557 84.884 19.018 -34.109 992 HD22 LEU 557 HD22 LEU 557 83.281 18.663 -34.751 993 HD23 LEU 557 HD23 LEU 557 83.827 20.334 -34.614 994 H ILE 558 H ILE 558 82.138 15.247 -37.910 995 HA ILE 558 HA ILE 558 82.201 15.819 -40.771 996 HB ILE 558 HB ILE 558 81.619 13.439 -41.056 997 HG12 ILE 558 HG12 ILE 558 82.147 12.405 -38.488 998 HG13 ILE 558 HG13 ILE 558 80.965 13.690 -38.260 999 HG21 ILE 558 HG21 ILE 558 83.742 12.534 -40.351 1000 HG22 ILE 558 HG22 ILE 558 83.948 13.840 -39.183 1001 HG23 ILE 558 HG23 ILE 558 83.970 14.190 -40.912 1002 HD11 ILE 558 HD11 ILE 558 80.637 11.043 -39.373 1003 HD12 ILE 558 HD12 ILE 558 80.008 12.298 -40.441 1004 HD13 ILE 558 HD13 ILE 558 79.428 12.181 -38.779 1005 H THR 559 H THR 559 80.458 16.345 -41.912 1006 HA THR 559 HA THR 559 77.798 15.628 -40.923 1007 HB THR 559 HB THR 559 77.417 18.176 -41.976 1008 HG1 THR 559 HG1 THR 559 79.418 18.418 -39.990 1009 HG21 THR 559 HG21 THR 559 76.302 18.499 -40.042 1010 HG22 THR 559 HG22 THR 559 77.673 18.003 -39.049 1011 HG23 THR 559 HG23 THR 559 76.634 16.786 -39.790 1012 H LYS 560 H LYS 560 76.476 14.956 -42.504 1013 HA LYS 560 HA LYS 560 77.465 15.094 -45.249 1014 HB2 LYS 560 HB2 LYS 560 76.182 13.101 -43.743 1015 HB3 LYS 560 HB3 LYS 560 75.004 13.615 -44.943 1016 HG2 LYS 560 HG2 LYS 560 76.173 11.837 -45.928 1017 HG3 LYS 560 HG3 LYS 560 76.835 13.298 -46.668 1018 HD2 LYS 560 HD2 LYS 560 78.873 12.724 -45.997 1019 HD3 LYS 560 HD3 LYS 560 78.331 12.735 -44.317 1020 HE2 LYS 560 HE2 LYS 560 77.609 10.370 -45.943 1021 HE3 LYS 560 HE3 LYS 560 79.311 10.555 -45.523 1022 HZ1 LYS 560 HZ1 LYS 560 77.949 9.241 -43.914 1023 HZ2 LYS 560 HZ2 LYS 560 77.126 10.666 -43.522 1024 HZ3 LYS 560 HZ3 LYS 560 78.787 10.544 -43.229 1025 H ALA 561 H ALA 561 76.913 17.421 -45.325 1026 HA ALA 561 HA ALA 561 74.839 18.038 -46.938 1027 HB1 ALA 561 HB1 ALA 561 73.885 17.716 -44.177 1028 HB2 ALA 561 HB2 ALA 561 73.008 17.615 -45.703 1029 HB3 ALA 561 HB3 ALA 561 73.356 19.189 -44.990 Start of MODEL 10 1 H1 MET 437 HT1 MET 437 134.688 -13.186 15.595 2 H2 MET 437 HT2 MET 437 134.084 -12.061 16.742 3 H3 MET 437 HT3 MET 437 134.253 -11.606 15.095 4 HA MET 437 HA MET 437 132.436 -12.674 14.441 5 HB2 MET 437 HB2 MET 437 133.520 -14.808 15.459 6 HB3 MET 437 HB3 MET 437 132.458 -14.501 16.826 7 HG2 MET 437 HG2 MET 437 130.709 -14.320 14.771 8 HG3 MET 437 HG3 MET 437 131.846 -15.511 14.143 9 HE1 MET 437 HE1 MET 437 131.121 -18.664 15.950 10 HE2 MET 437 HE2 MET 437 132.589 -17.706 15.753 11 HE3 MET 437 HE3 MET 437 131.457 -17.871 14.412 12 H HIS 438 H HIS 438 132.848 -10.502 16.408 13 HA HIS 438 HA HIS 438 130.520 -10.698 18.145 14 HB2 HIS 438 HB2 HIS 438 132.755 -8.707 17.847 15 HB3 HIS 438 HB3 HIS 438 131.314 -8.315 18.778 16 HD1 HIS 438 HD1 HIS 438 134.488 -9.049 19.599 17 HD2 HIS 438 HD2 HIS 438 130.960 -11.066 20.468 18 HE1 HIS 438 HE1 HIS 438 134.988 -10.428 21.643 19 HE2 HIS 438 HE2 HIS 438 132.841 -11.645 22.148 20 H HIS 439 H HIS 439 128.784 -10.650 16.726 21 HA HIS 439 HA HIS 439 127.047 -9.529 15.727 22 HB2 HIS 439 HB2 HIS 439 128.581 -7.411 16.764 23 HB3 HIS 439 HB3 HIS 439 128.278 -7.001 15.079 24 HD1 HIS 439 HD1 HIS 439 126.474 -7.684 18.309 25 HD2 HIS 439 HD2 HIS 439 125.680 -6.253 14.490 26 HE1 HIS 439 HE1 HIS 439 124.141 -6.752 18.413 27 HE2 HIS 439 HE2 HIS 439 123.654 -5.959 16.071 28 H HIS 440 H HIS 440 126.647 -8.313 13.544 29 HA HIS 440 HA HIS 440 128.715 -9.059 11.596 30 HB2 HIS 440 HB2 HIS 440 125.765 -9.675 11.324 31 HB3 HIS 440 HB3 HIS 440 126.990 -9.965 10.093 32 HD1 HIS 440 HD1 HIS 440 125.097 -11.977 12.002 33 HD2 HIS 440 HD2 HIS 440 129.225 -11.509 11.874 34 HE1 HIS 440 HE1 HIS 440 126.046 -14.116 12.924 35 HE2 HIS 440 HE2 HIS 440 128.545 -13.828 12.793 36 H HIS 441 H HIS 441 125.612 -7.379 12.036 37 HA HIS 441 HA HIS 441 124.717 -5.605 10.852 38 HB2 HIS 441 HB2 HIS 441 126.152 -3.556 11.190 39 HB3 HIS 441 HB3 HIS 441 125.820 -4.484 12.648 40 HD1 HIS 441 HD1 HIS 441 128.594 -3.857 10.157 41 HD2 HIS 441 HD2 HIS 441 128.043 -5.381 13.984 42 HE1 HIS 441 HE1 HIS 441 130.907 -4.197 11.085 43 HE2 HIS 441 HE2 HIS 441 130.548 -5.061 13.423 44 H HIS 442 H HIS 442 125.738 -7.370 8.993 45 HA HIS 442 HA HIS 442 127.630 -6.720 7.207 46 HB2 HIS 442 HB2 HIS 442 126.288 -7.700 5.456 47 HB3 HIS 442 HB3 HIS 442 125.985 -8.578 6.951 48 HD1 HIS 442 HD1 HIS 442 124.388 -5.789 4.918 49 HD2 HIS 442 HD2 HIS 442 123.351 -8.847 7.533 50 HE1 HIS 442 HE1 HIS 442 121.874 -5.793 4.984 51 HE2 HIS 442 HE2 HIS 442 121.272 -7.597 6.637 52 H HIS 443 H HIS 443 128.063 -5.207 5.683 53 HA HIS 443 HA HIS 443 127.393 -2.630 5.856 54 HB2 HIS 443 HB2 HIS 443 128.491 -4.288 3.788 55 HB3 HIS 443 HB3 HIS 443 127.438 -3.078 3.062 56 HD1 HIS 443 HD1 HIS 443 130.629 -3.186 2.896 57 HD2 HIS 443 HD2 HIS 443 128.351 -0.706 5.331 58 HE1 HIS 443 HE1 HIS 443 132.104 -1.217 3.419 59 HE2 HIS 443 HE2 HIS 443 130.721 0.249 4.931 60 H SER 444 H SER 444 125.350 -1.994 6.328 61 HA SER 444 HA SER 444 122.946 -2.918 5.505 62 HB2 SER 444 HB2 SER 444 123.949 -0.306 6.397 63 HB3 SER 444 HB3 SER 444 122.470 -0.213 5.442 64 HG SER 444 HG SER 444 121.716 -1.954 6.926 65 H ASN 445 H ASN 445 124.502 -0.156 3.865 66 HA ASN 445 HA ASN 445 122.805 -0.214 1.625 67 HB2 ASN 445 HB2 ASN 445 125.346 1.128 2.346 68 HB3 ASN 445 HB3 ASN 445 125.011 0.984 0.623 69 HD21 ASN 445 HD21 ASN 445 123.829 2.516 -0.258 70 HD22 ASN 445 HD22 ASN 445 122.788 3.608 0.584 71 H ALA 446 H ALA 446 122.632 -1.823 0.212 72 HA ALA 446 HA ALA 446 124.871 -3.608 -0.277 73 HB1 ALA 446 HB1 ALA 446 123.315 -5.139 -0.686 74 HB2 ALA 446 HB2 ALA 446 122.578 -4.138 -1.937 75 HB3 ALA 446 HB3 ALA 446 122.100 -3.939 -0.250 76 H THR 447 H THR 447 123.423 -0.862 -1.705 77 HA THR 447 HA THR 447 123.805 0.285 -3.636 78 HB THR 447 HB THR 447 126.127 -0.644 -4.759 79 HG1 THR 447 HG1 THR 447 126.804 -2.067 -3.277 80 HG21 THR 447 HG21 THR 447 126.392 1.152 -2.409 81 HG22 THR 447 HG22 THR 447 125.317 1.658 -3.711 82 HG23 THR 447 HG23 THR 447 127.017 1.331 -4.049 83 H GLY 448 H GLY 448 124.332 -0.029 -6.071 84 HA2 GLY 448 HA2 GLY 448 124.087 -1.231 -8.048 85 HA3 GLY 448 HA3 GLY 448 123.809 -2.683 -7.100 86 HA PRO 449 HA PRO 449 119.844 -0.868 -9.099 87 HB2 PRO 449 HB2 PRO 449 119.857 -3.560 -10.347 88 HB3 PRO 449 HB3 PRO 449 119.473 -1.991 -11.060 89 HG2 PRO 449 HG2 PRO 449 121.772 -3.225 -11.620 90 HG3 PRO 449 HG3 PRO 449 121.700 -1.463 -11.426 91 HD2 PRO 449 HD2 PRO 449 122.694 -3.544 -9.520 92 HD3 PRO 449 HD3 PRO 449 123.344 -1.927 -9.865 93 H GLN 450 H GLN 450 117.827 -1.343 -8.319 94 HA GLN 450 HA GLN 450 116.661 -3.618 -7.517 95 HB2 GLN 450 HB2 GLN 450 118.341 -4.341 -6.061 96 HB3 GLN 450 HB3 GLN 450 118.630 -2.723 -5.436 97 HG2 GLN 450 HG2 GLN 450 117.542 -4.132 -3.784 98 HG3 GLN 450 HG3 GLN 450 116.511 -2.780 -4.252 99 HE21 GLN 450 HE21 GLN 450 117.119 -6.203 -4.865 100 HE22 GLN 450 HE22 GLN 450 115.486 -6.608 -5.255 101 H PHE 451 H PHE 451 114.829 -2.441 -7.939 102 HA PHE 451 HA PHE 451 114.175 0.076 -6.950 103 HB2 PHE 451 HB2 PHE 451 112.033 -0.283 -7.780 104 HB3 PHE 451 HB3 PHE 451 113.000 -1.390 -8.747 105 HD1 PHE 451 HD1 PHE 451 112.792 -3.774 -8.491 106 HD2 PHE 451 HD2 PHE 451 110.526 -1.112 -6.065 107 HE1 PHE 451 HE1 PHE 451 111.345 -5.640 -7.802 108 HE2 PHE 451 HE2 PHE 451 109.075 -2.973 -5.368 109 HZ PHE 451 HZ PHE 451 109.482 -5.243 -6.238 110 H VAL 452 H VAL 452 114.080 0.682 -4.895 111 HA VAL 452 HA VAL 452 113.908 -0.954 -2.668 112 HB VAL 452 HB VAL 452 113.082 1.133 -1.463 113 HG11 VAL 452 HG11 VAL 452 115.621 0.687 -2.852 114 HG12 VAL 452 HG12 VAL 452 115.303 1.074 -1.161 115 HG13 VAL 452 HG13 VAL 452 115.340 2.359 -2.370 116 HG21 VAL 452 HG21 VAL 452 112.668 1.944 -4.189 117 HG22 VAL 452 HG22 VAL 452 113.785 3.048 -3.385 118 HG23 VAL 452 HG23 VAL 452 112.189 2.753 -2.697 119 H SER 453 H SER 453 112.300 -2.475 -2.671 120 HA SER 453 HA SER 453 109.589 -1.878 -3.311 121 HB2 SER 453 HB2 SER 453 109.303 -4.109 -3.284 122 HB3 SER 453 HB3 SER 453 111.058 -4.177 -3.134 123 HG SER 453 HG SER 453 110.636 -5.186 -1.342 124 H GLY 454 H GLY 454 110.968 -0.466 -0.895 125 HA2 GLY 454 HA2 GLY 454 110.481 -0.017 1.336 126 HA3 GLY 454 HA3 GLY 454 108.928 0.318 0.592 127 H VAL 455 H VAL 455 110.278 -2.915 0.815 128 HA VAL 455 HA VAL 455 109.262 -4.816 1.622 129 HB VAL 455 HB VAL 455 108.886 -3.638 4.291 130 HG11 VAL 455 HG11 VAL 455 109.362 -6.128 3.246 131 HG12 VAL 455 HG12 VAL 455 109.528 -5.680 4.943 132 HG13 VAL 455 HG13 VAL 455 110.941 -5.671 3.888 133 HG21 VAL 455 HG21 VAL 455 111.430 -3.498 4.571 134 HG22 VAL 455 HG22 VAL 455 110.620 -2.154 3.766 135 HG23 VAL 455 HG23 VAL 455 111.485 -3.359 2.814 136 H ILE 456 H ILE 456 107.274 -5.015 0.680 137 HA ILE 456 HA ILE 456 105.007 -3.482 1.504 138 HB ILE 456 HB ILE 456 105.212 -5.943 -0.226 139 HG12 ILE 456 HG12 ILE 456 106.234 -4.059 -1.288 140 HG13 ILE 456 HG13 ILE 456 104.645 -4.256 -2.020 141 HG21 ILE 456 HG21 ILE 456 103.004 -6.152 -0.163 142 HG22 ILE 456 HG22 ILE 456 102.810 -4.468 -0.652 143 HG23 ILE 456 HG23 ILE 456 102.933 -4.881 1.059 144 HD11 ILE 456 HD11 ILE 456 105.095 -1.926 -1.627 145 HD12 ILE 456 HD12 ILE 456 105.411 -2.243 0.078 146 HD13 ILE 456 HD13 ILE 456 103.787 -2.464 -0.573 147 H VAL 457 H VAL 457 103.623 -3.859 3.097 148 HA VAL 457 HA VAL 457 103.683 -6.492 4.418 149 HB VAL 457 HB VAL 457 103.206 -3.745 5.559 150 HG11 VAL 457 HG11 VAL 457 102.201 -6.356 6.496 151 HG12 VAL 457 HG12 VAL 457 101.583 -4.729 6.784 152 HG13 VAL 457 HG13 VAL 457 102.955 -5.329 7.716 153 HG21 VAL 457 HG21 VAL 457 105.495 -4.271 5.570 154 HG22 VAL 457 HG22 VAL 457 105.195 -5.942 6.048 155 HG23 VAL 457 HG23 VAL 457 104.937 -4.634 7.204 156 H LYS 458 H LYS 458 101.954 -7.640 3.755 157 HA LYS 458 HA LYS 458 99.490 -6.277 3.042 158 HB2 LYS 458 HB2 LYS 458 100.079 -8.013 1.544 159 HB3 LYS 458 HB3 LYS 458 100.387 -9.146 2.855 160 HG2 LYS 458 HG2 LYS 458 97.972 -9.109 3.395 161 HG3 LYS 458 HG3 LYS 458 97.709 -8.072 1.991 162 HD2 LYS 458 HD2 LYS 458 98.644 -9.833 0.545 163 HD3 LYS 458 HD3 LYS 458 98.844 -10.869 1.959 164 HE2 LYS 458 HE2 LYS 458 96.200 -10.061 2.094 165 HE3 LYS 458 HE3 LYS 458 96.474 -10.319 0.371 166 HZ1 LYS 458 HZ1 LYS 458 96.249 -12.236 2.482 167 HZ2 LYS 458 HZ2 LYS 458 97.648 -12.471 1.561 168 HZ3 LYS 458 HZ3 LYS 458 96.134 -12.458 0.808 169 H ILE 459 H ILE 459 97.931 -5.896 4.430 170 HA ILE 459 HA ILE 459 97.692 -7.623 6.805 171 HB ILE 459 HB ILE 459 96.629 -4.811 6.595 172 HG12 ILE 459 HG12 ILE 459 99.306 -5.827 7.507 173 HG13 ILE 459 HG13 ILE 459 98.940 -4.448 6.475 174 HG21 ILE 459 HG21 ILE 459 95.760 -6.616 8.267 175 HG22 ILE 459 HG22 ILE 459 96.096 -4.981 8.835 176 HG23 ILE 459 HG23 ILE 459 97.263 -6.271 9.124 177 HD11 ILE 459 HD11 ILE 459 99.753 -3.932 8.803 178 HD12 ILE 459 HD12 ILE 459 98.196 -4.531 9.380 179 HD13 ILE 459 HD13 ILE 459 98.262 -3.135 8.303 180 H ILE 460 H ILE 460 95.935 -8.831 6.926 181 HA ILE 460 HA ILE 460 93.505 -7.930 5.541 182 HB ILE 460 HB ILE 460 94.708 -9.722 4.224 183 HG12 ILE 460 HG12 ILE 460 92.149 -9.179 4.319 184 HG13 ILE 460 HG13 ILE 460 92.705 -10.623 3.477 185 HG21 ILE 460 HG21 ILE 460 94.156 -12.074 5.158 186 HG22 ILE 460 HG22 ILE 460 94.095 -11.252 6.717 187 HG23 ILE 460 HG23 ILE 460 95.576 -11.216 5.759 188 HD11 ILE 460 HD11 ILE 460 90.688 -10.722 5.130 189 HD12 ILE 460 HD12 ILE 460 91.958 -10.828 6.349 190 HD13 ILE 460 HD13 ILE 460 91.864 -12.035 5.067 191 H SER 461 H SER 461 91.647 -8.179 6.661 192 HA SER 461 HA SER 461 91.795 -9.685 9.187 193 HB2 SER 461 HB2 SER 461 91.885 -7.231 9.563 194 HB3 SER 461 HB3 SER 461 90.330 -7.079 8.761 195 HG SER 461 HG SER 461 90.495 -7.322 11.210 196 H THR 462 H THR 462 89.186 -9.291 9.996 197 HA THR 462 HA THR 462 87.709 -10.797 7.933 198 HB THR 462 HB THR 462 86.322 -11.623 9.906 199 HG1 THR 462 HG1 THR 462 87.342 -11.514 11.935 200 HG21 THR 462 HG21 THR 462 87.772 -13.441 10.318 201 HG22 THR 462 HG22 THR 462 89.208 -12.461 10.024 202 HG23 THR 462 HG23 THR 462 88.147 -12.894 8.683 203 H GLU 463 H GLU 463 87.786 -7.912 9.708 204 HA GLU 463 HA GLU 463 85.870 -6.520 8.465 205 HB2 GLU 463 HB2 GLU 463 84.614 -8.532 10.188 206 HB3 GLU 463 HB3 GLU 463 84.029 -6.899 10.472 207 HG2 GLU 463 HG2 GLU 463 83.234 -6.679 8.283 208 HG3 GLU 463 HG3 GLU 463 84.173 -8.057 7.712 209 HA PRO 464 HA PRO 464 86.217 -5.136 13.308 210 HB2 PRO 464 HB2 PRO 464 88.923 -6.426 13.359 211 HB3 PRO 464 HB3 PRO 464 87.823 -6.078 14.698 212 HG2 PRO 464 HG2 PRO 464 87.991 -8.537 13.687 213 HG3 PRO 464 HG3 PRO 464 86.432 -7.864 14.199 214 HD2 PRO 464 HD2 PRO 464 87.471 -8.356 11.470 215 HD3 PRO 464 HD3 PRO 464 85.794 -8.295 12.044 216 H LEU 465 H LEU 465 88.530 -5.375 10.685 217 HA LEU 465 HA LEU 465 90.377 -3.481 11.093 218 HB2 LEU 465 HB2 LEU 465 89.242 -4.664 8.837 219 HB3 LEU 465 HB3 LEU 465 89.114 -2.941 8.542 220 HG LEU 465 HG LEU 465 91.753 -3.775 9.512 221 HD11 LEU 465 HD11 LEU 465 91.907 -5.608 8.235 222 HD12 LEU 465 HD12 LEU 465 92.042 -4.470 6.894 223 HD13 LEU 465 HD13 LEU 465 90.480 -5.188 7.287 224 HD21 LEU 465 HD21 LEU 465 91.635 -1.590 8.748 225 HD22 LEU 465 HD22 LEU 465 90.609 -2.016 7.378 226 HD23 LEU 465 HD23 LEU 465 92.319 -2.446 7.365 227 HA PRO 466 HA PRO 466 87.694 -0.079 12.426 228 HB2 PRO 466 HB2 PRO 466 89.825 1.457 13.253 229 HB3 PRO 466 HB3 PRO 466 89.006 0.256 14.254 230 HG2 PRO 466 HG2 PRO 466 91.552 0.018 12.707 231 HG3 PRO 466 HG3 PRO 466 91.153 -0.610 14.317 232 HD2 PRO 466 HD2 PRO 466 91.175 -2.187 12.143 233 HD3 PRO 466 HD3 PRO 466 90.010 -2.429 13.461 234 H GLY 467 H GLY 467 90.741 0.339 10.618 235 HA2 GLY 467 HA2 GLY 467 89.906 1.442 8.337 236 HA3 GLY 467 HA3 GLY 467 89.741 2.803 9.436 237 H ARG 468 H ARG 468 91.331 3.492 7.593 238 HA ARG 468 HA ARG 468 93.996 2.600 7.644 239 HB2 ARG 468 HB2 ARG 468 94.457 4.906 6.636 240 HB3 ARG 468 HB3 ARG 468 93.360 3.849 5.756 241 HG2 ARG 468 HG2 ARG 468 91.922 5.499 7.634 242 HG3 ARG 468 HG3 ARG 468 92.901 6.476 6.538 243 HD2 ARG 468 HD2 ARG 468 91.386 4.262 5.310 244 HD3 ARG 468 HD3 ARG 468 90.424 5.594 5.952 245 HE ARG 468 HE ARG 468 92.200 6.936 4.521 246 HH11 ARG 468 HH11 ARG 468 90.425 4.047 3.725 247 HH12 ARG 468 HH12 ARG 468 90.412 4.369 2.025 248 HH21 ARG 468 HH21 ARG 468 92.191 7.368 2.286 249 HH22 ARG 468 HH22 ARG 468 91.417 6.258 1.206 250 H LYS 469 H LYS 469 92.309 5.136 9.421 251 HA LYS 469 HA LYS 469 94.541 6.307 10.651 252 HB2 LYS 469 HB2 LYS 469 92.869 7.112 12.349 253 HB3 LYS 469 HB3 LYS 469 92.467 7.481 10.678 254 HG2 LYS 469 HG2 LYS 469 91.235 5.058 11.089 255 HG3 LYS 469 HG3 LYS 469 91.032 5.884 12.635 256 HD2 LYS 469 HD2 LYS 469 89.521 7.292 11.785 257 HD3 LYS 469 HD3 LYS 469 90.530 7.642 10.380 258 HE2 LYS 469 HE2 LYS 469 89.781 5.374 9.489 259 HE3 LYS 469 HE3 LYS 469 88.554 5.409 10.755 260 HZ1 LYS 469 HZ1 LYS 469 87.614 6.261 8.750 261 HZ2 LYS 469 HZ2 LYS 469 88.883 7.358 8.542 262 HZ3 LYS 469 HZ3 LYS 469 87.797 7.556 9.823 263 H GLN 470 H GLN 470 92.415 3.673 11.726 264 HA GLN 470 HA GLN 470 93.818 3.339 14.204 265 HB2 GLN 470 HB2 GLN 470 91.547 2.016 12.831 266 HB3 GLN 470 HB3 GLN 470 92.432 1.053 14.007 267 HG2 GLN 470 HG2 GLN 470 90.991 3.649 14.470 268 HG3 GLN 470 HG3 GLN 470 90.602 2.062 15.130 269 HE21 GLN 470 HE21 GLN 470 92.546 4.882 15.421 270 HE22 GLN 470 HE22 GLN 470 93.328 4.458 16.902 271 H VAL 471 H VAL 471 93.740 1.596 11.107 272 HA VAL 471 HA VAL 471 95.493 -0.479 11.884 273 HB VAL 471 HB VAL 471 94.903 0.652 9.146 274 HG11 VAL 471 HG11 VAL 471 95.772 -1.815 8.609 275 HG12 VAL 471 HG12 VAL 471 96.757 -1.477 10.031 276 HG13 VAL 471 HG13 VAL 471 96.838 -0.411 8.629 277 HG21 VAL 471 HG21 VAL 471 93.922 -1.846 10.523 278 HG22 VAL 471 HG22 VAL 471 93.493 -1.317 8.896 279 HG23 VAL 471 HG23 VAL 471 92.991 -0.367 10.294 280 H ARG 472 H ARG 472 96.031 2.644 10.311 281 HA ARG 472 HA ARG 472 98.809 2.364 9.932 282 HB2 ARG 472 HB2 ARG 472 98.837 4.663 9.413 283 HB3 ARG 472 HB3 ARG 472 97.245 4.113 8.911 284 HG2 ARG 472 HG2 ARG 472 96.264 5.028 10.933 285 HG3 ARG 472 HG3 ARG 472 97.858 5.532 11.496 286 HD2 ARG 472 HD2 ARG 472 96.581 6.484 8.936 287 HD3 ARG 472 HD3 ARG 472 96.504 7.358 10.465 288 HE ARG 472 HE ARG 472 99.191 6.805 9.840 289 HH11 ARG 472 HH11 ARG 472 96.532 8.793 8.784 290 HH12 ARG 472 HH12 ARG 472 97.548 10.053 8.169 291 HH21 ARG 472 HH21 ARG 472 100.539 8.461 9.034 292 HH22 ARG 472 HH22 ARG 472 99.826 9.864 8.310 293 H ASP 473 H ASP 473 96.863 3.675 12.565 294 HA ASP 473 HA ASP 473 98.953 4.645 14.164 295 HB2 ASP 473 HB2 ASP 473 96.108 3.920 14.574 296 HB3 ASP 473 HB3 ASP 473 97.115 3.962 16.019 297 H THR 474 H THR 474 97.400 1.469 14.003 298 HA THR 474 HA THR 474 98.746 0.289 16.170 299 HB THR 474 HB THR 474 98.340 -1.887 14.796 300 HG1 THR 474 HG1 THR 474 96.595 -1.508 13.243 301 HG21 THR 474 HG21 THR 474 96.084 -0.106 15.707 302 HG22 THR 474 HG22 THR 474 96.959 -1.294 16.675 303 HG23 THR 474 HG23 THR 474 95.921 -1.826 15.351 304 H LEU 475 H LEU 475 99.340 -0.670 12.804 305 HA LEU 475 HA LEU 475 101.797 -1.769 13.086 306 HB2 LEU 475 HB2 LEU 475 102.262 -1.024 10.726 307 HB3 LEU 475 HB3 LEU 475 100.749 -1.876 10.967 308 HG LEU 475 HG LEU 475 99.915 0.690 11.244 309 HD11 LEU 475 HD11 LEU 475 102.327 1.332 10.609 310 HD12 LEU 475 HD12 LEU 475 100.992 2.154 9.800 311 HD13 LEU 475 HD13 LEU 475 101.861 0.859 8.976 312 HD21 LEU 475 HD21 LEU 475 99.121 0.487 8.915 313 HD22 LEU 475 HD22 LEU 475 98.852 -0.978 9.859 314 HD23 LEU 475 HD23 LEU 475 100.179 -0.907 8.699 315 H ALA 476 H ALA 476 101.099 1.691 12.748 316 HA ALA 476 HA ALA 476 103.820 2.508 12.675 317 HB1 ALA 476 HB1 ALA 476 101.418 4.133 13.497 318 HB2 ALA 476 HB2 ALA 476 101.982 3.918 11.840 319 HB3 ALA 476 HB3 ALA 476 102.996 4.756 13.014 320 H ALA 477 H ALA 477 101.611 1.701 15.208 321 HA ALA 477 HA ALA 477 102.984 3.012 17.333 322 HB1 ALA 477 HB1 ALA 477 100.918 2.548 18.107 323 HB2 ALA 477 HB2 ALA 477 101.663 1.029 18.606 324 HB3 ALA 477 HB3 ALA 477 100.748 1.112 17.100 325 H ILE 478 H ILE 478 103.311 -0.040 15.710 326 HA ILE 478 HA ILE 478 105.065 -1.179 17.707 327 HB ILE 478 HB ILE 478 104.365 -2.081 14.910 328 HG12 ILE 478 HG12 ILE 478 103.637 -3.924 16.961 329 HG13 ILE 478 HG13 ILE 478 103.062 -2.329 17.436 330 HG21 ILE 478 HG21 ILE 478 106.639 -2.766 16.377 331 HG22 ILE 478 HG22 ILE 478 105.993 -3.593 14.960 332 HG23 ILE 478 HG23 ILE 478 105.529 -4.120 16.577 333 HD11 ILE 478 HD11 ILE 478 101.412 -2.400 15.961 334 HD12 ILE 478 HD12 ILE 478 101.813 -4.101 15.730 335 HD13 ILE 478 HD13 ILE 478 102.500 -2.881 14.657 336 H SER 479 H SER 479 105.306 0.610 14.737 337 HA SER 479 HA SER 479 108.044 1.276 15.233 338 HB2 SER 479 HB2 SER 479 107.383 -0.865 13.322 339 HB3 SER 479 HB3 SER 479 108.419 0.401 12.665 340 HG SER 479 HG SER 479 109.287 -0.231 15.104 341 H GLU 480 H GLU 480 108.894 2.704 13.402 342 HA GLU 480 HA GLU 480 106.788 4.569 12.720 343 HB2 GLU 480 HB2 GLU 480 109.214 5.086 13.560 344 HB3 GLU 480 HB3 GLU 480 109.639 4.909 11.863 345 HG2 GLU 480 HG2 GLU 480 107.659 6.588 11.515 346 HG3 GLU 480 HG3 GLU 480 107.984 6.987 13.200 347 H VAL 481 H VAL 481 105.818 2.856 11.266 348 HA VAL 481 HA VAL 481 106.934 1.941 8.917 349 HB VAL 481 HB VAL 481 104.645 1.848 7.988 350 HG11 VAL 481 HG11 VAL 481 104.301 0.978 10.801 351 HG12 VAL 481 HG12 VAL 481 105.670 0.323 9.903 352 HG13 VAL 481 HG13 VAL 481 104.030 0.097 9.298 353 HG21 VAL 481 HG21 VAL 481 104.127 4.062 9.430 354 HG22 VAL 481 HG22 VAL 481 103.423 2.834 10.482 355 HG23 VAL 481 HG23 VAL 481 102.878 2.983 8.811 356 H LEU 482 H LEU 482 106.972 2.663 6.781 357 HA LEU 482 HA LEU 482 107.475 5.441 6.449 358 HB2 LEU 482 HB2 LEU 482 108.074 3.106 5.059 359 HB3 LEU 482 HB3 LEU 482 107.022 3.994 3.973 360 HG LEU 482 HG LEU 482 109.389 5.336 5.237 361 HD11 LEU 482 HD11 LEU 482 109.585 4.090 2.533 362 HD12 LEU 482 HD12 LEU 482 109.913 3.118 3.968 363 HD13 LEU 482 HD13 LEU 482 110.865 4.568 3.649 364 HD21 LEU 482 HD21 LEU 482 109.056 6.278 2.693 365 HD22 LEU 482 HD22 LEU 482 108.401 7.024 4.151 366 HD23 LEU 482 HD23 LEU 482 107.397 5.941 3.187 367 H TYR 483 H TYR 483 105.262 3.499 4.459 368 HA TYR 483 HA TYR 483 103.149 5.482 4.896 369 HB2 TYR 483 HB2 TYR 483 104.268 6.284 2.901 370 HB3 TYR 483 HB3 TYR 483 104.200 4.681 2.174 371 HD1 TYR 483 HD1 TYR 483 102.555 7.819 2.518 372 HD2 TYR 483 HD2 TYR 483 101.863 3.695 1.739 373 HE1 TYR 483 HE1 TYR 483 100.387 8.381 1.503 374 HE2 TYR 483 HE2 TYR 483 99.693 4.245 0.721 375 HH TYR 483 HH TYR 483 98.793 7.422 -0.087 376 H VAL 484 H VAL 484 101.188 4.569 5.109 377 HA VAL 484 HA VAL 484 100.960 1.718 4.436 378 HB VAL 484 HB VAL 484 100.636 2.007 6.764 379 HG11 VAL 484 HG11 VAL 484 100.198 4.144 7.342 380 HG12 VAL 484 HG12 VAL 484 98.527 3.581 7.326 381 HG13 VAL 484 HG13 VAL 484 99.184 4.432 5.929 382 HG21 VAL 484 HG21 VAL 484 99.054 0.493 5.649 383 HG22 VAL 484 HG22 VAL 484 97.909 1.824 5.486 384 HG23 VAL 484 HG23 VAL 484 98.355 1.237 7.088 385 H ASP 485 H ASP 485 99.760 1.185 2.764 386 HA ASP 485 HA ASP 485 97.748 3.074 1.772 387 HB2 ASP 485 HB2 ASP 485 99.239 2.539 0.030 388 HB3 ASP 485 HB3 ASP 485 99.286 0.835 0.476 389 H LEU 486 H LEU 486 95.625 2.616 1.805 390 HA LEU 486 HA LEU 486 94.808 -0.128 2.501 391 HB2 LEU 486 HB2 LEU 486 94.445 1.209 4.444 392 HB3 LEU 486 HB3 LEU 486 93.728 2.501 3.500 393 HG LEU 486 HG LEU 486 91.684 1.480 3.381 394 HD11 LEU 486 HD11 LEU 486 91.722 -0.518 2.386 395 HD12 LEU 486 HD12 LEU 486 91.780 -1.176 4.019 396 HD13 LEU 486 HD13 LEU 486 93.271 -0.955 3.106 397 HD21 LEU 486 HD21 LEU 486 91.854 -0.131 5.675 398 HD22 LEU 486 HD22 LEU 486 91.326 1.547 5.567 399 HD23 LEU 486 HD23 LEU 486 93.018 1.176 5.895 400 H LEU 487 H LEU 487 93.341 -1.044 1.138 401 HA LEU 487 HA LEU 487 92.631 0.294 -1.248 402 HB2 LEU 487 HB2 LEU 487 92.834 -2.299 -0.485 403 HB3 LEU 487 HB3 LEU 487 91.093 -2.100 -0.489 404 HG LEU 487 HG LEU 487 91.672 -2.942 -2.623 405 HD11 LEU 487 HD11 LEU 487 90.232 -0.726 -2.368 406 HD12 LEU 487 HD12 LEU 487 90.582 -1.448 -3.939 407 HD13 LEU 487 HD13 LEU 487 91.533 -0.078 -3.367 408 HD21 LEU 487 HD21 LEU 487 93.751 -0.763 -2.761 409 HD22 LEU 487 HD22 LEU 487 93.353 -1.885 -4.062 410 HD23 LEU 487 HD23 LEU 487 94.055 -2.489 -2.561 411 H GLU 488 H GLU 488 91.222 1.907 -1.275 412 HA GLU 488 HA GLU 488 89.441 3.237 -0.652 413 HB2 GLU 488 HB2 GLU 488 88.765 1.078 -2.264 414 HB3 GLU 488 HB3 GLU 488 87.494 1.124 -1.050 415 HG2 GLU 488 HG2 GLU 488 86.516 2.781 -2.129 416 HG3 GLU 488 HG3 GLU 488 87.953 3.778 -1.913 417 H GLY 489 H GLY 489 90.527 2.058 1.709 418 HA2 GLY 489 HA2 GLY 489 89.953 1.954 3.934 419 HA3 GLY 489 HA3 GLY 489 88.353 2.505 3.475 420 H ASP 490 H ASP 490 88.974 -0.203 1.696 421 HA ASP 490 HA ASP 490 87.037 -1.787 2.889 422 HB2 ASP 490 HB2 ASP 490 88.427 -1.952 0.601 423 HB3 ASP 490 HB3 ASP 490 89.287 -3.175 1.532 424 H THR 491 H THR 491 88.317 -4.342 3.169 425 HA THR 491 HA THR 491 89.504 -3.959 5.824 426 HB THR 491 HB THR 491 89.069 -6.487 5.997 427 HG1 THR 491 HG1 THR 491 87.183 -7.040 4.599 428 HG21 THR 491 HG21 THR 491 87.484 -5.654 7.322 429 HG22 THR 491 HG22 THR 491 86.394 -5.680 5.935 430 HG23 THR 491 HG23 THR 491 87.314 -4.222 6.307 431 H GLU 492 H GLU 492 90.633 -4.126 2.844 432 HA GLU 492 HA GLU 492 92.910 -5.854 3.565 433 HB2 GLU 492 HB2 GLU 492 93.169 -6.479 1.291 434 HB3 GLU 492 HB3 GLU 492 91.456 -6.650 1.648 435 HG2 GLU 492 HG2 GLU 492 91.247 -4.268 0.691 436 HG3 GLU 492 HG3 GLU 492 92.839 -4.575 -0.000 437 H CYS 493 H CYS 493 94.580 -4.613 4.109 438 HA CYS 493 HA CYS 493 95.231 -2.328 2.380 439 HB2 CYS 493 HB2 CYS 493 95.595 -0.873 4.165 440 HB3 CYS 493 HB3 CYS 493 94.147 -1.742 4.663 441 HG CYS 493 HG CYS 493 95.698 -1.729 6.700 442 H HIS 494 H HIS 494 97.422 -1.880 2.121 443 HA HIS 494 HA HIS 494 99.288 -3.836 3.279 444 HB2 HIS 494 HB2 HIS 494 99.245 -2.842 0.422 445 HB3 HIS 494 HB3 HIS 494 100.522 -3.831 1.122 446 HD1 HIS 494 HD1 HIS 494 96.725 -4.190 1.103 447 HD2 HIS 494 HD2 HIS 494 100.167 -6.346 0.224 448 HE1 HIS 494 HE1 HIS 494 95.929 -6.470 0.399 449 HE2 HIS 494 HE2 HIS 494 98.024 -7.727 -0.215 450 H ALA 495 H ALA 495 100.788 -2.822 4.468 451 HA ALA 495 HA ALA 495 101.323 -0.003 3.904 452 HB1 ALA 495 HB1 ALA 495 101.394 0.318 6.098 453 HB2 ALA 495 HB2 ALA 495 102.556 -0.991 6.319 454 HB3 ALA 495 HB3 ALA 495 100.828 -1.342 6.282 455 H ARG 496 H ARG 496 103.258 0.773 3.366 456 HA ARG 496 HA ARG 496 105.369 -1.133 2.704 457 HB2 ARG 496 HB2 ARG 496 105.615 1.788 2.145 458 HB3 ARG 496 HB3 ARG 496 106.154 0.416 1.187 459 HG2 ARG 496 HG2 ARG 496 103.498 0.065 1.024 460 HG3 ARG 496 HG3 ARG 496 103.565 1.818 1.201 461 HD2 ARG 496 HD2 ARG 496 105.560 1.272 -0.628 462 HD3 ARG 496 HD3 ARG 496 104.279 0.142 -1.064 463 HE ARG 496 HE ARG 496 103.053 1.904 -1.840 464 HH11 ARG 496 HH11 ARG 496 105.542 3.115 0.274 465 HH12 ARG 496 HH12 ARG 496 105.211 4.778 -0.077 466 HH21 ARG 496 HH21 ARG 496 102.612 4.091 -2.310 467 HH22 ARG 496 HH22 ARG 496 103.545 5.332 -1.545 468 H PHE 497 H PHE 497 107.224 -1.290 3.817 469 HA PHE 497 HA PHE 497 107.666 0.596 6.038 470 HB2 PHE 497 HB2 PHE 497 108.519 -2.283 5.690 471 HB3 PHE 497 HB3 PHE 497 109.091 -1.252 6.996 472 HD1 PHE 497 HD1 PHE 497 108.144 -1.906 8.977 473 HD2 PHE 497 HD2 PHE 497 105.728 -1.801 5.475 474 HE1 PHE 497 HE1 PHE 497 106.176 -2.524 10.319 475 HE2 PHE 497 HE2 PHE 497 103.759 -2.416 6.807 476 HZ PHE 497 HZ PHE 497 103.979 -2.780 9.235 477 H LYS 498 H LYS 498 109.830 1.271 6.502 478 HA LYS 498 HA LYS 498 111.390 1.684 4.104 479 HB2 LYS 498 HB2 LYS 498 112.783 3.132 5.517 480 HB3 LYS 498 HB3 LYS 498 111.078 3.536 5.664 481 HG2 LYS 498 HG2 LYS 498 111.408 1.745 7.697 482 HG3 LYS 498 HG3 LYS 498 112.965 2.576 7.675 483 HD2 LYS 498 HD2 LYS 498 110.608 4.321 7.439 484 HD3 LYS 498 HD3 LYS 498 110.766 3.477 8.980 485 HE2 LYS 498 HE2 LYS 498 113.322 4.372 8.491 486 HE3 LYS 498 HE3 LYS 498 112.318 5.687 7.885 487 HZ1 LYS 498 HZ1 LYS 498 112.100 4.495 10.596 488 HZ2 LYS 498 HZ2 LYS 498 111.217 5.813 10.009 489 HZ3 LYS 498 HZ3 LYS 498 112.887 5.950 10.236 490 H THR 499 H THR 499 111.384 -0.474 6.772 491 HA THR 499 HA THR 499 113.894 -1.647 5.811 492 HB THR 499 HB THR 499 114.310 -2.191 8.347 493 HG1 THR 499 HG1 THR 499 112.253 -0.841 8.775 494 HG21 THR 499 HG21 THR 499 114.907 0.625 7.503 495 HG22 THR 499 HG22 THR 499 115.661 -0.749 6.696 496 HG23 THR 499 HG23 THR 499 115.912 -0.496 8.423 497 HA PRO 500 HA PRO 500 111.668 -5.442 6.065 498 HB2 PRO 500 HB2 PRO 500 113.713 -7.187 6.430 499 HB3 PRO 500 HB3 PRO 500 113.400 -6.385 4.886 500 HG2 PRO 500 HG2 PRO 500 115.390 -5.693 7.013 501 HG3 PRO 500 HG3 PRO 500 115.601 -5.727 5.253 502 HD2 PRO 500 HD2 PRO 500 115.195 -3.430 6.624 503 HD3 PRO 500 HD3 PRO 500 114.602 -3.669 4.968 504 H GLU 501 H GLU 501 114.069 -4.818 8.585 505 HA GLU 501 HA GLU 501 113.254 -6.794 10.398 506 HB2 GLU 501 HB2 GLU 501 114.384 -5.387 12.113 507 HB3 GLU 501 HB3 GLU 501 115.368 -5.691 10.689 508 HG2 GLU 501 HG2 GLU 501 115.176 -3.509 9.930 509 HG3 GLU 501 HG3 GLU 501 113.740 -3.194 10.902 510 H ASP 502 H ASP 502 112.154 -3.474 9.926 511 HA ASP 502 HA ASP 502 110.538 -3.246 12.200 512 HB2 ASP 502 HB2 ASP 502 110.633 -1.902 9.539 513 HB3 ASP 502 HB3 ASP 502 109.202 -1.661 10.537 514 H ALA 503 H ALA 503 109.787 -4.454 8.953 515 HA ALA 503 HA ALA 503 107.033 -4.889 9.431 516 HB1 ALA 503 HB1 ALA 503 107.215 -5.020 7.215 517 HB2 ALA 503 HB2 ALA 503 107.700 -6.696 7.471 518 HB3 ALA 503 HB3 ALA 503 108.926 -5.442 7.295 519 H GLN 504 H GLN 504 109.864 -7.006 9.662 520 HA GLN 504 HA GLN 504 108.492 -9.394 10.203 521 HB2 GLN 504 HB2 GLN 504 110.831 -9.387 9.560 522 HB3 GLN 504 HB3 GLN 504 111.263 -8.508 11.018 523 HG2 GLN 504 HG2 GLN 504 110.323 -10.502 12.295 524 HG3 GLN 504 HG3 GLN 504 110.364 -11.352 10.751 525 HE21 GLN 504 HE21 GLN 504 112.751 -9.828 9.915 526 HE22 GLN 504 HE22 GLN 504 114.074 -10.547 10.760 527 H ALA 505 H ALA 505 109.784 -6.913 12.375 528 HA ALA 505 HA ALA 505 109.148 -8.259 14.772 529 HB1 ALA 505 HB1 ALA 505 109.084 -5.466 15.241 530 HB2 ALA 505 HB2 ALA 505 110.347 -5.794 14.054 531 HB3 ALA 505 HB3 ALA 505 110.366 -6.619 15.612 532 H VAL 506 H VAL 506 107.333 -5.894 12.843 533 HA VAL 506 HA VAL 506 105.235 -5.555 14.718 534 HB VAL 506 HB VAL 506 105.551 -3.886 13.026 535 HG11 VAL 506 HG11 VAL 506 104.815 -5.977 10.981 536 HG12 VAL 506 HG12 VAL 506 106.450 -5.384 11.280 537 HG13 VAL 506 HG13 VAL 506 105.213 -4.288 10.668 538 HG21 VAL 506 HG21 VAL 506 103.322 -3.499 12.429 539 HG22 VAL 506 HG22 VAL 506 103.213 -4.509 13.870 540 HG23 VAL 506 HG23 VAL 506 102.970 -5.220 12.275 541 H ILE 507 H ILE 507 105.558 -7.660 11.876 542 HA ILE 507 HA ILE 507 102.945 -8.711 11.978 543 HB ILE 507 HB ILE 507 103.914 -10.646 10.682 544 HG12 ILE 507 HG12 ILE 507 106.307 -9.646 9.781 545 HG13 ILE 507 HG13 ILE 507 106.370 -9.275 11.499 546 HG21 ILE 507 HG21 ILE 507 103.788 -7.825 9.925 547 HG22 ILE 507 HG22 ILE 507 103.095 -9.242 9.138 548 HG23 ILE 507 HG23 ILE 507 104.780 -8.811 8.853 549 HD11 ILE 507 HD11 ILE 507 106.282 -11.513 12.110 550 HD12 ILE 507 HD12 ILE 507 107.334 -11.502 10.695 551 HD13 ILE 507 HD13 ILE 507 105.653 -12.012 10.540 552 H ASN 508 H ASN 508 105.886 -9.551 13.634 553 HA ASN 508 HA ASN 508 104.994 -12.077 14.634 554 HB2 ASN 508 HB2 ASN 508 107.237 -10.208 15.356 555 HB3 ASN 508 HB3 ASN 508 106.881 -11.613 16.358 556 HD21 ASN 508 HD21 ASN 508 109.026 -10.688 14.296 557 HD22 ASN 508 HD22 ASN 508 109.298 -12.124 13.375 558 H ALA 509 H ALA 509 104.997 -8.775 15.819 559 HA ALA 509 HA ALA 509 103.914 -9.418 18.390 560 HB1 ALA 509 HB1 ALA 509 105.289 -7.308 17.513 561 HB2 ALA 509 HB2 ALA 509 104.234 -7.244 18.923 562 HB3 ALA 509 HB3 ALA 509 103.656 -6.659 17.363 563 H TYR 510 H TYR 510 102.575 -8.767 15.276 564 HA TYR 510 HA TYR 510 100.080 -7.745 16.011 565 HB2 TYR 510 HB2 TYR 510 101.291 -8.794 13.612 566 HB3 TYR 510 HB3 TYR 510 99.613 -9.312 13.754 567 HD1 TYR 510 HD1 TYR 510 98.709 -7.980 11.974 568 HD2 TYR 510 HD2 TYR 510 100.951 -6.170 15.099 569 HE1 TYR 510 HE1 TYR 510 97.979 -5.761 11.201 570 HE2 TYR 510 HE2 TYR 510 100.229 -3.942 14.336 571 HH TYR 510 HH TYR 510 99.104 -2.795 12.799 572 H THR 511 H THR 511 101.333 -10.913 16.418 573 HA THR 511 HA THR 511 99.065 -12.496 16.241 574 HB THR 511 HB THR 511 100.092 -13.979 17.887 575 HG1 THR 511 HG1 THR 511 102.022 -11.920 18.299 576 HG21 THR 511 HG21 THR 511 102.195 -12.746 16.109 577 HG22 THR 511 HG22 THR 511 101.006 -13.945 15.599 578 HG23 THR 511 HG23 THR 511 102.226 -14.369 16.800 579 H GLU 512 H GLU 512 100.143 -10.299 18.729 580 HA GLU 512 HA GLU 512 98.382 -10.923 20.785 581 HB2 GLU 512 HB2 GLU 512 99.450 -8.202 20.018 582 HB3 GLU 512 HB3 GLU 512 98.729 -8.610 21.568 583 HG2 GLU 512 HG2 GLU 512 100.888 -10.407 20.859 584 HG3 GLU 512 HG3 GLU 512 101.405 -8.722 20.919 585 H ILE 513 H ILE 513 97.916 -8.729 18.036 586 HA ILE 513 HA ILE 513 95.595 -7.476 18.606 587 HB ILE 513 HB ILE 513 96.081 -8.863 15.967 588 HG12 ILE 513 HG12 ILE 513 98.037 -7.628 16.275 589 HG13 ILE 513 HG13 ILE 513 97.004 -6.499 15.404 590 HG21 ILE 513 HG21 ILE 513 93.820 -7.960 16.253 591 HG22 ILE 513 HG22 ILE 513 94.725 -7.077 15.023 592 HG23 ILE 513 HG23 ILE 513 94.504 -6.379 16.628 593 HD11 ILE 513 HD11 ILE 513 97.743 -6.500 18.305 594 HD12 ILE 513 HD12 ILE 513 96.361 -5.590 17.695 595 HD13 ILE 513 HD13 ILE 513 97.983 -5.236 17.100 596 H ASN 514 H ASN 514 95.867 -10.827 17.450 597 HA ASN 514 HA ASN 514 93.272 -11.547 17.147 598 HB2 ASN 514 HB2 ASN 514 94.936 -13.173 16.708 599 HB3 ASN 514 HB3 ASN 514 95.572 -13.078 18.347 600 HD21 ASN 514 HD21 ASN 514 92.220 -13.328 17.279 601 HD22 ASN 514 HD22 ASN 514 91.901 -14.842 18.048 602 H LYS 515 H LYS 515 94.931 -10.914 20.161 603 HA LYS 515 HA LYS 515 93.177 -12.088 21.969 604 HB2 LYS 515 HB2 LYS 515 94.069 -10.591 23.622 605 HB3 LYS 515 HB3 LYS 515 95.374 -11.043 22.534 606 HG2 LYS 515 HG2 LYS 515 95.804 -8.853 22.479 607 HG3 LYS 515 HG3 LYS 515 94.448 -8.776 21.351 608 HD2 LYS 515 HD2 LYS 515 93.200 -7.620 22.797 609 HD3 LYS 515 HD3 LYS 515 93.567 -8.737 24.113 610 HE2 LYS 515 HE2 LYS 515 95.887 -7.523 24.088 611 HE3 LYS 515 HE3 LYS 515 94.978 -6.240 23.290 612 HZ1 LYS 515 HZ1 LYS 515 93.371 -6.487 25.237 613 HZ2 LYS 515 HZ2 LYS 515 94.851 -5.724 25.536 614 HZ3 LYS 515 HZ3 LYS 515 94.620 -7.330 26.010 615 H LYS 516 H LYS 516 92.884 -9.175 20.097 616 HA LYS 516 HA LYS 516 90.303 -8.593 21.390 617 HB2 LYS 516 HB2 LYS 516 92.321 -6.862 21.154 618 HB3 LYS 516 HB3 LYS 516 91.587 -6.612 19.576 619 HG2 LYS 516 HG2 LYS 516 90.827 -5.041 21.364 620 HG3 LYS 516 HG3 LYS 516 89.535 -5.920 20.543 621 HD2 LYS 516 HD2 LYS 516 90.634 -7.205 22.960 622 HD3 LYS 516 HD3 LYS 516 89.739 -5.708 23.225 623 HE2 LYS 516 HE2 LYS 516 87.760 -6.611 22.556 624 HE3 LYS 516 HE3 LYS 516 88.526 -7.712 21.411 625 HZ1 LYS 516 HZ1 LYS 516 88.555 -9.325 22.917 626 HZ2 LYS 516 HZ2 LYS 516 87.545 -8.365 23.876 627 HZ3 LYS 516 HZ3 LYS 516 89.219 -8.325 24.111 628 H HIS 517 H HIS 517 91.961 -8.841 18.274 629 HA HIS 517 HA HIS 517 89.532 -9.805 17.038 630 HB2 HIS 517 HB2 HIS 517 90.840 -7.538 15.601 631 HB3 HIS 517 HB3 HIS 517 89.179 -8.112 15.507 632 HD1 HIS 517 HD1 HIS 517 87.500 -7.170 17.214 633 HD2 HIS 517 HD2 HIS 517 91.361 -5.702 17.667 634 HE1 HIS 517 HE1 HIS 517 87.297 -5.218 18.787 635 HE2 HIS 517 HE2 HIS 517 89.637 -4.306 18.995 636 H CYS 518 H CYS 518 89.977 -11.280 15.499 637 HA CYS 518 HA CYS 518 92.601 -12.215 15.126 638 HB2 CYS 518 HB2 CYS 518 90.287 -12.755 13.263 639 HB3 CYS 518 HB3 CYS 518 91.670 -13.793 13.594 640 HG CYS 518 HG CYS 518 89.339 -14.438 14.870 641 H TRP 519 H TRP 519 94.135 -11.019 14.162 642 HA TRP 519 HA TRP 519 93.472 -9.770 11.574 643 HB2 TRP 519 HB2 TRP 519 94.237 -8.393 13.786 644 HB3 TRP 519 HB3 TRP 519 95.800 -8.694 13.028 645 HD1 TRP 519 HD1 TRP 519 93.488 -8.512 10.274 646 HE1 TRP 519 HE1 TRP 519 93.420 -6.191 9.222 647 HE3 TRP 519 HE3 TRP 519 95.844 -5.895 13.977 648 HZ2 TRP 519 HZ2 TRP 519 94.267 -3.555 9.866 649 HZ3 TRP 519 HZ3 TRP 519 96.180 -3.477 13.678 650 HH2 TRP 519 HH2 TRP 519 95.410 -2.333 11.665 651 H LYS 520 H LYS 520 94.869 -9.938 9.908 652 HA LYS 520 HA LYS 520 96.983 -11.963 10.231 653 HB2 LYS 520 HB2 LYS 520 95.830 -11.168 7.596 654 HB3 LYS 520 HB3 LYS 520 96.542 -12.703 8.074 655 HG2 LYS 520 HG2 LYS 520 93.894 -11.656 9.053 656 HG3 LYS 520 HG3 LYS 520 94.100 -12.819 7.740 657 HD2 LYS 520 HD2 LYS 520 94.274 -14.499 9.191 658 HD3 LYS 520 HD3 LYS 520 95.567 -13.669 10.062 659 HE2 LYS 520 HE2 LYS 520 93.941 -13.892 11.692 660 HE3 LYS 520 HE3 LYS 520 93.637 -12.267 11.079 661 HZ1 LYS 520 HZ1 LYS 520 91.542 -13.078 10.995 662 HZ2 LYS 520 HZ2 LYS 520 92.032 -14.686 10.804 663 HZ3 LYS 520 HZ3 LYS 520 92.055 -13.634 9.480 664 H LEU 521 H LEU 521 99.048 -11.501 9.711 665 HA LEU 521 HA LEU 521 99.612 -9.060 8.197 666 HB2 LEU 521 HB2 LEU 521 100.013 -9.328 10.982 667 HB3 LEU 521 HB3 LEU 521 101.600 -9.396 10.240 668 HG LEU 521 HG LEU 521 99.593 -7.157 10.115 669 HD11 LEU 521 HD11 LEU 521 101.046 -5.968 11.384 670 HD12 LEU 521 HD12 LEU 521 102.464 -6.773 10.716 671 HD13 LEU 521 HD13 LEU 521 101.486 -7.583 11.938 672 HD21 LEU 521 HD21 LEU 521 101.213 -6.027 8.603 673 HD22 LEU 521 HD22 LEU 521 100.385 -7.400 7.869 674 HD23 LEU 521 HD23 LEU 521 102.051 -7.568 8.424 675 H GLU 522 H GLU 522 100.809 -9.605 6.504 676 HA GLU 522 HA GLU 522 102.978 -11.546 6.845 677 HB2 GLU 522 HB2 GLU 522 100.563 -12.080 5.447 678 HB3 GLU 522 HB3 GLU 522 101.840 -11.921 4.250 679 HG2 GLU 522 HG2 GLU 522 101.928 -14.159 4.722 680 HG3 GLU 522 HG3 GLU 522 103.149 -13.523 5.825 681 H ILE 523 H ILE 523 104.763 -11.211 5.566 682 HA ILE 523 HA ILE 523 104.888 -8.608 4.238 683 HB ILE 523 HB ILE 523 107.063 -10.531 5.062 684 HG12 ILE 523 HG12 ILE 523 107.167 -7.820 6.097 685 HG13 ILE 523 HG13 ILE 523 105.650 -8.611 6.511 686 HG21 ILE 523 HG21 ILE 523 108.079 -9.585 3.248 687 HG22 ILE 523 HG22 ILE 523 108.457 -8.366 4.467 688 HG23 ILE 523 HG23 ILE 523 107.122 -8.106 3.344 689 HD11 ILE 523 HD11 ILE 523 106.961 -10.503 7.433 690 HD12 ILE 523 HD12 ILE 523 107.218 -8.973 8.273 691 HD13 ILE 523 HD13 ILE 523 108.429 -9.572 7.137 692 H LEU 524 H LEU 524 104.703 -8.461 2.103 693 HA LEU 524 HA LEU 524 104.474 -10.675 0.393 694 HB2 LEU 524 HB2 LEU 524 104.754 -7.737 0.016 695 HB3 LEU 524 HB3 LEU 524 105.016 -8.770 -1.373 696 HG LEU 524 HG LEU 524 102.727 -7.954 -1.327 697 HD11 LEU 524 HD11 LEU 524 103.021 -10.895 -0.749 698 HD12 LEU 524 HD12 LEU 524 103.036 -10.103 -2.324 699 HD13 LEU 524 HD13 LEU 524 101.552 -10.149 -1.375 700 HD21 LEU 524 HD21 LEU 524 101.641 -9.447 0.829 701 HD22 LEU 524 HD22 LEU 524 101.626 -7.702 0.576 702 HD23 LEU 524 HD23 LEU 524 102.958 -8.452 1.453 703 H SER 525 H SER 525 105.879 -11.661 -1.020 704 HA SER 525 HA SER 525 108.636 -10.724 -1.152 705 HB2 SER 525 HB2 SER 525 109.377 -12.246 0.320 706 HB3 SER 525 HB3 SER 525 107.773 -12.969 0.451 707 HG SER 525 HG SER 525 109.582 -14.311 -0.405 708 H GLY 526 H GLY 526 109.929 -11.905 -2.756 709 HA2 GLY 526 HA2 GLY 526 110.222 -12.535 -4.941 710 HA3 GLY 526 HA3 GLY 526 108.984 -13.730 -4.593 711 H ASP 527 H ASP 527 108.021 -13.655 -6.585 712 HA ASP 527 HA ASP 527 107.391 -11.436 -8.097 713 HB2 ASP 527 HB2 ASP 527 105.747 -13.964 -7.843 714 HB3 ASP 527 HB3 ASP 527 105.698 -12.825 -9.186 715 H HIS 528 H HIS 528 105.795 -12.688 -5.254 716 HA HIS 528 HA HIS 528 103.337 -11.347 -5.540 717 HB2 HIS 528 HB2 HIS 528 104.552 -13.031 -3.638 718 HB3 HIS 528 HB3 HIS 528 104.109 -11.565 -2.772 719 HD1 HIS 528 HD1 HIS 528 102.535 -13.712 -1.753 720 HD2 HIS 528 HD2 HIS 528 101.457 -11.904 -5.335 721 HE1 HIS 528 HE1 HIS 528 100.102 -14.262 -2.077 722 HE2 HIS 528 HE2 HIS 528 99.485 -13.203 -4.279 723 H GLU 529 H GLU 529 106.330 -10.406 -3.839 724 HA GLU 529 HA GLU 529 105.315 -7.904 -2.949 725 HB2 GLU 529 HB2 GLU 529 107.142 -8.627 -1.717 726 HB3 GLU 529 HB3 GLU 529 108.035 -9.133 -3.143 727 HG2 GLU 529 HG2 GLU 529 108.758 -6.991 -3.615 728 HG3 GLU 529 HG3 GLU 529 107.461 -6.240 -2.686 729 H GLN 530 H GLN 530 107.350 -8.832 -5.693 730 HA GLN 530 HA GLN 530 107.710 -6.226 -6.710 731 HB2 GLN 530 HB2 GLN 530 108.652 -7.223 -8.601 732 HB3 GLN 530 HB3 GLN 530 108.957 -8.394 -7.326 733 HG2 GLN 530 HG2 GLN 530 108.248 -9.669 -9.137 734 HG3 GLN 530 HG3 GLN 530 106.824 -9.546 -8.105 735 HE21 GLN 530 HE21 GLN 530 105.374 -9.889 -9.751 736 HE22 GLN 530 HE22 GLN 530 105.080 -8.734 -11.003 737 H ARG 531 H ARG 531 105.254 -8.677 -7.279 738 HA ARG 531 HA ARG 531 103.913 -7.500 -9.419 739 HB2 ARG 531 HB2 ARG 531 103.370 -9.740 -8.813 740 HB3 ARG 531 HB3 ARG 531 102.939 -9.263 -7.176 741 HG2 ARG 531 HG2 ARG 531 101.397 -8.010 -9.359 742 HG3 ARG 531 HG3 ARG 531 101.138 -9.735 -9.088 743 HD2 ARG 531 HD2 ARG 531 100.787 -9.185 -6.657 744 HD3 ARG 531 HD3 ARG 531 100.785 -7.484 -7.120 745 HE ARG 531 HE ARG 531 98.922 -8.585 -8.750 746 HH11 ARG 531 HH11 ARG 531 99.425 -8.603 -5.305 747 HH12 ARG 531 HH12 ARG 531 97.740 -8.743 -4.930 748 HH21 ARG 531 HH21 ARG 531 96.702 -8.771 -8.268 749 HH22 ARG 531 HH22 ARG 531 96.191 -8.842 -6.615 750 H TYR 532 H TYR 532 103.106 -7.274 -5.946 751 HA TYR 532 HA TYR 532 101.017 -5.471 -6.152 752 HB2 TYR 532 HB2 TYR 532 101.582 -6.619 -4.066 753 HB3 TYR 532 HB3 TYR 532 103.075 -5.694 -3.944 754 HD1 TYR 532 HD1 TYR 532 102.937 -3.210 -3.594 755 HD2 TYR 532 HD2 TYR 532 99.537 -5.744 -3.264 756 HE1 TYR 532 HE1 TYR 532 101.761 -1.455 -2.339 757 HE2 TYR 532 HE2 TYR 532 98.347 -3.994 -2.009 758 HH TYR 532 HH TYR 532 98.378 -1.698 -1.572 759 H TRP 533 H TRP 533 104.496 -4.844 -5.916 760 HA TRP 533 HA TRP 533 104.330 -2.044 -5.764 761 HB2 TRP 533 HB2 TRP 533 106.448 -4.001 -6.502 762 HB3 TRP 533 HB3 TRP 533 106.696 -2.321 -6.970 763 HD1 TRP 533 HD1 TRP 533 107.277 -4.593 -4.159 764 HE1 TRP 533 HE1 TRP 533 107.817 -3.288 -2.010 765 HE3 TRP 533 HE3 TRP 533 105.850 0.076 -5.668 766 HZ2 TRP 533 HZ2 TRP 533 107.654 -0.625 -1.075 767 HZ3 TRP 533 HZ3 TRP 533 106.076 1.948 -4.085 768 HH2 TRP 533 HH2 TRP 533 106.962 1.602 -1.838 769 H GLN 534 H GLN 534 104.426 -4.253 -8.517 770 HA GLN 534 HA GLN 534 104.735 -2.437 -10.590 771 HB2 GLN 534 HB2 GLN 534 103.088 -4.969 -10.450 772 HB3 GLN 534 HB3 GLN 534 103.353 -4.073 -11.939 773 HG2 GLN 534 HG2 GLN 534 105.322 -5.606 -10.293 774 HG3 GLN 534 HG3 GLN 534 104.942 -5.763 -12.007 775 HE21 GLN 534 HE21 GLN 534 106.957 -4.335 -9.692 776 HE22 GLN 534 HE22 GLN 534 107.861 -3.314 -10.753 777 H LYS 535 H LYS 535 101.831 -3.410 -8.833 778 HA LYS 535 HA LYS 535 99.977 -1.909 -10.320 779 HB2 LYS 535 HB2 LYS 535 98.796 -3.327 -9.008 780 HB3 LYS 535 HB3 LYS 535 100.026 -3.347 -7.754 781 HG2 LYS 535 HG2 LYS 535 98.232 -0.975 -8.102 782 HG3 LYS 535 HG3 LYS 535 97.700 -2.399 -7.205 783 HD2 LYS 535 HD2 LYS 535 100.312 -1.738 -6.318 784 HD3 LYS 535 HD3 LYS 535 99.355 -0.256 -6.325 785 HE2 LYS 535 HE2 LYS 535 98.408 -2.830 -5.081 786 HE3 LYS 535 HE3 LYS 535 99.298 -1.599 -4.186 787 HZ1 LYS 535 HZ1 LYS 535 96.968 -1.279 -3.846 788 HZ2 LYS 535 HZ2 LYS 535 96.661 -1.271 -5.509 789 HZ3 LYS 535 HZ3 LYS 535 97.535 -0.006 -4.805 790 H ILE 536 H ILE 536 101.963 -1.119 -7.502 791 HA ILE 536 HA ILE 536 100.836 1.410 -6.967 792 HB ILE 536 HB ILE 536 103.691 0.547 -6.477 793 HG12 ILE 536 HG12 ILE 536 101.246 0.303 -4.706 794 HG13 ILE 536 HG13 ILE 536 102.101 -1.031 -5.475 795 HG21 ILE 536 HG21 ILE 536 102.266 2.992 -5.981 796 HG22 ILE 536 HG22 ILE 536 103.971 2.618 -5.728 797 HG23 ILE 536 HG23 ILE 536 102.793 2.267 -4.462 798 HD11 ILE 536 HD11 ILE 536 103.975 0.478 -3.966 799 HD12 ILE 536 HD12 ILE 536 103.441 -1.185 -3.723 800 HD13 ILE 536 HD13 ILE 536 102.575 0.143 -2.950 801 H LEU 537 H LEU 537 104.003 0.759 -8.468 802 HA LEU 537 HA LEU 537 104.462 3.323 -9.429 803 HB2 LEU 537 HB2 LEU 537 105.452 0.613 -10.201 804 HB3 LEU 537 HB3 LEU 537 105.878 1.993 -11.193 805 HG LEU 537 HG LEU 537 106.382 2.582 -8.417 806 HD11 LEU 537 HD11 LEU 537 108.435 0.872 -8.560 807 HD12 LEU 537 HD12 LEU 537 107.210 -0.080 -9.399 808 HD13 LEU 537 HD13 LEU 537 106.915 0.485 -7.754 809 HD21 LEU 537 HD21 LEU 537 108.752 2.755 -9.444 810 HD22 LEU 537 HD22 LEU 537 107.501 3.874 -9.981 811 HD23 LEU 537 HD23 LEU 537 107.926 2.483 -10.979 812 H VAL 538 H VAL 538 103.313 0.527 -11.331 813 HA VAL 538 HA VAL 538 102.857 1.798 -13.725 814 HB VAL 538 HB VAL 538 101.221 -0.428 -12.505 815 HG11 VAL 538 HG11 VAL 538 99.915 0.428 -14.263 816 HG12 VAL 538 HG12 VAL 538 100.769 -0.951 -14.953 817 HG13 VAL 538 HG13 VAL 538 101.322 0.688 -15.292 818 HG21 VAL 538 HG21 VAL 538 103.762 -0.684 -12.862 819 HG22 VAL 538 HG22 VAL 538 103.363 -0.724 -14.579 820 HG23 VAL 538 HG23 VAL 538 102.694 -1.939 -13.490 821 H ASP 539 H ASP 539 100.740 1.679 -10.895 822 HA ASP 539 HA ASP 539 98.476 2.837 -12.110 823 HB2 ASP 539 HB2 ASP 539 98.389 1.661 -9.949 824 HB3 ASP 539 HB3 ASP 539 99.332 2.952 -9.210 825 H ARG 540 H ARG 540 101.285 4.241 -10.500 826 HA ARG 540 HA ARG 540 100.362 6.896 -10.392 827 HB2 ARG 540 HB2 ARG 540 103.234 6.030 -10.744 828 HB3 ARG 540 HB3 ARG 540 102.653 7.526 -10.025 829 HG2 ARG 540 HG2 ARG 540 101.475 5.420 -8.574 830 HG3 ARG 540 HG3 ARG 540 103.182 5.016 -8.780 831 HD2 ARG 540 HD2 ARG 540 103.873 6.709 -7.462 832 HD3 ARG 540 HD3 ARG 540 102.632 7.812 -8.054 833 HE ARG 540 HE ARG 540 102.521 6.229 -5.693 834 HH11 ARG 540 HH11 ARG 540 100.569 7.550 -8.255 835 HH12 ARG 540 HH12 ARG 540 99.120 7.587 -7.308 836 HH21 ARG 540 HH21 ARG 540 100.616 6.275 -4.434 837 HH22 ARG 540 HH22 ARG 540 99.147 6.864 -5.135 838 H GLN 541 H GLN 541 102.120 5.108 -12.881 839 HA GLN 541 HA GLN 541 102.579 7.275 -14.618 840 HB2 GLN 541 HB2 GLN 541 102.813 4.373 -14.713 841 HB3 GLN 541 HB3 GLN 541 102.321 5.052 -16.259 842 HG2 GLN 541 HG2 GLN 541 104.822 4.758 -15.785 843 HG3 GLN 541 HG3 GLN 541 104.271 6.276 -16.492 844 HE21 GLN 541 HE21 GLN 541 105.643 4.733 -13.728 845 HE22 GLN 541 HE22 GLN 541 106.003 6.170 -12.838 846 H ALA 542 H ALA 542 99.899 4.981 -14.368 847 HA ALA 542 HA ALA 542 98.517 5.784 -16.674 848 HB1 ALA 542 HB1 ALA 542 96.534 4.741 -15.616 849 HB2 ALA 542 HB2 ALA 542 97.469 4.550 -14.133 850 HB3 ALA 542 HB3 ALA 542 97.963 3.708 -15.602 851 H LYS 543 H LYS 543 98.473 7.028 -13.376 852 HA LYS 543 HA LYS 543 96.216 8.662 -13.556 853 HB2 LYS 543 HB2 LYS 543 98.517 8.402 -11.793 854 HB3 LYS 543 HB3 LYS 543 97.984 10.071 -11.945 855 HG2 LYS 543 HG2 LYS 543 96.142 9.716 -10.739 856 HG3 LYS 543 HG3 LYS 543 95.798 8.181 -11.539 857 HD2 LYS 543 HD2 LYS 543 98.137 7.915 -9.904 858 HD3 LYS 543 HD3 LYS 543 96.817 8.590 -8.947 859 HE2 LYS 543 HE2 LYS 543 95.466 6.663 -10.196 860 HE3 LYS 543 HE3 LYS 543 97.071 5.933 -10.240 861 HZ1 LYS 543 HZ1 LYS 543 96.168 7.043 -7.693 862 HZ2 LYS 543 HZ2 LYS 543 97.118 5.677 -8.001 863 HZ3 LYS 543 HZ3 LYS 543 95.442 5.604 -8.210 864 H LEU 544 H LEU 544 99.199 8.916 -15.154 865 HA LEU 544 HA LEU 544 99.488 11.692 -15.412 866 HB2 LEU 544 HB2 LEU 544 101.235 10.093 -16.021 867 HB3 LEU 544 HB3 LEU 544 100.249 9.505 -17.346 868 HG LEU 544 HG LEU 544 102.152 11.127 -17.900 869 HD11 LEU 544 HD11 LEU 544 101.087 11.485 -19.830 870 HD12 LEU 544 HD12 LEU 544 99.775 12.365 -19.045 871 HD13 LEU 544 HD13 LEU 544 99.744 10.603 -19.104 872 HD21 LEU 544 HD21 LEU 544 102.095 13.265 -17.229 873 HD22 LEU 544 HD22 LEU 544 101.023 12.666 -15.963 874 HD23 LEU 544 HD23 LEU 544 100.346 13.385 -17.424 875 H ASN 545 H ASN 545 97.217 9.528 -16.822 876 HA ASN 545 HA ASN 545 96.197 11.732 -18.479 877 HB2 ASN 545 HB2 ASN 545 97.276 9.317 -19.450 878 HB3 ASN 545 HB3 ASN 545 95.531 9.185 -19.646 879 HD21 ASN 545 HD21 ASN 545 98.189 11.471 -20.174 880 HD22 ASN 545 HD22 ASN 545 97.578 12.101 -21.662 881 H GLN 546 H GLN 546 93.933 10.514 -19.453 882 HA GLN 546 HA GLN 546 91.784 9.971 -18.956 883 HB2 GLN 546 HB2 GLN 546 93.051 8.800 -16.479 884 HB3 GLN 546 HB3 GLN 546 91.355 8.610 -16.902 885 HG2 GLN 546 HG2 GLN 546 92.610 7.798 -19.186 886 HG3 GLN 546 HG3 GLN 546 93.718 7.243 -17.932 887 HE21 GLN 546 HE21 GLN 546 92.529 5.388 -19.447 888 HE22 GLN 546 HE22 GLN 546 91.313 4.544 -18.555 889 HA PRO 547 HA PRO 547 91.735 13.616 -15.977 890 HB2 PRO 547 HB2 PRO 547 91.440 15.642 -17.713 891 HB3 PRO 547 HB3 PRO 547 93.034 14.988 -17.313 892 HG2 PRO 547 HG2 PRO 547 91.322 14.474 -19.713 893 HG3 PRO 547 HG3 PRO 547 93.072 14.744 -19.624 894 HD2 PRO 547 HD2 PRO 547 91.914 12.265 -19.833 895 HD3 PRO 547 HD3 PRO 547 93.504 12.558 -19.102 896 H ARG 548 H ARG 548 89.709 12.863 -15.283 897 HA ARG 548 HA ARG 548 87.424 13.968 -16.767 898 HB2 ARG 548 HB2 ARG 548 87.856 11.339 -16.757 899 HB3 ARG 548 HB3 ARG 548 87.037 11.463 -15.206 900 HG2 ARG 548 HG2 ARG 548 85.443 12.951 -16.888 901 HG3 ARG 548 HG3 ARG 548 85.964 11.598 -17.895 902 HD2 ARG 548 HD2 ARG 548 85.273 10.640 -15.289 903 HD3 ARG 548 HD3 ARG 548 83.954 11.627 -15.916 904 HE ARG 548 HE ARG 548 84.836 9.831 -17.904 905 HH11 ARG 548 HH11 ARG 548 83.072 9.924 -14.904 906 HH12 ARG 548 HH12 ARG 548 82.126 8.518 -15.264 907 HH21 ARG 548 HH21 ARG 548 83.598 7.974 -18.388 908 HH22 ARG 548 HH22 ARG 548 82.426 7.409 -17.245 909 H GLU 549 H GLU 549 88.829 15.176 -14.607 910 HA GLU 549 HA GLU 549 86.798 15.027 -12.478 911 HB2 GLU 549 HB2 GLU 549 89.544 16.122 -11.997 912 HB3 GLU 549 HB3 GLU 549 88.416 15.407 -10.852 913 HG2 GLU 549 HG2 GLU 549 88.803 13.215 -12.069 914 HG3 GLU 549 HG3 GLU 549 90.157 14.020 -12.862 915 H LYS 550 H LYS 550 85.498 16.580 -13.563 916 HA LYS 550 HA LYS 550 86.466 19.142 -14.307 917 HB2 LYS 550 HB2 LYS 550 84.102 17.720 -14.649 918 HB3 LYS 550 HB3 LYS 550 83.635 19.075 -13.632 919 HG2 LYS 550 HG2 LYS 550 84.328 20.653 -15.241 920 HG3 LYS 550 HG3 LYS 550 85.192 19.430 -16.174 921 HD2 LYS 550 HD2 LYS 550 83.007 18.323 -16.623 922 HD3 LYS 550 HD3 LYS 550 82.206 19.674 -15.817 923 HE2 LYS 550 HE2 LYS 550 84.121 20.252 -18.023 924 HE3 LYS 550 HE3 LYS 550 82.523 19.629 -18.433 925 HZ1 LYS 550 HZ1 LYS 550 83.184 22.133 -16.998 926 HZ2 LYS 550 HZ2 LYS 550 81.626 21.476 -16.999 927 HZ3 LYS 550 HZ3 LYS 550 82.341 21.956 -18.454 928 H LYS 551 H LYS 551 87.029 20.767 -13.037 929 HA LYS 551 HA LYS 551 86.480 20.698 -10.212 930 HB2 LYS 551 HB2 LYS 551 87.649 23.140 -11.399 931 HB3 LYS 551 HB3 LYS 551 88.164 22.210 -9.999 932 HG2 LYS 551 HG2 LYS 551 88.873 20.447 -11.786 933 HG3 LYS 551 HG3 LYS 551 88.843 21.837 -12.875 934 HD2 LYS 551 HD2 LYS 551 90.940 22.204 -12.179 935 HD3 LYS 551 HD3 LYS 551 90.195 22.818 -10.702 936 HE2 LYS 551 HE2 LYS 551 90.485 20.750 -9.587 937 HE3 LYS 551 HE3 LYS 551 90.891 19.917 -11.086 938 HZ1 LYS 551 HZ1 LYS 551 92.806 20.470 -9.589 939 HZ2 LYS 551 HZ2 LYS 551 92.551 22.100 -9.964 940 HZ3 LYS 551 HZ3 LYS 551 92.963 21.007 -11.186 941 H ARG 552 H ARG 552 84.058 20.780 -10.879 942 HA ARG 552 HA ARG 552 83.148 23.460 -10.288 943 HB2 ARG 552 HB2 ARG 552 83.084 22.436 -12.980 944 HB3 ARG 552 HB3 ARG 552 81.445 22.684 -12.394 945 HG2 ARG 552 HG2 ARG 552 83.583 24.792 -12.226 946 HG3 ARG 552 HG3 ARG 552 82.488 24.626 -13.601 947 HD2 ARG 552 HD2 ARG 552 80.573 24.952 -12.140 948 HD3 ARG 552 HD3 ARG 552 81.638 25.050 -10.738 949 HE ARG 552 HE ARG 552 82.119 27.219 -11.294 950 HH11 ARG 552 HH11 ARG 552 80.587 25.657 -14.004 951 HH12 ARG 552 HH12 ARG 552 80.417 27.119 -14.918 952 HH21 ARG 552 HH21 ARG 552 81.903 29.149 -12.488 953 HH22 ARG 552 HH22 ARG 552 81.166 29.106 -14.055 954 H GLY 553 H GLY 553 82.046 22.917 -8.496 955 HA2 GLY 553 HA2 GLY 553 79.533 21.708 -8.637 956 HA3 GLY 553 HA3 GLY 553 80.674 20.479 -8.114 957 H THR 554 H THR 554 80.598 23.944 -7.342 958 HA THR 554 HA THR 554 80.940 23.367 -4.542 959 HB THR 554 HB THR 554 82.078 25.298 -5.440 960 HG1 THR 554 HG1 THR 554 81.448 26.790 -3.905 961 HG21 THR 554 HG21 THR 554 80.619 25.859 -7.280 962 HG22 THR 554 HG22 THR 554 80.806 27.269 -6.238 963 HG23 THR 554 HG23 THR 554 79.329 26.308 -6.163 964 H GLU 555 H GLU 555 78.351 24.547 -6.625 965 HA GLU 555 HA GLU 555 76.299 23.597 -4.965 966 HB2 GLU 555 HB2 GLU 555 77.273 25.709 -3.725 967 HB3 GLU 555 HB3 GLU 555 76.303 26.587 -4.901 968 HG2 GLU 555 HG2 GLU 555 74.352 25.157 -4.138 969 HG3 GLU 555 HG3 GLU 555 75.380 24.666 -2.791 970 H LYS 556 H LYS 556 75.969 22.899 -7.213 971 HA LYS 556 HA LYS 556 75.233 24.784 -9.218 972 HB2 LYS 556 HB2 LYS 556 76.092 22.387 -9.539 973 HB3 LYS 556 HB3 LYS 556 74.442 21.879 -9.205 974 HG2 LYS 556 HG2 LYS 556 73.816 23.549 -11.086 975 HG3 LYS 556 HG3 LYS 556 75.515 23.403 -11.537 976 HD2 LYS 556 HD2 LYS 556 75.088 20.857 -11.426 977 HD3 LYS 556 HD3 LYS 556 73.381 21.298 -11.508 978 HE2 LYS 556 HE2 LYS 556 75.016 22.679 -13.484 979 HE3 LYS 556 HE3 LYS 556 75.064 20.926 -13.656 980 HZ1 LYS 556 HZ1 LYS 556 72.413 21.627 -13.217 981 HZ2 LYS 556 HZ2 LYS 556 73.103 21.044 -14.646 982 HZ3 LYS 556 HZ3 LYS 556 73.005 22.710 -14.375 983 H LEU 557 H LEU 557 73.771 25.735 -7.308 984 HA LEU 557 HA LEU 557 71.673 26.321 -6.650 985 HB2 LEU 557 HB2 LEU 557 70.948 24.979 -9.254 986 HB3 LEU 557 HB3 LEU 557 69.842 25.944 -8.295 987 HG LEU 557 HG LEU 557 72.352 27.308 -8.999 988 HD11 LEU 557 HD11 LEU 557 70.688 27.572 -11.277 989 HD12 LEU 557 HD12 LEU 557 70.989 25.852 -11.022 990 HD13 LEU 557 HD13 LEU 557 72.344 26.969 -11.188 991 HD21 LEU 557 HD21 LEU 557 69.421 27.943 -8.935 992 HD22 LEU 557 HD22 LEU 557 70.590 29.044 -9.662 993 HD23 LEU 557 HD23 LEU 557 70.723 28.618 -7.956 994 H ILE 558 H ILE 558 69.481 25.455 -6.037 995 HA ILE 558 HA ILE 558 69.701 22.607 -5.304 996 HB ILE 558 HB ILE 558 68.407 24.865 -3.776 997 HG12 ILE 558 HG12 ILE 558 70.311 23.146 -2.388 998 HG13 ILE 558 HG13 ILE 558 71.030 23.955 -3.777 999 HG21 ILE 558 HG21 ILE 558 68.436 21.921 -3.123 1000 HG22 ILE 558 HG22 ILE 558 67.035 22.840 -3.675 1001 HG23 ILE 558 HG23 ILE 558 67.770 23.206 -2.115 1002 HD11 ILE 558 HD11 ILE 558 70.659 26.067 -2.891 1003 HD12 ILE 558 HD12 ILE 558 71.141 25.106 -1.493 1004 HD13 ILE 558 HD13 ILE 558 69.438 25.484 -1.759 1005 H THR 559 H THR 559 68.515 21.697 -6.934 1006 HA THR 559 HA THR 559 65.673 22.465 -7.039 1007 HB THR 559 HB THR 559 66.698 23.253 -9.090 1008 HG1 THR 559 HG1 THR 559 65.130 22.458 -10.298 1009 HG21 THR 559 HG21 THR 559 67.856 21.793 -10.624 1010 HG22 THR 559 HG22 THR 559 67.591 20.409 -9.563 1011 HG23 THR 559 HG23 THR 559 68.648 21.725 -9.050 1012 H LYS 560 H LYS 560 64.204 20.759 -7.590 1013 HA LYS 560 HA LYS 560 64.665 18.362 -6.248 1014 HB2 LYS 560 HB2 LYS 560 62.684 18.733 -8.494 1015 HB3 LYS 560 HB3 LYS 560 62.578 17.605 -7.150 1016 HG2 LYS 560 HG2 LYS 560 62.525 19.652 -5.641 1017 HG3 LYS 560 HG3 LYS 560 62.243 20.584 -7.113 1018 HD2 LYS 560 HD2 LYS 560 60.120 20.086 -6.113 1019 HD3 LYS 560 HD3 LYS 560 60.279 19.127 -7.585 1020 HE2 LYS 560 HE2 LYS 560 59.375 17.986 -5.459 1021 HE3 LYS 560 HE3 LYS 560 60.601 17.149 -6.410 1022 HZ1 LYS 560 HZ1 LYS 560 61.076 17.062 -4.037 1023 HZ2 LYS 560 HZ2 LYS 560 61.124 18.750 -3.964 1024 HZ3 LYS 560 HZ3 LYS 560 62.284 17.911 -4.864 1025 H ALA 561 H ALA 561 65.886 16.681 -6.742 1026 HA ALA 561 HA ALA 561 66.333 16.045 -9.583 1027 HB1 ALA 561 HB1 ALA 561 68.575 15.060 -8.475 1028 HB2 ALA 561 HB2 ALA 561 68.293 16.441 -7.415 1029 HB3 ALA 561 HB3 ALA 561 68.455 16.683 -9.154 Start of MODEL 11 1 H1 MET 437 HT1 MET 437 104.107 -17.735 -37.652 2 H2 MET 437 HT2 MET 437 104.327 -17.945 -39.340 3 H3 MET 437 HT3 MET 437 103.181 -16.810 -38.757 4 HA MET 437 HA MET 437 106.081 -16.664 -38.871 5 HB2 MET 437 HB2 MET 437 104.170 -14.386 -39.095 6 HB3 MET 437 HB3 MET 437 105.659 -14.689 -39.981 7 HG2 MET 437 HG2 MET 437 104.375 -16.620 -41.077 8 HG3 MET 437 HG3 MET 437 102.932 -15.829 -40.445 9 HE1 MET 437 HE1 MET 437 103.043 -16.518 -43.171 10 HE2 MET 437 HE2 MET 437 103.194 -15.205 -44.339 11 HE3 MET 437 HE3 MET 437 101.880 -15.193 -43.162 12 H HIS 438 H HIS 438 106.192 -13.996 -37.984 13 HA HIS 438 HA HIS 438 106.281 -12.668 -36.116 14 HB2 HIS 438 HB2 HIS 438 104.024 -14.115 -35.598 15 HB3 HIS 438 HB3 HIS 438 105.049 -14.579 -34.244 16 HD1 HIS 438 HD1 HIS 438 103.927 -11.349 -35.924 17 HD2 HIS 438 HD2 HIS 438 104.871 -12.857 -32.168 18 HE1 HIS 438 HE1 HIS 438 103.486 -9.468 -34.314 19 HE2 HIS 438 HE2 HIS 438 104.104 -10.389 -32.052 20 H HIS 439 H HIS 439 107.132 -12.897 -33.719 21 HA HIS 439 HA HIS 439 108.708 -15.159 -33.078 22 HB2 HIS 439 HB2 HIS 439 110.944 -13.931 -33.321 23 HB3 HIS 439 HB3 HIS 439 110.214 -14.570 -34.789 24 HD1 HIS 439 HD1 HIS 439 112.188 -12.451 -35.281 25 HD2 HIS 439 HD2 HIS 439 108.226 -11.552 -34.411 26 HE1 HIS 439 HE1 HIS 439 111.809 -10.139 -36.190 27 HE2 HIS 439 HE2 HIS 439 109.376 -9.659 -35.745 28 H HIS 440 H HIS 440 109.937 -14.876 -31.112 29 HA HIS 440 HA HIS 440 110.488 -13.871 -29.111 30 HB2 HIS 440 HB2 HIS 440 110.178 -11.666 -30.628 31 HB3 HIS 440 HB3 HIS 440 108.805 -11.466 -29.544 32 HD1 HIS 440 HD1 HIS 440 111.419 -9.656 -29.603 33 HD2 HIS 440 HD2 HIS 440 110.585 -12.691 -26.890 34 HE1 HIS 440 HE1 HIS 440 112.787 -9.126 -27.561 35 HE2 HIS 440 HE2 HIS 440 112.260 -10.971 -25.927 36 H HIS 441 H HIS 441 109.054 -15.670 -28.496 37 HA HIS 441 HA HIS 441 106.414 -14.777 -27.559 38 HB2 HIS 441 HB2 HIS 441 107.483 -17.353 -28.540 39 HB3 HIS 441 HB3 HIS 441 106.375 -17.464 -27.176 40 HD1 HIS 441 HD1 HIS 441 104.057 -17.828 -27.916 41 HD2 HIS 441 HD2 HIS 441 106.184 -15.509 -30.630 42 HE1 HIS 441 HE1 HIS 441 102.443 -17.317 -29.774 43 HE2 HIS 441 HE2 HIS 441 103.744 -15.893 -31.396 44 H HIS 442 H HIS 442 108.426 -13.831 -26.025 45 HA HIS 442 HA HIS 442 108.587 -15.646 -23.719 46 HB2 HIS 442 HB2 HIS 442 110.176 -13.116 -24.173 47 HB3 HIS 442 HB3 HIS 442 110.468 -14.355 -22.957 48 HD1 HIS 442 HD1 HIS 442 112.843 -13.833 -24.546 49 HD2 HIS 442 HD2 HIS 442 109.898 -16.420 -25.924 50 HE1 HIS 442 HE1 HIS 442 113.979 -15.301 -26.242 51 HE2 HIS 442 HE2 HIS 442 112.198 -16.915 -26.999 52 H HIS 443 H HIS 443 108.853 -14.143 -21.598 53 HA HIS 443 HA HIS 443 106.279 -13.172 -21.051 54 HB2 HIS 443 HB2 HIS 443 108.882 -13.227 -19.633 55 HB3 HIS 443 HB3 HIS 443 107.722 -12.024 -19.078 56 HD1 HIS 443 HD1 HIS 443 108.537 -14.376 -17.269 57 HD2 HIS 443 HD2 HIS 443 105.218 -14.397 -19.769 58 HE1 HIS 443 HE1 HIS 443 106.971 -16.082 -16.291 59 HE2 HIS 443 HE2 HIS 443 104.977 -16.094 -17.831 60 H SER 444 H SER 444 105.999 -10.887 -20.031 61 HA SER 444 HA SER 444 107.114 -8.926 -21.928 62 HB2 SER 444 HB2 SER 444 104.660 -8.080 -20.609 63 HB3 SER 444 HB3 SER 444 105.047 -8.139 -22.328 64 HG SER 444 HG SER 444 103.869 -9.860 -22.447 65 H ASN 445 H ASN 445 105.461 -8.847 -18.764 66 HA ASN 445 HA ASN 445 106.466 -6.505 -17.794 67 HB2 ASN 445 HB2 ASN 445 105.847 -9.069 -16.325 68 HB3 ASN 445 HB3 ASN 445 106.248 -7.567 -15.496 69 HD21 ASN 445 HD21 ASN 445 104.749 -5.986 -15.325 70 HD22 ASN 445 HD22 ASN 445 103.124 -6.130 -15.894 71 H ALA 446 H ALA 446 108.126 -6.103 -16.121 72 HA ALA 446 HA ALA 446 110.358 -7.909 -15.950 73 HB1 ALA 446 HB1 ALA 446 110.417 -6.341 -18.160 74 HB2 ALA 446 HB2 ALA 446 111.849 -6.961 -17.338 75 HB3 ALA 446 HB3 ALA 446 111.278 -5.327 -17.003 76 H THR 447 H THR 447 112.242 -5.728 -15.376 77 HA THR 447 HA THR 447 111.041 -4.638 -12.919 78 HB THR 447 HB THR 447 113.268 -4.982 -11.803 79 HG1 THR 447 HG1 THR 447 114.236 -7.016 -13.063 80 HG21 THR 447 HG21 THR 447 112.292 -6.751 -10.874 81 HG22 THR 447 HG22 THR 447 112.652 -7.733 -12.295 82 HG23 THR 447 HG23 THR 447 111.156 -6.801 -12.223 83 H GLY 448 H GLY 448 111.724 -2.610 -12.279 84 HA2 GLY 448 HA2 GLY 448 112.944 -1.010 -14.371 85 HA3 GLY 448 HA3 GLY 448 112.225 -0.412 -12.883 86 HA PRO 449 HA PRO 449 116.671 -0.011 -12.081 87 HB2 PRO 449 HB2 PRO 449 116.585 2.387 -10.905 88 HB3 PRO 449 HB3 PRO 449 116.413 2.220 -12.656 89 HG2 PRO 449 HG2 PRO 449 114.329 2.726 -10.586 90 HG3 PRO 449 HG3 PRO 449 114.444 3.345 -12.242 91 HD2 PRO 449 HD2 PRO 449 112.871 1.186 -11.387 92 HD3 PRO 449 HD3 PRO 449 113.272 1.586 -13.068 93 H GLN 450 H GLN 450 116.140 -1.854 -10.562 94 HA GLN 450 HA GLN 450 115.893 -2.782 -8.473 95 HB2 GLN 450 HB2 GLN 450 118.196 -1.202 -8.669 96 HB3 GLN 450 HB3 GLN 450 117.521 -0.830 -7.089 97 HG2 GLN 450 HG2 GLN 450 119.010 -2.605 -6.740 98 HG3 GLN 450 HG3 GLN 450 117.402 -3.325 -6.700 99 HE21 GLN 450 HE21 GLN 450 120.247 -2.825 -8.703 100 HE22 GLN 450 HE22 GLN 450 120.009 -4.206 -9.713 101 H PHE 451 H PHE 451 113.695 -1.265 -8.920 102 HA PHE 451 HA PHE 451 113.059 0.821 -7.252 103 HB2 PHE 451 HB2 PHE 451 110.809 0.345 -7.673 104 HB3 PHE 451 HB3 PHE 451 111.639 -0.357 -9.059 105 HD1 PHE 451 HD1 PHE 451 110.000 -1.126 -5.847 106 HD2 PHE 451 HD2 PHE 451 111.566 -2.682 -9.485 107 HE1 PHE 451 HE1 PHE 451 108.960 -3.301 -5.360 108 HE2 PHE 451 HE2 PHE 451 110.528 -4.861 -9.005 109 HZ PHE 451 HZ PHE 451 109.223 -5.172 -6.940 110 H VAL 452 H VAL 452 113.055 1.065 -5.114 111 HA VAL 452 HA VAL 452 113.465 -1.102 -3.320 112 HB VAL 452 HB VAL 452 112.413 1.575 -2.449 113 HG11 VAL 452 HG11 VAL 452 113.238 1.052 -0.416 114 HG12 VAL 452 HG12 VAL 452 114.654 0.237 -1.081 115 HG13 VAL 452 HG13 VAL 452 113.102 -0.600 -1.018 116 HG21 VAL 452 HG21 VAL 452 114.160 2.688 -3.248 117 HG22 VAL 452 HG22 VAL 452 114.653 1.235 -4.118 118 HG23 VAL 452 HG23 VAL 452 115.274 1.546 -2.497 119 H SER 453 H SER 453 111.945 -2.563 -2.843 120 HA SER 453 HA SER 453 109.181 -2.085 -3.272 121 HB2 SER 453 HB2 SER 453 109.010 -4.319 -3.153 122 HB3 SER 453 HB3 SER 453 110.771 -4.319 -3.040 123 HG SER 453 HG SER 453 110.536 -4.267 -0.759 124 H GLY 454 H GLY 454 110.720 -0.544 -1.010 125 HA2 GLY 454 HA2 GLY 454 110.392 -0.042 1.247 126 HA3 GLY 454 HA3 GLY 454 108.817 0.333 0.574 127 H VAL 455 H VAL 455 110.063 -2.944 0.852 128 HA VAL 455 HA VAL 455 109.057 -4.779 1.795 129 HB VAL 455 HB VAL 455 108.821 -3.337 4.374 130 HG11 VAL 455 HG11 VAL 455 108.550 -5.784 4.150 131 HG12 VAL 455 HG12 VAL 455 109.864 -5.330 5.237 132 HG13 VAL 455 HG13 VAL 455 110.223 -5.890 3.602 133 HG21 VAL 455 HG21 VAL 455 111.292 -3.413 2.729 134 HG22 VAL 455 HG22 VAL 455 111.440 -3.695 4.463 135 HG23 VAL 455 HG23 VAL 455 110.732 -2.193 3.871 136 H ILE 456 H ILE 456 107.046 -4.934 0.853 137 HA ILE 456 HA ILE 456 104.801 -3.389 1.769 138 HB ILE 456 HB ILE 456 104.870 -5.824 -0.015 139 HG12 ILE 456 HG12 ILE 456 106.053 -4.128 -1.144 140 HG13 ILE 456 HG13 ILE 456 104.415 -4.020 -1.782 141 HG21 ILE 456 HG21 ILE 456 102.695 -4.685 1.280 142 HG22 ILE 456 HG22 ILE 456 102.646 -5.774 -0.106 143 HG23 ILE 456 HG23 ILE 456 102.628 -4.029 -0.356 144 HD11 ILE 456 HD11 ILE 456 105.783 -2.197 0.162 145 HD12 ILE 456 HD12 ILE 456 104.032 -2.203 -0.050 146 HD13 ILE 456 HD13 ILE 456 105.084 -1.812 -1.411 147 H VAL 457 H VAL 457 103.449 -3.853 3.398 148 HA VAL 457 HA VAL 457 103.551 -6.562 4.550 149 HB VAL 457 HB VAL 457 103.162 -3.884 5.870 150 HG11 VAL 457 HG11 VAL 457 101.494 -4.877 7.041 151 HG12 VAL 457 HG12 VAL 457 102.848 -5.561 7.939 152 HG13 VAL 457 HG13 VAL 457 102.060 -6.507 6.676 153 HG21 VAL 457 HG21 VAL 457 105.299 -4.231 6.379 154 HG22 VAL 457 HG22 VAL 457 105.253 -5.861 5.714 155 HG23 VAL 457 HG23 VAL 457 104.780 -5.577 7.389 156 H LYS 458 H LYS 458 101.829 -7.635 3.741 157 HA LYS 458 HA LYS 458 99.366 -6.291 3.116 158 HB2 LYS 458 HB2 LYS 458 99.977 -8.107 1.692 159 HB3 LYS 458 HB3 LYS 458 100.179 -9.196 3.059 160 HG2 LYS 458 HG2 LYS 458 97.738 -8.985 3.505 161 HG3 LYS 458 HG3 LYS 458 97.598 -8.054 2.013 162 HD2 LYS 458 HD2 LYS 458 98.745 -10.073 0.899 163 HD3 LYS 458 HD3 LYS 458 98.314 -10.944 2.371 164 HE2 LYS 458 HE2 LYS 458 95.985 -9.622 1.661 165 HE3 LYS 458 HE3 LYS 458 96.657 -10.160 0.122 166 HZ1 LYS 458 HZ1 LYS 458 95.675 -12.086 0.614 167 HZ2 LYS 458 HZ2 LYS 458 95.485 -11.700 2.250 168 HZ3 LYS 458 HZ3 LYS 458 96.952 -12.333 1.695 169 H ILE 459 H ILE 459 97.785 -5.867 4.473 170 HA ILE 459 HA ILE 459 97.552 -7.487 6.922 171 HB ILE 459 HB ILE 459 96.374 -4.741 6.687 172 HG12 ILE 459 HG12 ILE 459 99.233 -5.492 7.184 173 HG13 ILE 459 HG13 ILE 459 98.581 -4.153 6.244 174 HG21 ILE 459 HG21 ILE 459 96.604 -4.806 9.134 175 HG22 ILE 459 HG22 ILE 459 97.316 -6.414 9.017 176 HG23 ILE 459 HG23 ILE 459 95.642 -6.155 8.529 177 HD11 ILE 459 HD11 ILE 459 98.978 -4.383 9.189 178 HD12 ILE 459 HD12 ILE 459 97.756 -3.286 8.545 179 HD13 ILE 459 HD13 ILE 459 99.447 -3.088 8.086 180 H ILE 460 H ILE 460 95.808 -8.702 7.077 181 HA ILE 460 HA ILE 460 93.354 -7.831 5.709 182 HB ILE 460 HB ILE 460 94.491 -9.612 4.364 183 HG12 ILE 460 HG12 ILE 460 92.481 -10.762 3.854 184 HG13 ILE 460 HG13 ILE 460 91.879 -10.599 5.501 185 HG21 ILE 460 HG21 ILE 460 94.095 -11.972 5.347 186 HG22 ILE 460 HG22 ILE 460 94.097 -11.141 6.902 187 HG23 ILE 460 HG23 ILE 460 95.512 -11.052 5.853 188 HD11 ILE 460 HD11 ILE 460 91.072 -8.534 5.137 189 HD12 ILE 460 HD12 ILE 460 91.084 -9.061 3.454 190 HD13 ILE 460 HD13 ILE 460 92.408 -8.079 4.079 191 H SER 461 H SER 461 91.537 -8.015 6.891 192 HA SER 461 HA SER 461 91.741 -9.466 9.449 193 HB2 SER 461 HB2 SER 461 90.293 -7.793 10.463 194 HB3 SER 461 HB3 SER 461 91.683 -6.993 9.734 195 HG SER 461 HG SER 461 89.772 -7.162 7.899 196 H THR 462 H THR 462 89.100 -9.243 10.227 197 HA THR 462 HA THR 462 87.689 -10.728 8.105 198 HB THR 462 HB THR 462 86.612 -12.091 9.794 199 HG1 THR 462 HG1 THR 462 86.848 -11.750 11.923 200 HG21 THR 462 HG21 THR 462 89.559 -12.051 10.418 201 HG22 THR 462 HG22 THR 462 88.893 -12.714 8.926 202 HG23 THR 462 HG23 THR 462 88.458 -13.427 10.479 203 H GLU 463 H GLU 463 87.736 -7.877 9.625 204 HA GLU 463 HA GLU 463 85.516 -6.717 8.781 205 HB2 GLU 463 HB2 GLU 463 83.938 -8.230 9.579 206 HB3 GLU 463 HB3 GLU 463 84.808 -8.498 11.083 207 HG2 GLU 463 HG2 GLU 463 83.783 -6.811 12.124 208 HG3 GLU 463 HG3 GLU 463 83.867 -5.757 10.715 209 HA PRO 464 HA PRO 464 86.715 -5.027 13.374 210 HB2 PRO 464 HB2 PRO 464 89.463 -6.165 13.017 211 HB3 PRO 464 HB3 PRO 464 88.571 -5.829 14.506 212 HG2 PRO 464 HG2 PRO 464 88.742 -8.312 13.574 213 HG3 PRO 464 HG3 PRO 464 87.234 -7.715 14.291 214 HD2 PRO 464 HD2 PRO 464 87.906 -8.224 11.443 215 HD3 PRO 464 HD3 PRO 464 86.338 -8.318 12.268 216 H LEU 465 H LEU 465 88.875 -5.363 10.571 217 HA LEU 465 HA LEU 465 90.483 -3.220 10.683 218 HB2 LEU 465 HB2 LEU 465 89.319 -4.749 8.573 219 HB3 LEU 465 HB3 LEU 465 89.312 -3.060 8.101 220 HG LEU 465 HG LEU 465 91.855 -4.013 9.242 221 HD11 LEU 465 HD11 LEU 465 91.824 -5.931 8.056 222 HD12 LEU 465 HD12 LEU 465 92.258 -4.859 6.725 223 HD13 LEU 465 HD13 LEU 465 90.580 -5.354 6.947 224 HD21 LEU 465 HD21 LEU 465 92.758 -2.691 7.402 225 HD22 LEU 465 HD22 LEU 465 91.567 -1.772 8.321 226 HD23 LEU 465 HD23 LEU 465 91.131 -2.463 6.758 227 HA PRO 466 HA PRO 466 87.352 -0.032 11.510 228 HB2 PRO 466 HB2 PRO 466 89.130 1.724 12.569 229 HB3 PRO 466 HB3 PRO 466 88.439 0.383 13.491 230 HG2 PRO 466 HG2 PRO 466 91.093 0.554 12.105 231 HG3 PRO 466 HG3 PRO 466 90.720 -0.061 13.727 232 HD2 PRO 466 HD2 PRO 466 91.092 -1.706 11.632 233 HD3 PRO 466 HD3 PRO 466 89.917 -2.072 12.912 234 H GLY 467 H GLY 467 90.536 0.433 10.005 235 HA2 GLY 467 HA2 GLY 467 89.844 1.475 7.631 236 HA3 GLY 467 HA3 GLY 467 89.655 2.865 8.687 237 H ARG 468 H ARG 468 91.348 3.426 6.880 238 HA ARG 468 HA ARG 468 93.988 2.497 7.084 239 HB2 ARG 468 HB2 ARG 468 94.581 4.315 5.693 240 HB3 ARG 468 HB3 ARG 468 92.949 3.867 5.215 241 HG2 ARG 468 HG2 ARG 468 92.043 5.711 6.519 242 HG3 ARG 468 HG3 ARG 468 93.670 6.151 7.040 243 HD2 ARG 468 HD2 ARG 468 93.162 5.942 4.123 244 HD3 ARG 468 HD3 ARG 468 92.472 7.320 4.978 245 HE ARG 468 HE ARG 468 95.314 6.775 5.354 246 HH11 ARG 468 HH11 ARG 468 92.835 8.723 3.850 247 HH12 ARG 468 HH12 ARG 468 93.915 10.017 3.463 248 HH21 ARG 468 HH21 ARG 468 96.734 8.476 4.835 249 HH22 ARG 468 HH22 ARG 468 96.127 9.878 4.019 250 H LYS 469 H LYS 469 92.332 5.201 8.658 251 HA LYS 469 HA LYS 469 94.575 6.347 9.888 252 HB2 LYS 469 HB2 LYS 469 92.977 7.466 11.362 253 HB3 LYS 469 HB3 LYS 469 92.429 7.502 9.692 254 HG2 LYS 469 HG2 LYS 469 91.169 5.292 10.480 255 HG3 LYS 469 HG3 LYS 469 91.287 6.110 12.038 256 HD2 LYS 469 HD2 LYS 469 90.294 8.136 10.945 257 HD3 LYS 469 HD3 LYS 469 90.010 7.146 9.512 258 HE2 LYS 469 HE2 LYS 469 88.024 6.709 10.459 259 HE3 LYS 469 HE3 LYS 469 88.937 5.591 11.472 260 HZ1 LYS 469 HZ1 LYS 469 88.996 7.114 13.219 261 HZ2 LYS 469 HZ2 LYS 469 87.417 7.243 12.627 262 HZ3 LYS 469 HZ3 LYS 469 88.565 8.423 12.237 263 H GLN 470 H GLN 470 92.288 3.912 11.089 264 HA GLN 470 HA GLN 470 93.586 3.698 13.629 265 HB2 GLN 470 HB2 GLN 470 91.297 2.423 12.271 266 HB3 GLN 470 HB3 GLN 470 92.114 1.431 13.471 267 HG2 GLN 470 HG2 GLN 470 91.500 4.190 14.292 268 HG3 GLN 470 HG3 GLN 470 90.113 3.132 14.032 269 HE21 GLN 470 HE21 GLN 470 91.926 4.298 16.367 270 HE22 GLN 470 HE22 GLN 470 91.955 2.972 17.475 271 H VAL 471 H VAL 471 93.579 1.746 10.660 272 HA VAL 471 HA VAL 471 95.185 -0.340 11.669 273 HB VAL 471 HB VAL 471 94.704 0.619 8.853 274 HG11 VAL 471 HG11 VAL 471 96.612 -0.436 8.319 275 HG12 VAL 471 HG12 VAL 471 95.665 -1.905 8.554 276 HG13 VAL 471 HG13 VAL 471 96.686 -1.296 9.858 277 HG21 VAL 471 HG21 VAL 471 93.492 -1.369 10.661 278 HG22 VAL 471 HG22 VAL 471 93.702 -1.870 8.983 279 HG23 VAL 471 HG23 VAL 471 92.767 -0.423 9.361 280 H ARG 472 H ARG 472 95.993 2.629 9.904 281 HA ARG 472 HA ARG 472 98.761 2.146 9.702 282 HB2 ARG 472 HB2 ARG 472 98.940 4.288 8.865 283 HB3 ARG 472 HB3 ARG 472 97.243 3.947 8.558 284 HG2 ARG 472 HG2 ARG 472 96.646 5.160 10.611 285 HG3 ARG 472 HG3 ARG 472 98.351 5.544 10.857 286 HD2 ARG 472 HD2 ARG 472 98.017 6.382 8.312 287 HD3 ARG 472 HD3 ARG 472 96.403 6.675 8.958 288 HE ARG 472 HE ARG 472 97.260 8.359 10.274 289 HH11 ARG 472 HH11 ARG 472 99.859 6.515 8.872 290 HH12 ARG 472 HH12 ARG 472 101.087 7.642 9.341 291 HH21 ARG 472 HH21 ARG 472 98.869 9.853 10.897 292 HH22 ARG 472 HH22 ARG 472 100.523 9.541 10.492 293 H ASP 473 H ASP 473 96.818 3.822 12.139 294 HA ASP 473 HA ASP 473 98.993 4.700 13.720 295 HB2 ASP 473 HB2 ASP 473 96.349 5.240 13.708 296 HB3 ASP 473 HB3 ASP 473 96.420 4.127 15.070 297 H THR 474 H THR 474 97.051 1.764 13.721 298 HA THR 474 HA THR 474 97.941 0.694 16.164 299 HB THR 474 HB THR 474 97.419 -1.559 14.872 300 HG1 THR 474 HG1 THR 474 96.771 -1.226 12.894 301 HG21 THR 474 HG21 THR 474 94.870 -0.761 15.116 302 HG22 THR 474 HG22 THR 474 95.665 0.513 16.040 303 HG23 THR 474 HG23 THR 474 95.886 -1.175 16.496 304 H LEU 475 H LEU 475 99.022 -0.062 12.844 305 HA LEU 475 HA LEU 475 101.151 -1.731 13.620 306 HB2 LEU 475 HB2 LEU 475 102.057 -1.203 11.318 307 HB3 LEU 475 HB3 LEU 475 100.448 -1.894 11.377 308 HG LEU 475 HG LEU 475 99.773 0.697 11.328 309 HD11 LEU 475 HD11 LEU 475 101.578 1.319 9.331 310 HD12 LEU 475 HD12 LEU 475 102.579 0.625 10.606 311 HD13 LEU 475 HD13 LEU 475 101.536 2.004 10.956 312 HD21 LEU 475 HD21 LEU 475 100.520 -0.383 8.682 313 HD22 LEU 475 HD22 LEU 475 98.975 0.244 9.260 314 HD23 LEU 475 HD23 LEU 475 99.474 -1.395 9.680 315 H ALA 476 H ALA 476 100.946 1.740 13.015 316 HA ALA 476 HA ALA 476 103.724 2.245 13.293 317 HB1 ALA 476 HB1 ALA 476 102.781 4.635 13.858 318 HB2 ALA 476 HB2 ALA 476 101.277 3.940 13.252 319 HB3 ALA 476 HB3 ALA 476 102.705 3.992 12.218 320 H ALA 477 H ALA 477 101.130 1.751 15.533 321 HA ALA 477 HA ALA 477 102.389 3.008 17.774 322 HB1 ALA 477 HB1 ALA 477 100.403 0.825 18.166 323 HB2 ALA 477 HB2 ALA 477 99.870 2.320 17.397 324 HB3 ALA 477 HB3 ALA 477 100.574 2.361 19.014 325 H ILE 478 H ILE 478 102.481 -0.129 16.273 326 HA ILE 478 HA ILE 478 103.842 -1.397 18.487 327 HB ILE 478 HB ILE 478 103.292 -2.304 15.663 328 HG12 ILE 478 HG12 ILE 478 102.260 -3.954 17.797 329 HG13 ILE 478 HG13 ILE 478 101.745 -2.285 18.016 330 HG21 ILE 478 HG21 ILE 478 105.007 -3.711 15.892 331 HG22 ILE 478 HG22 ILE 478 104.032 -4.538 17.107 332 HG23 ILE 478 HG23 ILE 478 105.206 -3.318 17.600 333 HD11 ILE 478 HD11 ILE 478 101.113 -2.455 15.493 334 HD12 ILE 478 HD12 ILE 478 100.049 -3.126 16.730 335 HD13 ILE 478 HD13 ILE 478 101.121 -4.189 15.818 336 H SER 479 H SER 479 104.689 0.180 15.485 337 HA SER 479 HA SER 479 107.397 0.543 16.319 338 HB2 SER 479 HB2 SER 479 108.240 -0.605 14.109 339 HB3 SER 479 HB3 SER 479 107.963 -1.574 15.556 340 HG SER 479 HG SER 479 105.703 -1.315 14.085 341 H GLU 480 H GLU 480 108.690 1.671 14.561 342 HA GLU 480 HA GLU 480 107.059 3.766 13.474 343 HB2 GLU 480 HB2 GLU 480 109.192 4.379 14.370 344 HB3 GLU 480 HB3 GLU 480 110.023 3.211 13.350 345 HG2 GLU 480 HG2 GLU 480 108.981 4.618 11.408 346 HG3 GLU 480 HG3 GLU 480 108.877 5.866 12.648 347 H VAL 481 H VAL 481 105.991 3.587 11.632 348 HA VAL 481 HA VAL 481 107.102 1.900 9.489 349 HB VAL 481 HB VAL 481 104.689 2.192 8.558 350 HG11 VAL 481 HG11 VAL 481 105.956 0.231 10.002 351 HG12 VAL 481 HG12 VAL 481 104.407 0.065 9.178 352 HG13 VAL 481 HG13 VAL 481 104.453 0.467 10.894 353 HG21 VAL 481 HG21 VAL 481 104.354 3.851 10.629 354 HG22 VAL 481 HG22 VAL 481 103.827 2.346 11.382 355 HG23 VAL 481 HG23 VAL 481 103.033 2.925 9.917 356 H LEU 482 H LEU 482 106.473 2.681 7.241 357 HA LEU 482 HA LEU 482 107.249 5.487 7.048 358 HB2 LEU 482 HB2 LEU 482 108.589 4.080 5.714 359 HB3 LEU 482 HB3 LEU 482 107.202 3.205 5.095 360 HG LEU 482 HG LEU 482 106.529 5.417 3.977 361 HD11 LEU 482 HD11 LEU 482 107.778 7.191 4.442 362 HD12 LEU 482 HD12 LEU 482 109.097 6.427 3.555 363 HD13 LEU 482 HD13 LEU 482 108.960 6.202 5.299 364 HD21 LEU 482 HD21 LEU 482 108.889 3.743 3.174 365 HD22 LEU 482 HD22 LEU 482 108.246 5.014 2.134 366 HD23 LEU 482 HD23 LEU 482 107.225 3.653 2.597 367 H TYR 483 H TYR 483 105.035 3.430 5.155 368 HA TYR 483 HA TYR 483 102.928 5.424 5.470 369 HB2 TYR 483 HB2 TYR 483 104.057 6.231 3.504 370 HB3 TYR 483 HB3 TYR 483 104.067 4.621 2.792 371 HD1 TYR 483 HD1 TYR 483 101.651 3.547 2.526 372 HD2 TYR 483 HD2 TYR 483 102.444 7.715 2.797 373 HE1 TYR 483 HE1 TYR 483 99.512 4.021 1.408 374 HE2 TYR 483 HE2 TYR 483 100.307 8.203 1.682 375 HH TYR 483 HH TYR 483 98.273 7.280 1.117 376 H VAL 484 H VAL 484 100.870 4.617 5.298 377 HA VAL 484 HA VAL 484 100.677 1.707 4.882 378 HB VAL 484 HB VAL 484 98.836 3.505 6.468 379 HG11 VAL 484 HG11 VAL 484 97.381 1.855 5.965 380 HG12 VAL 484 HG12 VAL 484 98.233 1.004 7.253 381 HG13 VAL 484 HG13 VAL 484 98.657 0.704 5.568 382 HG21 VAL 484 HG21 VAL 484 99.950 1.558 8.124 383 HG22 VAL 484 HG22 VAL 484 100.326 3.282 8.106 384 HG23 VAL 484 HG23 VAL 484 101.295 2.156 7.152 385 H ASP 485 H ASP 485 99.787 1.129 3.018 386 HA ASP 485 HA ASP 485 97.962 2.985 1.664 387 HB2 ASP 485 HB2 ASP 485 99.813 2.324 0.289 388 HB3 ASP 485 HB3 ASP 485 99.549 0.622 0.654 389 H LEU 486 H LEU 486 96.026 2.572 2.693 390 HA LEU 486 HA LEU 486 95.030 -0.155 2.852 391 HB2 LEU 486 HB2 LEU 486 94.609 1.319 4.732 392 HB3 LEU 486 HB3 LEU 486 93.824 2.484 3.684 393 HG LEU 486 HG LEU 486 92.434 0.059 3.333 394 HD11 LEU 486 HD11 LEU 486 92.089 0.538 6.174 395 HD12 LEU 486 HD12 LEU 486 93.698 -0.069 5.783 396 HD13 LEU 486 HD13 LEU 486 92.269 -0.981 5.294 397 HD21 LEU 486 HD21 LEU 486 91.962 2.791 4.017 398 HD22 LEU 486 HD22 LEU 486 90.998 1.753 5.066 399 HD23 LEU 486 HD23 LEU 486 90.853 1.613 3.314 400 H LEU 487 H LEU 487 93.641 -1.069 1.429 401 HA LEU 487 HA LEU 487 93.090 0.206 -1.032 402 HB2 LEU 487 HB2 LEU 487 92.028 -2.312 0.233 403 HB3 LEU 487 HB3 LEU 487 91.580 -1.799 -1.384 404 HG LEU 487 HG LEU 487 93.535 -3.525 -0.978 405 HD11 LEU 487 HD11 LEU 487 94.036 -1.339 -2.965 406 HD12 LEU 487 HD12 LEU 487 92.659 -2.429 -3.128 407 HD13 LEU 487 HD13 LEU 487 94.299 -3.076 -3.130 408 HD21 LEU 487 HD21 LEU 487 94.884 -2.201 0.481 409 HD22 LEU 487 HD22 LEU 487 94.864 -0.843 -0.643 410 HD23 LEU 487 HD23 LEU 487 95.724 -2.324 -1.064 411 H GLU 488 H GLU 488 91.858 2.001 -0.972 412 HA GLU 488 HA GLU 488 89.785 2.634 0.717 413 HB2 GLU 488 HB2 GLU 488 88.958 4.099 -1.187 414 HB3 GLU 488 HB3 GLU 488 90.625 4.341 -0.686 415 HG2 GLU 488 HG2 GLU 488 90.402 2.365 -2.788 416 HG3 GLU 488 HG3 GLU 488 89.713 3.918 -3.258 417 H GLY 489 H GLY 489 88.018 1.497 1.159 418 HA2 GLY 489 HA2 GLY 489 85.875 0.680 0.692 419 HA3 GLY 489 HA3 GLY 489 86.269 0.696 -1.021 420 H ASP 490 H ASP 490 88.706 -0.732 0.804 421 HA ASP 490 HA ASP 490 87.604 -3.417 0.313 422 HB2 ASP 490 HB2 ASP 490 89.794 -2.257 -0.978 423 HB3 ASP 490 HB3 ASP 490 90.497 -3.346 0.213 424 H THR 491 H THR 491 88.170 -5.040 1.754 425 HA THR 491 HA THR 491 88.713 -4.130 4.437 426 HB THR 491 HB THR 491 88.190 -6.365 5.151 427 HG1 THR 491 HG1 THR 491 87.865 -7.253 2.494 428 HG21 THR 491 HG21 THR 491 86.023 -6.714 3.662 429 HG22 THR 491 HG22 THR 491 86.455 -5.100 3.099 430 HG23 THR 491 HG23 THR 491 86.156 -5.385 4.814 431 H GLU 492 H GLU 492 90.824 -4.436 2.124 432 HA GLU 492 HA GLU 492 92.844 -5.709 3.841 433 HB2 GLU 492 HB2 GLU 492 93.976 -6.373 1.641 434 HB3 GLU 492 HB3 GLU 492 92.562 -7.293 2.138 435 HG2 GLU 492 HG2 GLU 492 91.179 -6.171 0.563 436 HG3 GLU 492 HG3 GLU 492 92.448 -5.002 0.195 437 H CYS 493 H CYS 493 94.637 -4.563 4.201 438 HA CYS 493 HA CYS 493 95.211 -2.260 2.467 439 HB2 CYS 493 HB2 CYS 493 94.338 -1.172 4.324 440 HB3 CYS 493 HB3 CYS 493 94.972 -2.363 5.453 441 HG CYS 493 HG CYS 493 97.198 -1.191 5.470 442 H HIS 494 H HIS 494 97.398 -1.800 2.149 443 HA HIS 494 HA HIS 494 99.299 -3.736 3.296 444 HB2 HIS 494 HB2 HIS 494 99.128 -2.767 0.440 445 HB3 HIS 494 HB3 HIS 494 100.510 -3.641 1.091 446 HD1 HIS 494 HD1 HIS 494 96.753 -4.295 1.226 447 HD2 HIS 494 HD2 HIS 494 100.320 -6.192 0.256 448 HE1 HIS 494 HE1 HIS 494 96.112 -6.637 0.570 449 HE2 HIS 494 HE2 HIS 494 98.278 -7.740 -0.094 450 H ALA 495 H ALA 495 100.539 -2.583 4.650 451 HA ALA 495 HA ALA 495 101.227 0.168 3.993 452 HB1 ALA 495 HB1 ALA 495 101.345 -1.476 6.473 453 HB2 ALA 495 HB2 ALA 495 100.645 0.121 6.208 454 HB3 ALA 495 HB3 ALA 495 102.394 -0.066 6.327 455 H ARG 496 H ARG 496 103.197 0.884 3.459 456 HA ARG 496 HA ARG 496 105.243 -1.098 2.830 457 HB2 ARG 496 HB2 ARG 496 105.548 1.824 2.267 458 HB3 ARG 496 HB3 ARG 496 106.113 0.444 1.334 459 HG2 ARG 496 HG2 ARG 496 103.543 0.029 0.994 460 HG3 ARG 496 HG3 ARG 496 103.441 1.750 1.370 461 HD2 ARG 496 HD2 ARG 496 105.399 0.758 -0.660 462 HD3 ARG 496 HD3 ARG 496 103.709 0.990 -1.100 463 HE ARG 496 HE ARG 496 105.647 3.057 -0.431 464 HH11 ARG 496 HH11 ARG 496 102.330 2.226 -1.120 465 HH12 ARG 496 HH12 ARG 496 101.876 3.846 -1.524 466 HH21 ARG 496 HH21 ARG 496 105.048 5.196 -0.946 467 HH22 ARG 496 HH22 ARG 496 103.417 5.533 -1.425 468 H PHE 497 H PHE 497 107.084 -1.338 3.979 469 HA PHE 497 HA PHE 497 107.561 0.555 6.180 470 HB2 PHE 497 HB2 PHE 497 108.368 -2.334 5.842 471 HB3 PHE 497 HB3 PHE 497 108.979 -1.307 7.134 472 HD1 PHE 497 HD1 PHE 497 105.607 -1.841 5.633 473 HD2 PHE 497 HD2 PHE 497 108.018 -1.865 9.140 474 HE1 PHE 497 HE1 PHE 497 103.628 -2.394 6.984 475 HE2 PHE 497 HE2 PHE 497 106.042 -2.418 10.498 476 HZ PHE 497 HZ PHE 497 103.843 -2.684 9.420 477 H LYS 498 H LYS 498 109.720 1.193 6.669 478 HA LYS 498 HA LYS 498 111.259 1.743 4.305 479 HB2 LYS 498 HB2 LYS 498 110.842 3.120 6.585 480 HB3 LYS 498 HB3 LYS 498 112.392 2.382 6.962 481 HG2 LYS 498 HG2 LYS 498 113.353 4.041 5.858 482 HG3 LYS 498 HG3 LYS 498 112.683 3.358 4.375 483 HD2 LYS 498 HD2 LYS 498 111.437 5.180 4.121 484 HD3 LYS 498 HD3 LYS 498 110.612 4.811 5.637 485 HE2 LYS 498 HE2 LYS 498 113.159 5.935 6.237 486 HE3 LYS 498 HE3 LYS 498 112.356 6.968 5.055 487 HZ1 LYS 498 HZ1 LYS 498 111.064 6.032 7.556 488 HZ2 LYS 498 HZ2 LYS 498 110.496 7.214 6.486 489 HZ3 LYS 498 HZ3 LYS 498 111.874 7.512 7.421 490 H THR 499 H THR 499 111.325 -0.667 6.751 491 HA THR 499 HA THR 499 113.840 -1.678 5.634 492 HB THR 499 HB THR 499 114.224 -2.499 8.137 493 HG1 THR 499 HG1 THR 499 113.397 0.077 8.783 494 HG21 THR 499 HG21 THR 499 115.244 0.114 8.210 495 HG22 THR 499 HG22 THR 499 115.208 -0.348 6.507 496 HG23 THR 499 HG23 THR 499 116.071 -1.350 7.675 497 HA PRO 500 HA PRO 500 111.702 -5.532 5.534 498 HB2 PRO 500 HB2 PRO 500 113.772 -7.264 5.568 499 HB3 PRO 500 HB3 PRO 500 113.429 -6.234 4.173 500 HG2 PRO 500 HG2 PRO 500 115.438 -5.846 6.363 501 HG3 PRO 500 HG3 PRO 500 115.638 -5.631 4.614 502 HD2 PRO 500 HD2 PRO 500 115.210 -3.553 6.307 503 HD3 PRO 500 HD3 PRO 500 114.633 -3.557 4.628 504 H GLU 501 H GLU 501 114.260 -5.238 7.979 505 HA GLU 501 HA GLU 501 113.431 -7.393 9.588 506 HB2 GLU 501 HB2 GLU 501 114.868 -6.472 11.293 507 HB3 GLU 501 HB3 GLU 501 115.656 -6.299 9.732 508 HG2 GLU 501 HG2 GLU 501 116.015 -4.193 10.340 509 HG3 GLU 501 HG3 GLU 501 114.313 -3.933 9.963 510 H ASP 502 H ASP 502 112.501 -4.004 9.500 511 HA ASP 502 HA ASP 502 111.096 -3.873 11.916 512 HB2 ASP 502 HB2 ASP 502 111.717 -2.004 10.202 513 HB3 ASP 502 HB3 ASP 502 110.162 -2.397 9.475 514 H ALA 503 H ALA 503 110.134 -5.008 8.727 515 HA ALA 503 HA ALA 503 107.373 -5.296 9.286 516 HB1 ALA 503 HB1 ALA 503 108.849 -6.996 7.302 517 HB2 ALA 503 HB2 ALA 503 108.538 -5.286 7.002 518 HB3 ALA 503 HB3 ALA 503 107.190 -6.399 7.234 519 H GLN 504 H GLN 504 110.126 -7.503 9.518 520 HA GLN 504 HA GLN 504 108.693 -9.824 10.188 521 HB2 GLN 504 HB2 GLN 504 111.375 -9.123 9.845 522 HB3 GLN 504 HB3 GLN 504 111.272 -9.671 11.511 523 HG2 GLN 504 HG2 GLN 504 109.824 -11.538 10.018 524 HG3 GLN 504 HG3 GLN 504 111.279 -11.198 9.082 525 HE21 GLN 504 HE21 GLN 504 110.220 -13.452 10.913 526 HE22 GLN 504 HE22 GLN 504 111.594 -13.832 11.891 527 H ALA 505 H ALA 505 110.087 -7.266 12.186 528 HA ALA 505 HA ALA 505 109.513 -8.453 14.678 529 HB1 ALA 505 HB1 ALA 505 109.477 -5.646 14.992 530 HB2 ALA 505 HB2 ALA 505 110.679 -6.029 13.760 531 HB3 ALA 505 HB3 ALA 505 110.783 -6.774 15.356 532 H VAL 506 H VAL 506 107.653 -6.208 12.650 533 HA VAL 506 HA VAL 506 105.609 -5.733 14.558 534 HB VAL 506 HB VAL 506 105.901 -4.190 12.732 535 HG11 VAL 506 HG11 VAL 506 105.285 -4.835 10.416 536 HG12 VAL 506 HG12 VAL 506 105.170 -6.511 10.951 537 HG13 VAL 506 HG13 VAL 506 106.719 -5.669 11.017 538 HG21 VAL 506 HG21 VAL 506 103.378 -5.495 13.307 539 HG22 VAL 506 HG22 VAL 506 103.390 -4.762 11.703 540 HG23 VAL 506 HG23 VAL 506 103.744 -3.780 13.124 541 H ILE 507 H ILE 507 105.852 -8.016 11.853 542 HA ILE 507 HA ILE 507 103.240 -9.049 12.069 543 HB ILE 507 HB ILE 507 104.180 -11.082 10.909 544 HG12 ILE 507 HG12 ILE 507 106.551 -10.321 9.887 545 HG13 ILE 507 HG13 ILE 507 106.675 -9.595 11.482 546 HG21 ILE 507 HG21 ILE 507 104.946 -8.543 9.508 547 HG22 ILE 507 HG22 ILE 507 103.264 -8.962 9.828 548 HG23 ILE 507 HG23 ILE 507 104.259 -10.015 8.824 549 HD11 ILE 507 HD11 ILE 507 106.099 -11.856 12.425 550 HD12 ILE 507 HD12 ILE 507 107.669 -11.719 11.635 551 HD13 ILE 507 HD13 ILE 507 106.325 -12.490 10.795 552 H ASN 508 H ASN 508 106.191 -9.769 13.758 553 HA ASN 508 HA ASN 508 105.315 -12.220 14.936 554 HB2 ASN 508 HB2 ASN 508 107.571 -10.313 15.426 555 HB3 ASN 508 HB3 ASN 508 107.193 -11.517 16.655 556 HD21 ASN 508 HD21 ASN 508 108.914 -10.888 13.884 557 HD22 ASN 508 HD22 ASN 508 109.323 -12.509 13.446 558 H ALA 509 H ALA 509 105.294 -8.843 15.888 559 HA ALA 509 HA ALA 509 104.187 -9.314 18.490 560 HB1 ALA 509 HB1 ALA 509 103.895 -6.623 17.357 561 HB2 ALA 509 HB2 ALA 509 105.546 -7.242 17.406 562 HB3 ALA 509 HB3 ALA 509 104.595 -7.145 18.890 563 H TYR 510 H TYR 510 102.882 -8.872 15.326 564 HA TYR 510 HA TYR 510 100.397 -7.774 15.958 565 HB2 TYR 510 HB2 TYR 510 101.629 -8.942 13.646 566 HB3 TYR 510 HB3 TYR 510 99.965 -9.506 13.790 567 HD1 TYR 510 HD1 TYR 510 98.902 -8.303 12.051 568 HD2 TYR 510 HD2 TYR 510 101.317 -6.243 14.878 569 HE1 TYR 510 HE1 TYR 510 98.112 -6.158 11.147 570 HE2 TYR 510 HE2 TYR 510 100.533 -4.086 13.984 571 HH TYR 510 HH TYR 510 98.942 -3.105 12.676 572 H THR 511 H THR 511 101.560 -10.976 16.530 573 HA THR 511 HA THR 511 99.209 -12.452 16.473 574 HB THR 511 HB THR 511 100.206 -13.981 18.004 575 HG1 THR 511 HG1 THR 511 101.907 -11.830 18.785 576 HG21 THR 511 HG21 THR 511 101.706 -12.886 15.850 577 HG22 THR 511 HG22 THR 511 101.728 -14.531 16.483 578 HG23 THR 511 HG23 THR 511 102.825 -13.318 17.143 579 H GLU 512 H GLU 512 100.416 -10.137 18.778 580 HA GLU 512 HA GLU 512 98.668 -10.588 20.911 581 HB2 GLU 512 HB2 GLU 512 100.621 -8.648 20.177 582 HB3 GLU 512 HB3 GLU 512 99.183 -7.793 20.716 583 HG2 GLU 512 HG2 GLU 512 100.151 -8.041 22.729 584 HG3 GLU 512 HG3 GLU 512 99.358 -9.614 22.665 585 H ILE 513 H ILE 513 98.300 -8.467 18.087 586 HA ILE 513 HA ILE 513 96.110 -7.012 18.619 587 HB ILE 513 HB ILE 513 96.397 -8.613 16.070 588 HG12 ILE 513 HG12 ILE 513 98.428 -7.281 16.683 589 HG13 ILE 513 HG13 ILE 513 97.663 -6.758 15.187 590 HG21 ILE 513 HG21 ILE 513 95.073 -6.872 15.039 591 HG22 ILE 513 HG22 ILE 513 94.991 -5.990 16.563 592 HG23 ILE 513 HG23 ILE 513 94.193 -7.552 16.405 593 HD11 ILE 513 HD11 ILE 513 96.599 -5.309 17.429 594 HD12 ILE 513 HD12 ILE 513 97.391 -4.709 15.972 595 HD13 ILE 513 HD13 ILE 513 98.357 -5.184 17.369 596 H ASN 514 H ASN 514 96.049 -10.453 17.728 597 HA ASN 514 HA ASN 514 93.413 -10.995 17.527 598 HB2 ASN 514 HB2 ASN 514 95.182 -12.691 17.326 599 HB3 ASN 514 HB3 ASN 514 95.418 -12.650 19.071 600 HD21 ASN 514 HD21 ASN 514 92.399 -12.571 17.252 601 HD22 ASN 514 HD22 ASN 514 91.767 -14.047 17.889 602 H LYS 515 H LYS 515 95.131 -10.190 20.466 603 HA LYS 515 HA LYS 515 93.460 -11.061 22.444 604 HB2 LYS 515 HB2 LYS 515 95.187 -8.657 22.131 605 HB3 LYS 515 HB3 LYS 515 94.056 -8.670 23.476 606 HG2 LYS 515 HG2 LYS 515 95.986 -10.915 22.965 607 HG3 LYS 515 HG3 LYS 515 96.391 -9.507 23.951 608 HD2 LYS 515 HD2 LYS 515 94.479 -10.007 25.416 609 HD3 LYS 515 HD3 LYS 515 94.121 -11.435 24.444 610 HE2 LYS 515 HE2 LYS 515 95.727 -12.640 25.430 611 HE3 LYS 515 HE3 LYS 515 96.893 -11.321 25.338 612 HZ1 LYS 515 HZ1 LYS 515 95.351 -12.196 27.553 613 HZ2 LYS 515 HZ2 LYS 515 95.055 -10.560 27.241 614 HZ3 LYS 515 HZ3 LYS 515 96.636 -11.095 27.514 615 H LYS 516 H LYS 516 92.874 -8.579 20.099 616 HA LYS 516 HA LYS 516 90.227 -8.104 21.303 617 HB2 LYS 516 HB2 LYS 516 91.978 -6.171 21.290 618 HB3 LYS 516 HB3 LYS 516 91.586 -6.060 19.579 619 HG2 LYS 516 HG2 LYS 516 90.320 -4.502 21.069 620 HG3 LYS 516 HG3 LYS 516 89.323 -5.532 20.041 621 HD2 LYS 516 HD2 LYS 516 89.980 -6.556 22.740 622 HD3 LYS 516 HD3 LYS 516 88.847 -5.206 22.645 623 HE2 LYS 516 HE2 LYS 516 87.215 -6.481 21.783 624 HE3 LYS 516 HE3 LYS 516 88.323 -7.336 20.712 625 HZ1 LYS 516 HZ1 LYS 516 87.130 -8.412 22.870 626 HZ2 LYS 516 HZ2 LYS 516 88.641 -7.990 23.502 627 HZ3 LYS 516 HZ3 LYS 516 88.542 -9.010 22.155 628 H HIS 517 H HIS 517 92.086 -8.109 18.275 629 HA HIS 517 HA HIS 517 89.771 -9.253 16.913 630 HB2 HIS 517 HB2 HIS 517 91.234 -7.076 15.480 631 HB3 HIS 517 HB3 HIS 517 89.584 -7.645 15.261 632 HD1 HIS 517 HD1 HIS 517 87.775 -6.355 16.412 633 HD2 HIS 517 HD2 HIS 517 91.565 -5.357 17.792 634 HE1 HIS 517 HE1 HIS 517 87.443 -4.358 17.902 635 HE2 HIS 517 HE2 HIS 517 89.744 -3.797 18.760 636 H CYS 518 H CYS 518 90.424 -11.003 15.836 637 HA CYS 518 HA CYS 518 93.111 -11.754 15.559 638 HB2 CYS 518 HB2 CYS 518 92.206 -13.457 13.914 639 HB3 CYS 518 HB3 CYS 518 91.462 -13.475 15.509 640 HG CYS 518 HG CYS 518 89.289 -12.834 14.529 641 H TRP 519 H TRP 519 94.570 -10.672 14.381 642 HA TRP 519 HA TRP 519 93.736 -9.683 11.731 643 HB2 TRP 519 HB2 TRP 519 94.770 -8.220 13.816 644 HB3 TRP 519 HB3 TRP 519 96.181 -8.508 12.801 645 HD1 TRP 519 HD1 TRP 519 93.732 -8.511 10.296 646 HE1 TRP 519 HE1 TRP 519 93.298 -6.202 9.288 647 HE3 TRP 519 HE3 TRP 519 95.871 -5.628 13.936 648 HZ2 TRP 519 HZ2 TRP 519 93.796 -3.481 9.944 649 HZ3 TRP 519 HZ3 TRP 519 95.849 -3.186 13.670 650 HH2 TRP 519 HH2 TRP 519 94.834 -2.140 11.714 651 H LYS 520 H LYS 520 95.083 -9.871 10.001 652 HA LYS 520 HA LYS 520 97.141 -11.957 10.238 653 HB2 LYS 520 HB2 LYS 520 95.854 -11.125 7.672 654 HB3 LYS 520 HB3 LYS 520 96.583 -12.671 8.085 655 HG2 LYS 520 HG2 LYS 520 93.974 -11.601 9.149 656 HG3 LYS 520 HG3 LYS 520 94.162 -12.848 7.913 657 HD2 LYS 520 HD2 LYS 520 94.892 -14.425 9.428 658 HD3 LYS 520 HD3 LYS 520 95.481 -13.210 10.565 659 HE2 LYS 520 HE2 LYS 520 93.494 -14.331 11.426 660 HE3 LYS 520 HE3 LYS 520 93.184 -12.619 11.136 661 HZ1 LYS 520 HZ1 LYS 520 92.158 -14.963 9.702 662 HZ2 LYS 520 HZ2 LYS 520 92.360 -13.519 8.845 663 HZ3 LYS 520 HZ3 LYS 520 91.347 -13.563 10.198 664 H LEU 521 H LEU 521 99.201 -11.451 9.775 665 HA LEU 521 HA LEU 521 99.726 -9.058 8.154 666 HB2 LEU 521 HB2 LEU 521 100.051 -8.972 10.814 667 HB3 LEU 521 HB3 LEU 521 101.606 -9.644 10.371 668 HG LEU 521 HG LEU 521 102.134 -7.726 9.027 669 HD11 LEU 521 HD11 LEU 521 100.392 -6.825 7.942 670 HD12 LEU 521 HD12 LEU 521 100.252 -5.807 9.377 671 HD13 LEU 521 HD13 LEU 521 99.248 -7.249 9.216 672 HD21 LEU 521 HD21 LEU 521 102.741 -6.512 10.793 673 HD22 LEU 521 HD22 LEU 521 101.836 -7.670 11.769 674 HD23 LEU 521 HD23 LEU 521 101.067 -6.175 11.237 675 H GLU 522 H GLU 522 100.683 -9.796 6.378 676 HA GLU 522 HA GLU 522 102.871 -11.740 6.690 677 HB2 GLU 522 HB2 GLU 522 100.970 -12.913 5.742 678 HB3 GLU 522 HB3 GLU 522 100.783 -11.677 4.505 679 HG2 GLU 522 HG2 GLU 522 103.213 -12.325 3.863 680 HG3 GLU 522 HG3 GLU 522 102.859 -13.803 4.758 681 H ILE 523 H ILE 523 104.712 -11.334 5.569 682 HA ILE 523 HA ILE 523 104.901 -8.729 4.278 683 HB ILE 523 HB ILE 523 107.055 -10.717 5.010 684 HG12 ILE 523 HG12 ILE 523 106.531 -8.029 6.271 685 HG13 ILE 523 HG13 ILE 523 105.753 -9.495 6.858 686 HG21 ILE 523 HG21 ILE 523 107.091 -8.363 3.325 687 HG22 ILE 523 HG22 ILE 523 108.332 -9.590 3.578 688 HG23 ILE 523 HG23 ILE 523 108.208 -8.221 4.682 689 HD11 ILE 523 HD11 ILE 523 107.980 -8.620 7.919 690 HD12 ILE 523 HD12 ILE 523 108.707 -9.478 6.560 691 HD13 ILE 523 HD13 ILE 523 107.690 -10.347 7.709 692 H LEU 524 H LEU 524 104.705 -8.535 2.150 693 HA LEU 524 HA LEU 524 104.536 -10.717 0.378 694 HB2 LEU 524 HB2 LEU 524 104.586 -7.772 0.151 695 HB3 LEU 524 HB3 LEU 524 105.073 -8.654 -1.282 696 HG LEU 524 HG LEU 524 102.581 -7.964 -0.960 697 HD11 LEU 524 HD11 LEU 524 103.684 -10.542 -1.981 698 HD12 LEU 524 HD12 LEU 524 103.033 -9.166 -2.871 699 HD13 LEU 524 HD13 LEU 524 101.944 -10.258 -2.016 700 HD21 LEU 524 HD21 LEU 524 102.856 -9.459 1.317 701 HD22 LEU 524 HD22 LEU 524 102.098 -10.597 0.203 702 HD23 LEU 524 HD23 LEU 524 101.327 -9.047 0.541 703 H SER 525 H SER 525 105.984 -11.610 -1.056 704 HA SER 525 HA SER 525 108.687 -10.541 -1.197 705 HB2 SER 525 HB2 SER 525 109.246 -11.940 0.533 706 HB3 SER 525 HB3 SER 525 107.941 -13.073 0.181 707 HG SER 525 HG SER 525 110.053 -13.895 -0.309 708 H GLY 526 H GLY 526 110.045 -11.691 -2.783 709 HA2 GLY 526 HA2 GLY 526 110.384 -12.389 -4.938 710 HA3 GLY 526 HA3 GLY 526 109.124 -13.567 -4.608 711 H ASP 527 H ASP 527 108.486 -13.373 -6.815 712 HA ASP 527 HA ASP 527 107.798 -11.101 -8.182 713 HB2 ASP 527 HB2 ASP 527 106.619 -13.869 -8.225 714 HB3 ASP 527 HB3 ASP 527 106.018 -12.603 -9.290 715 H HIS 528 H HIS 528 106.074 -12.649 -5.569 716 HA HIS 528 HA HIS 528 103.570 -11.416 -5.944 717 HB2 HIS 528 HB2 HIS 528 104.551 -13.274 -4.197 718 HB3 HIS 528 HB3 HIS 528 104.380 -11.869 -3.148 719 HD1 HIS 528 HD1 HIS 528 102.432 -13.014 -1.873 720 HD2 HIS 528 HD2 HIS 528 101.699 -12.387 -5.915 721 HE1 HIS 528 HE1 HIS 528 99.962 -13.382 -2.174 722 HE2 HIS 528 HE2 HIS 528 99.548 -13.037 -4.635 723 H GLU 529 H GLU 529 106.407 -10.448 -4.035 724 HA GLU 529 HA GLU 529 105.239 -8.072 -3.008 725 HB2 GLU 529 HB2 GLU 529 107.082 -8.704 -1.773 726 HB3 GLU 529 HB3 GLU 529 107.997 -9.194 -3.192 727 HG2 GLU 529 HG2 GLU 529 108.212 -6.751 -3.760 728 HG3 GLU 529 HG3 GLU 529 107.540 -6.407 -2.166 729 H GLN 530 H GLN 530 107.350 -8.729 -5.763 730 HA GLN 530 HA GLN 530 107.583 -6.058 -6.638 731 HB2 GLN 530 HB2 GLN 530 108.790 -6.904 -8.373 732 HB3 GLN 530 HB3 GLN 530 108.798 -8.337 -7.357 733 HG2 GLN 530 HG2 GLN 530 108.189 -9.265 -9.337 734 HG3 GLN 530 HG3 GLN 530 106.595 -8.883 -8.689 735 HE21 GLN 530 HE21 GLN 530 105.778 -8.854 -10.819 736 HE22 GLN 530 HE22 GLN 530 106.044 -7.501 -11.859 737 H ARG 531 H ARG 531 105.219 -8.572 -7.252 738 HA ARG 531 HA ARG 531 103.839 -7.382 -9.373 739 HB2 ARG 531 HB2 ARG 531 103.079 -9.504 -9.141 740 HB3 ARG 531 HB3 ARG 531 103.326 -9.512 -7.402 741 HG2 ARG 531 HG2 ARG 531 100.961 -9.781 -8.113 742 HG3 ARG 531 HG3 ARG 531 101.240 -8.417 -7.028 743 HD2 ARG 531 HD2 ARG 531 100.323 -7.054 -8.517 744 HD3 ARG 531 HD3 ARG 531 101.579 -7.484 -9.678 745 HE ARG 531 HE ARG 531 99.829 -9.525 -9.901 746 HH11 ARG 531 HH11 ARG 531 99.462 -6.062 -9.984 747 HH12 ARG 531 HH12 ARG 531 98.106 -6.100 -11.061 748 HH21 ARG 531 HH21 ARG 531 98.042 -9.588 -11.317 749 HH22 ARG 531 HH22 ARG 531 97.298 -8.108 -11.819 750 H TYR 532 H TYR 532 103.181 -7.225 -5.867 751 HA TYR 532 HA TYR 532 100.980 -5.527 -5.986 752 HB2 TYR 532 HB2 TYR 532 101.580 -6.628 -3.916 753 HB3 TYR 532 HB3 TYR 532 103.108 -5.755 -3.852 754 HD1 TYR 532 HD1 TYR 532 103.085 -3.286 -3.479 755 HD2 TYR 532 HD2 TYR 532 99.587 -5.664 -3.066 756 HE1 TYR 532 HE1 TYR 532 102.019 -1.480 -2.194 757 HE2 TYR 532 HE2 TYR 532 98.508 -3.865 -1.781 758 HH TYR 532 HH TYR 532 98.667 -1.751 -1.083 759 H TRP 533 H TRP 533 104.437 -4.759 -5.848 760 HA TRP 533 HA TRP 533 104.134 -1.965 -5.693 761 HB2 TRP 533 HB2 TRP 533 106.345 -3.806 -6.478 762 HB3 TRP 533 HB3 TRP 533 106.499 -2.097 -6.884 763 HD1 TRP 533 HD1 TRP 533 106.913 -4.485 -4.049 764 HE1 TRP 533 HE1 TRP 533 107.492 -3.206 -1.895 765 HE3 TRP 533 HE3 TRP 533 105.921 0.270 -5.640 766 HZ2 TRP 533 HZ2 TRP 533 107.523 -0.529 -0.986 767 HZ3 TRP 533 HZ3 TRP 533 106.250 2.134 -4.067 768 HH2 TRP 533 HH2 TRP 533 107.034 1.741 -1.789 769 H GLN 534 H GLN 534 104.368 -4.164 -8.454 770 HA GLN 534 HA GLN 534 104.547 -2.332 -10.521 771 HB2 GLN 534 HB2 GLN 534 103.244 -5.025 -10.279 772 HB3 GLN 534 HB3 GLN 534 103.055 -4.095 -11.759 773 HG2 GLN 534 HG2 GLN 534 105.797 -4.058 -11.116 774 HG3 GLN 534 HG3 GLN 534 105.241 -5.720 -10.920 775 HE21 GLN 534 HE21 GLN 534 104.767 -3.016 -13.177 776 HE22 GLN 534 HE22 GLN 534 104.925 -3.965 -14.612 777 H LYS 535 H LYS 535 101.699 -3.507 -8.789 778 HA LYS 535 HA LYS 535 99.772 -2.067 -10.253 779 HB2 LYS 535 HB2 LYS 535 98.670 -3.598 -8.991 780 HB3 LYS 535 HB3 LYS 535 99.878 -3.565 -7.717 781 HG2 LYS 535 HG2 LYS 535 98.032 -1.247 -8.018 782 HG3 LYS 535 HG3 LYS 535 97.442 -2.736 -7.277 783 HD2 LYS 535 HD2 LYS 535 100.023 -2.022 -6.216 784 HD3 LYS 535 HD3 LYS 535 98.888 -0.683 -6.043 785 HE2 LYS 535 HE2 LYS 535 97.570 -3.125 -5.362 786 HE3 LYS 535 HE3 LYS 535 99.088 -3.020 -4.470 787 HZ1 LYS 535 HZ1 LYS 535 98.380 -0.731 -3.812 788 HZ2 LYS 535 HZ2 LYS 535 97.432 -1.977 -3.168 789 HZ3 LYS 535 HZ3 LYS 535 96.858 -1.066 -4.473 790 H ILE 536 H ILE 536 101.760 -1.269 -7.458 791 HA ILE 536 HA ILE 536 100.537 1.140 -6.721 792 HB ILE 536 HB ILE 536 103.419 0.269 -6.501 793 HG12 ILE 536 HG12 ILE 536 101.152 0.426 -4.500 794 HG13 ILE 536 HG13 ILE 536 101.872 -1.044 -5.153 795 HG21 ILE 536 HG21 ILE 536 102.216 2.874 -6.042 796 HG22 ILE 536 HG22 ILE 536 103.916 2.410 -6.125 797 HG23 ILE 536 HG23 ILE 536 103.027 2.237 -4.611 798 HD11 ILE 536 HD11 ILE 536 103.403 -1.048 -3.556 799 HD12 ILE 536 HD12 ILE 536 102.591 0.337 -2.826 800 HD13 ILE 536 HD13 ILE 536 103.906 0.588 -3.973 801 H LEU 537 H LEU 537 103.535 0.759 -8.623 802 HA LEU 537 HA LEU 537 103.853 3.347 -9.468 803 HB2 LEU 537 HB2 LEU 537 104.678 0.707 -10.443 804 HB3 LEU 537 HB3 LEU 537 104.607 1.929 -11.696 805 HG LEU 537 HG LEU 537 106.814 2.028 -10.973 806 HD11 LEU 537 HD11 LEU 537 107.077 4.184 -10.206 807 HD12 LEU 537 HD12 LEU 537 105.710 4.070 -9.097 808 HD13 LEU 537 HD13 LEU 537 105.428 4.222 -10.832 809 HD21 LEU 537 HD21 LEU 537 107.546 1.279 -9.006 810 HD22 LEU 537 HD22 LEU 537 105.877 0.809 -8.680 811 HD23 LEU 537 HD23 LEU 537 106.482 2.365 -8.110 812 H VAL 538 H VAL 538 102.060 0.786 -11.176 813 HA VAL 538 HA VAL 538 101.146 2.249 -13.332 814 HB VAL 538 HB VAL 538 99.576 0.137 -11.844 815 HG11 VAL 538 HG11 VAL 538 99.409 1.117 -14.692 816 HG12 VAL 538 HG12 VAL 538 98.203 1.346 -13.424 817 HG13 VAL 538 HG13 VAL 538 98.537 -0.272 -14.043 818 HG21 VAL 538 HG21 VAL 538 100.953 -1.429 -12.628 819 HG22 VAL 538 HG22 VAL 538 102.072 -0.124 -13.023 820 HG23 VAL 538 HG23 VAL 538 100.950 -0.724 -14.245 821 H ASP 539 H ASP 539 99.859 2.058 -10.057 822 HA ASP 539 HA ASP 539 97.488 3.512 -10.514 823 HB2 ASP 539 HB2 ASP 539 97.976 2.116 -8.487 824 HB3 ASP 539 HB3 ASP 539 99.069 3.385 -7.939 825 H ARG 540 H ARG 540 100.780 4.481 -9.745 826 HA ARG 540 HA ARG 540 100.283 7.177 -9.137 827 HB2 ARG 540 HB2 ARG 540 102.525 5.534 -9.326 828 HB3 ARG 540 HB3 ARG 540 102.793 6.766 -10.551 829 HG2 ARG 540 HG2 ARG 540 103.638 7.986 -8.894 830 HG3 ARG 540 HG3 ARG 540 101.963 8.243 -8.399 831 HD2 ARG 540 HD2 ARG 540 102.249 7.060 -6.534 832 HD3 ARG 540 HD3 ARG 540 102.970 5.719 -7.422 833 HE ARG 540 HE ARG 540 104.833 7.827 -7.162 834 HH11 ARG 540 HH11 ARG 540 103.278 5.306 -5.331 835 HH12 ARG 540 HH12 ARG 540 104.569 5.164 -4.184 836 HH21 ARG 540 HH21 ARG 540 106.539 7.648 -5.654 837 HH22 ARG 540 HH22 ARG 540 106.420 6.494 -4.367 838 H GLN 541 H GLN 541 100.927 5.532 -12.203 839 HA GLN 541 HA GLN 541 101.040 7.844 -13.818 840 HB2 GLN 541 HB2 GLN 541 100.669 4.933 -14.276 841 HB3 GLN 541 HB3 GLN 541 100.150 6.010 -15.567 842 HG2 GLN 541 HG2 GLN 541 102.486 5.140 -15.763 843 HG3 GLN 541 HG3 GLN 541 102.324 6.893 -15.834 844 HE21 GLN 541 HE21 GLN 541 104.179 4.520 -14.653 845 HE22 GLN 541 HE22 GLN 541 104.828 5.295 -13.252 846 H ALA 542 H ALA 542 98.372 5.702 -12.920 847 HA ALA 542 HA ALA 542 96.391 6.926 -14.504 848 HB1 ALA 542 HB1 ALA 542 96.512 4.833 -12.562 849 HB2 ALA 542 HB2 ALA 542 95.295 5.132 -13.802 850 HB3 ALA 542 HB3 ALA 542 95.136 5.879 -12.213 851 H LYS 543 H LYS 543 97.760 7.739 -11.419 852 HA LYS 543 HA LYS 543 95.739 9.352 -10.368 853 HB2 LYS 543 HB2 LYS 543 98.482 8.774 -9.793 854 HB3 LYS 543 HB3 LYS 543 98.234 10.512 -9.685 855 HG2 LYS 543 HG2 LYS 543 97.083 10.338 -7.786 856 HG3 LYS 543 HG3 LYS 543 96.131 8.977 -8.382 857 HD2 LYS 543 HD2 LYS 543 98.780 8.057 -7.998 858 HD3 LYS 543 HD3 LYS 543 98.324 8.969 -6.557 859 HE2 LYS 543 HE2 LYS 543 96.248 7.159 -7.565 860 HE3 LYS 543 HE3 LYS 543 97.714 6.352 -7.006 861 HZ1 LYS 543 HZ1 LYS 543 95.819 8.014 -5.486 862 HZ2 LYS 543 HZ2 LYS 543 97.424 7.885 -4.967 863 HZ3 LYS 543 HZ3 LYS 543 96.465 6.499 -5.098 864 H LEU 544 H LEU 544 97.639 9.838 -13.129 865 HA LEU 544 HA LEU 544 98.127 12.529 -13.257 866 HB2 LEU 544 HB2 LEU 544 98.131 10.427 -15.054 867 HB3 LEU 544 HB3 LEU 544 96.960 11.539 -15.736 868 HG LEU 544 HG LEU 544 99.153 11.952 -16.681 869 HD11 LEU 544 HD11 LEU 544 97.696 13.934 -15.116 870 HD12 LEU 544 HD12 LEU 544 98.298 14.012 -16.772 871 HD13 LEU 544 HD13 LEU 544 99.375 14.375 -15.424 872 HD21 LEU 544 HD21 LEU 544 100.936 12.884 -15.146 873 HD22 LEU 544 HD22 LEU 544 100.637 11.149 -15.031 874 HD23 LEU 544 HD23 LEU 544 99.986 12.239 -13.807 875 H ASN 545 H ASN 545 95.045 10.887 -13.565 876 HA ASN 545 HA ASN 545 93.684 13.357 -14.286 877 HB2 ASN 545 HB2 ASN 545 93.151 10.564 -14.618 878 HB3 ASN 545 HB3 ASN 545 91.812 11.297 -13.739 879 HD21 ASN 545 HD21 ASN 545 93.949 12.232 -16.417 880 HD22 ASN 545 HD22 ASN 545 92.682 12.752 -17.469 881 H GLN 546 H GLN 546 94.133 14.508 -12.331 882 HA GLN 546 HA GLN 546 93.373 15.437 -10.386 883 HB2 GLN 546 HB2 GLN 546 91.162 14.094 -11.286 884 HB3 GLN 546 HB3 GLN 546 91.412 13.357 -9.709 885 HG2 GLN 546 HG2 GLN 546 90.036 15.088 -9.156 886 HG3 GLN 546 HG3 GLN 546 91.612 15.839 -8.914 887 HE21 GLN 546 HE21 GLN 546 92.245 17.496 -10.218 888 HE22 GLN 546 HE22 GLN 546 91.219 18.231 -11.398 889 HA PRO 547 HA PRO 547 95.757 12.132 -8.163 890 HB2 PRO 547 HB2 PRO 547 98.070 13.445 -7.871 891 HB3 PRO 547 HB3 PRO 547 97.664 12.622 -9.382 892 HG2 PRO 547 HG2 PRO 547 97.490 15.531 -8.705 893 HG3 PRO 547 HG3 PRO 547 98.069 14.761 -10.194 894 HD2 PRO 547 HD2 PRO 547 95.553 15.833 -9.882 895 HD3 PRO 547 HD3 PRO 547 95.957 14.555 -11.045 896 H ARG 548 H ARG 548 94.554 12.313 -6.288 897 HA ARG 548 HA ARG 548 93.857 13.101 -4.255 898 HB2 ARG 548 HB2 ARG 548 96.836 13.515 -4.235 899 HB3 ARG 548 HB3 ARG 548 95.856 13.860 -2.818 900 HG2 ARG 548 HG2 ARG 548 94.997 11.370 -3.436 901 HG3 ARG 548 HG3 ARG 548 96.679 11.292 -3.966 902 HD2 ARG 548 HD2 ARG 548 96.669 12.606 -1.474 903 HD3 ARG 548 HD3 ARG 548 95.613 11.205 -1.310 904 HE ARG 548 HE ARG 548 97.479 9.906 -1.310 905 HH11 ARG 548 HH11 ARG 548 98.220 12.883 -2.959 906 HH12 ARG 548 HH12 ARG 548 99.884 12.476 -3.217 907 HH21 ARG 548 HH21 ARG 548 99.666 9.363 -1.640 908 HH22 ARG 548 HH22 ARG 548 100.707 10.474 -2.466 909 H GLU 549 H GLU 549 94.524 15.135 -2.607 910 HA GLU 549 HA GLU 549 93.982 17.315 -2.217 911 HB2 GLU 549 HB2 GLU 549 95.913 17.349 -4.475 912 HB3 GLU 549 HB3 GLU 549 95.062 18.850 -4.136 913 HG2 GLU 549 HG2 GLU 549 96.319 19.266 -2.358 914 HG3 GLU 549 HG3 GLU 549 96.094 17.638 -1.722 915 H LYS 550 H LYS 550 92.153 15.713 -3.866 916 HA LYS 550 HA LYS 550 91.070 17.435 -5.883 917 HB2 LYS 550 HB2 LYS 550 90.914 14.925 -5.890 918 HB3 LYS 550 HB3 LYS 550 89.748 15.053 -4.581 919 HG2 LYS 550 HG2 LYS 550 88.486 16.626 -6.228 920 HG3 LYS 550 HG3 LYS 550 89.465 15.813 -7.449 921 HD2 LYS 550 HD2 LYS 550 88.399 13.822 -7.174 922 HD3 LYS 550 HD3 LYS 550 88.094 14.099 -5.459 923 HE2 LYS 550 HE2 LYS 550 85.977 14.197 -6.443 924 HE3 LYS 550 HE3 LYS 550 86.435 15.887 -6.231 925 HZ1 LYS 550 HZ1 LYS 550 85.819 16.012 -8.374 926 HZ2 LYS 550 HZ2 LYS 550 86.050 14.363 -8.670 927 HZ3 LYS 550 HZ3 LYS 550 87.374 15.417 -8.676 928 H LYS 551 H LYS 551 91.079 17.781 -2.649 929 HA LYS 551 HA LYS 551 89.893 19.097 -1.213 930 HB2 LYS 551 HB2 LYS 551 88.369 19.842 -3.714 931 HB3 LYS 551 HB3 LYS 551 88.190 20.643 -2.159 932 HG2 LYS 551 HG2 LYS 551 90.875 20.462 -3.458 933 HG3 LYS 551 HG3 LYS 551 89.713 21.690 -3.963 934 HD2 LYS 551 HD2 LYS 551 90.419 21.297 -1.073 935 HD3 LYS 551 HD3 LYS 551 91.407 22.306 -2.131 936 HE2 LYS 551 HE2 LYS 551 89.331 23.586 -2.701 937 HE3 LYS 551 HE3 LYS 551 88.491 22.664 -1.455 938 HZ1 LYS 551 HZ1 LYS 551 90.903 23.789 -0.454 939 HZ2 LYS 551 HZ2 LYS 551 89.319 23.975 0.111 940 HZ3 LYS 551 HZ3 LYS 551 89.907 24.991 -1.106 941 H ARG 552 H ARG 552 88.472 18.421 0.260 942 HA ARG 552 HA ARG 552 86.868 16.181 -0.052 943 HB2 ARG 552 HB2 ARG 552 87.633 17.400 2.102 944 HB3 ARG 552 HB3 ARG 552 86.174 18.360 1.902 945 HG2 ARG 552 HG2 ARG 552 85.395 15.674 1.638 946 HG3 ARG 552 HG3 ARG 552 86.484 15.750 3.023 947 HD2 ARG 552 HD2 ARG 552 84.900 16.684 4.268 948 HD3 ARG 552 HD3 ARG 552 84.703 17.986 3.095 949 HE ARG 552 HE ARG 552 82.820 16.948 2.309 950 HH11 ARG 552 HH11 ARG 552 84.632 14.703 4.256 951 HH12 ARG 552 HH12 ARG 552 83.395 13.491 4.243 952 HH21 ARG 552 HH21 ARG 552 81.185 15.360 2.277 953 HH22 ARG 552 HH22 ARG 552 81.433 13.864 3.114 954 H GLY 553 H GLY 553 85.467 16.150 -1.748 955 HA2 GLY 553 HA2 GLY 553 83.995 18.002 -2.975 956 HA3 GLY 553 HA3 GLY 553 83.320 16.422 -2.611 957 H THR 554 H THR 554 82.685 19.596 -2.422 958 HA THR 554 HA THR 554 81.556 19.735 0.222 959 HB THR 554 HB THR 554 82.396 21.774 -0.804 960 HG1 THR 554 HG1 THR 554 80.325 23.020 -0.686 961 HG21 THR 554 HG21 THR 554 80.152 21.905 -2.747 962 HG22 THR 554 HG22 THR 554 81.532 20.883 -3.152 963 HG23 THR 554 HG23 THR 554 81.771 22.601 -2.836 964 H GLU 555 H GLU 555 80.409 19.098 -3.030 965 HA GLU 555 HA GLU 555 77.666 19.365 -2.650 966 HB2 GLU 555 HB2 GLU 555 79.423 17.955 -4.551 967 HB3 GLU 555 HB3 GLU 555 77.803 17.284 -4.404 968 HG2 GLU 555 HG2 GLU 555 76.845 19.465 -4.925 969 HG3 GLU 555 HG3 GLU 555 78.465 20.147 -5.056 970 H LYS 556 H LYS 556 76.418 16.992 -3.177 971 HA LYS 556 HA LYS 556 75.384 15.313 -2.019 972 HB2 LYS 556 HB2 LYS 556 77.796 14.446 -2.766 973 HB3 LYS 556 HB3 LYS 556 78.013 14.333 -1.025 974 HG2 LYS 556 HG2 LYS 556 77.275 12.216 -1.895 975 HG3 LYS 556 HG3 LYS 556 76.008 12.917 -0.887 976 HD2 LYS 556 HD2 LYS 556 74.877 13.732 -2.920 977 HD3 LYS 556 HD3 LYS 556 76.124 12.961 -3.902 978 HE2 LYS 556 HE2 LYS 556 73.960 11.673 -3.605 979 HE3 LYS 556 HE3 LYS 556 75.450 10.803 -3.249 980 HZ1 LYS 556 HZ1 LYS 556 73.721 12.095 -1.210 981 HZ2 LYS 556 HZ2 LYS 556 75.095 11.154 -0.911 982 HZ3 LYS 556 HZ3 LYS 556 73.711 10.443 -1.575 983 H LEU 557 H LEU 557 74.495 16.800 -0.464 984 HA LEU 557 HA LEU 557 75.852 16.879 2.132 985 HB2 LEU 557 HB2 LEU 557 73.999 18.525 2.679 986 HB3 LEU 557 HB3 LEU 557 75.180 19.032 1.485 987 HG LEU 557 HG LEU 557 72.973 17.753 0.164 988 HD11 LEU 557 HD11 LEU 557 71.125 18.693 1.004 989 HD12 LEU 557 HD12 LEU 557 71.933 20.226 1.327 990 HD13 LEU 557 HD13 LEU 557 72.081 18.894 2.472 991 HD21 LEU 557 HD21 LEU 557 73.158 19.532 -1.260 992 HD22 LEU 557 HD22 LEU 557 74.756 19.567 -0.515 993 HD23 LEU 557 HD23 LEU 557 73.502 20.679 0.035 994 H ILE 558 H ILE 558 74.922 14.385 1.553 995 HA ILE 558 HA ILE 558 72.932 14.033 3.632 996 HB ILE 558 HB ILE 558 72.369 12.637 1.045 997 HG12 ILE 558 HG12 ILE 558 71.520 15.426 1.830 998 HG13 ILE 558 HG13 ILE 558 72.320 14.918 0.347 999 HG21 ILE 558 HG21 ILE 558 70.116 12.514 1.975 1000 HG22 ILE 558 HG22 ILE 558 70.637 13.454 3.374 1001 HG23 ILE 558 HG23 ILE 558 71.304 11.846 3.095 1002 HD11 ILE 558 HD11 ILE 558 69.719 15.435 0.487 1003 HD12 ILE 558 HD12 ILE 558 69.680 13.725 0.917 1004 HD13 ILE 558 HD13 ILE 558 70.394 14.233 -0.613 1005 H THR 559 H THR 559 73.365 12.288 4.814 1006 HA THR 559 HA THR 559 74.845 10.060 3.617 1007 HB THR 559 HB THR 559 75.814 10.382 6.273 1008 HG1 THR 559 HG1 THR 559 75.268 12.684 5.741 1009 HG21 THR 559 HG21 THR 559 76.811 10.037 3.565 1010 HG22 THR 559 HG22 THR 559 77.429 9.396 5.087 1011 HG23 THR 559 HG23 THR 559 77.885 11.018 4.565 1012 H LYS 560 H LYS 560 74.804 8.104 4.977 1013 HA LYS 560 HA LYS 560 72.473 8.038 6.775 1014 HB2 LYS 560 HB2 LYS 560 72.197 7.007 4.409 1015 HB3 LYS 560 HB3 LYS 560 73.204 5.707 5.029 1016 HG2 LYS 560 HG2 LYS 560 71.604 5.031 6.569 1017 HG3 LYS 560 HG3 LYS 560 70.753 6.576 6.507 1018 HD2 LYS 560 HD2 LYS 560 70.205 6.022 4.098 1019 HD3 LYS 560 HD3 LYS 560 70.801 4.396 4.431 1020 HE2 LYS 560 HE2 LYS 560 69.079 4.895 6.527 1021 HE3 LYS 560 HE3 LYS 560 68.273 5.645 5.149 1022 HZ1 LYS 560 HZ1 LYS 560 67.704 3.659 4.384 1023 HZ2 LYS 560 HZ2 LYS 560 68.304 2.966 5.807 1024 HZ3 LYS 560 HZ3 LYS 560 69.299 3.097 4.445 1025 H ALA 561 H ALA 561 74.980 5.721 5.741 1026 HA ALA 561 HA ALA 561 76.012 5.632 8.466 1027 HB1 ALA 561 HB1 ALA 561 75.136 3.671 9.019 1028 HB2 ALA 561 HB2 ALA 561 75.822 2.930 7.573 1029 HB3 ALA 561 HB3 ALA 561 74.223 3.673 7.510 Start of MODEL 12 1 H1 MET 437 HT1 MET 437 132.153 9.148 -4.230 2 H2 MET 437 HT2 MET 437 131.968 7.472 -3.917 3 H3 MET 437 HT3 MET 437 133.512 8.108 -4.312 4 HA MET 437 HA MET 437 132.433 9.479 -2.124 5 HB2 MET 437 HB2 MET 437 131.262 7.176 -2.031 6 HB3 MET 437 HB3 MET 437 132.850 6.540 -1.628 7 HG2 MET 437 HG2 MET 437 132.769 7.319 0.464 8 HG3 MET 437 HG3 MET 437 132.046 8.850 -0.027 9 HE1 MET 437 HE1 MET 437 131.475 5.318 1.425 10 HE2 MET 437 HE2 MET 437 131.017 5.041 -0.255 11 HE3 MET 437 HE3 MET 437 129.795 4.975 1.015 12 H HIS 438 H HIS 438 134.592 6.724 -2.835 13 HA HIS 438 HA HIS 438 136.733 7.963 -1.331 14 HB2 HIS 438 HB2 HIS 438 136.058 5.324 -2.052 15 HB3 HIS 438 HB3 HIS 438 137.581 5.674 -2.865 16 HD1 HIS 438 HD1 HIS 438 139.637 5.443 -1.484 17 HD2 HIS 438 HD2 HIS 438 136.215 5.803 0.847 18 HE1 HIS 438 HE1 HIS 438 140.398 5.090 0.889 19 HE2 HIS 438 HE2 HIS 438 138.302 5.265 2.277 20 H HIS 439 H HIS 439 138.953 7.155 -2.811 21 HA HIS 439 HA HIS 439 139.635 9.300 -4.296 22 HB2 HIS 439 HB2 HIS 439 140.864 6.954 -3.745 23 HB3 HIS 439 HB3 HIS 439 140.567 6.746 -5.469 24 HD1 HIS 439 HD1 HIS 439 140.970 10.063 -5.715 25 HD2 HIS 439 HD2 HIS 439 143.637 7.135 -4.460 26 HE1 HIS 439 HE1 HIS 439 143.258 11.047 -6.057 27 HE2 HIS 439 HE2 HIS 439 144.855 9.280 -5.235 28 H HIS 440 H HIS 440 138.360 6.300 -5.750 29 HA HIS 440 HA HIS 440 137.672 7.829 -8.155 30 HB2 HIS 440 HB2 HIS 440 137.120 5.020 -8.409 31 HB3 HIS 440 HB3 HIS 440 138.271 6.006 -9.302 32 HD1 HIS 440 HD1 HIS 440 138.059 4.023 -6.078 33 HD2 HIS 440 HD2 HIS 440 140.888 5.462 -8.760 34 HE1 HIS 440 HE1 HIS 440 140.251 3.045 -5.331 35 HE2 HIS 440 HE2 HIS 440 141.937 3.873 -7.009 36 H HIS 441 H HIS 441 135.591 7.440 -9.188 37 HA HIS 441 HA HIS 441 133.472 7.233 -7.184 38 HB2 HIS 441 HB2 HIS 441 133.890 8.894 -9.442 39 HB3 HIS 441 HB3 HIS 441 132.478 7.903 -9.789 40 HD1 HIS 441 HD1 HIS 441 130.371 8.300 -8.367 41 HD2 HIS 441 HD2 HIS 441 133.578 10.734 -7.340 42 HE1 HIS 441 HE1 HIS 441 129.417 10.064 -6.850 43 HE2 HIS 441 HE2 HIS 441 131.365 11.556 -6.280 44 H HIS 442 H HIS 442 134.384 4.798 -7.511 45 HA HIS 442 HA HIS 442 133.177 3.375 -9.685 46 HB2 HIS 442 HB2 HIS 442 135.279 2.757 -8.266 47 HB3 HIS 442 HB3 HIS 442 134.107 2.057 -7.156 48 HD1 HIS 442 HD1 HIS 442 132.994 1.695 -10.590 49 HD2 HIS 442 HD2 HIS 442 135.492 -0.392 -8.007 50 HE1 HIS 442 HE1 HIS 442 133.243 -0.596 -11.599 51 HE2 HIS 442 HE2 HIS 442 134.821 -1.815 -10.060 52 H HIS 443 H HIS 443 132.416 3.902 -6.278 53 HA HIS 443 HA HIS 443 130.207 2.125 -6.191 54 HB2 HIS 443 HB2 HIS 443 131.628 3.602 -4.332 55 HB3 HIS 443 HB3 HIS 443 130.044 4.374 -4.335 56 HD1 HIS 443 HD1 HIS 443 128.762 3.464 -2.431 57 HD2 HIS 443 HD2 HIS 443 130.971 0.513 -4.351 58 HE1 HIS 443 HE1 HIS 443 128.174 1.317 -1.262 59 HE2 HIS 443 HE2 HIS 443 129.590 -0.440 -2.382 60 H SER 444 H SER 444 127.953 2.825 -5.776 61 HA SER 444 HA SER 444 126.042 3.953 -6.302 62 HB2 SER 444 HB2 SER 444 127.408 5.990 -5.608 63 HB3 SER 444 HB3 SER 444 127.738 6.233 -7.324 64 HG SER 444 HG SER 444 125.115 5.834 -6.967 65 H ASN 445 H ASN 445 124.720 3.839 -8.040 66 HA ASN 445 HA ASN 445 125.973 3.708 -10.702 67 HB2 ASN 445 HB2 ASN 445 124.313 1.716 -9.303 68 HB3 ASN 445 HB3 ASN 445 123.816 2.049 -10.958 69 HD21 ASN 445 HD21 ASN 445 125.744 0.171 -9.068 70 HD22 ASN 445 HD22 ASN 445 126.887 -0.352 -10.254 71 H ALA 446 H ALA 446 124.047 3.679 -12.411 72 HA ALA 446 HA ALA 446 122.458 6.065 -11.796 73 HB1 ALA 446 HB1 ALA 446 124.031 5.636 -13.925 74 HB2 ALA 446 HB2 ALA 446 122.610 6.680 -13.966 75 HB3 ALA 446 HB3 ALA 446 122.505 5.022 -14.559 76 H THR 447 H THR 447 120.955 4.778 -10.522 77 HA THR 447 HA THR 447 119.010 3.363 -12.226 78 HB THR 447 HB THR 447 119.040 2.708 -9.341 79 HG1 THR 447 HG1 THR 447 120.730 0.996 -10.325 80 HG21 THR 447 HG21 THR 447 119.089 0.624 -11.423 81 HG22 THR 447 HG22 THR 447 117.727 1.742 -11.494 82 HG23 THR 447 HG23 THR 447 118.026 0.811 -10.027 83 H GLY 448 H GLY 448 116.839 3.768 -11.883 84 HA2 GLY 448 HA2 GLY 448 116.258 6.284 -10.564 85 HA3 GLY 448 HA3 GLY 448 115.153 5.342 -11.551 86 HA PRO 449 HA PRO 449 113.151 4.635 -7.610 87 HB2 PRO 449 HB2 PRO 449 111.272 2.899 -8.597 88 HB3 PRO 449 HB3 PRO 449 111.140 4.657 -8.700 89 HG2 PRO 449 HG2 PRO 449 112.086 2.705 -10.765 90 HG3 PRO 449 HG3 PRO 449 111.011 4.104 -10.957 91 HD2 PRO 449 HD2 PRO 449 113.596 4.223 -11.656 92 HD3 PRO 449 HD3 PRO 449 112.771 5.617 -10.924 93 H GLN 450 H GLN 450 113.373 3.120 -6.049 94 HA GLN 450 HA GLN 450 113.973 0.360 -6.763 95 HB2 GLN 450 HB2 GLN 450 115.936 2.264 -5.709 96 HB3 GLN 450 HB3 GLN 450 115.813 0.790 -4.760 97 HG2 GLN 450 HG2 GLN 450 116.219 0.811 -7.737 98 HG3 GLN 450 HG3 GLN 450 117.541 0.775 -6.573 99 HE21 GLN 450 HE21 GLN 450 118.283 -1.155 -6.084 100 HE22 GLN 450 HE22 GLN 450 117.417 -2.645 -6.206 101 H PHE 451 H PHE 451 111.690 0.555 -5.839 102 HA PHE 451 HA PHE 451 111.117 1.129 -3.205 103 HB2 PHE 451 HB2 PHE 451 109.147 -0.222 -3.440 104 HB3 PHE 451 HB3 PHE 451 109.453 0.559 -4.987 105 HD1 PHE 451 HD1 PHE 451 109.312 -0.712 -6.888 106 HD2 PHE 451 HD2 PHE 451 110.226 -2.633 -3.199 107 HE1 PHE 451 HE1 PHE 451 109.220 -2.901 -8.008 108 HE2 PHE 451 HE2 PHE 451 110.138 -4.823 -4.314 109 HZ PHE 451 HZ PHE 451 109.631 -4.960 -6.722 110 H VAL 452 H VAL 452 111.393 0.159 -1.276 111 HA VAL 452 HA VAL 452 113.337 -1.880 -1.012 112 HB VAL 452 HB VAL 452 113.083 -0.281 0.760 113 HG11 VAL 452 HG11 VAL 452 110.255 -1.005 0.531 114 HG12 VAL 452 HG12 VAL 452 111.005 0.503 1.059 115 HG13 VAL 452 HG13 VAL 452 110.834 -0.839 2.190 116 HG21 VAL 452 HG21 VAL 452 112.465 -3.130 1.409 117 HG22 VAL 452 HG22 VAL 452 112.553 -1.933 2.701 118 HG23 VAL 452 HG23 VAL 452 113.952 -2.217 1.665 119 H SER 453 H SER 453 113.006 -3.883 -1.610 120 HA SER 453 HA SER 453 110.530 -5.113 -1.993 121 HB2 SER 453 HB2 SER 453 111.769 -6.683 -2.989 122 HB3 SER 453 HB3 SER 453 113.173 -5.697 -2.578 123 HG SER 453 HG SER 453 113.722 -7.465 -1.548 124 H GLY 454 H GLY 454 109.368 -6.622 -0.914 125 HA2 GLY 454 HA2 GLY 454 108.497 -7.807 0.831 126 HA3 GLY 454 HA3 GLY 454 110.127 -7.922 1.459 127 H VAL 455 H VAL 455 108.475 -4.831 1.015 128 HA VAL 455 HA VAL 455 108.355 -4.609 3.949 129 HB VAL 455 HB VAL 455 108.677 -2.258 3.783 130 HG11 VAL 455 HG11 VAL 455 110.666 -2.896 1.749 131 HG12 VAL 455 HG12 VAL 455 110.588 -4.073 3.056 132 HG13 VAL 455 HG13 VAL 455 110.882 -2.373 3.417 133 HG21 VAL 455 HG21 VAL 455 108.607 -2.533 0.781 134 HG22 VAL 455 HG22 VAL 455 108.799 -1.044 1.701 135 HG23 VAL 455 HG23 VAL 455 107.278 -1.928 1.766 136 H ILE 456 H ILE 456 106.455 -5.157 1.354 137 HA ILE 456 HA ILE 456 104.250 -3.420 2.105 138 HB ILE 456 HB ILE 456 104.449 -5.533 -0.040 139 HG12 ILE 456 HG12 ILE 456 105.766 -3.820 -0.843 140 HG13 ILE 456 HG13 ILE 456 104.187 -3.307 -1.419 141 HG21 ILE 456 HG21 ILE 456 102.166 -5.372 0.613 142 HG22 ILE 456 HG22 ILE 456 102.350 -4.462 -0.887 143 HG23 ILE 456 HG23 ILE 456 102.241 -3.610 0.653 144 HD11 ILE 456 HD11 ILE 456 105.360 -1.428 -0.500 145 HD12 ILE 456 HD12 ILE 456 105.622 -2.290 1.015 146 HD13 ILE 456 HD13 ILE 456 103.991 -1.823 0.537 147 H VAL 457 H VAL 457 103.652 -4.132 4.112 148 HA VAL 457 HA VAL 457 103.086 -6.902 4.637 149 HB VAL 457 HB VAL 457 102.717 -4.383 6.244 150 HG11 VAL 457 HG11 VAL 457 101.998 -5.782 8.126 151 HG12 VAL 457 HG12 VAL 457 101.954 -7.186 7.059 152 HG13 VAL 457 HG13 VAL 457 100.847 -5.838 6.791 153 HG21 VAL 457 HG21 VAL 457 104.887 -6.048 5.828 154 HG22 VAL 457 HG22 VAL 457 104.254 -6.556 7.394 155 HG23 VAL 457 HG23 VAL 457 104.704 -4.871 7.129 156 H LYS 458 H LYS 458 101.370 -7.803 3.689 157 HA LYS 458 HA LYS 458 99.000 -6.332 3.027 158 HB2 LYS 458 HB2 LYS 458 99.774 -8.232 1.659 159 HB3 LYS 458 HB3 LYS 458 99.497 -9.317 3.014 160 HG2 LYS 458 HG2 LYS 458 97.135 -8.936 2.919 161 HG3 LYS 458 HG3 LYS 458 97.344 -7.674 1.703 162 HD2 LYS 458 HD2 LYS 458 98.147 -9.294 0.102 163 HD3 LYS 458 HD3 LYS 458 98.096 -10.570 1.320 164 HE2 LYS 458 HE2 LYS 458 95.586 -9.920 1.511 165 HE3 LYS 458 HE3 LYS 458 95.841 -9.184 -0.070 166 HZ1 LYS 458 HZ1 LYS 458 96.658 -11.973 0.420 167 HZ2 LYS 458 HZ2 LYS 458 96.267 -11.219 -1.043 168 HZ3 LYS 458 HZ3 LYS 458 95.045 -11.608 0.059 169 H ILE 459 H ILE 459 97.370 -5.886 4.340 170 HA ILE 459 HA ILE 459 97.006 -7.559 6.734 171 HB ILE 459 HB ILE 459 96.070 -4.708 6.505 172 HG12 ILE 459 HG12 ILE 459 98.706 -5.827 7.432 173 HG13 ILE 459 HG13 ILE 459 98.406 -4.463 6.359 174 HG21 ILE 459 HG21 ILE 459 96.615 -6.324 8.982 175 HG22 ILE 459 HG22 ILE 459 95.050 -6.344 8.170 176 HG23 ILE 459 HG23 ILE 459 95.684 -4.834 8.826 177 HD11 ILE 459 HD11 ILE 459 97.680 -4.440 9.271 178 HD12 ILE 459 HD12 ILE 459 97.762 -3.075 8.157 179 HD13 ILE 459 HD13 ILE 459 99.241 -3.897 8.656 180 H ILE 460 H ILE 460 95.229 -8.674 6.858 181 HA ILE 460 HA ILE 460 92.812 -7.713 5.494 182 HB ILE 460 HB ILE 460 93.937 -9.535 4.147 183 HG12 ILE 460 HG12 ILE 460 91.857 -10.605 3.593 184 HG13 ILE 460 HG13 ILE 460 91.191 -10.254 5.184 185 HG21 ILE 460 HG21 ILE 460 94.788 -11.068 5.646 186 HG22 ILE 460 HG22 ILE 460 93.322 -11.875 5.089 187 HG23 ILE 460 HG23 ILE 460 93.338 -11.053 6.650 188 HD11 ILE 460 HD11 ILE 460 90.488 -8.821 3.154 189 HD12 ILE 460 HD12 ILE 460 92.043 -8.023 3.397 190 HD13 ILE 460 HD13 ILE 460 90.843 -8.031 4.690 191 H SER 461 H SER 461 90.958 -7.945 6.659 192 HA SER 461 HA SER 461 91.158 -9.471 9.167 193 HB2 SER 461 HB2 SER 461 91.309 -7.077 9.662 194 HB3 SER 461 HB3 SER 461 89.810 -6.791 8.788 195 HG SER 461 HG SER 461 88.899 -7.148 10.642 196 H THR 462 H THR 462 88.537 -8.902 10.009 197 HA THR 462 HA THR 462 86.824 -9.996 7.898 198 HB THR 462 HB THR 462 85.856 -11.632 9.544 199 HG1 THR 462 HG1 THR 462 87.012 -10.519 11.386 200 HG21 THR 462 HG21 THR 462 87.128 -12.771 8.039 201 HG22 THR 462 HG22 THR 462 88.085 -13.083 9.486 202 HG23 THR 462 HG23 THR 462 88.572 -11.812 8.365 203 H GLU 463 H GLU 463 87.252 -7.547 9.836 204 HA GLU 463 HA GLU 463 84.860 -6.354 9.739 205 HB2 GLU 463 HB2 GLU 463 83.610 -8.018 10.793 206 HB3 GLU 463 HB3 GLU 463 84.868 -8.362 11.968 207 HG2 GLU 463 HG2 GLU 463 83.255 -7.292 13.224 208 HG3 GLU 463 HG3 GLU 463 84.380 -5.989 12.853 209 HA PRO 464 HA PRO 464 87.139 -5.028 14.052 210 HB2 PRO 464 HB2 PRO 464 89.674 -6.172 12.937 211 HB3 PRO 464 HB3 PRO 464 89.201 -5.925 14.622 212 HG2 PRO 464 HG2 PRO 464 89.044 -8.338 13.421 213 HG3 PRO 464 HG3 PRO 464 87.911 -7.823 14.681 214 HD2 PRO 464 HD2 PRO 464 87.443 -8.227 11.817 215 HD3 PRO 464 HD3 PRO 464 86.272 -8.081 13.139 216 H LEU 465 H LEU 465 88.982 -5.296 11.002 217 HA LEU 465 HA LEU 465 90.437 -3.094 10.844 218 HB2 LEU 465 HB2 LEU 465 89.195 -4.747 8.949 219 HB3 LEU 465 HB3 LEU 465 88.826 -3.106 8.453 220 HG LEU 465 HG LEU 465 91.646 -3.598 9.163 221 HD11 LEU 465 HD11 LEU 465 90.347 -4.902 6.782 222 HD12 LEU 465 HD12 LEU 465 91.285 -5.673 8.060 223 HD13 LEU 465 HD13 LEU 465 92.080 -4.599 6.908 224 HD21 LEU 465 HD21 LEU 465 90.262 -2.246 6.850 225 HD22 LEU 465 HD22 LEU 465 91.998 -2.227 7.160 226 HD23 LEU 465 HD23 LEU 465 90.892 -1.457 8.297 227 HA PRO 466 HA PRO 466 87.251 -0.049 12.021 228 HB2 PRO 466 HB2 PRO 466 89.030 1.698 13.091 229 HB3 PRO 466 HB3 PRO 466 88.403 0.302 13.975 230 HG2 PRO 466 HG2 PRO 466 91.002 0.601 12.511 231 HG3 PRO 466 HG3 PRO 466 90.696 -0.105 14.109 232 HD2 PRO 466 HD2 PRO 466 91.034 -1.622 11.908 233 HD3 PRO 466 HD3 PRO 466 89.932 -2.094 13.217 234 H GLY 467 H GLY 467 90.374 0.590 10.450 235 HA2 GLY 467 HA2 GLY 467 89.505 1.740 8.155 236 HA3 GLY 467 HA3 GLY 467 89.431 3.069 9.302 237 H ARG 468 H ARG 468 91.012 3.596 7.312 238 HA ARG 468 HA ARG 468 93.638 2.608 7.373 239 HB2 ARG 468 HB2 ARG 468 94.208 4.454 5.976 240 HB3 ARG 468 HB3 ARG 468 92.574 3.970 5.540 241 HG2 ARG 468 HG2 ARG 468 91.779 5.800 7.117 242 HG3 ARG 468 HG3 ARG 468 93.450 6.369 7.113 243 HD2 ARG 468 HD2 ARG 468 93.331 7.119 4.979 244 HD3 ARG 468 HD3 ARG 468 92.237 5.833 4.473 245 HE ARG 468 HE ARG 468 90.440 7.161 5.047 246 HH11 ARG 468 HH11 ARG 468 93.407 8.609 6.159 247 HH12 ARG 468 HH12 ARG 468 92.669 10.125 6.557 248 HH21 ARG 468 HH21 ARG 468 89.461 9.155 5.564 249 HH22 ARG 468 HH22 ARG 468 90.427 10.434 6.220 250 H LYS 469 H LYS 469 92.139 5.367 9.015 251 HA LYS 469 HA LYS 469 94.485 6.407 10.167 252 HB2 LYS 469 HB2 LYS 469 93.085 7.767 11.485 253 HB3 LYS 469 HB3 LYS 469 92.199 7.520 9.988 254 HG2 LYS 469 HG2 LYS 469 90.994 5.633 11.195 255 HG3 LYS 469 HG3 LYS 469 91.698 6.285 12.675 256 HD2 LYS 469 HD2 LYS 469 90.444 8.207 12.589 257 HD3 LYS 469 HD3 LYS 469 90.274 8.143 10.834 258 HE2 LYS 469 HE2 LYS 469 88.474 6.754 10.921 259 HE3 LYS 469 HE3 LYS 469 89.025 5.956 12.393 260 HZ1 LYS 469 HZ1 LYS 469 88.376 7.934 13.645 261 HZ2 LYS 469 HZ2 LYS 469 87.059 7.266 12.821 262 HZ3 LYS 469 HZ3 LYS 469 87.809 8.661 12.226 263 H GLN 470 H GLN 470 92.105 4.091 11.406 264 HA GLN 470 HA GLN 470 93.418 3.790 13.925 265 HB2 GLN 470 HB2 GLN 470 91.139 2.458 12.534 266 HB3 GLN 470 HB3 GLN 470 91.863 1.660 13.925 267 HG2 GLN 470 HG2 GLN 470 91.539 4.006 15.045 268 HG3 GLN 470 HG3 GLN 470 90.327 4.204 13.779 269 HE21 GLN 470 HE21 GLN 470 88.372 3.754 14.470 270 HE22 GLN 470 HE22 GLN 470 87.942 2.515 15.595 271 H VAL 471 H VAL 471 93.306 1.879 10.936 272 HA VAL 471 HA VAL 471 94.846 -0.289 11.882 273 HB VAL 471 HB VAL 471 94.637 0.724 9.041 274 HG11 VAL 471 HG11 VAL 471 95.611 -1.845 10.244 275 HG12 VAL 471 HG12 VAL 471 96.413 -0.796 9.075 276 HG13 VAL 471 HG13 VAL 471 95.024 -1.766 8.584 277 HG21 VAL 471 HG21 VAL 471 93.042 -1.585 9.973 278 HG22 VAL 471 HG22 VAL 471 92.647 -0.331 8.798 279 HG23 VAL 471 HG23 VAL 471 92.528 0.009 10.524 280 H ARG 472 H ARG 472 95.740 2.700 10.194 281 HA ARG 472 HA ARG 472 98.490 2.135 9.959 282 HB2 ARG 472 HB2 ARG 472 98.778 4.463 9.456 283 HB3 ARG 472 HB3 ARG 472 97.271 3.935 8.721 284 HG2 ARG 472 HG2 ARG 472 96.027 4.919 10.588 285 HG3 ARG 472 HG3 ARG 472 97.546 5.475 11.292 286 HD2 ARG 472 HD2 ARG 472 97.812 6.513 8.847 287 HD3 ARG 472 HD3 ARG 472 96.051 6.484 8.941 288 HE ARG 472 HE ARG 472 97.206 7.619 11.281 289 HH11 ARG 472 HH11 ARG 472 96.415 8.299 7.958 290 HH12 ARG 472 HH12 ARG 472 96.243 10.004 8.214 291 HH21 ARG 472 HH21 ARG 472 96.984 9.858 11.627 292 HH22 ARG 472 HH22 ARG 472 96.566 10.890 10.301 293 H ASP 473 H ASP 473 96.576 3.706 12.473 294 HA ASP 473 HA ASP 473 98.729 4.549 14.087 295 HB2 ASP 473 HB2 ASP 473 95.805 4.139 14.478 296 HB3 ASP 473 HB3 ASP 473 96.812 4.281 15.916 297 H THR 474 H THR 474 96.909 1.539 13.929 298 HA THR 474 HA THR 474 97.940 0.356 16.276 299 HB THR 474 HB THR 474 97.400 -1.823 14.847 300 HG1 THR 474 HG1 THR 474 95.653 0.010 13.591 301 HG21 THR 474 HG21 THR 474 96.078 -1.415 16.723 302 HG22 THR 474 HG22 THR 474 94.920 -1.376 15.393 303 HG23 THR 474 HG23 THR 474 95.503 0.132 16.098 304 H LEU 475 H LEU 475 98.814 -0.163 12.864 305 HA LEU 475 HA LEU 475 101.048 -1.802 13.412 306 HB2 LEU 475 HB2 LEU 475 101.691 -1.250 11.042 307 HB3 LEU 475 HB3 LEU 475 100.092 -1.940 11.252 308 HG LEU 475 HG LEU 475 99.515 0.716 11.343 309 HD11 LEU 475 HD11 LEU 475 100.740 1.689 9.378 310 HD12 LEU 475 HD12 LEU 475 101.882 0.352 9.520 311 HD13 LEU 475 HD13 LEU 475 101.700 1.500 10.845 312 HD21 LEU 475 HD21 LEU 475 99.726 -0.839 8.775 313 HD22 LEU 475 HD22 LEU 475 98.563 0.418 9.194 314 HD23 LEU 475 HD23 LEU 475 98.491 -1.152 9.993 315 H ALA 476 H ALA 476 100.688 1.668 12.840 316 HA ALA 476 HA ALA 476 103.470 2.240 12.895 317 HB1 ALA 476 HB1 ALA 476 101.508 3.678 11.988 318 HB2 ALA 476 HB2 ALA 476 102.901 4.472 12.722 319 HB3 ALA 476 HB3 ALA 476 101.411 4.271 13.645 320 H ALA 477 H ALA 477 101.054 1.758 15.332 321 HA ALA 477 HA ALA 477 102.462 3.080 17.442 322 HB1 ALA 477 HB1 ALA 477 100.268 1.013 17.593 323 HB2 ALA 477 HB2 ALA 477 100.050 2.764 17.581 324 HB3 ALA 477 HB3 ALA 477 100.861 1.986 18.939 325 H ILE 478 H ILE 478 102.455 -0.110 16.045 326 HA ILE 478 HA ILE 478 103.957 -1.297 18.210 327 HB ILE 478 HB ILE 478 103.090 -2.280 15.505 328 HG12 ILE 478 HG12 ILE 478 102.469 -4.004 17.696 329 HG13 ILE 478 HG13 ILE 478 102.037 -2.358 18.148 330 HG21 ILE 478 HG21 ILE 478 105.175 -3.417 17.299 331 HG22 ILE 478 HG22 ILE 478 105.091 -3.396 15.537 332 HG23 ILE 478 HG23 ILE 478 104.088 -4.521 16.454 333 HD11 ILE 478 HD11 ILE 478 101.010 -2.485 15.653 334 HD12 ILE 478 HD12 ILE 478 100.111 -2.853 17.126 335 HD13 ILE 478 HD13 ILE 478 100.828 -4.159 16.180 336 H SER 479 H SER 479 104.617 0.153 15.097 337 HA SER 479 HA SER 479 107.377 0.507 15.757 338 HB2 SER 479 HB2 SER 479 108.099 -1.463 14.919 339 HB3 SER 479 HB3 SER 479 106.580 -1.764 14.077 340 HG SER 479 HG SER 479 108.246 -1.470 12.585 341 H GLU 480 H GLU 480 108.558 1.672 14.025 342 HA GLU 480 HA GLU 480 106.890 3.720 12.932 343 HB2 GLU 480 HB2 GLU 480 108.857 4.859 12.418 344 HB3 GLU 480 HB3 GLU 480 109.297 3.923 13.839 345 HG2 GLU 480 HG2 GLU 480 110.256 2.202 12.302 346 HG3 GLU 480 HG3 GLU 480 109.978 3.327 10.974 347 H VAL 481 H VAL 481 105.708 3.393 11.179 348 HA VAL 481 HA VAL 481 106.771 1.717 9.010 349 HB VAL 481 HB VAL 481 104.396 1.792 8.153 350 HG11 VAL 481 HG11 VAL 481 103.863 0.496 10.622 351 HG12 VAL 481 HG12 VAL 481 105.566 0.252 10.229 352 HG13 VAL 481 HG13 VAL 481 104.316 -0.223 9.077 353 HG21 VAL 481 HG21 VAL 481 103.331 2.409 10.803 354 HG22 VAL 481 HG22 VAL 481 102.769 2.912 9.209 355 HG23 VAL 481 HG23 VAL 481 104.080 3.788 9.999 356 H LEU 482 H LEU 482 106.386 2.413 6.801 357 HA LEU 482 HA LEU 482 107.054 5.199 6.479 358 HB2 LEU 482 HB2 LEU 482 108.256 3.692 5.105 359 HB3 LEU 482 HB3 LEU 482 106.791 2.885 4.577 360 HG LEU 482 HG LEU 482 106.332 5.409 3.673 361 HD11 LEU 482 HD11 LEU 482 108.366 6.230 2.635 362 HD12 LEU 482 HD12 LEU 482 109.292 4.920 3.369 363 HD13 LEU 482 HD13 LEU 482 108.558 6.159 4.387 364 HD21 LEU 482 HD21 LEU 482 106.736 4.533 1.508 365 HD22 LEU 482 HD22 LEU 482 106.187 3.183 2.500 366 HD23 LEU 482 HD23 LEU 482 107.900 3.361 2.123 367 H TYR 483 H TYR 483 104.737 3.235 4.630 368 HA TYR 483 HA TYR 483 102.660 5.237 5.100 369 HB2 TYR 483 HB2 TYR 483 103.662 6.154 3.152 370 HB3 TYR 483 HB3 TYR 483 103.797 4.573 2.391 371 HD1 TYR 483 HD1 TYR 483 101.587 3.361 1.824 372 HD2 TYR 483 HD2 TYR 483 101.832 7.517 2.696 373 HE1 TYR 483 HE1 TYR 483 99.433 3.719 0.695 374 HE2 TYR 483 HE2 TYR 483 99.678 7.887 1.568 375 HH TYR 483 HH TYR 483 98.380 6.336 -0.467 376 H VAL 484 H VAL 484 100.588 4.484 4.944 377 HA VAL 484 HA VAL 484 100.324 1.594 4.491 378 HB VAL 484 HB VAL 484 98.259 3.292 5.860 379 HG11 VAL 484 HG11 VAL 484 97.995 0.989 7.042 380 HG12 VAL 484 HG12 VAL 484 98.882 0.376 5.646 381 HG13 VAL 484 HG13 VAL 484 97.348 1.216 5.417 382 HG21 VAL 484 HG21 VAL 484 99.946 1.811 7.685 383 HG22 VAL 484 HG22 VAL 484 99.457 3.506 7.726 384 HG23 VAL 484 HG23 VAL 484 100.866 3.017 6.784 385 H ASP 485 H ASP 485 99.509 1.034 2.591 386 HA ASP 485 HA ASP 485 97.733 2.900 1.192 387 HB2 ASP 485 HB2 ASP 485 99.794 2.010 0.053 388 HB3 ASP 485 HB3 ASP 485 99.043 0.418 0.074 389 H LEU 486 H LEU 486 95.805 2.493 2.227 390 HA LEU 486 HA LEU 486 94.770 -0.233 2.268 391 HB2 LEU 486 HB2 LEU 486 94.464 1.148 4.257 392 HB3 LEU 486 HB3 LEU 486 93.600 2.345 3.309 393 HG LEU 486 HG LEU 486 92.398 -0.289 3.070 394 HD11 LEU 486 HD11 LEU 486 93.461 -0.032 5.510 395 HD12 LEU 486 HD12 LEU 486 91.921 -0.839 5.209 396 HD13 LEU 486 HD13 LEU 486 91.946 0.835 5.763 397 HD21 LEU 486 HD21 LEU 486 91.666 2.406 2.960 398 HD22 LEU 486 HD22 LEU 486 90.799 1.736 4.341 399 HD23 LEU 486 HD23 LEU 486 90.621 1.002 2.747 400 H LEU 487 H LEU 487 93.379 -1.016 0.809 401 HA LEU 487 HA LEU 487 92.752 0.380 -1.543 402 HB2 LEU 487 HB2 LEU 487 91.676 -2.136 -0.308 403 HB3 LEU 487 HB3 LEU 487 91.037 -1.519 -1.820 404 HG LEU 487 HG LEU 487 93.739 -1.538 -2.301 405 HD11 LEU 487 HD11 LEU 487 93.040 -3.826 -0.482 406 HD12 LEU 487 HD12 LEU 487 94.373 -2.680 -0.338 407 HD13 LEU 487 HD13 LEU 487 94.384 -3.889 -1.622 408 HD21 LEU 487 HD21 LEU 487 92.575 -2.384 -4.037 409 HD22 LEU 487 HD22 LEU 487 91.414 -3.209 -2.997 410 HD23 LEU 487 HD23 LEU 487 92.994 -3.929 -3.299 411 H GLU 488 H GLU 488 91.719 2.304 -1.191 412 HA GLU 488 HA GLU 488 89.797 3.052 0.530 413 HB2 GLU 488 HB2 GLU 488 90.812 4.416 -1.347 414 HB3 GLU 488 HB3 GLU 488 89.592 3.717 -2.404 415 HG2 GLU 488 HG2 GLU 488 88.405 5.525 -1.849 416 HG3 GLU 488 HG3 GLU 488 88.047 4.619 -0.379 417 H GLY 489 H GLY 489 87.950 2.179 1.160 418 HA2 GLY 489 HA2 GLY 489 85.769 1.411 0.980 419 HA3 GLY 489 HA3 GLY 489 85.945 1.415 -0.768 420 H ASP 490 H ASP 490 88.463 -0.210 0.807 421 HA ASP 490 HA ASP 490 87.140 -2.794 0.308 422 HB2 ASP 490 HB2 ASP 490 89.349 -1.797 -1.017 423 HB3 ASP 490 HB3 ASP 490 90.058 -2.844 0.207 424 H THR 491 H THR 491 87.960 -4.596 1.563 425 HA THR 491 HA THR 491 88.447 -3.789 4.323 426 HB THR 491 HB THR 491 88.227 -6.542 4.338 427 HG1 THR 491 HG1 THR 491 86.188 -5.639 2.595 428 HG21 THR 491 HG21 THR 491 86.269 -6.179 5.505 429 HG22 THR 491 HG22 THR 491 85.777 -4.839 4.470 430 HG23 THR 491 HG23 THR 491 87.063 -4.612 5.653 431 H GLU 492 H GLU 492 90.476 -4.124 1.948 432 HA GLU 492 HA GLU 492 92.467 -5.574 3.555 433 HB2 GLU 492 HB2 GLU 492 93.035 -5.643 0.708 434 HB3 GLU 492 HB3 GLU 492 92.985 -6.959 1.874 435 HG2 GLU 492 HG2 GLU 492 90.702 -7.333 1.526 436 HG3 GLU 492 HG3 GLU 492 90.481 -5.774 0.732 437 H CYS 493 H CYS 493 94.257 -4.472 3.996 438 HA CYS 493 HA CYS 493 94.968 -2.172 2.302 439 HB2 CYS 493 HB2 CYS 493 95.914 -1.365 4.696 440 HB3 CYS 493 HB3 CYS 493 94.314 -0.938 4.100 441 HG CYS 493 HG CYS 493 94.253 -1.892 6.586 442 H HIS 494 H HIS 494 97.188 -1.782 2.041 443 HA HIS 494 HA HIS 494 98.958 -3.899 3.076 444 HB2 HIS 494 HB2 HIS 494 99.083 -2.575 0.360 445 HB3 HIS 494 HB3 HIS 494 100.215 -3.780 0.964 446 HD1 HIS 494 HD1 HIS 494 96.405 -3.698 0.778 447 HD2 HIS 494 HD2 HIS 494 99.626 -6.115 -0.245 448 HE1 HIS 494 HE1 HIS 494 95.398 -5.770 -0.233 449 HE2 HIS 494 HE2 HIS 494 97.366 -7.217 -0.849 450 H ALA 495 H ALA 495 100.017 -2.855 4.686 451 HA ALA 495 HA ALA 495 100.896 -0.131 4.384 452 HB1 ALA 495 HB1 ALA 495 100.156 -0.840 6.560 453 HB2 ALA 495 HB2 ALA 495 101.871 -0.433 6.636 454 HB3 ALA 495 HB3 ALA 495 101.366 -2.123 6.594 455 H ARG 496 H ARG 496 102.739 0.514 3.523 456 HA ARG 496 HA ARG 496 104.813 -1.445 2.926 457 HB2 ARG 496 HB2 ARG 496 105.201 1.372 2.127 458 HB3 ARG 496 HB3 ARG 496 105.419 -0.105 1.195 459 HG2 ARG 496 HG2 ARG 496 102.795 -0.172 1.298 460 HG3 ARG 496 HG3 ARG 496 102.987 1.560 1.577 461 HD2 ARG 496 HD2 ARG 496 104.714 0.938 -0.536 462 HD3 ARG 496 HD3 ARG 496 103.224 0.058 -0.869 463 HE ARG 496 HE ARG 496 102.099 2.075 -1.111 464 HH11 ARG 496 HH11 ARG 496 105.388 2.603 -0.086 465 HH12 ARG 496 HH12 ARG 496 105.365 4.296 -0.449 466 HH21 ARG 496 HH21 ARG 496 102.061 4.304 -1.587 467 HH22 ARG 496 HH22 ARG 496 103.475 5.263 -1.300 468 H PHE 497 H PHE 497 106.827 -1.449 3.797 469 HA PHE 497 HA PHE 497 107.327 0.503 5.949 470 HB2 PHE 497 HB2 PHE 497 108.291 -2.342 5.613 471 HB3 PHE 497 HB3 PHE 497 108.884 -1.251 6.862 472 HD1 PHE 497 HD1 PHE 497 105.499 -2.083 5.527 473 HD2 PHE 497 HD2 PHE 497 108.052 -1.806 8.921 474 HE1 PHE 497 HE1 PHE 497 103.630 -2.743 6.982 475 HE2 PHE 497 HE2 PHE 497 106.187 -2.469 10.382 476 HZ PHE 497 HZ PHE 497 103.971 -2.938 9.413 477 H LYS 498 H LYS 498 109.379 1.425 6.168 478 HA LYS 498 HA LYS 498 110.711 1.985 3.734 479 HB2 LYS 498 HB2 LYS 498 111.913 3.542 4.922 480 HB3 LYS 498 HB3 LYS 498 110.523 3.350 5.981 481 HG2 LYS 498 HG2 LYS 498 112.094 1.474 7.034 482 HG3 LYS 498 HG3 LYS 498 113.338 2.536 6.374 483 HD2 LYS 498 HD2 LYS 498 112.009 4.425 7.538 484 HD3 LYS 498 HD3 LYS 498 111.268 3.116 8.462 485 HE2 LYS 498 HE2 LYS 498 114.217 3.083 8.246 486 HE3 LYS 498 HE3 LYS 498 113.513 4.372 9.222 487 HZ1 LYS 498 HZ1 LYS 498 113.143 1.451 9.588 488 HZ2 LYS 498 HZ2 LYS 498 112.276 2.624 10.442 489 HZ3 LYS 498 HZ3 LYS 498 113.954 2.515 10.624 490 H THR 499 H THR 499 111.046 -0.526 6.031 491 HA THR 499 HA THR 499 113.376 -1.537 4.582 492 HB THR 499 HB THR 499 113.957 -2.340 7.143 493 HG1 THR 499 HG1 THR 499 112.359 -0.431 7.610 494 HG21 THR 499 HG21 THR 499 115.936 -1.560 6.491 495 HG22 THR 499 HG22 THR 499 115.351 0.102 6.566 496 HG23 THR 499 HG23 THR 499 115.146 -0.840 5.088 497 HA PRO 500 HA PRO 500 111.213 -5.362 4.898 498 HB2 PRO 500 HB2 PRO 500 113.226 -7.115 4.560 499 HB3 PRO 500 HB3 PRO 500 112.674 -6.061 3.253 500 HG2 PRO 500 HG2 PRO 500 115.036 -5.747 5.064 501 HG3 PRO 500 HG3 PRO 500 114.930 -5.496 3.312 502 HD2 PRO 500 HD2 PRO 500 114.834 -3.462 5.127 503 HD3 PRO 500 HD3 PRO 500 114.032 -3.394 3.545 504 H GLU 501 H GLU 501 114.210 -5.186 6.808 505 HA GLU 501 HA GLU 501 113.566 -7.283 8.580 506 HB2 GLU 501 HB2 GLU 501 115.317 -6.258 10.048 507 HB3 GLU 501 HB3 GLU 501 115.848 -6.577 8.402 508 HG2 GLU 501 HG2 GLU 501 115.341 -4.163 7.895 509 HG3 GLU 501 HG3 GLU 501 115.133 -3.932 9.630 510 H ASP 502 H ASP 502 112.929 -3.823 8.639 511 HA ASP 502 HA ASP 502 112.072 -3.534 11.267 512 HB2 ASP 502 HB2 ASP 502 112.318 -1.831 9.219 513 HB3 ASP 502 HB3 ASP 502 110.575 -2.071 9.151 514 H ALA 503 H ALA 503 110.308 -4.646 8.417 515 HA ALA 503 HA ALA 503 107.765 -4.785 9.643 516 HB1 ALA 503 HB1 ALA 503 107.137 -6.220 7.746 517 HB2 ALA 503 HB2 ALA 503 108.832 -6.302 7.265 518 HB3 ALA 503 HB3 ALA 503 107.980 -4.759 7.229 519 H GLN 504 H GLN 504 110.398 -7.110 9.295 520 HA GLN 504 HA GLN 504 109.145 -9.421 10.162 521 HB2 GLN 504 HB2 GLN 504 111.401 -9.458 9.297 522 HB3 GLN 504 HB3 GLN 504 111.975 -8.473 10.636 523 HG2 GLN 504 HG2 GLN 504 111.403 -10.307 12.184 524 HG3 GLN 504 HG3 GLN 504 110.941 -11.294 10.797 525 HE21 GLN 504 HE21 GLN 504 112.938 -11.965 12.671 526 HE22 GLN 504 HE22 GLN 504 114.452 -12.019 11.842 527 H ALA 505 H ALA 505 110.549 -6.797 12.057 528 HA ALA 505 HA ALA 505 110.222 -8.006 14.586 529 HB1 ALA 505 HB1 ALA 505 111.126 -6.124 15.411 530 HB2 ALA 505 HB2 ALA 505 110.016 -5.079 14.525 531 HB3 ALA 505 HB3 ALA 505 111.436 -5.743 13.718 532 H VAL 506 H VAL 506 108.116 -5.909 12.665 533 HA VAL 506 HA VAL 506 106.138 -5.543 14.658 534 HB VAL 506 HB VAL 506 105.752 -5.395 11.669 535 HG11 VAL 506 HG11 VAL 506 103.856 -5.285 13.599 536 HG12 VAL 506 HG12 VAL 506 103.747 -4.449 12.049 537 HG13 VAL 506 HG13 VAL 506 104.307 -3.584 13.480 538 HG21 VAL 506 HG21 VAL 506 107.092 -3.573 13.590 539 HG22 VAL 506 HG22 VAL 506 106.074 -2.845 12.347 540 HG23 VAL 506 HG23 VAL 506 107.431 -3.873 11.886 541 H ILE 507 H ILE 507 106.415 -7.867 11.986 542 HA ILE 507 HA ILE 507 103.866 -9.016 12.296 543 HB ILE 507 HB ILE 507 104.825 -10.998 11.115 544 HG12 ILE 507 HG12 ILE 507 107.147 -10.494 10.090 545 HG13 ILE 507 HG13 ILE 507 107.336 -9.386 11.443 546 HG21 ILE 507 HG21 ILE 507 104.150 -8.538 10.164 547 HG22 ILE 507 HG22 ILE 507 104.476 -9.951 9.162 548 HG23 ILE 507 HG23 ILE 507 105.749 -8.767 9.459 549 HD11 ILE 507 HD11 ILE 507 106.425 -12.030 12.248 550 HD12 ILE 507 HD12 ILE 507 107.750 -11.049 12.870 551 HD13 ILE 507 HD13 ILE 507 107.990 -12.042 11.435 552 H ASN 508 H ASN 508 106.916 -9.646 13.888 553 HA ASN 508 HA ASN 508 106.120 -12.090 15.131 554 HB2 ASN 508 HB2 ASN 508 108.339 -10.119 15.638 555 HB3 ASN 508 HB3 ASN 508 108.066 -11.480 16.721 556 HD21 ASN 508 HD21 ASN 508 109.774 -10.460 14.120 557 HD22 ASN 508 HD22 ASN 508 110.177 -11.986 13.418 558 H ALA 509 H ALA 509 106.079 -8.706 16.043 559 HA ALA 509 HA ALA 509 105.114 -9.152 18.702 560 HB1 ALA 509 HB1 ALA 509 105.488 -6.715 17.004 561 HB2 ALA 509 HB2 ALA 509 106.326 -7.179 18.487 562 HB3 ALA 509 HB3 ALA 509 104.652 -6.627 18.555 563 H TYR 510 H TYR 510 103.657 -8.774 15.595 564 HA TYR 510 HA TYR 510 101.170 -7.757 16.302 565 HB2 TYR 510 HB2 TYR 510 102.344 -9.000 13.982 566 HB3 TYR 510 HB3 TYR 510 100.674 -9.521 14.202 567 HD1 TYR 510 HD1 TYR 510 99.627 -8.358 12.420 568 HD2 TYR 510 HD2 TYR 510 102.090 -6.254 15.177 569 HE1 TYR 510 HE1 TYR 510 98.834 -6.225 11.486 570 HE2 TYR 510 HE2 TYR 510 101.305 -4.111 14.249 571 HH TYR 510 HH TYR 510 99.815 -3.792 11.361 572 H THR 511 H THR 511 102.451 -10.808 17.128 573 HA THR 511 HA THR 511 100.305 -12.519 17.051 574 HB THR 511 HB THR 511 101.184 -13.612 19.051 575 HG1 THR 511 HG1 THR 511 101.703 -11.535 20.145 576 HG21 THR 511 HG21 THR 511 103.799 -13.081 18.117 577 HG22 THR 511 HG22 THR 511 102.715 -12.989 16.729 578 HG23 THR 511 HG23 THR 511 102.755 -14.446 17.721 579 H GLU 512 H GLU 512 100.946 -9.863 19.229 580 HA GLU 512 HA GLU 512 98.901 -10.277 21.089 581 HB2 GLU 512 HB2 GLU 512 100.642 -8.038 20.301 582 HB3 GLU 512 HB3 GLU 512 99.124 -7.562 21.047 583 HG2 GLU 512 HG2 GLU 512 99.814 -9.391 22.813 584 HG3 GLU 512 HG3 GLU 512 101.428 -9.034 22.200 585 H ILE 513 H ILE 513 98.785 -8.939 17.863 586 HA ILE 513 HA ILE 513 96.422 -7.469 18.011 587 HB ILE 513 HB ILE 513 97.329 -9.129 15.656 588 HG12 ILE 513 HG12 ILE 513 98.933 -7.364 16.777 589 HG13 ILE 513 HG13 ILE 513 98.775 -7.441 15.025 590 HG21 ILE 513 HG21 ILE 513 96.117 -7.386 14.349 591 HG22 ILE 513 HG22 ILE 513 95.492 -6.750 15.871 592 HG23 ILE 513 HG23 ILE 513 95.073 -8.385 15.361 593 HD11 ILE 513 HD11 ILE 513 96.987 -5.611 16.538 594 HD12 ILE 513 HD12 ILE 513 97.640 -5.464 14.905 595 HD13 ILE 513 HD13 ILE 513 98.675 -5.159 16.300 596 H ASN 514 H ASN 514 96.860 -10.931 17.247 597 HA ASN 514 HA ASN 514 94.225 -11.591 16.752 598 HB2 ASN 514 HB2 ASN 514 96.018 -13.165 16.344 599 HB3 ASN 514 HB3 ASN 514 96.394 -13.241 18.063 600 HD21 ASN 514 HD21 ASN 514 93.416 -13.461 16.145 601 HD22 ASN 514 HD22 ASN 514 92.881 -14.953 16.835 602 H LYS 515 H LYS 515 95.828 -11.033 19.807 603 HA LYS 515 HA LYS 515 93.878 -12.202 21.484 604 HB2 LYS 515 HB2 LYS 515 95.878 -9.997 21.999 605 HB3 LYS 515 HB3 LYS 515 94.877 -10.721 23.250 606 HG2 LYS 515 HG2 LYS 515 96.888 -12.184 21.552 607 HG3 LYS 515 HG3 LYS 515 97.129 -11.661 23.220 608 HD2 LYS 515 HD2 LYS 515 94.687 -13.179 22.947 609 HD3 LYS 515 HD3 LYS 515 96.073 -14.094 22.351 610 HE2 LYS 515 HE2 LYS 515 96.999 -14.282 24.403 611 HE3 LYS 515 HE3 LYS 515 96.473 -12.676 24.903 612 HZ1 LYS 515 HZ1 LYS 515 94.855 -15.161 24.846 613 HZ2 LYS 515 HZ2 LYS 515 94.192 -13.626 25.094 614 HZ3 LYS 515 HZ3 LYS 515 95.302 -14.254 26.204 615 H LYS 516 H LYS 516 94.083 -9.140 19.849 616 HA LYS 516 HA LYS 516 91.784 -8.104 21.328 617 HB2 LYS 516 HB2 LYS 516 93.993 -6.808 20.628 618 HB3 LYS 516 HB3 LYS 516 93.087 -6.551 19.144 619 HG2 LYS 516 HG2 LYS 516 92.794 -4.683 20.643 620 HG3 LYS 516 HG3 LYS 516 91.267 -5.545 20.443 621 HD2 LYS 516 HD2 LYS 516 92.979 -6.409 22.691 622 HD3 LYS 516 HD3 LYS 516 92.250 -4.809 22.833 623 HE2 LYS 516 HE2 LYS 516 90.163 -5.636 23.059 624 HE3 LYS 516 HE3 LYS 516 90.449 -6.949 21.917 625 HZ1 LYS 516 HZ1 LYS 516 91.574 -6.921 24.660 626 HZ2 LYS 516 HZ2 LYS 516 91.512 -8.221 23.581 627 HZ3 LYS 516 HZ3 LYS 516 90.088 -7.636 24.280 628 H HIS 517 H HIS 517 92.767 -8.987 18.048 629 HA HIS 517 HA HIS 517 90.045 -9.556 17.334 630 HB2 HIS 517 HB2 HIS 517 91.364 -7.482 15.610 631 HB3 HIS 517 HB3 HIS 517 89.664 -7.926 15.700 632 HD1 HIS 517 HD1 HIS 517 88.308 -6.975 17.744 633 HD2 HIS 517 HD2 HIS 517 92.170 -5.494 17.347 634 HE1 HIS 517 HE1 HIS 517 88.404 -4.941 19.221 635 HE2 HIS 517 HE2 HIS 517 90.737 -4.036 18.931 636 H CYS 518 H CYS 518 89.923 -11.035 15.721 637 HA CYS 518 HA CYS 518 92.215 -12.443 14.935 638 HB2 CYS 518 HB2 CYS 518 89.367 -12.621 14.499 639 HB3 CYS 518 HB3 CYS 518 90.229 -12.948 13.000 640 HG CYS 518 HG CYS 518 90.116 -15.214 14.097 641 H TRP 519 H TRP 519 93.541 -10.614 14.223 642 HA TRP 519 HA TRP 519 92.892 -9.610 11.540 643 HB2 TRP 519 HB2 TRP 519 93.801 -8.271 13.731 644 HB3 TRP 519 HB3 TRP 519 95.309 -8.596 12.877 645 HD1 TRP 519 HD1 TRP 519 93.080 -8.384 10.155 646 HE1 TRP 519 HE1 TRP 519 92.904 -6.032 9.173 647 HE3 TRP 519 HE3 TRP 519 95.134 -5.754 14.020 648 HZ2 TRP 519 HZ2 TRP 519 93.564 -3.367 9.937 649 HZ3 TRP 519 HZ3 TRP 519 95.329 -3.312 13.818 650 HH2 TRP 519 HH2 TRP 519 94.560 -2.146 11.816 651 H LYS 520 H LYS 520 94.223 -9.827 9.821 652 HA LYS 520 HA LYS 520 96.291 -11.905 10.073 653 HB2 LYS 520 HB2 LYS 520 95.097 -11.068 7.470 654 HB3 LYS 520 HB3 LYS 520 95.772 -12.625 7.927 655 HG2 LYS 520 HG2 LYS 520 93.189 -11.512 9.002 656 HG3 LYS 520 HG3 LYS 520 93.307 -12.631 7.640 657 HD2 LYS 520 HD2 LYS 520 93.621 -14.395 8.983 658 HD3 LYS 520 HD3 LYS 520 94.791 -13.529 9.982 659 HE2 LYS 520 HE2 LYS 520 92.589 -14.309 11.066 660 HE3 LYS 520 HE3 LYS 520 93.146 -12.665 11.380 661 HZ1 LYS 520 HZ1 LYS 520 90.682 -13.342 10.492 662 HZ2 LYS 520 HZ2 LYS 520 91.461 -12.883 9.062 663 HZ3 LYS 520 HZ3 LYS 520 91.376 -11.803 10.360 664 H LEU 521 H LEU 521 98.344 -11.399 9.668 665 HA LEU 521 HA LEU 521 98.928 -9.026 8.057 666 HB2 LEU 521 HB2 LEU 521 99.382 -7.936 9.971 667 HB3 LEU 521 HB3 LEU 521 99.478 -9.414 10.904 668 HG LEU 521 HG LEU 521 101.773 -8.969 9.123 669 HD11 LEU 521 HD11 LEU 521 100.858 -6.700 10.326 670 HD12 LEU 521 HD12 LEU 521 102.538 -7.013 9.888 671 HD13 LEU 521 HD13 LEU 521 101.981 -7.327 11.533 672 HD21 LEU 521 HD21 LEU 521 101.267 -10.641 11.126 673 HD22 LEU 521 HD22 LEU 521 101.966 -9.319 12.061 674 HD23 LEU 521 HD23 LEU 521 102.895 -10.071 10.767 675 H GLU 522 H GLU 522 99.885 -9.942 6.356 676 HA GLU 522 HA GLU 522 102.086 -11.836 6.862 677 HB2 GLU 522 HB2 GLU 522 100.202 -12.929 5.755 678 HB3 GLU 522 HB3 GLU 522 100.217 -11.708 4.488 679 HG2 GLU 522 HG2 GLU 522 101.647 -12.920 3.328 680 HG3 GLU 522 HG3 GLU 522 102.815 -12.824 4.646 681 H ILE 523 H ILE 523 104.025 -11.453 5.910 682 HA ILE 523 HA ILE 523 104.397 -8.843 4.692 683 HB ILE 523 HB ILE 523 106.289 -10.947 5.711 684 HG12 ILE 523 HG12 ILE 523 105.945 -8.017 6.379 685 HG13 ILE 523 HG13 ILE 523 105.250 -9.349 7.298 686 HG21 ILE 523 HG21 ILE 523 107.884 -8.807 5.013 687 HG22 ILE 523 HG22 ILE 523 106.813 -8.993 3.625 688 HG23 ILE 523 HG23 ILE 523 107.792 -10.354 4.173 689 HD11 ILE 523 HD11 ILE 523 108.120 -9.610 6.913 690 HD12 ILE 523 HD12 ILE 523 107.155 -9.720 8.385 691 HD13 ILE 523 HD13 ILE 523 107.660 -8.143 7.778 692 H LEU 524 H LEU 524 104.245 -8.590 2.569 693 HA LEU 524 HA LEU 524 104.084 -10.678 0.708 694 HB2 LEU 524 HB2 LEU 524 104.296 -7.735 0.608 695 HB3 LEU 524 HB3 LEU 524 104.828 -8.580 -0.832 696 HG LEU 524 HG LEU 524 102.390 -7.792 -0.732 697 HD11 LEU 524 HD11 LEU 524 101.614 -9.950 -1.808 698 HD12 LEU 524 HD12 LEU 524 103.217 -10.592 -1.446 699 HD13 LEU 524 HD13 LEU 524 103.044 -9.193 -2.507 700 HD21 LEU 524 HD21 LEU 524 100.887 -9.523 0.309 701 HD22 LEU 524 HD22 LEU 524 101.757 -8.491 1.444 702 HD23 LEU 524 HD23 LEU 524 102.310 -10.140 1.149 703 H SER 525 H SER 525 105.573 -11.728 -0.510 704 HA SER 525 HA SER 525 108.326 -10.758 -0.548 705 HB2 SER 525 HB2 SER 525 109.214 -12.944 0.148 706 HB3 SER 525 HB3 SER 525 108.202 -12.236 1.407 707 HG SER 525 HG SER 525 107.571 -14.339 -0.375 708 H GLY 526 H GLY 526 109.702 -11.941 -2.071 709 HA2 GLY 526 HA2 GLY 526 110.112 -12.658 -4.212 710 HA3 GLY 526 HA3 GLY 526 108.842 -13.833 -3.902 711 H ASP 527 H ASP 527 108.435 -13.594 -6.217 712 HA ASP 527 HA ASP 527 107.765 -11.427 -7.659 713 HB2 ASP 527 HB2 ASP 527 106.058 -13.925 -7.606 714 HB3 ASP 527 HB3 ASP 527 106.243 -12.798 -8.947 715 H HIS 528 H HIS 528 105.931 -12.758 -4.999 716 HA HIS 528 HA HIS 528 103.512 -11.373 -5.451 717 HB2 HIS 528 HB2 HIS 528 104.391 -13.242 -3.628 718 HB3 HIS 528 HB3 HIS 528 104.193 -11.804 -2.633 719 HD1 HIS 528 HD1 HIS 528 102.268 -13.486 -1.608 720 HD2 HIS 528 HD2 HIS 528 101.539 -11.763 -5.319 721 HE1 HIS 528 HE1 HIS 528 99.788 -13.688 -1.967 722 HE2 HIS 528 HE2 HIS 528 99.372 -12.664 -4.232 723 H GLU 529 H GLU 529 106.370 -10.574 -3.468 724 HA GLU 529 HA GLU 529 105.335 -8.112 -2.522 725 HB2 GLU 529 HB2 GLU 529 107.341 -7.873 -1.429 726 HB3 GLU 529 HB3 GLU 529 107.361 -9.604 -1.716 727 HG2 GLU 529 HG2 GLU 529 108.695 -9.118 -3.799 728 HG3 GLU 529 HG3 GLU 529 108.849 -7.466 -3.204 729 H GLN 530 H GLN 530 107.526 -8.933 -5.186 730 HA GLN 530 HA GLN 530 107.972 -6.286 -6.043 731 HB2 GLN 530 HB2 GLN 530 109.102 -7.203 -7.835 732 HB3 GLN 530 HB3 GLN 530 109.177 -8.523 -6.677 733 HG2 GLN 530 HG2 GLN 530 108.581 -9.606 -8.612 734 HG3 GLN 530 HG3 GLN 530 107.018 -9.341 -7.844 735 HE21 GLN 530 HE21 GLN 530 106.244 -9.670 -10.054 736 HE22 GLN 530 HE22 GLN 530 106.192 -8.315 -11.126 737 H ARG 531 H ARG 531 105.551 -8.690 -6.866 738 HA ARG 531 HA ARG 531 104.357 -7.459 -9.047 739 HB2 ARG 531 HB2 ARG 531 103.780 -9.712 -8.464 740 HB3 ARG 531 HB3 ARG 531 103.166 -9.207 -6.896 741 HG2 ARG 531 HG2 ARG 531 101.756 -7.763 -8.885 742 HG3 ARG 531 HG3 ARG 531 101.773 -9.465 -9.350 743 HD2 ARG 531 HD2 ARG 531 101.243 -9.596 -6.669 744 HD3 ARG 531 HD3 ARG 531 100.392 -8.127 -7.146 745 HE ARG 531 HE ARG 531 98.816 -9.488 -8.056 746 HH11 ARG 531 HH11 ARG 531 101.882 -11.127 -8.198 747 HH12 ARG 531 HH12 ARG 531 101.231 -12.560 -8.924 748 HH21 ARG 531 HH21 ARG 531 97.943 -11.371 -9.009 749 HH22 ARG 531 HH22 ARG 531 98.990 -12.698 -9.386 750 H TYR 532 H TYR 532 103.414 -7.182 -5.603 751 HA TYR 532 HA TYR 532 101.364 -5.309 -6.024 752 HB2 TYR 532 HB2 TYR 532 101.567 -6.515 -3.917 753 HB3 TYR 532 HB3 TYR 532 103.110 -5.731 -3.587 754 HD1 TYR 532 HD1 TYR 532 103.126 -3.215 -3.237 755 HD2 TYR 532 HD2 TYR 532 99.542 -5.507 -3.273 756 HE1 TYR 532 HE1 TYR 532 101.953 -1.390 -2.078 757 HE2 TYR 532 HE2 TYR 532 98.360 -3.687 -2.116 758 HH TYR 532 HH TYR 532 100.064 -0.763 -1.063 759 H TRP 533 H TRP 533 104.807 -4.869 -5.317 760 HA TRP 533 HA TRP 533 104.783 -2.071 -5.110 761 HB2 TRP 533 HB2 TRP 533 106.840 -4.155 -5.586 762 HB3 TRP 533 HB3 TRP 533 107.264 -2.514 -6.059 763 HD1 TRP 533 HD1 TRP 533 107.372 -4.738 -3.153 764 HE1 TRP 533 HE1 TRP 533 107.789 -3.413 -0.988 765 HE3 TRP 533 HE3 TRP 533 106.458 -0.025 -4.902 766 HZ2 TRP 533 HZ2 TRP 533 107.734 -0.721 -0.135 767 HZ3 TRP 533 HZ3 TRP 533 106.663 1.871 -3.347 768 HH2 TRP 533 HH2 TRP 533 107.289 1.528 -1.012 769 H GLN 534 H GLN 534 105.191 -4.219 -7.885 770 HA GLN 534 HA GLN 534 105.812 -2.298 -9.818 771 HB2 GLN 534 HB2 GLN 534 104.391 -4.950 -9.994 772 HB3 GLN 534 HB3 GLN 534 104.727 -3.974 -11.417 773 HG2 GLN 534 HG2 GLN 534 106.824 -4.963 -9.497 774 HG3 GLN 534 HG3 GLN 534 106.388 -5.763 -11.007 775 HE21 GLN 534 HE21 GLN 534 108.938 -4.644 -10.178 776 HE22 GLN 534 HE22 GLN 534 109.352 -3.453 -11.359 777 H LYS 535 H LYS 535 102.695 -3.521 -8.682 778 HA LYS 535 HA LYS 535 101.050 -2.113 -10.450 779 HB2 LYS 535 HB2 LYS 535 99.760 -3.604 -9.322 780 HB3 LYS 535 HB3 LYS 535 100.730 -3.492 -7.863 781 HG2 LYS 535 HG2 LYS 535 98.865 -1.289 -8.659 782 HG3 LYS 535 HG3 LYS 535 98.300 -2.704 -7.769 783 HD2 LYS 535 HD2 LYS 535 100.699 -1.682 -6.572 784 HD3 LYS 535 HD3 LYS 535 99.509 -0.388 -6.733 785 HE2 LYS 535 HE2 LYS 535 98.050 -2.579 -5.835 786 HE3 LYS 535 HE3 LYS 535 99.556 -2.647 -4.921 787 HZ1 LYS 535 HZ1 LYS 535 98.451 -1.220 -3.599 788 HZ2 LYS 535 HZ2 LYS 535 97.415 -0.685 -4.824 789 HZ3 LYS 535 HZ3 LYS 535 98.984 -0.064 -4.714 790 H ILE 536 H ILE 536 102.538 -1.199 -7.390 791 HA ILE 536 HA ILE 536 101.234 1.261 -7.002 792 HB ILE 536 HB ILE 536 104.071 0.538 -6.243 793 HG12 ILE 536 HG12 ILE 536 101.484 0.253 -4.699 794 HG13 ILE 536 HG13 ILE 536 102.461 -1.065 -5.338 795 HG21 ILE 536 HG21 ILE 536 103.540 2.961 -6.191 796 HG22 ILE 536 HG22 ILE 536 103.930 2.289 -4.608 797 HG23 ILE 536 HG23 ILE 536 102.252 2.615 -5.038 798 HD11 ILE 536 HD11 ILE 536 104.260 0.311 -3.811 799 HD12 ILE 536 HD12 ILE 536 103.370 -1.126 -3.310 800 HD13 ILE 536 HD13 ILE 536 102.766 0.477 -2.891 801 H LEU 537 H LEU 537 104.216 0.430 -8.722 802 HA LEU 537 HA LEU 537 105.064 2.973 -9.426 803 HB2 LEU 537 HB2 LEU 537 105.476 0.242 -10.449 804 HB3 LEU 537 HB3 LEU 537 105.765 1.518 -11.615 805 HG LEU 537 HG LEU 537 107.325 2.564 -9.920 806 HD11 LEU 537 HD11 LEU 537 108.205 0.534 -8.406 807 HD12 LEU 537 HD12 LEU 537 106.487 0.142 -8.459 808 HD13 LEU 537 HD13 LEU 537 107.016 1.713 -7.853 809 HD21 LEU 537 HD21 LEU 537 108.040 -0.193 -10.909 810 HD22 LEU 537 HD22 LEU 537 109.165 1.099 -10.491 811 HD23 LEU 537 HD23 LEU 537 108.089 1.280 -11.877 812 H VAL 538 H VAL 538 103.085 0.744 -11.394 813 HA VAL 538 HA VAL 538 102.571 2.477 -13.501 814 HB VAL 538 HB VAL 538 100.865 0.260 -12.368 815 HG11 VAL 538 HG11 VAL 538 100.285 2.209 -14.474 816 HG12 VAL 538 HG12 VAL 538 99.198 1.152 -13.574 817 HG13 VAL 538 HG13 VAL 538 100.082 0.528 -14.967 818 HG21 VAL 538 HG21 VAL 538 102.618 -0.872 -13.247 819 HG22 VAL 538 HG22 VAL 538 103.067 0.444 -14.331 820 HG23 VAL 538 HG23 VAL 538 101.728 -0.625 -14.749 821 H ASP 539 H ASP 539 100.868 2.105 -10.418 822 HA ASP 539 HA ASP 539 98.730 3.853 -11.029 823 HB2 ASP 539 HB2 ASP 539 98.423 2.403 -9.179 824 HB3 ASP 539 HB3 ASP 539 99.933 2.914 -8.429 825 H ARG 540 H ARG 540 101.919 4.335 -9.613 826 HA ARG 540 HA ARG 540 101.592 7.036 -8.882 827 HB2 ARG 540 HB2 ARG 540 104.059 5.439 -9.582 828 HB3 ARG 540 HB3 ARG 540 104.118 7.096 -8.999 829 HG2 ARG 540 HG2 ARG 540 102.950 4.754 -7.507 830 HG3 ARG 540 HG3 ARG 540 104.529 5.485 -7.212 831 HD2 ARG 540 HD2 ARG 540 103.651 7.227 -6.091 832 HD3 ARG 540 HD3 ARG 540 102.282 7.373 -7.191 833 HE ARG 540 HE ARG 540 101.904 5.069 -5.668 834 HH11 ARG 540 HH11 ARG 540 102.068 8.518 -5.210 835 HH12 ARG 540 HH12 ARG 540 101.005 8.518 -3.843 836 HH21 ARG 540 HH21 ARG 540 100.502 5.057 -3.868 837 HH22 ARG 540 HH22 ARG 540 100.115 6.549 -3.079 838 H GLN 541 H GLN 541 102.665 5.480 -11.860 839 HA GLN 541 HA GLN 541 103.456 7.803 -13.235 840 HB2 GLN 541 HB2 GLN 541 103.018 5.008 -13.857 841 HB3 GLN 541 HB3 GLN 541 102.432 6.038 -15.156 842 HG2 GLN 541 HG2 GLN 541 104.491 6.419 -15.866 843 HG3 GLN 541 HG3 GLN 541 105.005 6.941 -14.263 844 HE21 GLN 541 HE21 GLN 541 105.357 5.095 -12.696 845 HE22 GLN 541 HE22 GLN 541 106.200 3.717 -13.307 846 H ALA 542 H ALA 542 100.346 6.136 -12.985 847 HA ALA 542 HA ALA 542 98.924 7.699 -14.831 848 HB1 ALA 542 HB1 ALA 542 98.319 5.550 -13.232 849 HB2 ALA 542 HB2 ALA 542 97.175 6.434 -14.243 850 HB3 ALA 542 HB3 ALA 542 97.341 6.842 -12.535 851 H LYS 543 H LYS 543 99.684 8.156 -11.432 852 HA LYS 543 HA LYS 543 97.987 10.302 -10.861 853 HB2 LYS 543 HB2 LYS 543 100.277 9.027 -9.648 854 HB3 LYS 543 HB3 LYS 543 100.387 10.773 -9.471 855 HG2 LYS 543 HG2 LYS 543 99.159 10.403 -7.633 856 HG3 LYS 543 HG3 LYS 543 97.813 10.385 -8.775 857 HD2 LYS 543 HD2 LYS 543 99.146 7.803 -8.538 858 HD3 LYS 543 HD3 LYS 543 98.465 8.372 -7.012 859 HE2 LYS 543 HE2 LYS 543 96.647 8.798 -9.223 860 HE3 LYS 543 HE3 LYS 543 97.106 7.102 -9.077 861 HZ1 LYS 543 HZ1 LYS 543 95.885 6.878 -7.248 862 HZ2 LYS 543 HZ2 LYS 543 95.190 8.375 -7.618 863 HZ3 LYS 543 HZ3 LYS 543 96.497 8.292 -6.547 864 H LEU 544 H LEU 544 100.841 10.128 -12.784 865 HA LEU 544 HA LEU 544 101.825 12.712 -12.693 866 HB2 LEU 544 HB2 LEU 544 102.539 10.558 -14.054 867 HB3 LEU 544 HB3 LEU 544 101.628 11.338 -15.333 868 HG LEU 544 HG LEU 544 103.163 13.409 -14.616 869 HD11 LEU 544 HD11 LEU 544 104.825 12.869 -13.254 870 HD12 LEU 544 HD12 LEU 544 105.438 11.762 -14.481 871 HD13 LEU 544 HD13 LEU 544 104.319 11.180 -13.248 872 HD21 LEU 544 HD21 LEU 544 103.237 11.353 -16.651 873 HD22 LEU 544 HD22 LEU 544 104.844 12.001 -16.318 874 HD23 LEU 544 HD23 LEU 544 103.536 13.087 -16.786 875 H ASN 545 H ASN 545 98.895 11.517 -14.093 876 HA ASN 545 HA ASN 545 98.430 13.963 -15.603 877 HB2 ASN 545 HB2 ASN 545 96.613 11.571 -15.262 878 HB3 ASN 545 HB3 ASN 545 96.445 12.860 -16.451 879 HD21 ASN 545 HD21 ASN 545 98.853 13.168 -17.503 880 HD22 ASN 545 HD22 ASN 545 99.416 11.712 -18.243 881 H GLN 546 H GLN 546 96.633 12.091 -13.152 882 HA GLN 546 HA GLN 546 94.632 13.778 -12.507 883 HB2 GLN 546 HB2 GLN 546 95.469 11.543 -11.385 884 HB3 GLN 546 HB3 GLN 546 96.192 12.647 -10.221 885 HG2 GLN 546 HG2 GLN 546 94.247 12.991 -9.222 886 HG3 GLN 546 HG3 GLN 546 93.452 13.359 -10.753 887 HE21 GLN 546 HE21 GLN 546 93.170 11.285 -12.143 888 HE22 GLN 546 HE22 GLN 546 92.471 9.944 -11.309 889 HA PRO 547 HA PRO 547 97.064 17.566 -11.802 890 HB2 PRO 547 HB2 PRO 547 94.253 18.454 -11.331 891 HB3 PRO 547 HB3 PRO 547 95.533 19.223 -12.278 892 HG2 PRO 547 HG2 PRO 547 93.557 17.918 -13.489 893 HG3 PRO 547 HG3 PRO 547 95.220 17.811 -14.093 894 HD2 PRO 547 HD2 PRO 547 93.628 15.810 -12.558 895 HD3 PRO 547 HD3 PRO 547 94.841 15.553 -13.828 896 H ARG 548 H ARG 548 97.977 16.832 -9.842 897 HA ARG 548 HA ARG 548 96.407 17.539 -7.453 898 HB2 ARG 548 HB2 ARG 548 97.538 15.022 -8.131 899 HB3 ARG 548 HB3 ARG 548 98.466 15.673 -6.788 900 HG2 ARG 548 HG2 ARG 548 96.537 15.829 -5.417 901 HG3 ARG 548 HG3 ARG 548 95.466 15.492 -6.778 902 HD2 ARG 548 HD2 ARG 548 96.561 13.253 -6.973 903 HD3 ARG 548 HD3 ARG 548 97.423 13.606 -5.477 904 HE ARG 548 HE ARG 548 94.846 13.983 -4.784 905 HH11 ARG 548 HH11 ARG 548 96.508 11.378 -6.392 906 HH12 ARG 548 HH12 ARG 548 95.448 10.152 -5.783 907 HH21 ARG 548 HH21 ARG 548 93.442 12.376 -3.978 908 HH22 ARG 548 HH22 ARG 548 93.704 10.720 -4.411 909 H GLU 549 H GLU 549 98.152 17.577 -5.504 910 HA GLU 549 HA GLU 549 99.739 19.878 -6.023 911 HB2 GLU 549 HB2 GLU 549 99.443 18.047 -3.651 912 HB3 GLU 549 HB3 GLU 549 100.613 19.360 -3.656 913 HG2 GLU 549 HG2 GLU 549 98.885 20.991 -3.895 914 HG3 GLU 549 HG3 GLU 549 97.669 19.738 -4.141 915 H LYS 550 H LYS 550 100.873 18.726 -7.869 916 HA LYS 550 HA LYS 550 103.155 17.137 -6.927 917 HB2 LYS 550 HB2 LYS 550 101.536 17.152 -9.352 918 HB3 LYS 550 HB3 LYS 550 103.261 17.172 -9.695 919 HG2 LYS 550 HG2 LYS 550 101.722 15.129 -8.118 920 HG3 LYS 550 HG3 LYS 550 102.576 14.906 -9.645 921 HD2 LYS 550 HD2 LYS 550 104.481 15.919 -7.867 922 HD3 LYS 550 HD3 LYS 550 103.569 14.720 -6.945 923 HE2 LYS 550 HE2 LYS 550 104.569 13.050 -8.021 924 HE3 LYS 550 HE3 LYS 550 104.133 13.735 -9.586 925 HZ1 LYS 550 HZ1 LYS 550 106.095 15.034 -9.607 926 HZ2 LYS 550 HZ2 LYS 550 106.566 13.467 -9.183 927 HZ3 LYS 550 HZ3 LYS 550 106.456 14.666 -7.996 928 H LYS 551 H LYS 551 102.379 20.279 -7.657 929 HA LYS 551 HA LYS 551 105.140 20.885 -8.488 930 HB2 LYS 551 HB2 LYS 551 102.637 21.707 -9.599 931 HB3 LYS 551 HB3 LYS 551 103.454 23.125 -8.952 932 HG2 LYS 551 HG2 LYS 551 104.607 23.199 -10.844 933 HG3 LYS 551 HG3 LYS 551 105.442 21.740 -10.307 934 HD2 LYS 551 HD2 LYS 551 104.571 21.378 -12.524 935 HD3 LYS 551 HD3 LYS 551 103.663 20.385 -11.382 936 HE2 LYS 551 HE2 LYS 551 102.079 21.355 -12.858 937 HE3 LYS 551 HE3 LYS 551 101.939 22.212 -11.324 938 HZ1 LYS 551 HZ1 LYS 551 103.021 23.155 -13.885 939 HZ2 LYS 551 HZ2 LYS 551 103.627 23.817 -12.453 940 HZ3 LYS 551 HZ3 LYS 551 101.977 23.936 -12.806 941 H ARG 552 H ARG 552 105.741 20.843 -6.236 942 HA ARG 552 HA ARG 552 104.582 22.641 -4.355 943 HB2 ARG 552 HB2 ARG 552 107.116 21.020 -4.402 944 HB3 ARG 552 HB3 ARG 552 106.778 22.145 -3.093 945 HG2 ARG 552 HG2 ARG 552 105.941 20.231 -2.194 946 HG3 ARG 552 HG3 ARG 552 104.496 20.836 -3.007 947 HD2 ARG 552 HD2 ARG 552 104.667 19.294 -4.733 948 HD3 ARG 552 HD3 ARG 552 106.381 19.006 -4.439 949 HE ARG 552 HE ARG 552 104.213 17.594 -3.292 950 HH11 ARG 552 HH11 ARG 552 107.374 18.852 -2.548 951 HH12 ARG 552 HH12 ARG 552 107.689 17.685 -1.307 952 HH21 ARG 552 HH21 ARG 552 104.616 16.054 -1.661 953 HH22 ARG 552 HH22 ARG 552 106.121 16.093 -0.804 954 H GLY 553 H GLY 553 104.725 24.428 -6.090 955 HA2 GLY 553 HA2 GLY 553 107.294 25.851 -5.766 956 HA3 GLY 553 HA3 GLY 553 106.276 25.993 -7.190 957 H THR 554 H THR 554 106.156 28.243 -6.987 958 HA THR 554 HA THR 554 104.951 30.123 -6.475 959 HB THR 554 HB THR 554 103.636 28.902 -4.095 960 HG1 THR 554 HG1 THR 554 102.596 28.379 -6.670 961 HG21 THR 554 HG21 THR 554 102.902 30.832 -6.271 962 HG22 THR 554 HG22 THR 554 102.920 31.082 -4.525 963 HG23 THR 554 HG23 THR 554 101.667 30.082 -5.260 964 H GLU 555 H GLU 555 105.786 28.346 -3.494 965 HA GLU 555 HA GLU 555 107.305 30.710 -2.631 966 HB2 GLU 555 HB2 GLU 555 106.566 29.860 -0.244 967 HB3 GLU 555 HB3 GLU 555 105.542 30.940 -1.179 968 HG2 GLU 555 HG2 GLU 555 103.949 29.383 -1.493 969 HG3 GLU 555 HG3 GLU 555 105.111 28.063 -1.625 970 H LYS 556 H LYS 556 109.348 30.272 -2.142 971 HA LYS 556 HA LYS 556 110.281 28.121 -0.652 972 HB2 LYS 556 HB2 LYS 556 109.546 26.817 -2.663 973 HB3 LYS 556 HB3 LYS 556 110.735 27.700 -3.610 974 HG2 LYS 556 HG2 LYS 556 112.339 26.307 -2.989 975 HG3 LYS 556 HG3 LYS 556 111.982 26.584 -1.284 976 HD2 LYS 556 HD2 LYS 556 111.050 24.571 -1.111 977 HD3 LYS 556 HD3 LYS 556 109.948 24.928 -2.442 978 HE2 LYS 556 HE2 LYS 556 112.023 24.426 -3.933 979 HE3 LYS 556 HE3 LYS 556 112.629 23.600 -2.499 980 HZ1 LYS 556 HZ1 LYS 556 110.340 22.448 -2.542 981 HZ2 LYS 556 HZ2 LYS 556 111.532 21.936 -3.627 982 HZ3 LYS 556 HZ3 LYS 556 110.284 22.947 -4.158 983 H LEU 557 H LEU 557 111.200 30.251 -0.006 984 HA LEU 557 HA LEU 557 112.952 31.792 -1.444 985 HB2 LEU 557 HB2 LEU 557 113.115 30.992 1.461 986 HB3 LEU 557 HB3 LEU 557 114.078 32.267 0.741 987 HG LEU 557 HG LEU 557 111.514 32.996 0.049 988 HD11 LEU 557 HD11 LEU 557 111.197 32.506 2.932 989 HD12 LEU 557 HD12 LEU 557 111.058 31.084 1.899 990 HD13 LEU 557 HD13 LEU 557 110.004 32.473 1.634 991 HD21 LEU 557 HD21 LEU 557 113.179 34.543 0.785 992 HD22 LEU 557 HD22 LEU 557 113.233 33.807 2.387 993 HD23 LEU 557 HD23 LEU 557 111.795 34.686 1.868 994 H ILE 558 H ILE 558 114.928 31.551 -2.292 995 HA ILE 558 HA ILE 558 116.552 29.256 -1.419 996 HB ILE 558 HB ILE 558 117.335 29.494 -3.993 997 HG12 ILE 558 HG12 ILE 558 115.292 29.621 -5.392 998 HG13 ILE 558 HG13 ILE 558 114.361 30.059 -3.962 999 HG21 ILE 558 HG21 ILE 558 116.907 27.377 -3.107 1000 HG22 ILE 558 HG22 ILE 558 115.730 27.542 -4.410 1001 HG23 ILE 558 HG23 ILE 558 115.229 27.771 -2.734 1002 HD11 ILE 558 HD11 ILE 558 114.736 32.134 -4.755 1003 HD12 ILE 558 HD12 ILE 558 116.222 31.671 -5.584 1004 HD13 ILE 558 HD13 ILE 558 116.234 31.953 -3.843 1005 H THR 559 H THR 559 118.869 29.478 -2.078 1006 HA THR 559 HA THR 559 119.707 32.278 -1.747 1007 HB THR 559 HB THR 559 121.377 29.811 -1.244 1008 HG1 THR 559 HG1 THR 559 120.947 30.327 1.006 1009 HG21 THR 559 HG21 THR 559 123.047 31.254 -0.988 1010 HG22 THR 559 HG22 THR 559 122.155 32.037 0.315 1011 HG23 THR 559 HG23 THR 559 121.967 32.600 -1.345 1012 H LYS 560 H LYS 560 118.980 31.616 -4.293 1013 HA LYS 560 HA LYS 560 119.731 31.882 -6.428 1014 HB2 LYS 560 HB2 LYS 560 122.577 31.948 -5.491 1015 HB3 LYS 560 HB3 LYS 560 121.836 32.795 -6.841 1016 HG2 LYS 560 HG2 LYS 560 121.670 33.434 -3.916 1017 HG3 LYS 560 HG3 LYS 560 122.270 34.442 -5.235 1018 HD2 LYS 560 HD2 LYS 560 119.402 33.558 -4.948 1019 HD3 LYS 560 HD3 LYS 560 120.023 35.107 -4.376 1020 HE2 LYS 560 HE2 LYS 560 120.909 35.245 -6.871 1021 HE3 LYS 560 HE3 LYS 560 119.558 34.146 -7.148 1022 HZ1 LYS 560 HZ1 LYS 560 118.705 36.289 -7.454 1023 HZ2 LYS 560 HZ2 LYS 560 119.476 36.903 -6.079 1024 HZ3 LYS 560 HZ3 LYS 560 118.172 35.838 -5.912 1025 H ALA 561 H ALA 561 122.135 30.908 -7.597 1026 HA ALA 561 HA ALA 561 121.539 28.053 -7.530 1027 HB1 ALA 561 HB1 ALA 561 123.555 28.991 -9.445 1028 HB2 ALA 561 HB2 ALA 561 121.960 29.721 -9.631 1029 HB3 ALA 561 HB3 ALA 561 122.139 27.967 -9.691 Start of MODEL 13 1 H1 MET 437 HT1 MET 437 132.826 -6.153 21.782 2 H2 MET 437 HT2 MET 437 134.439 -5.618 22.023 3 H3 MET 437 HT3 MET 437 133.364 -4.700 21.051 4 HA MET 437 HA MET 437 133.058 -5.219 23.930 5 HB2 MET 437 HB2 MET 437 134.810 -3.500 22.585 6 HB3 MET 437 HB3 MET 437 133.474 -2.475 23.091 7 HG2 MET 437 HG2 MET 437 135.014 -2.368 24.839 8 HG3 MET 437 HG3 MET 437 133.769 -3.485 25.399 9 HE1 MET 437 HE1 MET 437 136.510 -2.803 26.382 10 HE2 MET 437 HE2 MET 437 137.817 -3.957 26.117 11 HE3 MET 437 HE3 MET 437 136.514 -4.343 27.241 12 H HIS 438 H HIS 438 132.016 -3.396 21.064 13 HA HIS 438 HA HIS 438 129.263 -3.625 21.824 14 HB2 HIS 438 HB2 HIS 438 130.110 -1.696 23.219 15 HB3 HIS 438 HB3 HIS 438 130.403 -0.830 21.715 16 HD1 HIS 438 HD1 HIS 438 128.458 0.400 23.657 17 HD2 HIS 438 HD2 HIS 438 127.302 -2.300 20.717 18 HE1 HIS 438 HE1 HIS 438 126.007 0.826 23.278 19 HE2 HIS 438 HE2 HIS 438 125.346 -0.774 21.447 20 H HIS 439 H HIS 439 130.917 -4.334 19.581 21 HA HIS 439 HA HIS 439 130.845 -2.685 17.390 22 HB2 HIS 439 HB2 HIS 439 130.500 -5.671 17.612 23 HB3 HIS 439 HB3 HIS 439 130.557 -4.855 16.054 24 HD1 HIS 439 HD1 HIS 439 132.714 -6.874 16.655 25 HD2 HIS 439 HD2 HIS 439 133.063 -2.845 17.609 26 HE1 HIS 439 HE1 HIS 439 135.184 -6.437 16.828 27 HE2 HIS 439 HE2 HIS 439 135.373 -3.973 17.321 28 H HIS 440 H HIS 440 129.378 -2.160 15.807 29 HA HIS 440 HA HIS 440 126.734 -3.278 15.748 30 HB2 HIS 440 HB2 HIS 440 126.885 -1.442 17.640 31 HB3 HIS 440 HB3 HIS 440 126.755 -0.334 16.278 32 HD1 HIS 440 HD1 HIS 440 124.845 -3.160 17.920 33 HD2 HIS 440 HD2 HIS 440 124.214 0.027 15.328 34 HE1 HIS 440 HE1 HIS 440 122.353 -3.037 17.599 35 HE2 HIS 440 HE2 HIS 440 121.997 -1.126 15.996 36 H HIS 441 H HIS 441 126.003 -3.213 13.722 37 HA HIS 441 HA HIS 441 125.916 -1.177 11.938 38 HB2 HIS 441 HB2 HIS 441 128.644 -2.044 12.273 39 HB3 HIS 441 HB3 HIS 441 128.118 -2.343 10.620 40 HD1 HIS 441 HD1 HIS 441 130.184 -0.339 10.634 41 HD2 HIS 441 HD2 HIS 441 126.259 0.711 11.504 42 HE1 HIS 441 HE1 HIS 441 130.039 2.134 10.205 43 HE2 HIS 441 HE2 HIS 441 127.672 2.760 10.803 44 H HIS 442 H HIS 442 126.449 -4.561 12.481 45 HA HIS 442 HA HIS 442 126.132 -5.833 10.149 46 HB2 HIS 442 HB2 HIS 442 126.109 -6.897 12.420 47 HB3 HIS 442 HB3 HIS 442 124.405 -6.475 12.545 48 HD1 HIS 442 HD1 HIS 442 122.935 -8.365 11.985 49 HD2 HIS 442 HD2 HIS 442 126.494 -8.503 9.843 50 HE1 HIS 442 HE1 HIS 442 122.792 -10.444 10.576 51 HE2 HIS 442 HE2 HIS 442 124.937 -10.484 9.255 52 H HIS 443 H HIS 443 124.672 -6.075 8.555 53 HA HIS 443 HA HIS 443 121.925 -5.793 8.686 54 HB2 HIS 443 HB2 HIS 443 123.378 -3.225 8.422 55 HB3 HIS 443 HB3 HIS 443 122.022 -3.460 7.325 56 HD1 HIS 443 HD1 HIS 443 122.651 -1.918 10.377 57 HD2 HIS 443 HD2 HIS 443 119.690 -4.537 9.097 58 HE1 HIS 443 HE1 HIS 443 120.737 -1.602 11.977 59 HE2 HIS 443 HE2 HIS 443 118.985 -3.249 11.226 60 H SER 444 H SER 444 120.898 -5.758 6.563 61 HA SER 444 HA SER 444 122.268 -7.305 4.676 62 HB2 SER 444 HB2 SER 444 119.695 -6.857 5.037 63 HB3 SER 444 HB3 SER 444 119.959 -5.596 3.831 64 HG SER 444 HG SER 444 119.595 -8.165 3.408 65 H ASN 445 H ASN 445 122.869 -6.777 2.483 66 HA ASN 445 HA ASN 445 123.272 -3.995 1.800 67 HB2 ASN 445 HB2 ASN 445 125.819 -4.908 1.319 68 HB3 ASN 445 HB3 ASN 445 125.343 -3.904 2.685 69 HD21 ASN 445 HD21 ASN 445 127.261 -6.283 2.088 70 HD22 ASN 445 HD22 ASN 445 127.055 -7.287 3.479 71 H ALA 446 H ALA 446 122.363 -4.059 -0.154 72 HA ALA 446 HA ALA 446 123.589 -5.720 -2.198 73 HB1 ALA 446 HB1 ALA 446 121.050 -6.154 -2.945 74 HB2 ALA 446 HB2 ALA 446 120.845 -6.148 -1.193 75 HB3 ALA 446 HB3 ALA 446 121.970 -7.278 -1.945 76 H THR 447 H THR 447 120.453 -4.092 -2.230 77 HA THR 447 HA THR 447 119.633 -2.412 -3.531 78 HB THR 447 HB THR 447 120.843 -0.339 -3.546 79 HG1 THR 447 HG1 THR 447 123.164 -1.384 -2.412 80 HG21 THR 447 HG21 THR 447 121.208 -0.009 -1.233 81 HG22 THR 447 HG22 THR 447 121.642 -1.700 -0.983 82 HG23 THR 447 HG23 THR 447 119.973 -1.264 -1.353 83 H GLY 448 H GLY 448 120.678 -0.728 -5.408 84 HA2 GLY 448 HA2 GLY 448 121.871 -0.668 -7.462 85 HA3 GLY 448 HA3 GLY 448 122.083 -2.410 -7.359 86 HA PRO 449 HA PRO 449 118.694 -2.314 -10.273 87 HB2 PRO 449 HB2 PRO 449 119.021 -4.787 -11.238 88 HB3 PRO 449 HB3 PRO 449 120.166 -3.494 -11.612 89 HG2 PRO 449 HG2 PRO 449 120.427 -5.766 -9.707 90 HG3 PRO 449 HG3 PRO 449 121.664 -4.989 -10.708 91 HD2 PRO 449 HD2 PRO 449 121.195 -4.513 -7.981 92 HD3 PRO 449 HD3 PRO 449 122.176 -3.509 -9.065 93 H GLN 450 H GLN 450 117.242 -2.230 -8.327 94 HA GLN 450 HA GLN 450 115.278 -4.189 -8.438 95 HB2 GLN 450 HB2 GLN 450 116.767 -5.727 -7.371 96 HB3 GLN 450 HB3 GLN 450 117.211 -4.543 -6.148 97 HG2 GLN 450 HG2 GLN 450 115.620 -6.387 -5.452 98 HG3 GLN 450 HG3 GLN 450 115.156 -4.733 -5.051 99 HE21 GLN 450 HE21 GLN 450 114.895 -6.702 -7.994 100 HE22 GLN 450 HE22 GLN 450 113.192 -6.489 -8.189 101 H PHE 451 H PHE 451 113.996 -2.351 -8.448 102 HA PHE 451 HA PHE 451 113.962 -0.157 -6.882 103 HB2 PHE 451 HB2 PHE 451 111.531 -0.067 -7.151 104 HB3 PHE 451 HB3 PHE 451 112.306 -0.591 -8.643 105 HD1 PHE 451 HD1 PHE 451 111.723 -2.620 -9.649 106 HD2 PHE 451 HD2 PHE 451 110.489 -1.815 -5.656 107 HE1 PHE 451 HE1 PHE 451 110.279 -4.612 -9.697 108 HE2 PHE 451 HE2 PHE 451 109.044 -3.806 -5.696 109 HZ PHE 451 HZ PHE 451 108.939 -5.207 -7.717 110 H VAL 452 H VAL 452 113.863 0.283 -4.770 111 HA VAL 452 HA VAL 452 113.788 -1.679 -2.786 112 HB VAL 452 HB VAL 452 112.959 1.189 -2.350 113 HG11 VAL 452 HG11 VAL 452 113.359 0.857 -0.145 114 HG12 VAL 452 HG12 VAL 452 114.651 -0.306 -0.440 115 HG13 VAL 452 HG13 VAL 452 112.965 -0.807 -0.573 116 HG21 VAL 452 HG21 VAL 452 115.306 0.409 -3.577 117 HG22 VAL 452 HG22 VAL 452 115.766 0.600 -1.886 118 HG23 VAL 452 HG23 VAL 452 115.021 1.942 -2.754 119 H SER 453 H SER 453 112.109 -3.018 -2.475 120 HA SER 453 HA SER 453 109.420 -2.304 -3.071 121 HB2 SER 453 HB2 SER 453 108.909 -4.510 -2.703 122 HB3 SER 453 HB3 SER 453 110.643 -4.649 -2.989 123 HG SER 453 HG SER 453 110.842 -5.364 -1.034 124 H GLY 454 H GLY 454 110.948 -0.869 -0.745 125 HA2 GLY 454 HA2 GLY 454 110.533 -0.307 1.482 126 HA3 GLY 454 HA3 GLY 454 109.023 0.160 0.722 127 H VAL 455 H VAL 455 110.028 -3.195 1.102 128 HA VAL 455 HA VAL 455 108.837 -4.936 2.023 129 HB VAL 455 HB VAL 455 108.414 -3.691 4.606 130 HG11 VAL 455 HG11 VAL 455 110.390 -5.800 3.761 131 HG12 VAL 455 HG12 VAL 455 108.689 -6.115 4.101 132 HG13 VAL 455 HG13 VAL 455 109.747 -5.520 5.379 133 HG21 VAL 455 HG21 VAL 455 110.945 -3.096 3.166 134 HG22 VAL 455 HG22 VAL 455 111.043 -3.531 4.871 135 HG23 VAL 455 HG23 VAL 455 110.079 -2.141 4.370 136 H ILE 456 H ILE 456 106.858 -5.021 1.019 137 HA ILE 456 HA ILE 456 104.706 -3.277 1.899 138 HB ILE 456 HB ILE 456 104.814 -5.405 -0.230 139 HG12 ILE 456 HG12 ILE 456 105.959 -3.534 -1.030 140 HG13 ILE 456 HG13 ILE 456 104.325 -3.297 -1.638 141 HG21 ILE 456 HG21 ILE 456 102.583 -5.294 0.815 142 HG22 ILE 456 HG22 ILE 456 102.575 -4.758 -0.866 143 HG23 ILE 456 HG23 ILE 456 102.516 -3.572 0.437 144 HD11 ILE 456 HD11 ILE 456 105.579 -1.952 0.740 145 HD12 ILE 456 HD12 ILE 456 103.892 -1.774 0.258 146 HD13 ILE 456 HD13 ILE 456 105.177 -1.219 -0.813 147 H VAL 457 H VAL 457 104.078 -3.900 3.923 148 HA VAL 457 HA VAL 457 103.584 -6.674 4.545 149 HB VAL 457 HB VAL 457 104.403 -4.887 6.193 150 HG11 VAL 457 HG11 VAL 457 102.635 -3.238 5.618 151 HG12 VAL 457 HG12 VAL 457 102.740 -3.589 7.344 152 HG13 VAL 457 HG13 VAL 457 101.451 -4.303 6.376 153 HG21 VAL 457 HG21 VAL 457 102.944 -7.243 6.512 154 HG22 VAL 457 HG22 VAL 457 102.218 -6.094 7.636 155 HG23 VAL 457 HG23 VAL 457 103.945 -6.438 7.720 156 H LYS 458 H LYS 458 101.817 -7.691 3.961 157 HA LYS 458 HA LYS 458 99.445 -6.250 3.146 158 HB2 LYS 458 HB2 LYS 458 100.077 -8.102 1.776 159 HB3 LYS 458 HB3 LYS 458 100.163 -9.179 3.163 160 HG2 LYS 458 HG2 LYS 458 97.633 -8.574 3.416 161 HG3 LYS 458 HG3 LYS 458 97.781 -8.148 1.710 162 HD2 LYS 458 HD2 LYS 458 98.812 -10.440 1.372 163 HD3 LYS 458 HD3 LYS 458 98.273 -10.817 3.010 164 HE2 LYS 458 HE2 LYS 458 96.227 -11.253 2.272 165 HE3 LYS 458 HE3 LYS 458 96.111 -9.642 1.565 166 HZ1 LYS 458 HZ1 LYS 458 97.743 -11.225 -0.076 167 HZ2 LYS 458 HZ2 LYS 458 96.239 -10.542 -0.437 168 HZ3 LYS 458 HZ3 LYS 458 96.323 -12.089 0.240 169 H ILE 459 H ILE 459 97.772 -5.804 4.404 170 HA ILE 459 HA ILE 459 97.429 -7.362 6.880 171 HB ILE 459 HB ILE 459 96.435 -4.554 6.429 172 HG12 ILE 459 HG12 ILE 459 98.978 -5.575 7.681 173 HG13 ILE 459 HG13 ILE 459 98.792 -4.341 6.441 174 HG21 ILE 459 HG21 ILE 459 95.569 -6.397 8.224 175 HG22 ILE 459 HG22 ILE 459 95.519 -4.652 8.485 176 HG23 ILE 459 HG23 ILE 459 96.849 -5.603 9.144 177 HD11 ILE 459 HD11 ILE 459 97.824 -2.827 8.064 178 HD12 ILE 459 HD12 ILE 459 99.405 -3.394 8.604 179 HD13 ILE 459 HD13 ILE 459 97.937 -4.068 9.311 180 H ILE 460 H ILE 460 95.705 -8.586 6.969 181 HA ILE 460 HA ILE 460 93.281 -7.749 5.524 182 HB ILE 460 HB ILE 460 94.570 -9.580 4.288 183 HG12 ILE 460 HG12 ILE 460 92.098 -8.969 4.070 184 HG13 ILE 460 HG13 ILE 460 92.578 -10.564 3.500 185 HG21 ILE 460 HG21 ILE 460 93.829 -11.036 6.778 186 HG22 ILE 460 HG22 ILE 460 95.302 -11.117 5.810 187 HG23 ILE 460 HG23 ILE 460 93.829 -11.900 5.240 188 HD11 ILE 460 HD11 ILE 460 91.131 -11.528 4.861 189 HD12 ILE 460 HD12 ILE 460 90.554 -9.924 5.317 190 HD13 ILE 460 HD13 ILE 460 91.826 -10.704 6.257 191 H SER 461 H SER 461 91.407 -8.013 6.665 192 HA SER 461 HA SER 461 91.669 -9.341 9.283 193 HB2 SER 461 HB2 SER 461 90.199 -7.677 10.242 194 HB3 SER 461 HB3 SER 461 91.527 -6.858 9.425 195 HG SER 461 HG SER 461 89.163 -7.361 8.010 196 H THR 462 H THR 462 89.166 -9.294 10.181 197 HA THR 462 HA THR 462 87.670 -10.912 8.219 198 HB THR 462 HB THR 462 86.573 -11.792 10.456 199 HG1 THR 462 HG1 THR 462 87.612 -10.892 12.098 200 HG21 THR 462 HG21 THR 462 88.484 -12.755 8.684 201 HG22 THR 462 HG22 THR 462 87.580 -13.694 9.871 202 HG23 THR 462 HG23 THR 462 89.172 -13.053 10.280 203 H GLU 463 H GLU 463 87.694 -7.989 9.748 204 HA GLU 463 HA GLU 463 85.442 -6.887 8.877 205 HB2 GLU 463 HB2 GLU 463 84.765 -8.837 10.979 206 HB3 GLU 463 HB3 GLU 463 84.030 -7.253 11.179 207 HG2 GLU 463 HG2 GLU 463 83.831 -8.268 8.459 208 HG3 GLU 463 HG3 GLU 463 83.053 -9.307 9.652 209 HA PRO 464 HA PRO 464 86.588 -5.116 13.446 210 HB2 PRO 464 HB2 PRO 464 89.364 -6.189 13.124 211 HB3 PRO 464 HB3 PRO 464 88.452 -5.859 14.602 212 HG2 PRO 464 HG2 PRO 464 88.696 -8.347 13.701 213 HG3 PRO 464 HG3 PRO 464 87.164 -7.780 14.393 214 HD2 PRO 464 HD2 PRO 464 87.886 -8.298 11.557 215 HD3 PRO 464 HD3 PRO 464 86.313 -8.438 12.367 216 H LEU 465 H LEU 465 88.568 -5.384 10.537 217 HA LEU 465 HA LEU 465 90.236 -3.273 10.632 218 HB2 LEU 465 HB2 LEU 465 89.026 -4.762 8.565 219 HB3 LEU 465 HB3 LEU 465 88.834 -3.073 8.133 220 HG LEU 465 HG LEU 465 91.535 -3.760 9.050 221 HD11 LEU 465 HD11 LEU 465 91.842 -4.658 6.546 222 HD12 LEU 465 HD12 LEU 465 90.235 -5.299 6.894 223 HD13 LEU 465 HD13 LEU 465 91.595 -5.721 7.934 224 HD21 LEU 465 HD21 LEU 465 90.764 -2.545 6.427 225 HD22 LEU 465 HD22 LEU 465 92.188 -2.246 7.424 226 HD23 LEU 465 HD23 LEU 465 90.615 -1.624 7.924 227 HA PRO 466 HA PRO 466 87.272 -0.017 11.622 228 HB2 PRO 466 HB2 PRO 466 89.566 1.483 12.545 229 HB3 PRO 466 HB3 PRO 466 88.248 0.793 13.492 230 HG2 PRO 466 HG2 PRO 466 90.832 -0.112 13.582 231 HG3 PRO 466 HG3 PRO 466 89.419 -1.111 13.963 232 HD2 PRO 466 HD2 PRO 466 91.051 -1.002 11.464 233 HD3 PRO 466 HD3 PRO 466 90.322 -2.402 12.279 234 H GLY 467 H GLY 467 90.484 0.536 10.194 235 HA2 GLY 467 HA2 GLY 467 89.773 1.655 7.827 236 HA3 GLY 467 HA3 GLY 467 89.645 3.001 8.949 237 H ARG 468 H ARG 468 91.365 3.390 7.004 238 HA ARG 468 HA ARG 468 93.964 2.389 7.314 239 HB2 ARG 468 HB2 ARG 468 94.526 4.712 6.201 240 HB3 ARG 468 HB3 ARG 468 93.702 3.449 5.297 241 HG2 ARG 468 HG2 ARG 468 91.676 4.541 5.348 242 HG3 ARG 468 HG3 ARG 468 92.102 5.482 6.779 243 HD2 ARG 468 HD2 ARG 468 93.811 6.662 5.349 244 HD3 ARG 468 HD3 ARG 468 93.080 5.862 3.958 245 HE ARG 468 HE ARG 468 91.050 7.139 5.385 246 HH11 ARG 468 HH11 ARG 468 93.870 7.956 3.516 247 HH12 ARG 468 HH12 ARG 468 93.238 9.479 2.988 248 HH21 ARG 468 HH21 ARG 468 90.207 9.143 4.699 249 HH22 ARG 468 HH22 ARG 468 91.155 10.156 3.662 250 H LYS 469 H LYS 469 92.341 5.172 8.766 251 HA LYS 469 HA LYS 469 94.581 6.335 9.985 252 HB2 LYS 469 HB2 LYS 469 92.904 7.337 11.567 253 HB3 LYS 469 HB3 LYS 469 92.561 7.598 9.863 254 HG2 LYS 469 HG2 LYS 469 91.227 5.246 10.471 255 HG3 LYS 469 HG3 LYS 469 90.982 6.271 11.887 256 HD2 LYS 469 HD2 LYS 469 90.339 8.108 10.245 257 HD3 LYS 469 HD3 LYS 469 90.264 6.839 9.021 258 HE2 LYS 469 HE2 LYS 469 88.227 6.276 9.701 259 HE3 LYS 469 HE3 LYS 469 88.838 5.962 11.325 260 HZ1 LYS 469 HZ1 LYS 469 88.269 8.724 10.476 261 HZ2 LYS 469 HZ2 LYS 469 88.282 8.067 12.035 262 HZ3 LYS 469 HZ3 LYS 469 87.004 7.720 10.983 263 H GLN 470 H GLN 470 92.300 3.886 11.182 264 HA GLN 470 HA GLN 470 93.661 3.659 13.702 265 HB2 GLN 470 HB2 GLN 470 91.156 3.135 13.092 266 HB3 GLN 470 HB3 GLN 470 91.799 1.549 12.690 267 HG2 GLN 470 HG2 GLN 470 91.651 0.995 14.823 268 HG3 GLN 470 HG3 GLN 470 92.881 2.203 15.188 269 HE21 GLN 470 HE21 GLN 470 89.548 1.386 15.331 270 HE22 GLN 470 HE22 GLN 470 89.019 2.769 16.220 271 H VAL 471 H VAL 471 93.472 1.697 10.734 272 HA VAL 471 HA VAL 471 95.061 -0.432 11.630 273 HB VAL 471 HB VAL 471 94.762 0.663 8.830 274 HG11 VAL 471 HG11 VAL 471 96.594 -0.592 8.443 275 HG12 VAL 471 HG12 VAL 471 95.437 -1.922 8.479 276 HG13 VAL 471 HG13 VAL 471 96.387 -1.540 9.915 277 HG21 VAL 471 HG21 VAL 471 93.140 -1.081 10.520 278 HG22 VAL 471 HG22 VAL 471 93.499 -1.761 8.933 279 HG23 VAL 471 HG23 VAL 471 92.707 -0.194 9.058 280 H ARG 472 H ARG 472 95.940 2.601 10.020 281 HA ARG 472 HA ARG 472 98.706 2.080 9.854 282 HB2 ARG 472 HB2 ARG 472 98.936 4.237 9.088 283 HB3 ARG 472 HB3 ARG 472 97.235 3.959 8.753 284 HG2 ARG 472 HG2 ARG 472 96.741 5.058 10.968 285 HG3 ARG 472 HG3 ARG 472 98.441 5.531 11.008 286 HD2 ARG 472 HD2 ARG 472 97.233 6.153 8.457 287 HD3 ARG 472 HD3 ARG 472 96.345 6.898 9.786 288 HE ARG 472 HE ARG 472 98.986 7.571 8.871 289 HH11 ARG 472 HH11 ARG 472 96.769 7.660 11.555 290 HH12 ARG 472 HH12 ARG 472 97.543 9.009 12.318 291 HH21 ARG 472 HH21 ARG 472 100.012 9.347 9.866 292 HH22 ARG 472 HH22 ARG 472 99.387 9.968 11.357 293 H ASP 473 H ASP 473 96.710 3.654 12.313 294 HA ASP 473 HA ASP 473 98.818 4.484 13.990 295 HB2 ASP 473 HB2 ASP 473 96.357 5.191 14.070 296 HB3 ASP 473 HB3 ASP 473 96.074 3.700 14.963 297 H THR 474 H THR 474 97.018 1.469 13.756 298 HA THR 474 HA THR 474 98.008 0.285 16.130 299 HB THR 474 HB THR 474 97.486 -1.873 14.569 300 HG1 THR 474 HG1 THR 474 95.403 -0.885 13.507 301 HG21 THR 474 HG21 THR 474 96.429 -1.148 16.739 302 HG22 THR 474 HG22 THR 474 95.347 -1.950 15.600 303 HG23 THR 474 HG23 THR 474 95.297 -0.197 15.777 304 H LEU 475 H LEU 475 98.915 -0.247 12.717 305 HA LEU 475 HA LEU 475 101.136 -1.884 13.278 306 HB2 LEU 475 HB2 LEU 475 101.892 -1.175 10.959 307 HB3 LEU 475 HB3 LEU 475 100.329 -1.960 11.070 308 HG LEU 475 HG LEU 475 99.620 0.670 11.249 309 HD11 LEU 475 HD11 LEU 475 102.159 0.457 9.697 310 HD12 LEU 475 HD12 LEU 475 101.607 1.732 10.784 311 HD13 LEU 475 HD13 LEU 475 100.907 1.584 9.172 312 HD21 LEU 475 HD21 LEU 475 99.947 -0.939 8.719 313 HD22 LEU 475 HD22 LEU 475 98.852 0.421 8.962 314 HD23 LEU 475 HD23 LEU 475 98.603 -1.080 9.853 315 H ALA 476 H ALA 476 100.727 1.587 12.933 316 HA ALA 476 HA ALA 476 103.483 2.259 13.092 317 HB1 ALA 476 HB1 ALA 476 101.141 3.999 13.849 318 HB2 ALA 476 HB2 ALA 476 101.711 3.769 12.195 319 HB3 ALA 476 HB3 ALA 476 102.761 4.525 13.393 320 H ALA 477 H ALA 477 101.050 1.423 15.402 321 HA ALA 477 HA ALA 477 102.329 2.576 17.686 322 HB1 ALA 477 HB1 ALA 477 100.679 0.364 18.425 323 HB2 ALA 477 HB2 ALA 477 99.869 1.295 17.166 324 HB3 ALA 477 HB3 ALA 477 100.389 2.089 18.652 325 H ILE 478 H ILE 478 102.544 -0.430 15.944 326 HA ILE 478 HA ILE 478 104.066 -1.771 18.005 327 HB ILE 478 HB ILE 478 103.257 -2.475 15.200 328 HG12 ILE 478 HG12 ILE 478 102.701 -4.614 16.760 329 HG13 ILE 478 HG13 ILE 478 102.632 -3.331 17.964 330 HG21 ILE 478 HG21 ILE 478 105.361 -3.875 16.837 331 HG22 ILE 478 HG22 ILE 478 105.518 -3.213 15.210 332 HG23 ILE 478 HG23 ILE 478 104.509 -4.631 15.492 333 HD11 ILE 478 HD11 ILE 478 100.641 -4.111 16.155 334 HD12 ILE 478 HD12 ILE 478 101.199 -2.523 15.628 335 HD13 ILE 478 HD13 ILE 478 100.616 -2.751 17.277 336 H SER 479 H SER 479 104.658 0.087 15.117 337 HA SER 479 HA SER 479 107.321 0.698 15.858 338 HB2 SER 479 HB2 SER 479 107.026 -1.723 14.415 339 HB3 SER 479 HB3 SER 479 107.706 -0.542 13.296 340 HG SER 479 HG SER 479 108.735 -1.420 15.776 341 H GLU 480 H GLU 480 108.344 2.176 14.354 342 HA GLU 480 HA GLU 480 106.449 3.937 13.157 343 HB2 GLU 480 HB2 GLU 480 108.679 4.543 14.261 344 HB3 GLU 480 HB3 GLU 480 109.430 4.053 12.748 345 HG2 GLU 480 HG2 GLU 480 107.790 5.706 11.653 346 HG3 GLU 480 HG3 GLU 480 107.594 6.353 13.282 347 H VAL 481 H VAL 481 105.556 3.715 11.227 348 HA VAL 481 HA VAL 481 106.961 2.151 9.171 349 HB VAL 481 HB VAL 481 104.734 2.068 8.030 350 HG11 VAL 481 HG11 VAL 481 103.964 0.839 10.505 351 HG12 VAL 481 HG12 VAL 481 105.688 0.602 10.221 352 HG13 VAL 481 HG13 VAL 481 104.515 0.088 9.008 353 HG21 VAL 481 HG21 VAL 481 104.047 4.097 9.718 354 HG22 VAL 481 HG22 VAL 481 103.278 2.709 10.488 355 HG23 VAL 481 HG23 VAL 481 102.905 3.105 8.811 356 H LEU 482 H LEU 482 106.564 2.878 6.892 357 HA LEU 482 HA LEU 482 107.221 5.695 6.705 358 HB2 LEU 482 HB2 LEU 482 108.160 3.540 5.389 359 HB3 LEU 482 HB3 LEU 482 106.927 4.061 4.256 360 HG LEU 482 HG LEU 482 109.487 5.371 5.004 361 HD11 LEU 482 HD11 LEU 482 109.210 6.039 2.534 362 HD12 LEU 482 HD12 LEU 482 107.899 4.859 2.517 363 HD13 LEU 482 HD13 LEU 482 109.540 4.349 2.916 364 HD21 LEU 482 HD21 LEU 482 108.453 7.501 3.948 365 HD22 LEU 482 HD22 LEU 482 108.192 7.174 5.660 366 HD23 LEU 482 HD23 LEU 482 106.920 6.819 4.491 367 H TYR 483 H TYR 483 105.084 3.642 4.723 368 HA TYR 483 HA TYR 483 102.975 5.664 4.969 369 HB2 TYR 483 HB2 TYR 483 104.178 6.324 2.965 370 HB3 TYR 483 HB3 TYR 483 104.091 4.683 2.334 371 HD1 TYR 483 HD1 TYR 483 101.710 3.727 1.930 372 HD2 TYR 483 HD2 TYR 483 102.547 7.876 2.380 373 HE1 TYR 483 HE1 TYR 483 99.594 4.271 0.798 374 HE2 TYR 483 HE2 TYR 483 100.434 8.431 1.251 375 HH TYR 483 HH TYR 483 98.048 6.021 0.526 376 H VAL 484 H VAL 484 100.912 4.870 4.842 377 HA VAL 484 HA VAL 484 100.689 1.946 4.615 378 HB VAL 484 HB VAL 484 98.640 3.786 5.841 379 HG11 VAL 484 HG11 VAL 484 98.342 1.237 5.082 380 HG12 VAL 484 HG12 VAL 484 97.530 1.921 6.491 381 HG13 VAL 484 HG13 VAL 484 99.007 0.978 6.694 382 HG21 VAL 484 HG21 VAL 484 99.822 2.557 7.960 383 HG22 VAL 484 HG22 VAL 484 100.183 4.198 7.423 384 HG23 VAL 484 HG23 VAL 484 101.209 2.857 6.912 385 H ASP 485 H ASP 485 99.915 1.233 2.749 386 HA ASP 485 HA ASP 485 98.174 2.977 1.164 387 HB2 ASP 485 HB2 ASP 485 99.203 0.390 0.095 388 HB3 ASP 485 HB3 ASP 485 98.939 1.923 -0.732 389 H LEU 486 H LEU 486 96.258 2.621 2.359 390 HA LEU 486 HA LEU 486 95.203 -0.076 2.539 391 HB2 LEU 486 HB2 LEU 486 94.712 1.228 4.429 392 HB3 LEU 486 HB3 LEU 486 94.255 2.618 3.463 393 HG LEU 486 HG LEU 486 92.139 1.801 3.025 394 HD11 LEU 486 HD11 LEU 486 92.021 -0.249 2.171 395 HD12 LEU 486 HD12 LEU 486 91.938 -0.838 3.832 396 HD13 LEU 486 HD13 LEU 486 93.492 -0.758 3.002 397 HD21 LEU 486 HD21 LEU 486 92.929 0.728 5.727 398 HD22 LEU 486 HD22 LEU 486 91.262 0.834 5.159 399 HD23 LEU 486 HD23 LEU 486 92.222 2.300 5.358 400 H LEU 487 H LEU 487 93.901 -0.995 1.074 401 HA LEU 487 HA LEU 487 93.330 0.223 -1.382 402 HB2 LEU 487 HB2 LEU 487 92.314 -2.237 -0.003 403 HB3 LEU 487 HB3 LEU 487 91.641 -1.738 -1.544 404 HG LEU 487 HG LEU 487 94.573 -2.278 -1.094 405 HD11 LEU 487 HD11 LEU 487 93.074 -4.274 -0.763 406 HD12 LEU 487 HD12 LEU 487 94.280 -4.424 -2.042 407 HD13 LEU 487 HD13 LEU 487 92.597 -4.092 -2.451 408 HD21 LEU 487 HD21 LEU 487 92.903 -1.486 -3.421 409 HD22 LEU 487 HD22 LEU 487 94.254 -2.585 -3.695 410 HD23 LEU 487 HD23 LEU 487 94.540 -0.997 -2.983 411 H GLU 488 H GLU 488 92.329 2.219 -0.933 412 HA GLU 488 HA GLU 488 90.244 2.904 0.604 413 HB2 GLU 488 HB2 GLU 488 91.414 4.339 -1.119 414 HB3 GLU 488 HB3 GLU 488 90.317 3.665 -2.316 415 HG2 GLU 488 HG2 GLU 488 88.415 4.576 -1.131 416 HG3 GLU 488 HG3 GLU 488 89.474 5.188 0.138 417 H GLY 489 H GLY 489 88.356 1.982 1.036 418 HA2 GLY 489 HA2 GLY 489 86.184 1.267 0.569 419 HA3 GLY 489 HA3 GLY 489 86.597 1.200 -1.136 420 H ASP 490 H ASP 490 88.972 -0.365 0.596 421 HA ASP 490 HA ASP 490 87.631 -2.966 0.247 422 HB2 ASP 490 HB2 ASP 490 89.726 -2.131 -1.250 423 HB3 ASP 490 HB3 ASP 490 90.582 -2.901 0.084 424 H THR 491 H THR 491 88.322 -4.675 1.647 425 HA THR 491 HA THR 491 88.873 -3.713 4.330 426 HB THR 491 HB THR 491 88.520 -6.195 4.901 427 HG1 THR 491 HG1 THR 491 88.397 -7.423 3.175 428 HG21 THR 491 HG21 THR 491 86.009 -5.343 3.672 429 HG22 THR 491 HG22 THR 491 86.787 -4.087 4.636 430 HG23 THR 491 HG23 THR 491 86.398 -5.645 5.366 431 H GLU 492 H GLU 492 90.917 -4.179 1.985 432 HA GLU 492 HA GLU 492 92.896 -5.545 3.682 433 HB2 GLU 492 HB2 GLU 492 92.899 -5.631 0.667 434 HB3 GLU 492 HB3 GLU 492 93.895 -6.571 1.771 435 HG2 GLU 492 HG2 GLU 492 91.375 -7.264 2.551 436 HG3 GLU 492 HG3 GLU 492 91.181 -7.051 0.811 437 H CYS 493 H CYS 493 94.610 -4.363 4.184 438 HA CYS 493 HA CYS 493 95.323 -2.099 2.443 439 HB2 CYS 493 HB2 CYS 493 95.586 -0.672 4.252 440 HB3 CYS 493 HB3 CYS 493 94.205 -1.628 4.766 441 HG CYS 493 HG CYS 493 96.394 -1.286 6.500 442 H HIS 494 H HIS 494 97.489 -1.760 2.057 443 HA HIS 494 HA HIS 494 99.360 -3.689 3.269 444 HB2 HIS 494 HB2 HIS 494 99.337 -2.706 0.406 445 HB3 HIS 494 HB3 HIS 494 100.576 -3.736 1.113 446 HD1 HIS 494 HD1 HIS 494 96.775 -4.006 1.179 447 HD2 HIS 494 HD2 HIS 494 100.137 -6.202 0.109 448 HE1 HIS 494 HE1 HIS 494 95.907 -6.247 0.438 449 HE2 HIS 494 HE2 HIS 494 97.953 -7.537 -0.267 450 H ALA 495 H ALA 495 100.590 -2.533 4.625 451 HA ALA 495 HA ALA 495 101.266 0.220 3.982 452 HB1 ALA 495 HB1 ALA 495 100.644 0.056 6.205 453 HB2 ALA 495 HB2 ALA 495 102.406 0.057 6.290 454 HB3 ALA 495 HB3 ALA 495 101.517 -1.459 6.444 455 H ARG 496 H ARG 496 103.216 0.967 3.433 456 HA ARG 496 HA ARG 496 105.290 -0.981 2.803 457 HB2 ARG 496 HB2 ARG 496 105.762 1.869 2.204 458 HB3 ARG 496 HB3 ARG 496 105.991 0.451 1.191 459 HG2 ARG 496 HG2 ARG 496 103.386 0.423 1.124 460 HG3 ARG 496 HG3 ARG 496 103.553 2.116 1.595 461 HD2 ARG 496 HD2 ARG 496 105.093 0.987 -0.715 462 HD3 ARG 496 HD3 ARG 496 103.430 1.536 -0.913 463 HE ARG 496 HE ARG 496 105.096 3.489 0.353 464 HH11 ARG 496 HH11 ARG 496 104.138 2.146 -2.713 465 HH12 ARG 496 HH12 ARG 496 104.509 3.583 -3.606 466 HH21 ARG 496 HH21 ARG 496 105.586 5.391 -0.815 467 HH22 ARG 496 HH22 ARG 496 105.332 5.427 -2.528 468 H PHE 497 H PHE 497 107.024 -1.265 4.028 469 HA PHE 497 HA PHE 497 107.535 0.616 6.222 470 HB2 PHE 497 HB2 PHE 497 108.309 -2.268 5.798 471 HB3 PHE 497 HB3 PHE 497 108.996 -1.285 7.085 472 HD1 PHE 497 HD1 PHE 497 105.502 -1.353 5.822 473 HD2 PHE 497 HD2 PHE 497 108.158 -2.237 9.026 474 HE1 PHE 497 HE1 PHE 497 103.585 -1.889 7.251 475 HE2 PHE 497 HE2 PHE 497 106.240 -2.779 10.467 476 HZ PHE 497 HZ PHE 497 103.947 -2.606 9.581 477 H LYS 498 H LYS 498 109.659 1.337 6.677 478 HA LYS 498 HA LYS 498 111.211 1.836 4.308 479 HB2 LYS 498 HB2 LYS 498 111.066 3.683 5.750 480 HB3 LYS 498 HB3 LYS 498 111.411 2.714 7.176 481 HG2 LYS 498 HG2 LYS 498 113.637 2.874 6.910 482 HG3 LYS 498 HG3 LYS 498 113.543 2.781 5.151 483 HD2 LYS 498 HD2 LYS 498 112.558 5.153 5.284 484 HD3 LYS 498 HD3 LYS 498 113.192 5.171 6.931 485 HE2 LYS 498 HE2 LYS 498 115.045 5.976 5.934 486 HE3 LYS 498 HE3 LYS 498 115.353 4.275 5.587 487 HZ1 LYS 498 HZ1 LYS 498 115.427 4.898 3.469 488 HZ2 LYS 498 HZ2 LYS 498 114.758 6.418 3.788 489 HZ3 LYS 498 HZ3 LYS 498 113.747 5.086 3.544 490 H THR 499 H THR 499 111.287 -0.483 6.836 491 HA THR 499 HA THR 499 113.869 -1.451 5.821 492 HB THR 499 HB THR 499 113.940 -2.284 8.427 493 HG1 THR 499 HG1 THR 499 113.331 -0.636 9.735 494 HG21 THR 499 HG21 THR 499 115.162 0.319 7.566 495 HG22 THR 499 HG22 THR 499 115.705 -1.225 6.908 496 HG23 THR 499 HG23 THR 499 115.828 -0.912 8.638 497 HA PRO 500 HA PRO 500 111.842 -5.354 5.596 498 HB2 PRO 500 HB2 PRO 500 113.950 -7.027 5.700 499 HB3 PRO 500 HB3 PRO 500 113.654 -5.974 4.311 500 HG2 PRO 500 HG2 PRO 500 115.541 -5.589 6.604 501 HG3 PRO 500 HG3 PRO 500 115.820 -5.329 4.872 502 HD2 PRO 500 HD2 PRO 500 115.249 -3.308 6.599 503 HD3 PRO 500 HD3 PRO 500 114.784 -3.276 4.887 504 H GLU 501 H GLU 501 114.303 -5.060 8.142 505 HA GLU 501 HA GLU 501 113.410 -7.232 9.704 506 HB2 GLU 501 HB2 GLU 501 114.700 -6.113 11.542 507 HB3 GLU 501 HB3 GLU 501 115.615 -6.372 10.063 508 HG2 GLU 501 HG2 GLU 501 114.415 -3.821 9.877 509 HG3 GLU 501 HG3 GLU 501 115.146 -3.953 11.475 510 H ASP 502 H ASP 502 112.505 -3.846 9.573 511 HA ASP 502 HA ASP 502 111.037 -3.660 11.942 512 HB2 ASP 502 HB2 ASP 502 111.656 -1.933 9.936 513 HB3 ASP 502 HB3 ASP 502 109.947 -2.207 9.611 514 H ALA 503 H ALA 503 110.089 -4.757 8.718 515 HA ALA 503 HA ALA 503 107.339 -5.091 9.304 516 HB1 ALA 503 HB1 ALA 503 108.288 -6.912 7.269 517 HB2 ALA 503 HB2 ALA 503 108.918 -5.282 7.031 518 HB3 ALA 503 HB3 ALA 503 107.179 -5.547 7.135 519 H GLN 504 H GLN 504 110.121 -7.275 9.412 520 HA GLN 504 HA GLN 504 108.721 -9.642 9.998 521 HB2 GLN 504 HB2 GLN 504 111.272 -9.156 9.427 522 HB3 GLN 504 HB3 GLN 504 111.425 -9.176 11.179 523 HG2 GLN 504 HG2 GLN 504 109.948 -11.434 10.665 524 HG3 GLN 504 HG3 GLN 504 111.069 -11.370 9.306 525 HE21 GLN 504 HE21 GLN 504 113.382 -10.773 10.044 526 HE22 GLN 504 HE22 GLN 504 113.974 -11.666 11.400 527 H ALA 505 H ALA 505 110.101 -7.147 12.074 528 HA ALA 505 HA ALA 505 109.575 -8.422 14.527 529 HB1 ALA 505 HB1 ALA 505 111.142 -6.703 14.637 530 HB2 ALA 505 HB2 ALA 505 109.724 -6.033 15.444 531 HB3 ALA 505 HB3 ALA 505 110.096 -5.567 13.784 532 H VAL 506 H VAL 506 107.632 -6.154 12.601 533 HA VAL 506 HA VAL 506 105.625 -5.804 14.567 534 HB VAL 506 HB VAL 506 105.934 -4.218 12.719 535 HG11 VAL 506 HG11 VAL 506 104.943 -6.509 11.046 536 HG12 VAL 506 HG12 VAL 506 106.423 -5.572 10.856 537 HG13 VAL 506 HG13 VAL 506 104.862 -4.833 10.509 538 HG21 VAL 506 HG21 VAL 506 103.447 -5.282 13.672 539 HG22 VAL 506 HG22 VAL 506 103.254 -4.682 12.025 540 HG23 VAL 506 HG23 VAL 506 103.873 -3.615 13.286 541 H ILE 507 H ILE 507 105.854 -8.020 11.792 542 HA ILE 507 HA ILE 507 103.253 -9.093 12.098 543 HB ILE 507 HB ILE 507 104.224 -11.096 10.833 544 HG12 ILE 507 HG12 ILE 507 106.422 -9.757 9.682 545 HG13 ILE 507 HG13 ILE 507 106.632 -9.645 11.423 546 HG21 ILE 507 HG21 ILE 507 104.095 -8.290 9.805 547 HG22 ILE 507 HG22 ILE 507 102.964 -9.623 9.567 548 HG23 ILE 507 HG23 ILE 507 104.515 -9.623 8.728 549 HD11 ILE 507 HD11 ILE 507 107.226 -11.809 9.749 550 HD12 ILE 507 HD12 ILE 507 105.850 -12.301 10.737 551 HD13 ILE 507 HD13 ILE 507 107.332 -11.737 11.508 552 H ASN 508 H ASN 508 106.348 -9.895 13.508 553 HA ASN 508 HA ASN 508 105.522 -12.364 14.688 554 HB2 ASN 508 HB2 ASN 508 107.815 -10.495 15.323 555 HB3 ASN 508 HB3 ASN 508 107.573 -12.047 16.120 556 HD21 ASN 508 HD21 ASN 508 109.659 -10.905 14.246 557 HD22 ASN 508 HD22 ASN 508 109.826 -12.113 13.022 558 H ALA 509 H ALA 509 105.682 -9.018 15.742 559 HA ALA 509 HA ALA 509 104.803 -9.540 18.418 560 HB1 ALA 509 HB1 ALA 509 106.206 -7.563 17.613 561 HB2 ALA 509 HB2 ALA 509 104.917 -7.230 18.770 562 HB3 ALA 509 HB3 ALA 509 104.680 -6.868 17.059 563 H TYR 510 H TYR 510 103.261 -9.018 15.388 564 HA TYR 510 HA TYR 510 100.843 -7.903 16.204 565 HB2 TYR 510 HB2 TYR 510 101.908 -9.055 13.813 566 HB3 TYR 510 HB3 TYR 510 100.271 -9.651 14.072 567 HD1 TYR 510 HD1 TYR 510 99.101 -8.480 12.381 568 HD2 TYR 510 HD2 TYR 510 101.600 -6.357 15.090 569 HE1 TYR 510 HE1 TYR 510 98.199 -6.357 11.531 570 HE2 TYR 510 HE2 TYR 510 100.703 -4.223 14.249 571 HH TYR 510 HH TYR 510 98.334 -4.138 11.605 572 H THR 511 H THR 511 102.054 -10.981 16.944 573 HA THR 511 HA THR 511 99.833 -12.623 16.905 574 HB THR 511 HB THR 511 101.749 -13.716 17.645 575 HG1 THR 511 HG1 THR 511 100.860 -14.678 19.302 576 HG21 THR 511 HG21 THR 511 102.584 -12.441 20.024 577 HG22 THR 511 HG22 THR 511 102.373 -11.183 18.806 578 HG23 THR 511 HG23 THR 511 103.443 -12.549 18.487 579 H GLU 512 H GLU 512 100.721 -10.070 19.116 580 HA GLU 512 HA GLU 512 98.725 -10.494 21.059 581 HB2 GLU 512 HB2 GLU 512 100.653 -8.381 20.388 582 HB3 GLU 512 HB3 GLU 512 99.196 -7.800 21.182 583 HG2 GLU 512 HG2 GLU 512 99.756 -9.855 22.790 584 HG3 GLU 512 HG3 GLU 512 101.384 -9.487 22.223 585 H ILE 513 H ILE 513 98.668 -8.909 17.956 586 HA ILE 513 HA ILE 513 96.475 -7.239 18.220 587 HB ILE 513 HB ILE 513 97.187 -8.896 15.799 588 HG12 ILE 513 HG12 ILE 513 99.058 -7.512 16.586 589 HG13 ILE 513 HG13 ILE 513 98.423 -6.910 15.059 590 HG21 ILE 513 HG21 ILE 513 94.930 -7.992 15.673 591 HG22 ILE 513 HG22 ILE 513 95.994 -7.175 14.528 592 HG23 ILE 513 HG23 ILE 513 95.543 -6.379 16.035 593 HD11 ILE 513 HD11 ILE 513 97.174 -5.679 17.376 594 HD12 ILE 513 HD12 ILE 513 97.892 -4.941 15.944 595 HD13 ILE 513 HD13 ILE 513 98.917 -5.420 17.298 596 H ASN 514 H ASN 514 96.521 -10.706 17.393 597 HA ASN 514 HA ASN 514 93.812 -11.061 16.941 598 HB2 ASN 514 HB2 ASN 514 95.212 -12.870 16.395 599 HB3 ASN 514 HB3 ASN 514 95.958 -12.891 17.989 600 HD21 ASN 514 HD21 ASN 514 92.551 -12.795 17.056 601 HD22 ASN 514 HD22 ASN 514 92.113 -14.271 17.839 602 H LYS 515 H LYS 515 95.511 -10.542 19.903 603 HA LYS 515 HA LYS 515 93.703 -11.657 21.730 604 HB2 LYS 515 HB2 LYS 515 95.288 -9.142 22.226 605 HB3 LYS 515 HB3 LYS 515 94.784 -10.353 23.398 606 HG2 LYS 515 HG2 LYS 515 96.466 -11.413 21.258 607 HG3 LYS 515 HG3 LYS 515 97.252 -10.188 22.257 608 HD2 LYS 515 HD2 LYS 515 97.446 -11.599 23.974 609 HD3 LYS 515 HD3 LYS 515 95.751 -12.075 23.860 610 HE2 LYS 515 HE2 LYS 515 96.502 -13.487 21.846 611 HE3 LYS 515 HE3 LYS 515 98.134 -13.244 22.466 612 HZ1 LYS 515 HZ1 LYS 515 95.872 -14.502 23.923 613 HZ2 LYS 515 HZ2 LYS 515 97.403 -14.208 24.582 614 HZ3 LYS 515 HZ3 LYS 515 97.230 -15.297 23.298 615 H LYS 516 H LYS 516 93.416 -8.963 19.678 616 HA LYS 516 HA LYS 516 91.043 -8.040 21.161 617 HB2 LYS 516 HB2 LYS 516 93.152 -6.489 20.804 618 HB3 LYS 516 HB3 LYS 516 92.441 -6.258 19.213 619 HG2 LYS 516 HG2 LYS 516 91.530 -4.510 20.381 620 HG3 LYS 516 HG3 LYS 516 90.274 -5.736 20.561 621 HD2 LYS 516 HD2 LYS 516 92.463 -5.307 22.584 622 HD3 LYS 516 HD3 LYS 516 90.901 -4.490 22.664 623 HE2 LYS 516 HE2 LYS 516 89.987 -6.951 22.421 624 HE3 LYS 516 HE3 LYS 516 91.572 -7.363 23.075 625 HZ1 LYS 516 HZ1 LYS 516 89.300 -6.374 24.430 626 HZ2 LYS 516 HZ2 LYS 516 90.585 -5.293 24.630 627 HZ3 LYS 516 HZ3 LYS 516 90.768 -6.914 25.075 628 H HIS 517 H HIS 517 92.456 -8.755 18.029 629 HA HIS 517 HA HIS 517 89.889 -9.453 16.957 630 HB2 HIS 517 HB2 HIS 517 91.225 -7.441 15.243 631 HB3 HIS 517 HB3 HIS 517 89.509 -7.755 15.486 632 HD1 HIS 517 HD1 HIS 517 88.326 -6.474 17.383 633 HD2 HIS 517 HD2 HIS 517 92.364 -5.573 16.997 634 HE1 HIS 517 HE1 HIS 517 88.695 -4.426 18.795 635 HE2 HIS 517 HE2 HIS 517 91.122 -3.839 18.461 636 H CYS 518 H CYS 518 90.128 -11.066 15.541 637 HA CYS 518 HA CYS 518 92.607 -12.245 15.039 638 HB2 CYS 518 HB2 CYS 518 89.908 -12.562 13.742 639 HB3 CYS 518 HB3 CYS 518 91.301 -13.499 13.213 640 HG CYS 518 HG CYS 518 90.381 -15.039 14.932 641 H TRP 519 H TRP 519 93.835 -10.345 14.315 642 HA TRP 519 HA TRP 519 93.308 -9.499 11.565 643 HB2 TRP 519 HB2 TRP 519 94.233 -8.121 13.768 644 HB3 TRP 519 HB3 TRP 519 95.696 -8.391 12.820 645 HD1 TRP 519 HD1 TRP 519 93.576 -8.308 10.116 646 HE1 TRP 519 HE1 TRP 519 93.137 -5.983 9.169 647 HE3 TRP 519 HE3 TRP 519 95.062 -5.529 14.134 648 HZ2 TRP 519 HZ2 TRP 519 93.382 -3.274 10.018 649 HZ3 TRP 519 HZ3 TRP 519 94.926 -3.079 13.989 650 HH2 TRP 519 HH2 TRP 519 94.103 -1.977 11.972 651 H LYS 520 H LYS 520 94.700 -9.753 9.900 652 HA LYS 520 HA LYS 520 96.710 -11.864 10.248 653 HB2 LYS 520 HB2 LYS 520 95.545 -11.022 7.632 654 HB3 LYS 520 HB3 LYS 520 96.227 -12.580 8.078 655 HG2 LYS 520 HG2 LYS 520 93.591 -11.436 8.987 656 HG3 LYS 520 HG3 LYS 520 93.833 -12.765 7.848 657 HD2 LYS 520 HD2 LYS 520 94.638 -14.200 9.535 658 HD3 LYS 520 HD3 LYS 520 94.875 -12.866 10.666 659 HE2 LYS 520 HE2 LYS 520 92.802 -13.072 11.438 660 HE3 LYS 520 HE3 LYS 520 92.133 -12.978 9.809 661 HZ1 LYS 520 HZ1 LYS 520 93.364 -15.510 10.426 662 HZ2 LYS 520 HZ2 LYS 520 91.862 -15.180 9.721 663 HZ3 LYS 520 HZ3 LYS 520 92.030 -15.150 11.404 664 H LEU 521 H LEU 521 98.779 -11.533 9.679 665 HA LEU 521 HA LEU 521 99.461 -9.084 8.209 666 HB2 LEU 521 HB2 LEU 521 99.817 -9.202 10.859 667 HB3 LEU 521 HB3 LEU 521 101.303 -9.980 10.357 668 HG LEU 521 HG LEU 521 101.923 -8.011 9.058 669 HD11 LEU 521 HD11 LEU 521 99.232 -7.440 9.059 670 HD12 LEU 521 HD12 LEU 521 100.520 -6.371 8.504 671 HD13 LEU 521 HD13 LEU 521 99.904 -6.230 10.151 672 HD21 LEU 521 HD21 LEU 521 101.659 -8.134 11.896 673 HD22 LEU 521 HD22 LEU 521 101.452 -6.465 11.365 674 HD23 LEU 521 HD23 LEU 521 102.911 -7.355 10.930 675 H GLU 522 H GLU 522 100.293 -9.810 6.358 676 HA GLU 522 HA GLU 522 102.276 -11.984 6.500 677 HB2 GLU 522 HB2 GLU 522 99.973 -12.462 5.392 678 HB3 GLU 522 HB3 GLU 522 100.598 -11.502 4.058 679 HG2 GLU 522 HG2 GLU 522 101.768 -13.216 3.296 680 HG3 GLU 522 HG3 GLU 522 102.544 -13.446 4.863 681 H ILE 523 H ILE 523 104.235 -11.426 5.849 682 HA ILE 523 HA ILE 523 104.709 -8.866 4.622 683 HB ILE 523 HB ILE 523 106.650 -11.089 5.267 684 HG12 ILE 523 HG12 ILE 523 105.700 -10.320 7.311 685 HG13 ILE 523 HG13 ILE 523 107.263 -9.523 7.165 686 HG21 ILE 523 HG21 ILE 523 107.856 -8.516 5.220 687 HG22 ILE 523 HG22 ILE 523 106.976 -8.748 3.709 688 HG23 ILE 523 HG23 ILE 523 108.201 -9.917 4.205 689 HD11 ILE 523 HD11 ILE 523 104.552 -8.332 6.664 690 HD12 ILE 523 HD12 ILE 523 106.071 -7.525 6.274 691 HD13 ILE 523 HD13 ILE 523 105.690 -7.928 7.950 692 H LEU 524 H LEU 524 104.514 -8.547 2.506 693 HA LEU 524 HA LEU 524 104.323 -10.607 0.597 694 HB2 LEU 524 HB2 LEU 524 104.861 -7.658 0.287 695 HB3 LEU 524 HB3 LEU 524 104.594 -8.740 -1.064 696 HG LEU 524 HG LEU 524 102.656 -7.665 0.911 697 HD11 LEU 524 HD11 LEU 524 101.260 -7.962 -1.284 698 HD12 LEU 524 HD12 LEU 524 102.851 -8.097 -2.030 699 HD13 LEU 524 HD13 LEU 524 102.420 -6.643 -1.130 700 HD21 LEU 524 HD21 LEU 524 102.261 -10.329 -0.450 701 HD22 LEU 524 HD22 LEU 524 101.091 -9.471 0.551 702 HD23 LEU 524 HD23 LEU 524 102.569 -10.107 1.272 703 H SER 525 H SER 525 105.782 -11.594 -0.679 704 HA SER 525 HA SER 525 108.510 -10.570 -0.831 705 HB2 SER 525 HB2 SER 525 108.089 -12.325 1.101 706 HB3 SER 525 HB3 SER 525 108.194 -13.481 -0.228 707 HG SER 525 HG SER 525 110.263 -13.291 0.129 708 H GLY 526 H GLY 526 109.831 -11.737 -2.440 709 HA2 GLY 526 HA2 GLY 526 110.137 -12.427 -4.605 710 HA3 GLY 526 HA3 GLY 526 108.902 -13.619 -4.239 711 H ASP 527 H ASP 527 107.681 -13.647 -6.021 712 HA ASP 527 HA ASP 527 107.131 -11.442 -7.667 713 HB2 ASP 527 HB2 ASP 527 106.503 -14.215 -7.628 714 HB3 ASP 527 HB3 ASP 527 104.995 -13.335 -7.848 715 H HIS 528 H HIS 528 105.548 -12.644 -4.787 716 HA HIS 528 HA HIS 528 103.091 -11.303 -5.108 717 HB2 HIS 528 HB2 HIS 528 104.005 -13.093 -3.316 718 HB3 HIS 528 HB3 HIS 528 104.150 -11.623 -2.356 719 HD1 HIS 528 HD1 HIS 528 102.236 -12.586 -0.819 720 HD2 HIS 528 HD2 HIS 528 101.110 -11.747 -4.729 721 HE1 HIS 528 HE1 HIS 528 99.721 -12.583 -0.808 722 HE2 HIS 528 HE2 HIS 528 99.063 -12.009 -3.172 723 H GLU 529 H GLU 529 106.086 -10.345 -3.428 724 HA GLU 529 HA GLU 529 105.085 -7.823 -2.588 725 HB2 GLU 529 HB2 GLU 529 106.918 -8.513 -1.351 726 HB3 GLU 529 HB3 GLU 529 107.791 -9.083 -2.766 727 HG2 GLU 529 HG2 GLU 529 108.937 -7.178 -2.002 728 HG3 GLU 529 HG3 GLU 529 108.049 -6.671 -3.438 729 H GLN 530 H GLN 530 107.082 -8.839 -5.330 730 HA GLN 530 HA GLN 530 107.467 -6.282 -6.434 731 HB2 GLN 530 HB2 GLN 530 108.838 -8.183 -7.093 732 HB3 GLN 530 HB3 GLN 530 107.432 -8.991 -7.774 733 HG2 GLN 530 HG2 GLN 530 107.620 -6.438 -8.979 734 HG3 GLN 530 HG3 GLN 530 109.222 -7.174 -9.018 735 HE21 GLN 530 HE21 GLN 530 105.891 -8.352 -9.370 736 HE22 GLN 530 HE22 GLN 530 106.165 -9.196 -10.853 737 H ARG 531 H ARG 531 104.956 -8.708 -6.902 738 HA ARG 531 HA ARG 531 103.628 -7.545 -9.063 739 HB2 ARG 531 HB2 ARG 531 103.147 -9.810 -8.271 740 HB3 ARG 531 HB3 ARG 531 102.479 -9.161 -6.780 741 HG2 ARG 531 HG2 ARG 531 101.172 -7.965 -9.035 742 HG3 ARG 531 HG3 ARG 531 101.127 -9.726 -9.164 743 HD2 ARG 531 HD2 ARG 531 100.545 -9.284 -6.513 744 HD3 ARG 531 HD3 ARG 531 99.736 -7.942 -7.322 745 HE ARG 531 HE ARG 531 98.162 -9.440 -7.982 746 HH11 ARG 531 HH11 ARG 531 101.178 -11.135 -7.595 747 HH12 ARG 531 HH12 ARG 531 100.513 -12.680 -8.009 748 HH21 ARG 531 HH21 ARG 531 97.274 -11.469 -8.530 749 HH22 ARG 531 HH22 ARG 531 98.293 -12.870 -8.541 750 H TYR 532 H TYR 532 103.000 -7.163 -5.571 751 HA TYR 532 HA TYR 532 100.888 -5.356 -5.791 752 HB2 TYR 532 HB2 TYR 532 101.479 -6.445 -3.678 753 HB3 TYR 532 HB3 TYR 532 102.986 -5.535 -3.619 754 HD1 TYR 532 HD1 TYR 532 102.907 -3.061 -3.310 755 HD2 TYR 532 HD2 TYR 532 99.441 -5.490 -2.927 756 HE1 TYR 532 HE1 TYR 532 101.770 -1.238 -2.113 757 HE2 TYR 532 HE2 TYR 532 98.292 -3.676 -1.729 758 HH TYR 532 HH TYR 532 99.582 -0.483 -1.559 759 H TRP 533 H TRP 533 104.381 -4.768 -5.624 760 HA TRP 533 HA TRP 533 104.253 -1.962 -5.577 761 HB2 TRP 533 HB2 TRP 533 106.344 -3.963 -6.321 762 HB3 TRP 533 HB3 TRP 533 106.605 -2.271 -6.746 763 HD1 TRP 533 HD1 TRP 533 107.062 -4.640 -3.956 764 HE1 TRP 533 HE1 TRP 533 107.674 -3.388 -1.798 765 HE3 TRP 533 HE3 TRP 533 105.938 0.118 -5.439 766 HZ2 TRP 533 HZ2 TRP 533 107.678 -0.725 -0.843 767 HZ3 TRP 533 HZ3 TRP 533 106.270 1.962 -3.844 768 HH2 TRP 533 HH2 TRP 533 107.122 1.548 -1.595 769 H GLN 534 H GLN 534 104.389 -4.266 -8.259 770 HA GLN 534 HA GLN 534 104.686 -2.509 -10.381 771 HB2 GLN 534 HB2 GLN 534 103.233 -5.129 -10.107 772 HB3 GLN 534 HB3 GLN 534 103.214 -4.245 -11.627 773 HG2 GLN 534 HG2 GLN 534 105.559 -5.451 -10.203 774 HG3 GLN 534 HG3 GLN 534 104.949 -5.810 -11.817 775 HE21 GLN 534 HE21 GLN 534 106.752 -3.566 -9.864 776 HE22 GLN 534 HE22 GLN 534 107.472 -2.695 -11.170 777 H LYS 535 H LYS 535 101.788 -3.488 -8.627 778 HA LYS 535 HA LYS 535 99.922 -2.052 -10.174 779 HB2 LYS 535 HB2 LYS 535 98.743 -3.456 -8.840 780 HB3 LYS 535 HB3 LYS 535 99.967 -3.441 -7.580 781 HG2 LYS 535 HG2 LYS 535 98.133 -1.107 -7.990 782 HG3 LYS 535 HG3 LYS 535 97.647 -2.510 -7.036 783 HD2 LYS 535 HD2 LYS 535 100.287 -1.633 -6.287 784 HD3 LYS 535 HD3 LYS 535 99.134 -0.301 -6.176 785 HE2 LYS 535 HE2 LYS 535 99.147 -2.921 -4.731 786 HE3 LYS 535 HE3 LYS 535 99.002 -1.289 -4.079 787 HZ1 LYS 535 HZ1 LYS 535 96.956 -3.031 -5.196 788 HZ2 LYS 535 HZ2 LYS 535 96.818 -1.386 -5.564 789 HZ3 LYS 535 HZ3 LYS 535 96.847 -1.891 -3.950 790 H ILE 536 H ILE 536 101.933 -1.202 -7.412 791 HA ILE 536 HA ILE 536 100.802 1.331 -6.881 792 HB ILE 536 HB ILE 536 103.660 0.467 -6.413 793 HG12 ILE 536 HG12 ILE 536 101.213 0.196 -4.655 794 HG13 ILE 536 HG13 ILE 536 102.139 -1.119 -5.372 795 HG21 ILE 536 HG21 ILE 536 102.639 2.232 -4.429 796 HG22 ILE 536 HG22 ILE 536 102.347 2.940 -6.018 797 HG23 ILE 536 HG23 ILE 536 103.983 2.480 -5.545 798 HD11 ILE 536 HD11 ILE 536 102.602 0.370 -2.928 799 HD12 ILE 536 HD12 ILE 536 104.032 0.287 -3.957 800 HD13 ILE 536 HD13 ILE 536 103.231 -1.196 -3.440 801 H LEU 537 H LEU 537 103.983 0.675 -8.350 802 HA LEU 537 HA LEU 537 104.571 3.142 -9.330 803 HB2 LEU 537 HB2 LEU 537 105.169 0.387 -10.299 804 HB3 LEU 537 HB3 LEU 537 105.578 1.736 -11.343 805 HG LEU 537 HG LEU 537 106.532 2.232 -8.668 806 HD11 LEU 537 HD11 LEU 537 107.126 -0.435 -9.875 807 HD12 LEU 537 HD12 LEU 537 106.802 -0.012 -8.195 808 HD13 LEU 537 HD13 LEU 537 108.354 0.401 -8.923 809 HD21 LEU 537 HD21 LEU 537 108.571 2.696 -9.795 810 HD22 LEU 537 HD22 LEU 537 107.269 3.255 -10.846 811 HD23 LEU 537 HD23 LEU 537 108.093 1.735 -11.195 812 H VAL 538 H VAL 538 102.842 0.626 -11.183 813 HA VAL 538 HA VAL 538 102.237 2.189 -13.411 814 HB VAL 538 HB VAL 538 100.653 -0.098 -12.233 815 HG11 VAL 538 HG11 VAL 538 99.177 0.062 -13.893 816 HG12 VAL 538 HG12 VAL 538 100.445 0.282 -15.098 817 HG13 VAL 538 HG13 VAL 538 99.833 1.670 -14.197 818 HG21 VAL 538 HG21 VAL 538 102.038 -1.536 -13.277 819 HG22 VAL 538 HG22 VAL 538 103.180 -0.195 -13.186 820 HG23 VAL 538 HG23 VAL 538 102.263 -0.473 -14.666 821 H ASP 539 H ASP 539 100.529 1.787 -10.353 822 HA ASP 539 HA ASP 539 98.198 3.211 -11.055 823 HB2 ASP 539 HB2 ASP 539 98.242 1.769 -9.097 824 HB3 ASP 539 HB3 ASP 539 99.485 2.768 -8.352 825 H ARG 540 H ARG 540 101.311 4.198 -9.748 826 HA ARG 540 HA ARG 540 100.655 6.854 -9.107 827 HB2 ARG 540 HB2 ARG 540 103.122 5.292 -9.511 828 HB3 ARG 540 HB3 ARG 540 103.286 7.020 -9.791 829 HG2 ARG 540 HG2 ARG 540 102.229 5.747 -7.274 830 HG3 ARG 540 HG3 ARG 540 103.852 6.404 -7.497 831 HD2 ARG 540 HD2 ARG 540 101.977 8.386 -8.288 832 HD3 ARG 540 HD3 ARG 540 101.477 7.759 -6.717 833 HE ARG 540 HE ARG 540 104.245 8.290 -6.696 834 HH11 ARG 540 HH11 ARG 540 101.168 9.921 -6.716 835 HH12 ARG 540 HH12 ARG 540 101.763 11.328 -5.900 836 HH21 ARG 540 HH21 ARG 540 105.039 10.136 -5.622 837 HH22 ARG 540 HH22 ARG 540 103.966 11.451 -5.279 838 H GLN 541 H GLN 541 101.834 5.370 -12.094 839 HA GLN 541 HA GLN 541 102.200 7.758 -13.545 840 HB2 GLN 541 HB2 GLN 541 101.749 4.893 -14.330 841 HB3 GLN 541 HB3 GLN 541 101.798 6.153 -15.554 842 HG2 GLN 541 HG2 GLN 541 104.021 6.405 -15.395 843 HG3 GLN 541 HG3 GLN 541 104.024 6.199 -13.644 844 HE21 GLN 541 HE21 GLN 541 103.809 4.000 -12.830 845 HE22 GLN 541 HE22 GLN 541 104.477 2.697 -13.746 846 H ALA 542 H ALA 542 99.428 5.588 -13.205 847 HA ALA 542 HA ALA 542 97.738 6.877 -15.048 848 HB1 ALA 542 HB1 ALA 542 95.924 5.787 -13.469 849 HB2 ALA 542 HB2 ALA 542 97.336 4.948 -12.826 850 HB3 ALA 542 HB3 ALA 542 96.930 4.808 -14.537 851 H LYS 543 H LYS 543 98.442 7.503 -11.677 852 HA LYS 543 HA LYS 543 96.263 9.171 -11.087 853 HB2 LYS 543 HB2 LYS 543 99.048 8.994 -9.954 854 HB3 LYS 543 HB3 LYS 543 97.852 10.120 -9.327 855 HG2 LYS 543 HG2 LYS 543 96.357 8.211 -8.852 856 HG3 LYS 543 HG3 LYS 543 97.634 7.118 -9.389 857 HD2 LYS 543 HD2 LYS 543 99.055 8.479 -7.627 858 HD3 LYS 543 HD3 LYS 543 97.462 8.784 -6.929 859 HE2 LYS 543 HE2 LYS 543 97.046 6.378 -6.826 860 HE3 LYS 543 HE3 LYS 543 98.627 6.068 -7.540 861 HZ1 LYS 543 HZ1 LYS 543 99.687 7.004 -5.626 862 HZ2 LYS 543 HZ2 LYS 543 98.584 5.833 -5.100 863 HZ3 LYS 543 HZ3 LYS 543 98.203 7.475 -4.960 864 H LEU 544 H LEU 544 99.290 9.790 -12.725 865 HA LEU 544 HA LEU 544 99.610 12.480 -12.568 866 HB2 LEU 544 HB2 LEU 544 101.045 10.964 -13.877 867 HB3 LEU 544 HB3 LEU 544 99.799 10.859 -15.105 868 HG LEU 544 HG LEU 544 100.029 13.350 -15.419 869 HD11 LEU 544 HD11 LEU 544 102.385 12.889 -13.605 870 HD12 LEU 544 HD12 LEU 544 101.038 14.003 -13.370 871 HD13 LEU 544 HD13 LEU 544 102.214 14.299 -14.651 872 HD21 LEU 544 HD21 LEU 544 101.660 11.212 -16.339 873 HD22 LEU 544 HD22 LEU 544 102.670 12.647 -16.160 874 HD23 LEU 544 HD23 LEU 544 101.226 12.706 -17.170 875 H ASN 545 H ASN 545 97.026 10.799 -14.193 876 HA ASN 545 HA ASN 545 95.575 13.270 -14.493 877 HB2 ASN 545 HB2 ASN 545 97.134 12.775 -16.601 878 HB3 ASN 545 HB3 ASN 545 95.776 11.745 -17.043 879 HD21 ASN 545 HD21 ASN 545 96.332 14.999 -15.734 880 HD22 ASN 545 HD22 ASN 545 95.170 15.786 -16.742 881 H GLN 546 H GLN 546 93.741 12.665 -13.548 882 HA GLN 546 HA GLN 546 91.772 11.591 -13.165 883 HB2 GLN 546 HB2 GLN 546 91.539 11.683 -15.623 884 HB3 GLN 546 HB3 GLN 546 92.384 10.147 -15.748 885 HG2 GLN 546 HG2 GLN 546 90.614 8.946 -14.903 886 HG3 GLN 546 HG3 GLN 546 89.928 10.340 -14.070 887 HE21 GLN 546 HE21 GLN 546 88.646 11.780 -15.200 888 HE22 GLN 546 HE22 GLN 546 88.007 11.426 -16.766 889 HA PRO 547 HA PRO 547 93.281 8.064 -10.928 890 HB2 PRO 547 HB2 PRO 547 90.908 7.360 -9.782 891 HB3 PRO 547 HB3 PRO 547 91.905 8.700 -9.206 892 HG2 PRO 547 HG2 PRO 547 89.488 8.758 -10.970 893 HG3 PRO 547 HG3 PRO 547 89.920 9.831 -9.625 894 HD2 PRO 547 HD2 PRO 547 90.279 10.539 -12.206 895 HD3 PRO 547 HD3 PRO 547 91.378 11.070 -10.918 896 H ARG 548 H ARG 548 91.776 5.822 -10.388 897 HA ARG 548 HA ARG 548 90.379 4.724 -12.557 898 HB2 ARG 548 HB2 ARG 548 93.281 4.682 -12.792 899 HB3 ARG 548 HB3 ARG 548 92.591 3.067 -12.841 900 HG2 ARG 548 HG2 ARG 548 90.960 4.576 -14.508 901 HG3 ARG 548 HG3 ARG 548 92.600 5.127 -14.856 902 HD2 ARG 548 HD2 ARG 548 92.313 2.220 -14.600 903 HD3 ARG 548 HD3 ARG 548 91.424 2.927 -15.950 904 HE ARG 548 HE ARG 548 93.969 4.002 -16.043 905 HH11 ARG 548 HH11 ARG 548 92.523 0.839 -16.238 906 HH12 ARG 548 HH12 ARG 548 93.752 0.200 -17.276 907 HH21 ARG 548 HH21 ARG 548 95.595 3.167 -17.407 908 HH22 ARG 548 HH22 ARG 548 95.499 1.522 -17.940 909 H GLU 549 H GLU 549 89.167 3.240 -11.607 910 HA GLU 549 HA GLU 549 90.277 1.135 -10.029 911 HB2 GLU 549 HB2 GLU 549 90.205 3.006 -8.380 912 HB3 GLU 549 HB3 GLU 549 88.464 3.090 -8.606 913 HG2 GLU 549 HG2 GLU 549 88.075 1.260 -7.357 914 HG3 GLU 549 HG3 GLU 549 89.531 0.437 -7.914 915 H LYS 550 H LYS 550 89.156 0.196 -11.913 916 HA LYS 550 HA LYS 550 86.711 -0.970 -11.182 917 HB2 LYS 550 HB2 LYS 550 86.058 1.457 -11.849 918 HB3 LYS 550 HB3 LYS 550 86.323 0.903 -13.496 919 HG2 LYS 550 HG2 LYS 550 84.014 0.683 -13.068 920 HG3 LYS 550 HG3 LYS 550 84.689 -0.946 -13.027 921 HD2 LYS 550 HD2 LYS 550 84.013 -1.240 -10.926 922 HD3 LYS 550 HD3 LYS 550 84.788 0.261 -10.413 923 HE2 LYS 550 HE2 LYS 550 82.431 0.854 -11.931 924 HE3 LYS 550 HE3 LYS 550 82.035 -0.281 -10.642 925 HZ1 LYS 550 HZ1 LYS 550 81.980 2.242 -10.173 926 HZ2 LYS 550 HZ2 LYS 550 83.661 2.102 -10.052 927 HZ3 LYS 550 HZ3 LYS 550 82.663 1.207 -9.020 928 H LYS 551 H LYS 551 87.133 -2.929 -11.969 929 HA LYS 551 HA LYS 551 86.974 -3.725 -14.542 930 HB2 LYS 551 HB2 LYS 551 89.452 -2.329 -14.154 931 HB3 LYS 551 HB3 LYS 551 89.783 -4.010 -14.548 932 HG2 LYS 551 HG2 LYS 551 87.733 -2.987 -16.273 933 HG3 LYS 551 HG3 LYS 551 89.144 -1.926 -16.304 934 HD2 LYS 551 HD2 LYS 551 89.505 -4.886 -16.519 935 HD3 LYS 551 HD3 LYS 551 89.001 -3.959 -17.935 936 HE2 LYS 551 HE2 LYS 551 91.564 -3.858 -16.407 937 HE3 LYS 551 HE3 LYS 551 91.299 -3.940 -18.148 938 HZ1 LYS 551 HZ1 LYS 551 90.324 -1.616 -17.878 939 HZ2 LYS 551 HZ2 LYS 551 92.005 -1.773 -17.770 940 HZ3 LYS 551 HZ3 LYS 551 91.080 -1.597 -16.364 941 H ARG 552 H ARG 552 88.431 -4.151 -11.449 942 HA ARG 552 HA ARG 552 89.173 -6.892 -11.813 943 HB2 ARG 552 HB2 ARG 552 89.629 -4.919 -9.875 944 HB3 ARG 552 HB3 ARG 552 88.721 -6.179 -9.053 945 HG2 ARG 552 HG2 ARG 552 90.357 -7.820 -9.585 946 HG3 ARG 552 HG3 ARG 552 91.196 -6.713 -10.674 947 HD2 ARG 552 HD2 ARG 552 92.211 -5.599 -8.981 948 HD3 ARG 552 HD3 ARG 552 90.849 -5.807 -7.883 949 HE ARG 552 HE ARG 552 92.130 -8.287 -8.354 950 HH11 ARG 552 HH11 ARG 552 92.521 -5.277 -6.650 951 HH12 ARG 552 HH12 ARG 552 93.503 -5.960 -5.399 952 HH21 ARG 552 HH21 ARG 552 93.424 -9.201 -6.711 953 HH22 ARG 552 HH22 ARG 552 94.018 -8.194 -5.434 954 H GLY 553 H GLY 553 86.830 -5.546 -9.507 955 HA2 GLY 553 HA2 GLY 553 84.590 -6.156 -9.202 956 HA3 GLY 553 HA3 GLY 553 84.798 -7.425 -10.399 957 H THR 554 H THR 554 84.862 -9.450 -9.671 958 HA THR 554 HA THR 554 84.750 -11.187 -8.187 959 HB THR 554 HB THR 554 86.790 -11.740 -7.408 960 HG1 THR 554 HG1 THR 554 87.328 -10.791 -5.603 961 HG21 THR 554 HG21 THR 554 87.691 -9.092 -8.526 962 HG22 THR 554 HG22 THR 554 87.213 -10.457 -9.534 963 HG23 THR 554 HG23 THR 554 88.598 -10.602 -8.452 964 H GLU 555 H GLU 555 85.027 -11.693 -5.653 965 HA GLU 555 HA GLU 555 84.271 -9.645 -3.843 966 HB2 GLU 555 HB2 GLU 555 82.169 -10.141 -5.331 967 HB3 GLU 555 HB3 GLU 555 82.023 -11.565 -4.310 968 HG2 GLU 555 HG2 GLU 555 82.039 -10.060 -2.327 969 HG3 GLU 555 HG3 GLU 555 81.989 -8.689 -3.434 970 H LYS 556 H LYS 556 86.254 -11.389 -3.580 971 HA LYS 556 HA LYS 556 85.488 -13.783 -2.200 972 HB2 LYS 556 HB2 LYS 556 87.869 -14.080 -1.798 973 HB3 LYS 556 HB3 LYS 556 87.592 -13.623 -3.473 974 HG2 LYS 556 HG2 LYS 556 88.357 -11.413 -3.091 975 HG3 LYS 556 HG3 LYS 556 88.363 -11.650 -1.342 976 HD2 LYS 556 HD2 LYS 556 90.049 -13.364 -3.132 977 HD3 LYS 556 HD3 LYS 556 90.603 -11.765 -2.626 978 HE2 LYS 556 HE2 LYS 556 90.400 -12.405 -0.294 979 HE3 LYS 556 HE3 LYS 556 89.758 -13.980 -0.761 980 HZ1 LYS 556 HZ1 LYS 556 91.835 -14.566 -1.731 981 HZ2 LYS 556 HZ2 LYS 556 92.155 -13.983 -0.177 982 HZ3 LYS 556 HZ3 LYS 556 92.454 -13.006 -1.525 983 H LEU 557 H LEU 557 85.326 -14.154 -0.052 984 HA LEU 557 HA LEU 557 85.199 -11.832 1.680 985 HB2 LEU 557 HB2 LEU 557 84.285 -14.658 1.820 986 HB3 LEU 557 HB3 LEU 557 84.563 -13.818 3.334 987 HG LEU 557 HG LEU 557 82.675 -12.926 1.155 988 HD11 LEU 557 HD11 LEU 557 81.372 -13.412 3.610 989 HD12 LEU 557 HD12 LEU 557 82.379 -14.818 3.265 990 HD13 LEU 557 HD13 LEU 557 81.187 -14.277 2.084 991 HD21 LEU 557 HD21 LEU 557 83.881 -11.507 3.335 992 HD22 LEU 557 HD22 LEU 557 82.141 -11.636 3.589 993 HD23 LEU 557 HD23 LEU 557 82.763 -10.921 2.102 994 H ILE 558 H ILE 558 86.908 -14.951 1.626 995 HA ILE 558 HA ILE 558 89.308 -13.862 2.635 996 HB ILE 558 HB ILE 558 88.960 -15.531 4.781 997 HG12 ILE 558 HG12 ILE 558 86.442 -13.873 4.589 998 HG13 ILE 558 HG13 ILE 558 86.494 -15.585 4.183 999 HG21 ILE 558 HG21 ILE 558 88.234 -12.721 5.260 1000 HG22 ILE 558 HG22 ILE 558 89.723 -12.979 4.352 1001 HG23 ILE 558 HG23 ILE 558 89.531 -13.695 5.952 1002 HD11 ILE 558 HD11 ILE 558 86.435 -16.196 6.321 1003 HD12 ILE 558 HD12 ILE 558 85.938 -14.535 6.644 1004 HD13 ILE 558 HD13 ILE 558 87.635 -14.993 6.791 1005 H THR 559 H THR 559 90.982 -15.446 2.890 1006 HA THR 559 HA THR 559 90.297 -18.062 1.713 1007 HB THR 559 HB THR 559 93.032 -16.896 1.391 1008 HG1 THR 559 HG1 THR 559 90.987 -16.401 -0.511 1009 HG21 THR 559 HG21 THR 559 93.316 -18.615 -0.001 1010 HG22 THR 559 HG22 THR 559 91.832 -18.237 -0.875 1011 HG23 THR 559 HG23 THR 559 91.770 -19.235 0.578 1012 H LYS 560 H LYS 560 91.099 -19.868 2.663 1013 HA LYS 560 HA LYS 560 92.337 -19.539 5.270 1014 HB2 LYS 560 HB2 LYS 560 90.904 -21.717 3.846 1015 HB3 LYS 560 HB3 LYS 560 92.090 -22.198 5.052 1016 HG2 LYS 560 HG2 LYS 560 90.464 -20.124 6.136 1017 HG3 LYS 560 HG3 LYS 560 89.426 -21.377 5.451 1018 HD2 LYS 560 HD2 LYS 560 89.806 -22.647 7.234 1019 HD3 LYS 560 HD3 LYS 560 91.525 -22.678 6.834 1020 HE2 LYS 560 HE2 LYS 560 91.694 -21.741 8.891 1021 HE3 LYS 560 HE3 LYS 560 91.405 -20.266 7.971 1022 HZ1 LYS 560 HZ1 LYS 560 89.823 -21.427 10.008 1023 HZ2 LYS 560 HZ2 LYS 560 88.915 -21.303 8.586 1024 HZ3 LYS 560 HZ3 LYS 560 89.642 -19.926 9.246 1025 H ALA 561 H ALA 561 92.952 -22.137 2.952 1026 HA ALA 561 HA ALA 561 95.711 -21.338 2.605 1027 HB1 ALA 561 HB1 ALA 561 95.622 -24.105 3.524 1028 HB2 ALA 561 HB2 ALA 561 95.187 -22.933 4.768 1029 HB3 ALA 561 HB3 ALA 561 96.739 -22.806 3.940 Start of MODEL 14 1 H1 MET 437 HT1 MET 437 106.371 22.955 4.513 2 H2 MET 437 HT2 MET 437 107.550 22.837 5.756 3 H3 MET 437 HT3 MET 437 106.753 21.426 5.189 4 HA MET 437 HA MET 437 107.709 22.008 2.956 5 HB2 MET 437 HB2 MET 437 108.399 24.255 3.442 6 HB3 MET 437 HB3 MET 437 109.333 23.728 4.834 7 HG2 MET 437 HG2 MET 437 110.854 24.216 3.081 8 HG3 MET 437 HG3 MET 437 110.810 22.465 3.279 9 HE1 MET 437 HE1 MET 437 108.333 24.930 1.665 10 HE2 MET 437 HE2 MET 437 108.541 24.672 -0.067 11 HE3 MET 437 HE3 MET 437 109.795 25.496 0.858 12 H HIS 438 H HIS 438 107.831 19.755 3.289 13 HA HIS 438 HA HIS 438 110.412 18.724 3.656 14 HB2 HIS 438 HB2 HIS 438 109.701 17.291 5.740 15 HB3 HIS 438 HB3 HIS 438 110.351 18.912 5.963 16 HD1 HIS 438 HD1 HIS 438 106.790 18.122 4.969 17 HD2 HIS 438 HD2 HIS 438 108.930 19.620 8.201 18 HE1 HIS 438 HE1 HIS 438 105.059 18.950 6.596 19 HE2 HIS 438 HE2 HIS 438 106.377 19.866 8.538 20 H HIS 439 H HIS 439 109.833 17.720 1.719 21 HA HIS 439 HA HIS 439 107.906 15.506 1.999 22 HB2 HIS 439 HB2 HIS 439 107.734 15.762 -0.572 23 HB3 HIS 439 HB3 HIS 439 106.888 16.924 0.445 24 HD1 HIS 439 HD1 HIS 439 107.885 19.338 0.563 25 HD2 HIS 439 HD2 HIS 439 109.768 16.809 -2.143 26 HE1 HIS 439 HE1 HIS 439 109.290 20.835 -0.889 27 HE2 HIS 439 HE2 HIS 439 110.360 19.291 -2.568 28 H HIS 440 H HIS 440 108.370 13.971 -0.083 29 HA HIS 440 HA HIS 440 111.149 13.579 -0.654 30 HB2 HIS 440 HB2 HIS 440 110.079 11.181 0.691 31 HB3 HIS 440 HB3 HIS 440 111.701 11.867 0.728 32 HD1 HIS 440 HD1 HIS 440 112.278 13.421 2.660 33 HD2 HIS 440 HD2 HIS 440 108.299 12.226 2.642 34 HE1 HIS 440 HE1 HIS 440 111.348 14.147 4.881 35 HE2 HIS 440 HE2 HIS 440 108.966 13.328 4.884 36 H HIS 441 H HIS 441 111.332 12.627 -2.575 37 HA HIS 441 HA HIS 441 110.058 10.417 -3.548 38 HB2 HIS 441 HB2 HIS 441 108.314 12.757 -3.607 39 HB3 HIS 441 HB3 HIS 441 108.520 12.026 -5.196 40 HD1 HIS 441 HD1 HIS 441 106.033 11.976 -2.962 41 HD2 HIS 441 HD2 HIS 441 108.435 8.878 -4.342 42 HE1 HIS 441 HE1 HIS 441 104.718 9.872 -2.553 43 HE2 HIS 441 HE2 HIS 441 106.229 8.005 -3.314 44 H HIS 442 H HIS 442 112.002 10.107 -4.549 45 HA HIS 442 HA HIS 442 113.485 11.906 -6.024 46 HB2 HIS 442 HB2 HIS 442 114.195 9.729 -7.314 47 HB3 HIS 442 HB3 HIS 442 114.610 9.928 -5.614 48 HD1 HIS 442 HD1 HIS 442 111.626 8.485 -7.505 49 HD2 HIS 442 HD2 HIS 442 114.079 7.665 -4.253 50 HE1 HIS 442 HE1 HIS 442 110.797 6.303 -6.572 51 HE2 HIS 442 HE2 HIS 442 112.241 5.870 -4.554 52 H HIS 443 H HIS 443 113.850 11.954 -8.385 53 HA HIS 443 HA HIS 443 111.281 12.068 -9.781 54 HB2 HIS 443 HB2 HIS 443 113.393 13.845 -9.660 55 HB3 HIS 443 HB3 HIS 443 113.621 13.072 -11.223 56 HD1 HIS 443 HD1 HIS 443 113.041 15.699 -11.896 57 HD2 HIS 443 HD2 HIS 443 109.918 13.287 -10.591 58 HE1 HIS 443 HE1 HIS 443 110.940 16.838 -12.678 59 HE2 HIS 443 HE2 HIS 443 109.060 15.392 -11.827 60 H SER 444 H SER 444 112.600 12.053 -12.405 61 HA SER 444 HA SER 444 112.942 10.564 -14.092 62 HB2 SER 444 HB2 SER 444 114.496 8.555 -12.798 63 HB3 SER 444 HB3 SER 444 115.052 9.852 -13.857 64 HG SER 444 HG SER 444 114.944 11.190 -11.873 65 H ASN 445 H ASN 445 111.199 9.465 -14.716 66 HA ASN 445 HA ASN 445 110.328 7.182 -13.070 67 HB2 ASN 445 HB2 ASN 445 108.238 7.729 -14.807 68 HB3 ASN 445 HB3 ASN 445 108.323 8.194 -13.111 69 HD21 ASN 445 HD21 ASN 445 107.322 10.113 -13.161 70 HD22 ASN 445 HD22 ASN 445 107.851 11.475 -14.084 71 H ALA 446 H ALA 446 109.051 5.544 -14.501 72 HA ALA 446 HA ALA 446 109.077 3.974 -16.146 73 HB1 ALA 446 HB1 ALA 446 108.641 5.474 -17.848 74 HB2 ALA 446 HB2 ALA 446 110.145 4.729 -18.388 75 HB3 ALA 446 HB3 ALA 446 110.171 6.323 -17.634 76 H THR 447 H THR 447 111.595 4.859 -14.419 77 HA THR 447 HA THR 447 113.141 2.565 -15.042 78 HB THR 447 HB THR 447 114.576 5.144 -15.655 79 HG1 THR 447 HG1 THR 447 113.739 5.084 -17.591 80 HG21 THR 447 HG21 THR 447 116.349 3.825 -16.346 81 HG22 THR 447 HG22 THR 447 115.329 2.408 -16.599 82 HG23 THR 447 HG23 THR 447 115.732 2.924 -14.962 83 H GLY 448 H GLY 448 112.569 2.501 -12.739 84 HA2 GLY 448 HA2 GLY 448 114.696 3.729 -11.148 85 HA3 GLY 448 HA3 GLY 448 113.038 4.050 -10.664 86 HA PRO 449 HA PRO 449 113.672 -0.633 -9.894 87 HB2 PRO 449 HB2 PRO 449 116.039 -1.770 -10.451 88 HB3 PRO 449 HB3 PRO 449 114.806 -1.528 -11.695 89 HG2 PRO 449 HG2 PRO 449 117.262 0.080 -11.122 90 HG3 PRO 449 HG3 PRO 449 116.582 -0.409 -12.684 91 HD2 PRO 449 HD2 PRO 449 116.237 2.076 -11.564 92 HD3 PRO 449 HD3 PRO 449 115.114 1.343 -12.727 93 H GLN 450 H GLN 450 113.852 0.987 -7.925 94 HA GLN 450 HA GLN 450 115.798 -0.186 -6.138 95 HB2 GLN 450 HB2 GLN 450 116.830 1.893 -7.302 96 HB3 GLN 450 HB3 GLN 450 115.756 2.814 -6.259 97 HG2 GLN 450 HG2 GLN 450 118.155 2.406 -5.477 98 HG3 GLN 450 HG3 GLN 450 116.846 2.145 -4.325 99 HE21 GLN 450 HE21 GLN 450 116.908 0.323 -3.226 100 HE22 GLN 450 HE22 GLN 450 117.749 -1.114 -3.684 101 H PHE 451 H PHE 451 112.915 -0.156 -6.395 102 HA PHE 451 HA PHE 451 111.847 1.578 -4.373 103 HB2 PHE 451 HB2 PHE 451 109.753 0.487 -4.778 104 HB3 PHE 451 HB3 PHE 451 110.543 0.697 -6.338 105 HD1 PHE 451 HD1 PHE 451 111.005 -1.142 -7.713 106 HD2 PHE 451 HD2 PHE 451 109.856 -1.768 -3.663 107 HE1 PHE 451 HE1 PHE 451 110.777 -3.552 -8.155 108 HE2 PHE 451 HE2 PHE 451 109.626 -4.179 -4.097 109 HZ PHE 451 HZ PHE 451 110.087 -5.074 -6.346 110 H VAL 452 H VAL 452 111.534 1.180 -2.252 111 HA VAL 452 HA VAL 452 112.999 -0.653 -0.842 112 HB VAL 452 HB VAL 452 111.903 1.228 0.239 113 HG11 VAL 452 HG11 VAL 452 109.321 0.398 0.787 114 HG12 VAL 452 HG12 VAL 452 109.535 0.038 -0.926 115 HG13 VAL 452 HG13 VAL 452 109.800 1.676 -0.329 116 HG21 VAL 452 HG21 VAL 452 110.699 -0.268 2.101 117 HG22 VAL 452 HG22 VAL 452 112.449 -0.165 1.931 118 HG23 VAL 452 HG23 VAL 452 111.575 -1.532 1.238 119 H SER 453 H SER 453 112.957 -2.655 -1.793 120 HA SER 453 HA SER 453 110.606 -4.146 -2.312 121 HB2 SER 453 HB2 SER 453 112.009 -5.546 -3.361 122 HB3 SER 453 HB3 SER 453 113.262 -4.357 -3.007 123 HG SER 453 HG SER 453 113.999 -6.269 -2.212 124 H GLY 454 H GLY 454 109.690 -5.862 -1.283 125 HA2 GLY 454 HA2 GLY 454 109.049 -7.235 0.423 126 HA3 GLY 454 HA3 GLY 454 110.690 -7.126 1.017 127 H VAL 455 H VAL 455 108.538 -4.330 0.759 128 HA VAL 455 HA VAL 455 108.361 -4.358 3.697 129 HB VAL 455 HB VAL 455 108.445 -1.932 3.713 130 HG11 VAL 455 HG11 VAL 455 110.771 -1.670 3.316 131 HG12 VAL 455 HG12 VAL 455 110.776 -2.957 2.109 132 HG13 VAL 455 HG13 VAL 455 110.527 -3.344 3.811 133 HG21 VAL 455 HG21 VAL 455 108.072 -0.699 1.899 134 HG22 VAL 455 HG22 VAL 455 107.829 -2.188 0.985 135 HG23 VAL 455 HG23 VAL 455 109.429 -1.451 1.063 136 H ILE 456 H ILE 456 106.607 -4.876 1.062 137 HA ILE 456 HA ILE 456 104.280 -3.266 1.761 138 HB ILE 456 HB ILE 456 104.748 -5.265 -0.448 139 HG12 ILE 456 HG12 ILE 456 105.827 -3.327 -1.114 140 HG13 ILE 456 HG13 ILE 456 104.210 -3.059 -1.752 141 HG21 ILE 456 HG21 ILE 456 102.435 -3.842 -1.023 142 HG22 ILE 456 HG22 ILE 456 102.275 -4.278 0.678 143 HG23 ILE 456 HG23 ILE 456 102.540 -5.533 -0.532 144 HD11 ILE 456 HD11 ILE 456 104.752 -1.036 -0.779 145 HD12 ILE 456 HD12 ILE 456 105.525 -1.800 0.610 146 HD13 ILE 456 HD13 ILE 456 103.768 -1.829 0.452 147 H VAL 457 H VAL 457 103.580 -4.073 3.717 148 HA VAL 457 HA VAL 457 103.118 -6.931 3.983 149 HB VAL 457 HB VAL 457 102.688 -4.702 5.973 150 HG11 VAL 457 HG11 VAL 457 102.813 -7.618 6.638 151 HG12 VAL 457 HG12 VAL 457 101.292 -6.870 6.152 152 HG13 VAL 457 HG13 VAL 457 102.144 -6.286 7.581 153 HG21 VAL 457 HG21 VAL 457 104.906 -4.781 6.186 154 HG22 VAL 457 HG22 VAL 457 105.025 -6.205 5.152 155 HG23 VAL 457 HG23 VAL 457 104.693 -6.390 6.874 156 H LYS 458 H LYS 458 101.305 -7.833 3.416 157 HA LYS 458 HA LYS 458 98.925 -6.298 2.874 158 HB2 LYS 458 HB2 LYS 458 99.271 -8.034 1.337 159 HB3 LYS 458 HB3 LYS 458 99.680 -9.192 2.596 160 HG2 LYS 458 HG2 LYS 458 97.296 -9.053 3.363 161 HG3 LYS 458 HG3 LYS 458 96.960 -8.112 1.908 162 HD2 LYS 458 HD2 LYS 458 98.190 -10.158 0.754 163 HD3 LYS 458 HD3 LYS 458 97.626 -10.993 2.201 164 HE2 LYS 458 HE2 LYS 458 95.373 -10.570 1.703 165 HE3 LYS 458 HE3 LYS 458 95.781 -9.318 0.529 166 HZ1 LYS 458 HZ1 LYS 458 96.368 -10.868 -1.050 167 HZ2 LYS 458 HZ2 LYS 458 95.066 -11.639 -0.293 168 HZ3 LYS 458 HZ3 LYS 458 96.650 -12.095 0.081 169 H ILE 459 H ILE 459 97.343 -5.897 4.266 170 HA ILE 459 HA ILE 459 97.145 -7.581 6.675 171 HB ILE 459 HB ILE 459 96.247 -4.709 6.463 172 HG12 ILE 459 HG12 ILE 459 98.777 -5.897 7.624 173 HG13 ILE 459 HG13 ILE 459 98.661 -4.756 6.289 174 HG21 ILE 459 HG21 ILE 459 95.750 -6.790 8.350 175 HG22 ILE 459 HG22 ILE 459 95.195 -5.116 8.377 176 HG23 ILE 459 HG23 ILE 459 96.734 -5.546 9.121 177 HD11 ILE 459 HD11 ILE 459 99.377 -3.594 8.248 178 HD12 ILE 459 HD12 ILE 459 98.023 -4.233 9.181 179 HD13 ILE 459 HD13 ILE 459 97.731 -3.090 7.870 180 H ILE 460 H ILE 460 95.348 -8.699 6.923 181 HA ILE 460 HA ILE 460 92.885 -7.734 5.662 182 HB ILE 460 HB ILE 460 94.040 -9.639 4.346 183 HG12 ILE 460 HG12 ILE 460 91.581 -8.719 4.320 184 HG13 ILE 460 HG13 ILE 460 91.991 -10.189 3.444 185 HG21 ILE 460 HG21 ILE 460 93.270 -11.041 6.830 186 HG22 ILE 460 HG22 ILE 460 94.558 -11.383 5.679 187 HG23 ILE 460 HG23 ILE 460 92.901 -11.861 5.316 188 HD11 ILE 460 HD11 ILE 460 90.939 -10.286 6.244 189 HD12 ILE 460 HD12 ILE 460 90.954 -11.553 5.019 190 HD13 ILE 460 HD13 ILE 460 89.864 -10.177 4.849 191 H SER 461 H SER 461 91.049 -7.985 6.845 192 HA SER 461 HA SER 461 91.320 -9.422 9.401 193 HB2 SER 461 HB2 SER 461 91.424 -7.063 9.891 194 HB3 SER 461 HB3 SER 461 90.004 -6.750 8.902 195 HG SER 461 HG SER 461 89.791 -6.980 11.324 196 H THR 462 H THR 462 88.729 -8.997 10.306 197 HA THR 462 HA THR 462 87.042 -10.253 8.246 198 HB THR 462 HB THR 462 86.091 -11.739 10.034 199 HG1 THR 462 HG1 THR 462 88.427 -11.525 11.526 200 HG21 THR 462 HG21 THR 462 88.818 -12.676 10.072 201 HG22 THR 462 HG22 THR 462 88.387 -12.057 8.479 202 HG23 THR 462 HG23 THR 462 87.419 -13.330 9.221 203 H GLU 463 H GLU 463 87.394 -7.678 10.168 204 HA GLU 463 HA GLU 463 85.035 -6.461 9.842 205 HB2 GLU 463 HB2 GLU 463 83.629 -8.028 10.795 206 HB3 GLU 463 HB3 GLU 463 84.807 -8.505 12.010 207 HG2 GLU 463 HG2 GLU 463 84.226 -6.822 13.437 208 HG3 GLU 463 HG3 GLU 463 83.682 -5.759 12.141 209 HA PRO 464 HA PRO 464 87.093 -5.127 14.220 210 HB2 PRO 464 HB2 PRO 464 89.706 -6.310 13.369 211 HB3 PRO 464 HB3 PRO 464 89.060 -6.068 14.997 212 HG2 PRO 464 HG2 PRO 464 89.006 -8.478 13.873 213 HG3 PRO 464 HG3 PRO 464 87.646 -7.903 14.854 214 HD2 PRO 464 HD2 PRO 464 87.860 -8.199 11.903 215 HD3 PRO 464 HD3 PRO 464 86.438 -8.343 12.954 216 H LEU 465 H LEU 465 88.785 -5.364 11.104 217 HA LEU 465 HA LEU 465 90.455 -3.264 11.070 218 HB2 LEU 465 HB2 LEU 465 89.132 -4.755 9.123 219 HB3 LEU 465 HB3 LEU 465 88.755 -3.089 8.728 220 HG LEU 465 HG LEU 465 91.594 -3.597 9.312 221 HD11 LEU 465 HD11 LEU 465 91.396 -5.603 8.163 222 HD12 LEU 465 HD12 LEU 465 91.848 -4.458 6.899 223 HD13 LEU 465 HD13 LEU 465 90.168 -4.969 7.066 224 HD21 LEU 465 HD21 LEU 465 90.433 -1.482 8.419 225 HD22 LEU 465 HD22 LEU 465 90.397 -2.331 6.874 226 HD23 LEU 465 HD23 LEU 465 91.940 -1.995 7.659 227 HA PRO 466 HA PRO 466 87.572 -0.027 12.408 228 HB2 PRO 466 HB2 PRO 466 89.478 1.604 13.397 229 HB3 PRO 466 HB3 PRO 466 88.895 0.189 14.282 230 HG2 PRO 466 HG2 PRO 466 91.368 0.493 12.614 231 HG3 PRO 466 HG3 PRO 466 91.182 -0.268 14.206 232 HD2 PRO 466 HD2 PRO 466 91.285 -1.693 11.904 233 HD3 PRO 466 HD3 PRO 466 90.343 -2.217 13.315 234 H GLY 467 H GLY 467 90.656 0.546 10.716 235 HA2 GLY 467 HA2 GLY 467 89.820 1.694 8.435 236 HA3 GLY 467 HA3 GLY 467 89.660 3.022 9.574 237 H ARG 468 H ARG 468 91.280 3.654 7.666 238 HA ARG 468 HA ARG 468 93.934 2.749 7.791 239 HB2 ARG 468 HB2 ARG 468 94.486 4.550 6.385 240 HB3 ARG 468 HB3 ARG 468 92.827 4.146 5.966 241 HG2 ARG 468 HG2 ARG 468 92.235 6.003 7.697 242 HG3 ARG 468 HG3 ARG 468 93.893 6.531 7.397 243 HD2 ARG 468 HD2 ARG 468 92.882 7.714 5.748 244 HD3 ARG 468 HD3 ARG 468 93.099 6.200 4.871 245 HE ARG 468 HE ARG 468 90.612 6.322 6.287 246 HH11 ARG 468 HH11 ARG 468 92.254 7.247 3.356 247 HH12 ARG 468 HH12 ARG 468 90.801 7.338 2.418 248 HH21 ARG 468 HH21 ARG 468 88.694 6.444 5.062 249 HH22 ARG 468 HH22 ARG 468 88.777 6.883 3.389 250 H LYS 469 H LYS 469 92.273 5.366 9.497 251 HA LYS 469 HA LYS 469 94.541 6.509 10.700 252 HB2 LYS 469 HB2 LYS 469 92.839 7.308 12.436 253 HB3 LYS 469 HB3 LYS 469 92.570 7.791 10.767 254 HG2 LYS 469 HG2 LYS 469 90.518 6.981 10.929 255 HG3 LYS 469 HG3 LYS 469 91.216 5.367 11.066 256 HD2 LYS 469 HD2 LYS 469 90.329 5.249 13.106 257 HD3 LYS 469 HD3 LYS 469 91.480 6.491 13.605 258 HE2 LYS 469 HE2 LYS 469 89.882 8.043 13.773 259 HE3 LYS 469 HE3 LYS 469 89.178 7.598 12.219 260 HZ1 LYS 469 HZ1 LYS 469 88.334 6.901 14.858 261 HZ2 LYS 469 HZ2 LYS 469 88.517 5.533 13.881 262 HZ3 LYS 469 HZ3 LYS 469 87.492 6.787 13.394 263 H GLN 470 H GLN 470 92.323 3.982 11.844 264 HA GLN 470 HA GLN 470 93.800 3.619 14.287 265 HB2 GLN 470 HB2 GLN 470 91.333 2.525 13.092 266 HB3 GLN 470 HB3 GLN 470 92.215 1.424 14.142 267 HG2 GLN 470 HG2 GLN 470 91.794 2.633 16.011 268 HG3 GLN 470 HG3 GLN 470 91.761 4.168 15.146 269 HE21 GLN 470 HE21 GLN 470 89.926 1.853 16.671 270 HE22 GLN 470 HE22 GLN 470 88.369 2.301 16.071 271 H VAL 471 H VAL 471 93.409 1.844 11.238 272 HA VAL 471 HA VAL 471 94.996 -0.368 11.931 273 HB VAL 471 HB VAL 471 94.412 0.871 9.243 274 HG11 VAL 471 HG11 VAL 471 96.396 -1.103 9.940 275 HG12 VAL 471 HG12 VAL 471 96.081 -0.322 8.390 276 HG13 VAL 471 HG13 VAL 471 95.188 -1.774 8.844 277 HG21 VAL 471 HG21 VAL 471 93.046 -0.997 10.992 278 HG22 VAL 471 HG22 VAL 471 93.313 -1.662 9.380 279 HG23 VAL 471 HG23 VAL 471 92.450 -0.139 9.571 280 H ARG 472 H ARG 472 95.799 2.720 10.396 281 HA ARG 472 HA ARG 472 98.536 2.183 9.979 282 HB2 ARG 472 HB2 ARG 472 98.783 4.471 9.479 283 HB3 ARG 472 HB3 ARG 472 97.147 4.076 8.975 284 HG2 ARG 472 HG2 ARG 472 96.309 5.014 11.102 285 HG3 ARG 472 HG3 ARG 472 97.959 5.495 11.502 286 HD2 ARG 472 HD2 ARG 472 96.858 6.333 8.875 287 HD3 ARG 472 HD3 ARG 472 96.256 7.147 10.318 288 HE ARG 472 HE ARG 472 98.845 7.435 9.125 289 HH11 ARG 472 HH11 ARG 472 97.057 7.627 12.107 290 HH12 ARG 472 HH12 ARG 472 98.157 8.741 12.846 291 HH21 ARG 472 HH21 ARG 472 100.299 8.907 10.087 292 HH22 ARG 472 HH22 ARG 472 100.000 9.469 11.698 293 H ASP 473 H ASP 473 96.753 3.653 12.660 294 HA ASP 473 HA ASP 473 99.007 4.358 14.203 295 HB2 ASP 473 HB2 ASP 473 96.094 4.014 14.718 296 HB3 ASP 473 HB3 ASP 473 97.169 4.031 16.113 297 H THR 474 H THR 474 97.149 1.398 13.899 298 HA THR 474 HA THR 474 98.258 0.047 16.131 299 HB THR 474 HB THR 474 97.582 -2.030 14.626 300 HG1 THR 474 HG1 THR 474 95.863 -1.417 13.212 301 HG21 THR 474 HG21 THR 474 96.448 -1.419 16.681 302 HG22 THR 474 HG22 THR 474 95.264 -1.801 15.429 303 HG23 THR 474 HG23 THR 474 95.591 -0.120 15.849 304 H LEU 475 H LEU 475 98.926 -0.324 12.637 305 HA LEU 475 HA LEU 475 101.165 -2.009 13.000 306 HB2 LEU 475 HB2 LEU 475 101.712 -1.344 10.629 307 HB3 LEU 475 HB3 LEU 475 100.121 -2.040 10.875 308 HG LEU 475 HG LEU 475 99.526 0.589 11.107 309 HD11 LEU 475 HD11 LEU 475 101.197 0.871 8.747 310 HD12 LEU 475 HD12 LEU 475 102.135 0.679 10.227 311 HD13 LEU 475 HD13 LEU 475 100.948 1.976 10.097 312 HD21 LEU 475 HD21 LEU 475 98.863 0.433 8.685 313 HD22 LEU 475 HD22 LEU 475 98.282 -0.875 9.716 314 HD23 LEU 475 HD23 LEU 475 99.660 -1.140 8.647 315 H ALA 476 H ALA 476 100.824 1.482 12.592 316 HA ALA 476 HA ALA 476 103.610 2.033 12.540 317 HB1 ALA 476 HB1 ALA 476 102.971 4.366 12.870 318 HB2 ALA 476 HB2 ALA 476 101.320 3.867 13.242 319 HB3 ALA 476 HB3 ALA 476 101.978 3.605 11.628 320 H ALA 477 H ALA 477 101.306 1.455 15.061 321 HA ALA 477 HA ALA 477 102.813 2.676 17.165 322 HB1 ALA 477 HB1 ALA 477 100.405 0.932 17.029 323 HB2 ALA 477 HB2 ALA 477 100.622 2.504 17.800 324 HB3 ALA 477 HB3 ALA 477 101.273 1.052 18.559 325 H ILE 478 H ILE 478 102.727 -0.444 15.622 326 HA ILE 478 HA ILE 478 104.333 -1.736 17.650 327 HB ILE 478 HB ILE 478 103.362 -2.589 14.930 328 HG12 ILE 478 HG12 ILE 478 102.789 -4.367 17.115 329 HG13 ILE 478 HG13 ILE 478 102.316 -2.728 17.550 330 HG21 ILE 478 HG21 ILE 478 105.240 -3.829 14.808 331 HG22 ILE 478 HG22 ILE 478 104.374 -4.874 15.936 332 HG23 ILE 478 HG23 ILE 478 105.557 -3.714 16.540 333 HD11 ILE 478 HD11 ILE 478 101.195 -4.554 15.531 334 HD12 ILE 478 HD12 ILE 478 101.270 -2.847 15.094 335 HD13 ILE 478 HD13 ILE 478 100.402 -3.349 16.546 336 H SER 479 H SER 479 104.811 -0.140 14.580 337 HA SER 479 HA SER 479 107.563 0.325 15.064 338 HB2 SER 479 HB2 SER 479 108.321 -1.699 14.363 339 HB3 SER 479 HB3 SER 479 106.829 -2.067 13.497 340 HG SER 479 HG SER 479 107.597 -1.132 11.733 341 H GLU 480 H GLU 480 107.731 2.318 14.280 342 HA GLU 480 HA GLU 480 106.101 3.738 12.702 343 HB2 GLU 480 HB2 GLU 480 108.120 4.674 13.728 344 HB3 GLU 480 HB3 GLU 480 109.120 3.834 12.551 345 HG2 GLU 480 HG2 GLU 480 107.305 5.289 11.029 346 HG3 GLU 480 HG3 GLU 480 107.765 6.369 12.346 347 H VAL 481 H VAL 481 105.287 3.579 10.731 348 HA VAL 481 HA VAL 481 106.739 1.976 8.728 349 HB VAL 481 HB VAL 481 104.484 1.691 7.646 350 HG11 VAL 481 HG11 VAL 481 105.706 0.266 9.655 351 HG12 VAL 481 HG12 VAL 481 104.351 -0.284 8.671 352 HG13 VAL 481 HG13 VAL 481 104.055 0.453 10.244 353 HG21 VAL 481 HG21 VAL 481 103.628 3.672 9.204 354 HG22 VAL 481 HG22 VAL 481 103.190 2.313 10.240 355 HG23 VAL 481 HG23 VAL 481 102.550 2.413 8.599 356 H LEU 482 H LEU 482 106.501 2.618 6.487 357 HA LEU 482 HA LEU 482 106.951 5.394 6.116 358 HB2 LEU 482 HB2 LEU 482 107.893 3.501 4.728 359 HB3 LEU 482 HB3 LEU 482 106.317 3.369 3.973 360 HG LEU 482 HG LEU 482 108.202 4.733 2.806 361 HD11 LEU 482 HD11 LEU 482 105.305 5.205 3.021 362 HD12 LEU 482 HD12 LEU 482 106.306 4.883 1.605 363 HD13 LEU 482 HD13 LEU 482 106.242 6.508 2.289 364 HD21 LEU 482 HD21 LEU 482 107.107 6.810 4.697 365 HD22 LEU 482 HD22 LEU 482 108.266 7.074 3.394 366 HD23 LEU 482 HD23 LEU 482 108.719 6.102 4.793 367 H TYR 483 H TYR 483 104.503 3.412 4.459 368 HA TYR 483 HA TYR 483 102.444 5.363 5.118 369 HB2 TYR 483 HB2 TYR 483 103.193 6.402 3.142 370 HB3 TYR 483 HB3 TYR 483 103.436 4.862 2.322 371 HD1 TYR 483 HD1 TYR 483 101.115 7.529 3.034 372 HD2 TYR 483 HD2 TYR 483 101.428 3.532 1.608 373 HE1 TYR 483 HE1 TYR 483 98.878 7.717 2.030 374 HE2 TYR 483 HE2 TYR 483 99.193 3.711 0.599 375 HH TYR 483 HH TYR 483 97.337 4.960 0.435 376 H VAL 484 H VAL 484 100.394 4.549 5.107 377 HA VAL 484 HA VAL 484 100.175 1.656 4.705 378 HB VAL 484 HB VAL 484 98.043 3.365 5.949 379 HG11 VAL 484 HG11 VAL 484 98.833 0.565 6.677 380 HG12 VAL 484 HG12 VAL 484 97.777 0.893 5.304 381 HG13 VAL 484 HG13 VAL 484 97.291 1.384 6.926 382 HG21 VAL 484 HG21 VAL 484 99.709 2.126 7.929 383 HG22 VAL 484 HG22 VAL 484 99.257 3.822 7.754 384 HG23 VAL 484 HG23 VAL 484 100.676 3.196 6.914 385 H ASP 485 H ASP 485 99.304 0.932 2.884 386 HA ASP 485 HA ASP 485 97.594 2.725 1.321 387 HB2 ASP 485 HB2 ASP 485 99.566 1.771 0.201 388 HB3 ASP 485 HB3 ASP 485 98.945 0.151 0.493 389 H LEU 486 H LEU 486 95.683 2.439 2.494 390 HA LEU 486 HA LEU 486 94.528 -0.245 2.582 391 HB2 LEU 486 HB2 LEU 486 94.238 0.902 4.620 392 HB3 LEU 486 HB3 LEU 486 93.773 2.389 3.815 393 HG LEU 486 HG LEU 486 91.863 0.443 3.073 394 HD11 LEU 486 HD11 LEU 486 91.220 0.354 5.761 395 HD12 LEU 486 HD12 LEU 486 92.943 -0.021 5.721 396 HD13 LEU 486 HD13 LEU 486 91.808 -0.987 4.776 397 HD21 LEU 486 HD21 LEU 486 91.154 2.337 5.200 398 HD22 LEU 486 HD22 LEU 486 90.449 2.107 3.600 399 HD23 LEU 486 HD23 LEU 486 91.920 3.061 3.786 400 H LEU 487 H LEU 487 93.027 -0.933 1.167 401 HA LEU 487 HA LEU 487 92.333 0.692 -1.068 402 HB2 LEU 487 HB2 LEU 487 92.047 -2.074 -0.284 403 HB3 LEU 487 HB3 LEU 487 90.561 -1.478 -1.001 404 HG LEU 487 HG LEU 487 91.757 -0.824 -3.019 405 HD11 LEU 487 HD11 LEU 487 94.058 -1.147 -1.310 406 HD12 LEU 487 HD12 LEU 487 93.916 -0.334 -2.868 407 HD13 LEU 487 HD13 LEU 487 94.236 -2.067 -2.805 408 HD21 LEU 487 HD21 LEU 487 91.121 -3.358 -2.277 409 HD22 LEU 487 HD22 LEU 487 92.818 -3.542 -2.722 410 HD23 LEU 487 HD23 LEU 487 91.666 -2.891 -3.888 411 H GLU 488 H GLU 488 91.190 2.475 -0.495 412 HA GLU 488 HA GLU 488 89.348 2.989 1.352 413 HB2 GLU 488 HB2 GLU 488 90.007 4.604 -0.372 414 HB3 GLU 488 HB3 GLU 488 89.038 3.739 -1.560 415 HG2 GLU 488 HG2 GLU 488 87.907 5.739 -0.746 416 HG3 GLU 488 HG3 GLU 488 87.015 4.272 -0.342 417 H GLY 489 H GLY 489 87.532 2.123 2.071 418 HA2 GLY 489 HA2 GLY 489 85.437 1.156 2.057 419 HA3 GLY 489 HA3 GLY 489 85.472 1.201 0.302 420 H ASP 490 H ASP 490 88.240 -0.283 1.473 421 HA ASP 490 HA ASP 490 87.022 -2.943 1.111 422 HB2 ASP 490 HB2 ASP 490 88.715 -2.044 -0.638 423 HB3 ASP 490 HB3 ASP 490 89.925 -2.370 0.599 424 H THR 491 H THR 491 87.760 -4.645 2.406 425 HA THR 491 HA THR 491 88.678 -3.816 5.026 426 HB THR 491 HB THR 491 88.454 -6.663 4.814 427 HG1 THR 491 HG1 THR 491 86.122 -6.602 4.283 428 HG21 THR 491 HG21 THR 491 86.546 -6.247 6.397 429 HG22 THR 491 HG22 THR 491 86.828 -4.521 6.170 430 HG23 THR 491 HG23 THR 491 88.085 -5.535 6.878 431 H GLU 492 H GLU 492 90.368 -4.158 2.406 432 HA GLU 492 HA GLU 492 92.540 -5.655 3.715 433 HB2 GLU 492 HB2 GLU 492 92.173 -5.467 0.731 434 HB3 GLU 492 HB3 GLU 492 93.259 -6.524 1.621 435 HG2 GLU 492 HG2 GLU 492 91.474 -7.870 2.386 436 HG3 GLU 492 HG3 GLU 492 90.270 -6.700 1.845 437 H CYS 493 H CYS 493 94.221 -4.444 4.204 438 HA CYS 493 HA CYS 493 94.909 -2.175 2.464 439 HB2 CYS 493 HB2 CYS 493 95.765 -1.110 4.667 440 HB3 CYS 493 HB3 CYS 493 94.036 -1.068 4.335 441 HG CYS 493 HG CYS 493 93.722 -2.166 6.486 442 H HIS 494 H HIS 494 97.092 -1.878 2.082 443 HA HIS 494 HA HIS 494 98.896 -3.876 3.281 444 HB2 HIS 494 HB2 HIS 494 98.939 -2.787 0.458 445 HB3 HIS 494 HB3 HIS 494 100.155 -3.859 1.145 446 HD1 HIS 494 HD1 HIS 494 96.350 -4.086 1.152 447 HD2 HIS 494 HD2 HIS 494 99.699 -6.278 0.038 448 HE1 HIS 494 HE1 HIS 494 95.465 -6.285 0.312 449 HE2 HIS 494 HE2 HIS 494 97.514 -7.628 -0.273 450 H ALA 495 H ALA 495 100.075 -2.776 4.730 451 HA ALA 495 HA ALA 495 100.809 -0.023 4.247 452 HB1 ALA 495 HB1 ALA 495 101.698 -0.025 6.483 453 HB2 ALA 495 HB2 ALA 495 101.568 -1.781 6.571 454 HB3 ALA 495 HB3 ALA 495 100.111 -0.793 6.489 455 H ARG 496 H ARG 496 102.670 0.703 3.481 456 HA ARG 496 HA ARG 496 104.769 -1.218 2.840 457 HB2 ARG 496 HB2 ARG 496 105.069 1.630 2.080 458 HB3 ARG 496 HB3 ARG 496 105.396 0.176 1.147 459 HG2 ARG 496 HG2 ARG 496 102.900 -0.102 0.927 460 HG3 ARG 496 HG3 ARG 496 102.750 1.520 1.608 461 HD2 ARG 496 HD2 ARG 496 104.696 1.398 -0.542 462 HD3 ARG 496 HD3 ARG 496 103.096 0.881 -1.063 463 HE ARG 496 HE ARG 496 103.859 3.534 -0.117 464 HH11 ARG 496 HH11 ARG 496 101.338 1.374 -1.193 465 HH12 ARG 496 HH12 ARG 496 100.225 2.650 -1.547 466 HH21 ARG 496 HH21 ARG 496 102.391 5.214 -0.581 467 HH22 ARG 496 HH22 ARG 496 100.819 4.829 -1.199 468 H PHE 497 H PHE 497 106.741 -1.232 3.773 469 HA PHE 497 HA PHE 497 107.213 0.754 5.901 470 HB2 PHE 497 HB2 PHE 497 108.271 -2.069 5.636 471 HB3 PHE 497 HB3 PHE 497 108.679 -0.955 6.937 472 HD1 PHE 497 HD1 PHE 497 105.527 -2.086 5.276 473 HD2 PHE 497 HD2 PHE 497 107.642 -1.448 8.913 474 HE1 PHE 497 HE1 PHE 497 103.568 -2.861 6.546 475 HE2 PHE 497 HE2 PHE 497 105.687 -2.223 10.189 476 HZ PHE 497 HZ PHE 497 103.646 -2.930 9.005 477 H LYS 498 H LYS 498 109.332 1.591 6.187 478 HA LYS 498 HA LYS 498 110.674 2.147 3.741 479 HB2 LYS 498 HB2 LYS 498 110.532 3.716 5.680 480 HB3 LYS 498 HB3 LYS 498 111.647 2.673 6.553 481 HG2 LYS 498 HG2 LYS 498 113.414 3.149 5.059 482 HG3 LYS 498 HG3 LYS 498 112.322 3.914 3.901 483 HD2 LYS 498 HD2 LYS 498 112.220 5.857 5.077 484 HD3 LYS 498 HD3 LYS 498 112.389 5.048 6.636 485 HE2 LYS 498 HE2 LYS 498 114.458 5.928 6.594 486 HE3 LYS 498 HE3 LYS 498 114.813 4.551 5.550 487 HZ1 LYS 498 HZ1 LYS 498 114.886 7.306 4.934 488 HZ2 LYS 498 HZ2 LYS 498 113.775 6.533 3.920 489 HZ3 LYS 498 HZ3 LYS 498 115.376 5.993 3.985 490 H THR 499 H THR 499 110.930 -0.380 6.008 491 HA THR 499 HA THR 499 113.295 -1.392 4.618 492 HB THR 499 HB THR 499 113.875 -2.248 7.123 493 HG1 THR 499 HG1 THR 499 113.774 -0.230 8.398 494 HG21 THR 499 HG21 THR 499 115.780 -1.367 6.391 495 HG22 THR 499 HG22 THR 499 115.198 0.218 6.902 496 HG23 THR 499 HG23 THR 499 114.912 -0.336 5.253 497 HA PRO 500 HA PRO 500 111.086 -5.204 4.797 498 HB2 PRO 500 HB2 PRO 500 113.091 -6.978 4.516 499 HB3 PRO 500 HB3 PRO 500 112.602 -5.903 3.201 500 HG2 PRO 500 HG2 PRO 500 114.893 -5.634 5.112 501 HG3 PRO 500 HG3 PRO 500 114.863 -5.366 3.358 502 HD2 PRO 500 HD2 PRO 500 114.719 -3.344 5.176 503 HD3 PRO 500 HD3 PRO 500 113.969 -3.260 3.570 504 H GLU 501 H GLU 501 113.983 -5.040 6.849 505 HA GLU 501 HA GLU 501 113.383 -7.197 8.521 506 HB2 GLU 501 HB2 GLU 501 114.895 -6.037 10.166 507 HB3 GLU 501 HB3 GLU 501 115.585 -6.295 8.570 508 HG2 GLU 501 HG2 GLU 501 115.194 -3.992 7.979 509 HG3 GLU 501 HG3 GLU 501 114.370 -3.708 9.512 510 H ASP 502 H ASP 502 112.227 -3.905 8.519 511 HA ASP 502 HA ASP 502 111.197 -3.811 11.136 512 HB2 ASP 502 HB2 ASP 502 110.755 -2.281 8.623 513 HB3 ASP 502 HB3 ASP 502 109.539 -2.128 9.887 514 H ALA 503 H ALA 503 109.929 -5.150 8.160 515 HA ALA 503 HA ALA 503 107.240 -5.425 8.973 516 HB1 ALA 503 HB1 ALA 503 108.549 -7.328 7.066 517 HB2 ALA 503 HB2 ALA 503 108.255 -5.648 6.616 518 HB3 ALA 503 HB3 ALA 503 106.904 -6.693 7.054 519 H GLN 504 H GLN 504 110.025 -7.598 9.218 520 HA GLN 504 HA GLN 504 108.698 -9.867 10.153 521 HB2 GLN 504 HB2 GLN 504 111.324 -9.160 9.651 522 HB3 GLN 504 HB3 GLN 504 111.315 -9.459 11.383 523 HG2 GLN 504 HG2 GLN 504 111.898 -11.430 9.974 524 HG3 GLN 504 HG3 GLN 504 110.551 -11.684 11.083 525 HE21 GLN 504 HE21 GLN 504 110.416 -13.504 9.399 526 HE22 GLN 504 HE22 GLN 504 109.358 -13.207 8.067 527 H ALA 505 H ALA 505 109.982 -7.087 11.927 528 HA ALA 505 HA ALA 505 109.515 -8.122 14.510 529 HB1 ALA 505 HB1 ALA 505 109.651 -5.231 13.666 530 HB2 ALA 505 HB2 ALA 505 111.031 -6.244 14.088 531 HB3 ALA 505 HB3 ALA 505 109.822 -5.851 15.309 532 H VAL 506 H VAL 506 107.507 -6.144 12.356 533 HA VAL 506 HA VAL 506 105.456 -5.657 14.245 534 HB VAL 506 HB VAL 506 105.270 -5.656 11.232 535 HG11 VAL 506 HG11 VAL 506 103.186 -5.625 12.954 536 HG12 VAL 506 HG12 VAL 506 103.182 -4.829 11.381 537 HG13 VAL 506 HG13 VAL 506 103.540 -3.901 12.837 538 HG21 VAL 506 HG21 VAL 506 106.737 -3.984 12.950 539 HG22 VAL 506 HG22 VAL 506 105.324 -3.059 12.442 540 HG23 VAL 506 HG23 VAL 506 106.408 -3.749 11.233 541 H ILE 507 H ILE 507 105.812 -8.125 11.716 542 HA ILE 507 HA ILE 507 103.260 -9.278 12.076 543 HB ILE 507 HB ILE 507 104.261 -11.322 11.010 544 HG12 ILE 507 HG12 ILE 507 106.567 -10.507 9.869 545 HG13 ILE 507 HG13 ILE 507 106.704 -9.709 11.429 546 HG21 ILE 507 HG21 ILE 507 103.457 -10.287 9.220 547 HG22 ILE 507 HG22 ILE 507 105.042 -9.550 8.985 548 HG23 ILE 507 HG23 ILE 507 103.809 -8.708 9.923 549 HD11 ILE 507 HD11 ILE 507 107.340 -12.347 10.808 550 HD12 ILE 507 HD12 ILE 507 105.867 -12.429 11.775 551 HD13 ILE 507 HD13 ILE 507 107.290 -11.602 12.405 552 H ASN 508 H ASN 508 106.326 -9.780 13.675 553 HA ASN 508 HA ASN 508 105.578 -12.171 15.043 554 HB2 ASN 508 HB2 ASN 508 107.732 -10.123 15.602 555 HB3 ASN 508 HB3 ASN 508 107.538 -11.611 16.524 556 HD21 ASN 508 HD21 ASN 508 109.655 -10.529 14.669 557 HD22 ASN 508 HD22 ASN 508 109.945 -11.818 13.556 558 H ALA 509 H ALA 509 105.489 -8.743 15.781 559 HA ALA 509 HA ALA 509 104.534 -9.075 18.463 560 HB1 ALA 509 HB1 ALA 509 104.550 -6.762 18.630 561 HB2 ALA 509 HB2 ALA 509 104.252 -6.535 16.906 562 HB3 ALA 509 HB3 ALA 509 105.834 -7.083 17.465 563 H TYR 510 H TYR 510 103.082 -8.776 15.332 564 HA TYR 510 HA TYR 510 100.576 -7.798 15.968 565 HB2 TYR 510 HB2 TYR 510 101.791 -9.100 13.729 566 HB3 TYR 510 HB3 TYR 510 100.173 -9.755 13.987 567 HD1 TYR 510 HD1 TYR 510 99.101 -8.791 12.081 568 HD2 TYR 510 HD2 TYR 510 101.225 -6.332 14.823 569 HE1 TYR 510 HE1 TYR 510 98.128 -6.791 11.026 570 HE2 TYR 510 HE2 TYR 510 100.261 -4.321 13.778 571 HH TYR 510 HH TYR 510 98.177 -3.771 12.425 572 H THR 511 H THR 511 101.904 -10.880 16.782 573 HA THR 511 HA THR 511 99.677 -12.499 16.915 574 HB THR 511 HB THR 511 101.746 -13.484 17.528 575 HG1 THR 511 HG1 THR 511 100.438 -13.229 20.039 576 HG21 THR 511 HG21 THR 511 102.300 -12.257 20.068 577 HG22 THR 511 HG22 THR 511 102.248 -11.035 18.797 578 HG23 THR 511 HG23 THR 511 103.339 -12.413 18.652 579 H GLU 512 H GLU 512 100.707 -9.913 19.026 580 HA GLU 512 HA GLU 512 98.832 -10.286 21.095 581 HB2 GLU 512 HB2 GLU 512 100.901 -8.467 20.491 582 HB3 GLU 512 HB3 GLU 512 99.454 -7.498 20.731 583 HG2 GLU 512 HG2 GLU 512 99.230 -9.080 22.857 584 HG3 GLU 512 HG3 GLU 512 100.979 -9.146 22.655 585 H ILE 513 H ILE 513 98.614 -8.691 17.992 586 HA ILE 513 HA ILE 513 96.453 -7.030 18.308 587 HB ILE 513 HB ILE 513 97.034 -8.810 15.939 588 HG12 ILE 513 HG12 ILE 513 98.818 -7.167 16.734 589 HG13 ILE 513 HG13 ILE 513 98.304 -7.013 15.057 590 HG21 ILE 513 HG21 ILE 513 94.719 -7.951 15.965 591 HG22 ILE 513 HG22 ILE 513 95.677 -7.299 14.637 592 HG23 ILE 513 HG23 ILE 513 95.353 -6.309 16.059 593 HD11 ILE 513 HD11 ILE 513 97.549 -5.266 17.379 594 HD12 ILE 513 HD12 ILE 513 96.759 -5.187 15.804 595 HD13 ILE 513 HD13 ILE 513 98.480 -4.830 15.947 596 H ASN 514 H ASN 514 96.366 -10.535 17.647 597 HA ASN 514 HA ASN 514 93.599 -10.800 17.448 598 HB2 ASN 514 HB2 ASN 514 95.002 -12.614 16.763 599 HB3 ASN 514 HB3 ASN 514 95.715 -12.747 18.367 600 HD21 ASN 514 HD21 ASN 514 92.384 -12.545 17.158 601 HD22 ASN 514 HD22 ASN 514 91.827 -13.970 17.961 602 H LYS 515 H LYS 515 95.614 -10.336 20.221 603 HA LYS 515 HA LYS 515 94.107 -11.435 22.263 604 HB2 LYS 515 HB2 LYS 515 95.597 -8.807 22.355 605 HB3 LYS 515 HB3 LYS 515 95.150 -9.797 23.738 606 HG2 LYS 515 HG2 LYS 515 96.758 -11.132 21.660 607 HG3 LYS 515 HG3 LYS 515 97.565 -9.860 22.579 608 HD2 LYS 515 HD2 LYS 515 98.002 -11.628 23.949 609 HD3 LYS 515 HD3 LYS 515 96.442 -11.141 24.615 610 HE2 LYS 515 HE2 LYS 515 96.067 -13.378 24.349 611 HE3 LYS 515 HE3 LYS 515 95.531 -12.796 22.774 612 HZ1 LYS 515 HZ1 LYS 515 97.834 -14.413 23.461 613 HZ2 LYS 515 HZ2 LYS 515 98.129 -13.201 22.319 614 HZ3 LYS 515 HZ3 LYS 515 96.933 -14.362 22.030 615 H LYS 516 H LYS 516 93.364 -8.802 20.213 616 HA LYS 516 HA LYS 516 91.003 -8.173 21.861 617 HB2 LYS 516 HB2 LYS 516 92.865 -6.372 21.624 618 HB3 LYS 516 HB3 LYS 516 92.238 -6.173 19.994 619 HG2 LYS 516 HG2 LYS 516 91.073 -4.564 21.140 620 HG3 LYS 516 HG3 LYS 516 89.946 -5.920 21.197 621 HD2 LYS 516 HD2 LYS 516 91.930 -5.333 23.385 622 HD3 LYS 516 HD3 LYS 516 90.290 -4.684 23.371 623 HE2 LYS 516 HE2 LYS 516 89.654 -7.213 23.002 624 HE3 LYS 516 HE3 LYS 516 91.226 -7.486 23.753 625 HZ1 LYS 516 HZ1 LYS 516 88.794 -6.841 24.990 626 HZ2 LYS 516 HZ2 LYS 516 89.873 -5.568 25.264 627 HZ3 LYS 516 HZ3 LYS 516 90.294 -7.143 25.714 628 H HIS 517 H HIS 517 92.369 -8.360 18.611 629 HA HIS 517 HA HIS 517 89.839 -9.310 17.581 630 HB2 HIS 517 HB2 HIS 517 90.983 -7.098 15.966 631 HB3 HIS 517 HB3 HIS 517 89.303 -7.579 16.188 632 HD1 HIS 517 HD1 HIS 517 88.039 -6.575 18.217 633 HD2 HIS 517 HD2 HIS 517 91.932 -5.190 17.770 634 HE1 HIS 517 HE1 HIS 517 88.217 -4.572 19.727 635 HE2 HIS 517 HE2 HIS 517 90.569 -3.727 19.413 636 H CYS 518 H CYS 518 90.209 -10.875 16.141 637 HA CYS 518 HA CYS 518 92.791 -11.738 15.489 638 HB2 CYS 518 HB2 CYS 518 90.541 -13.024 15.439 639 HB3 CYS 518 HB3 CYS 518 90.393 -12.403 13.799 640 HG CYS 518 HG CYS 518 92.825 -14.169 14.594 641 H TRP 519 H TRP 519 94.224 -10.931 14.101 642 HA TRP 519 HA TRP 519 93.231 -9.589 11.678 643 HB2 TRP 519 HB2 TRP 519 94.262 -8.178 13.743 644 HB3 TRP 519 HB3 TRP 519 95.727 -8.505 12.818 645 HD1 TRP 519 HD1 TRP 519 93.163 -8.356 10.310 646 HE1 TRP 519 HE1 TRP 519 92.977 -6.040 9.252 647 HE3 TRP 519 HE3 TRP 519 95.830 -5.683 13.756 648 HZ2 TRP 519 HZ2 TRP 519 93.850 -3.388 9.803 649 HZ3 TRP 519 HZ3 TRP 519 96.109 -3.266 13.415 650 HH2 TRP 519 HH2 TRP 519 95.142 -2.148 11.475 651 H LYS 520 H LYS 520 94.384 -9.836 9.854 652 HA LYS 520 HA LYS 520 96.541 -11.836 9.946 653 HB2 LYS 520 HB2 LYS 520 95.083 -11.144 7.449 654 HB3 LYS 520 HB3 LYS 520 95.783 -12.682 7.937 655 HG2 LYS 520 HG2 LYS 520 93.342 -11.491 9.229 656 HG3 LYS 520 HG3 LYS 520 93.273 -12.600 7.856 657 HD2 LYS 520 HD2 LYS 520 94.099 -14.385 9.097 658 HD3 LYS 520 HD3 LYS 520 94.801 -13.332 10.327 659 HE2 LYS 520 HE2 LYS 520 92.873 -13.188 11.486 660 HE3 LYS 520 HE3 LYS 520 91.884 -13.128 10.028 661 HZ1 LYS 520 HZ1 LYS 520 92.442 -15.335 11.710 662 HZ2 LYS 520 HZ2 LYS 520 92.944 -15.676 10.131 663 HZ3 LYS 520 HZ3 LYS 520 91.341 -15.223 10.429 664 H LEU 521 H LEU 521 98.540 -11.171 9.431 665 HA LEU 521 HA LEU 521 98.827 -8.965 7.533 666 HB2 LEU 521 HB2 LEU 521 99.745 -7.541 8.969 667 HB3 LEU 521 HB3 LEU 521 99.163 -8.592 10.242 668 HG LEU 521 HG LEU 521 101.871 -9.004 9.010 669 HD11 LEU 521 HD11 LEU 521 102.043 -7.663 11.516 670 HD12 LEU 521 HD12 LEU 521 101.046 -6.704 10.422 671 HD13 LEU 521 HD13 LEU 521 102.680 -7.170 9.948 672 HD21 LEU 521 HD21 LEU 521 102.294 -10.361 10.811 673 HD22 LEU 521 HD22 LEU 521 100.567 -10.645 10.593 674 HD23 LEU 521 HD23 LEU 521 101.128 -9.537 11.846 675 H GLU 522 H GLU 522 99.802 -9.936 5.886 676 HA GLU 522 HA GLU 522 102.063 -11.732 6.456 677 HB2 GLU 522 HB2 GLU 522 99.831 -12.273 4.982 678 HB3 GLU 522 HB3 GLU 522 100.946 -11.736 3.732 679 HG2 GLU 522 HG2 GLU 522 101.065 -14.125 3.954 680 HG3 GLU 522 HG3 GLU 522 102.578 -13.404 4.501 681 H ILE 523 H ILE 523 104.039 -11.289 5.657 682 HA ILE 523 HA ILE 523 104.423 -8.699 4.391 683 HB ILE 523 HB ILE 523 106.539 -10.684 5.221 684 HG12 ILE 523 HG12 ILE 523 105.512 -8.331 6.816 685 HG13 ILE 523 HG13 ILE 523 104.992 -9.991 7.089 686 HG21 ILE 523 HG21 ILE 523 107.412 -9.053 3.721 687 HG22 ILE 523 HG22 ILE 523 107.935 -8.609 5.345 688 HG23 ILE 523 HG23 ILE 523 106.602 -7.743 4.579 689 HD11 ILE 523 HD11 ILE 523 107.026 -10.625 7.951 690 HD12 ILE 523 HD12 ILE 523 106.877 -8.969 8.538 691 HD13 ILE 523 HD13 ILE 523 107.896 -9.322 7.142 692 H LEU 524 H LEU 524 104.459 -8.510 2.249 693 HA LEU 524 HA LEU 524 104.544 -10.699 0.475 694 HB2 LEU 524 HB2 LEU 524 104.875 -7.736 0.090 695 HB3 LEU 524 HB3 LEU 524 105.001 -8.855 -1.253 696 HG LEU 524 HG LEU 524 102.599 -8.110 0.364 697 HD11 LEU 524 HD11 LEU 524 101.591 -8.009 -1.890 698 HD12 LEU 524 HD12 LEU 524 103.154 -8.445 -2.579 699 HD13 LEU 524 HD13 LEU 524 102.971 -6.927 -1.701 700 HD21 LEU 524 HD21 LEU 524 102.672 -10.527 0.532 701 HD22 LEU 524 HD22 LEU 524 102.922 -10.664 -1.209 702 HD23 LEU 524 HD23 LEU 524 101.398 -10.036 -0.584 703 H SER 525 H SER 525 106.170 -11.595 -0.720 704 HA SER 525 HA SER 525 108.858 -10.478 -0.514 705 HB2 SER 525 HB2 SER 525 109.245 -11.939 1.198 706 HB3 SER 525 HB3 SER 525 107.949 -13.028 0.703 707 HG SER 525 HG SER 525 109.498 -14.200 -0.086 708 H GLY 526 H GLY 526 110.402 -11.517 -1.979 709 HA2 GLY 526 HA2 GLY 526 110.982 -12.059 -4.132 710 HA3 GLY 526 HA3 GLY 526 109.852 -13.385 -3.914 711 H ASP 527 H ASP 527 109.091 -13.390 -6.003 712 HA ASP 527 HA ASP 527 108.416 -11.275 -7.604 713 HB2 ASP 527 HB2 ASP 527 107.911 -14.078 -7.572 714 HB3 ASP 527 HB3 ASP 527 106.398 -13.263 -7.959 715 H HIS 528 H HIS 528 106.640 -12.555 -4.870 716 HA HIS 528 HA HIS 528 104.176 -11.274 -5.393 717 HB2 HIS 528 HB2 HIS 528 104.965 -13.095 -3.574 718 HB3 HIS 528 HB3 HIS 528 104.993 -11.652 -2.566 719 HD1 HIS 528 HD1 HIS 528 102.992 -13.077 -1.355 720 HD2 HIS 528 HD2 HIS 528 102.155 -11.391 -5.060 721 HE1 HIS 528 HE1 HIS 528 100.484 -13.042 -1.527 722 HE2 HIS 528 HE2 HIS 528 100.002 -11.923 -3.732 723 H GLU 529 H GLU 529 106.985 -10.311 -3.439 724 HA GLU 529 HA GLU 529 105.888 -7.833 -2.594 725 HB2 GLU 529 HB2 GLU 529 107.848 -7.557 -1.462 726 HB3 GLU 529 HB3 GLU 529 107.998 -9.274 -1.790 727 HG2 GLU 529 HG2 GLU 529 109.338 -8.699 -3.809 728 HG3 GLU 529 HG3 GLU 529 109.295 -7.015 -3.291 729 H GLN 530 H GLN 530 108.093 -8.751 -5.194 730 HA GLN 530 HA GLN 530 108.527 -6.161 -6.218 731 HB2 GLN 530 HB2 GLN 530 110.081 -7.705 -6.966 732 HB3 GLN 530 HB3 GLN 530 108.869 -8.943 -7.259 733 HG2 GLN 530 HG2 GLN 530 108.486 -6.643 -8.971 734 HG3 GLN 530 HG3 GLN 530 110.097 -7.338 -9.145 735 HE21 GLN 530 HE21 GLN 530 106.804 -7.642 -9.895 736 HE22 GLN 530 HE22 GLN 530 106.882 -9.167 -10.704 737 H ARG 531 H ARG 531 106.065 -8.584 -6.825 738 HA ARG 531 HA ARG 531 104.914 -7.449 -9.117 739 HB2 ARG 531 HB2 ARG 531 104.308 -9.668 -8.625 740 HB3 ARG 531 HB3 ARG 531 103.860 -9.271 -6.972 741 HG2 ARG 531 HG2 ARG 531 102.304 -7.863 -9.011 742 HG3 ARG 531 HG3 ARG 531 102.117 -9.617 -9.023 743 HD2 ARG 531 HD2 ARG 531 101.479 -9.616 -6.704 744 HD3 ARG 531 HD3 ARG 531 101.823 -7.892 -6.569 745 HE ARG 531 HE ARG 531 99.884 -8.385 -8.580 746 HH11 ARG 531 HH11 ARG 531 100.303 -8.244 -5.126 747 HH12 ARG 531 HH12 ARG 531 98.651 -7.825 -4.812 748 HH21 ARG 531 HH21 ARG 531 97.706 -7.839 -8.178 749 HH22 ARG 531 HH22 ARG 531 97.176 -7.596 -6.546 750 H TYR 532 H TYR 532 103.985 -7.104 -5.686 751 HA TYR 532 HA TYR 532 101.844 -5.352 -6.134 752 HB2 TYR 532 HB2 TYR 532 102.221 -6.529 -3.998 753 HB3 TYR 532 HB3 TYR 532 103.631 -5.516 -3.698 754 HD1 TYR 532 HD1 TYR 532 103.213 -2.958 -3.656 755 HD2 TYR 532 HD2 TYR 532 100.140 -5.862 -3.201 756 HE1 TYR 532 HE1 TYR 532 101.783 -1.269 -2.598 757 HE2 TYR 532 HE2 TYR 532 98.697 -4.178 -2.137 758 HH TYR 532 HH TYR 532 98.432 -1.957 -1.753 759 H TRP 533 H TRP 533 105.274 -4.688 -5.481 760 HA TRP 533 HA TRP 533 105.018 -1.886 -5.377 761 HB2 TRP 533 HB2 TRP 533 107.269 -3.791 -5.764 762 HB3 TRP 533 HB3 TRP 533 107.541 -2.112 -6.221 763 HD1 TRP 533 HD1 TRP 533 107.913 -4.290 -3.343 764 HE1 TRP 533 HE1 TRP 533 108.052 -2.955 -1.150 765 HE3 TRP 533 HE3 TRP 533 106.246 0.230 -5.045 766 HZ2 TRP 533 HZ2 TRP 533 107.524 -0.323 -0.258 767 HZ3 TRP 533 HZ3 TRP 533 106.090 2.106 -3.459 768 HH2 TRP 533 HH2 TRP 533 106.716 1.832 -1.115 769 H GLN 534 H GLN 534 105.320 -4.149 -8.020 770 HA GLN 534 HA GLN 534 105.944 -2.352 -10.085 771 HB2 GLN 534 HB2 GLN 534 104.571 -5.018 -9.987 772 HB3 GLN 534 HB3 GLN 534 104.618 -4.113 -11.493 773 HG2 GLN 534 HG2 GLN 534 107.235 -4.132 -10.418 774 HG3 GLN 534 HG3 GLN 534 106.609 -5.778 -10.351 775 HE21 GLN 534 HE21 GLN 534 105.830 -3.277 -12.706 776 HE22 GLN 534 HE22 GLN 534 106.485 -4.105 -14.074 777 H LYS 535 H LYS 535 102.885 -3.363 -8.668 778 HA LYS 535 HA LYS 535 101.177 -2.003 -10.451 779 HB2 LYS 535 HB2 LYS 535 100.255 -2.123 -7.655 780 HB3 LYS 535 HB3 LYS 535 99.472 -2.690 -9.120 781 HG2 LYS 535 HG2 LYS 535 100.859 -4.704 -9.081 782 HG3 LYS 535 HG3 LYS 535 101.647 -4.132 -7.613 783 HD2 LYS 535 HD2 LYS 535 98.872 -5.149 -7.995 784 HD3 LYS 535 HD3 LYS 535 100.054 -5.544 -6.746 785 HE2 LYS 535 HE2 LYS 535 99.739 -3.346 -5.740 786 HE3 LYS 535 HE3 LYS 535 98.580 -2.925 -7.000 787 HZ1 LYS 535 HZ1 LYS 535 97.489 -5.158 -6.099 788 HZ2 LYS 535 HZ2 LYS 535 97.134 -3.640 -5.443 789 HZ3 LYS 535 HZ3 LYS 535 98.256 -4.650 -4.679 790 H ILE 536 H ILE 536 102.776 -1.056 -7.457 791 HA ILE 536 HA ILE 536 101.557 1.452 -7.120 792 HB ILE 536 HB ILE 536 104.358 0.631 -6.340 793 HG12 ILE 536 HG12 ILE 536 101.714 0.430 -4.888 794 HG13 ILE 536 HG13 ILE 536 102.770 -0.895 -5.368 795 HG21 ILE 536 HG21 ILE 536 103.605 3.135 -6.371 796 HG22 ILE 536 HG22 ILE 536 104.502 2.490 -4.997 797 HG23 ILE 536 HG23 ILE 536 102.752 2.685 -4.895 798 HD11 ILE 536 HD11 ILE 536 102.699 0.371 -2.910 799 HD12 ILE 536 HD12 ILE 536 104.152 0.999 -3.687 800 HD13 ILE 536 HD13 ILE 536 103.938 -0.740 -3.493 801 H LEU 537 H LEU 537 104.530 0.530 -8.825 802 HA LEU 537 HA LEU 537 105.253 3.150 -9.599 803 HB2 LEU 537 HB2 LEU 537 106.060 0.396 -10.353 804 HB3 LEU 537 HB3 LEU 537 106.459 1.680 -11.478 805 HG LEU 537 HG LEU 537 108.241 1.037 -9.779 806 HD11 LEU 537 HD11 LEU 537 107.288 3.741 -10.481 807 HD12 LEU 537 HD12 LEU 537 108.842 2.966 -10.788 808 HD13 LEU 537 HD13 LEU 537 108.490 3.638 -9.195 809 HD21 LEU 537 HD21 LEU 537 106.214 1.304 -7.971 810 HD22 LEU 537 HD22 LEU 537 107.065 2.839 -7.798 811 HD23 LEU 537 HD23 LEU 537 107.934 1.320 -7.579 812 H VAL 538 H VAL 538 103.551 0.552 -11.333 813 HA VAL 538 HA VAL 538 103.222 1.933 -13.753 814 HB VAL 538 HB VAL 538 101.506 -0.232 -12.533 815 HG11 VAL 538 HG11 VAL 538 100.576 -0.590 -14.721 816 HG12 VAL 538 HG12 VAL 538 101.595 0.676 -15.406 817 HG13 VAL 538 HG13 VAL 538 100.319 1.093 -14.262 818 HG21 VAL 538 HG21 VAL 538 103.035 -1.698 -13.221 819 HG22 VAL 538 HG22 VAL 538 104.113 -0.327 -13.484 820 HG23 VAL 538 HG23 VAL 538 103.136 -0.949 -14.814 821 H ASP 539 H ASP 539 101.225 1.823 -10.837 822 HA ASP 539 HA ASP 539 99.017 3.233 -11.890 823 HB2 ASP 539 HB2 ASP 539 98.600 2.069 -9.894 824 HB3 ASP 539 HB3 ASP 539 100.029 2.726 -9.104 825 H ARG 540 H ARG 540 101.983 4.275 -10.293 826 HA ARG 540 HA ARG 540 101.310 6.987 -9.973 827 HB2 ARG 540 HB2 ARG 540 103.244 5.796 -8.898 828 HB3 ARG 540 HB3 ARG 540 104.074 5.862 -10.448 829 HG2 ARG 540 HG2 ARG 540 104.751 7.630 -8.839 830 HG3 ARG 540 HG3 ARG 540 104.159 8.244 -10.382 831 HD2 ARG 540 HD2 ARG 540 101.988 8.706 -9.382 832 HD3 ARG 540 HD3 ARG 540 102.538 8.040 -7.846 833 HE ARG 540 HE ARG 540 103.065 10.655 -8.878 834 HH11 ARG 540 HH11 ARG 540 104.298 8.122 -6.831 835 HH12 ARG 540 HH12 ARG 540 105.252 9.192 -5.860 836 HH21 ARG 540 HH21 ARG 540 104.320 12.074 -7.610 837 HH22 ARG 540 HH22 ARG 540 105.264 11.442 -6.302 838 H GLN 541 H GLN 541 102.847 5.231 -12.627 839 HA GLN 541 HA GLN 541 103.461 7.464 -14.230 840 HB2 GLN 541 HB2 GLN 541 103.377 4.553 -14.551 841 HB3 GLN 541 HB3 GLN 541 103.007 5.431 -16.030 842 HG2 GLN 541 HG2 GLN 541 105.147 5.870 -16.355 843 HG3 GLN 541 HG3 GLN 541 105.274 6.623 -14.765 844 HE21 GLN 541 HE21 GLN 541 106.367 5.604 -13.205 845 HE22 GLN 541 HE22 GLN 541 107.036 4.016 -13.338 846 H ALA 542 H ALA 542 100.611 5.381 -14.052 847 HA ALA 542 HA ALA 542 99.216 6.424 -16.242 848 HB1 ALA 542 HB1 ALA 542 97.166 5.688 -14.773 849 HB2 ALA 542 HB2 ALA 542 98.422 4.955 -13.776 850 HB3 ALA 542 HB3 ALA 542 98.259 4.491 -15.468 851 H LYS 543 H LYS 543 99.443 7.500 -12.896 852 HA LYS 543 HA LYS 543 97.399 9.325 -12.737 853 HB2 LYS 543 HB2 LYS 543 99.684 8.736 -11.252 854 HB3 LYS 543 HB3 LYS 543 99.845 10.442 -11.643 855 HG2 LYS 543 HG2 LYS 543 98.181 11.044 -10.271 856 HG3 LYS 543 HG3 LYS 543 97.182 9.657 -10.710 857 HD2 LYS 543 HD2 LYS 543 99.631 9.238 -9.055 858 HD3 LYS 543 HD3 LYS 543 98.170 9.870 -8.294 859 HE2 LYS 543 HE2 LYS 543 97.086 7.840 -9.637 860 HE3 LYS 543 HE3 LYS 543 98.713 7.192 -9.446 861 HZ1 LYS 543 HZ1 LYS 543 97.198 8.277 -7.150 862 HZ2 LYS 543 HZ2 LYS 543 98.535 7.239 -7.134 863 HZ3 LYS 543 HZ3 LYS 543 97.026 6.667 -7.643 864 H LEU 544 H LEU 544 100.251 9.477 -14.676 865 HA LEU 544 HA LEU 544 100.783 12.072 -15.148 866 HB2 LEU 544 HB2 LEU 544 101.929 10.358 -16.358 867 HB3 LEU 544 HB3 LEU 544 100.455 9.860 -17.167 868 HG LEU 544 HG LEU 544 102.120 11.199 -18.541 869 HD11 LEU 544 HD11 LEU 544 100.425 11.770 -19.889 870 HD12 LEU 544 HD12 LEU 544 99.643 12.756 -18.653 871 HD13 LEU 544 HD13 LEU 544 99.410 11.008 -18.665 872 HD21 LEU 544 HD21 LEU 544 102.660 13.308 -18.023 873 HD22 LEU 544 HD22 LEU 544 102.086 12.903 -16.406 874 HD23 LEU 544 HD23 LEU 544 101.012 13.714 -17.546 875 H ASN 545 H ASN 545 97.873 10.383 -16.141 876 HA ASN 545 HA ASN 545 96.760 11.943 -18.040 877 HB2 ASN 545 HB2 ASN 545 95.661 10.413 -15.766 878 HB3 ASN 545 HB3 ASN 545 94.577 11.615 -16.460 879 HD21 ASN 545 HD21 ASN 545 97.026 9.974 -18.319 880 HD22 ASN 545 HD22 ASN 545 95.944 9.022 -19.272 881 H GLN 546 H GLN 546 96.221 12.609 -14.569 882 HA GLN 546 HA GLN 546 96.756 15.375 -14.800 883 HB2 GLN 546 HB2 GLN 546 94.549 16.313 -14.644 884 HB3 GLN 546 HB3 GLN 546 94.603 15.268 -16.059 885 HG2 GLN 546 HG2 GLN 546 92.856 14.150 -15.306 886 HG3 GLN 546 HG3 GLN 546 93.756 13.699 -13.860 887 HE21 GLN 546 HE21 GLN 546 90.912 14.729 -14.626 888 HE22 GLN 546 HE22 GLN 546 90.582 15.873 -13.375 889 HA PRO 547 HA PRO 547 96.952 14.859 -10.430 890 HB2 PRO 547 HB2 PRO 547 96.728 17.429 -9.599 891 HB3 PRO 547 HB3 PRO 547 98.179 16.804 -10.390 892 HG2 PRO 547 HG2 PRO 547 95.932 18.407 -11.545 893 HG3 PRO 547 HG3 PRO 547 97.677 18.570 -11.814 894 HD2 PRO 547 HD2 PRO 547 96.025 17.321 -13.572 895 HD3 PRO 547 HD3 PRO 547 97.725 16.863 -13.357 896 H ARG 548 H ARG 548 94.915 13.710 -10.268 897 HA ARG 548 HA ARG 548 92.430 15.031 -9.979 898 HB2 ARG 548 HB2 ARG 548 93.141 12.352 -8.792 899 HB3 ARG 548 HB3 ARG 548 91.555 12.923 -9.291 900 HG2 ARG 548 HG2 ARG 548 93.466 12.967 -11.470 901 HG3 ARG 548 HG3 ARG 548 93.278 11.358 -10.769 902 HD2 ARG 548 HD2 ARG 548 90.904 13.050 -11.482 903 HD3 ARG 548 HD3 ARG 548 91.707 12.039 -12.681 904 HE ARG 548 HE ARG 548 90.903 10.708 -10.233 905 HH11 ARG 548 HH11 ARG 548 90.123 11.507 -13.532 906 HH12 ARG 548 HH12 ARG 548 88.989 10.211 -13.716 907 HH21 ARG 548 HH21 ARG 548 89.410 8.999 -10.462 908 HH22 ARG 548 HH22 ARG 548 88.583 8.784 -11.970 909 H GLU 549 H GLU 549 91.236 14.164 -7.723 910 HA GLU 549 HA GLU 549 92.747 15.528 -5.592 911 HB2 GLU 549 HB2 GLU 549 89.766 15.369 -6.060 912 HB3 GLU 549 HB3 GLU 549 90.501 16.052 -4.617 913 HG2 GLU 549 HG2 GLU 549 90.615 18.004 -5.637 914 HG3 GLU 549 HG3 GLU 549 91.738 17.307 -6.803 915 H LYS 550 H LYS 550 93.680 13.873 -4.503 916 HA LYS 550 HA LYS 550 91.911 11.723 -3.536 917 HB2 LYS 550 HB2 LYS 550 93.850 11.081 -5.044 918 HB3 LYS 550 HB3 LYS 550 94.919 11.588 -3.744 919 HG2 LYS 550 HG2 LYS 550 94.804 9.433 -3.144 920 HG3 LYS 550 HG3 LYS 550 93.277 9.915 -2.405 921 HD2 LYS 550 HD2 LYS 550 92.494 9.416 -4.958 922 HD3 LYS 550 HD3 LYS 550 93.792 8.236 -4.761 923 HE2 LYS 550 HE2 LYS 550 92.041 8.353 -2.447 924 HE3 LYS 550 HE3 LYS 550 91.167 7.956 -3.926 925 HZ1 LYS 550 HZ1 LYS 550 92.841 6.307 -2.380 926 HZ2 LYS 550 HZ2 LYS 550 93.510 6.459 -3.926 927 HZ3 LYS 550 HZ3 LYS 550 91.924 5.900 -3.742 928 H LYS 551 H LYS 551 91.334 12.048 -1.489 929 HA LYS 551 HA LYS 551 92.361 13.853 0.299 930 HB2 LYS 551 HB2 LYS 551 90.238 12.601 0.590 931 HB3 LYS 551 HB3 LYS 551 91.165 11.169 1.014 932 HG2 LYS 551 HG2 LYS 551 90.973 11.836 3.124 933 HG3 LYS 551 HG3 LYS 551 92.147 13.093 2.726 934 HD2 LYS 551 HD2 LYS 551 90.452 14.691 2.344 935 HD3 LYS 551 HD3 LYS 551 89.191 13.457 2.302 936 HE2 LYS 551 HE2 LYS 551 90.845 13.982 4.756 937 HE3 LYS 551 HE3 LYS 551 89.365 14.875 4.413 938 HZ1 LYS 551 HZ1 LYS 551 88.952 12.080 4.136 939 HZ2 LYS 551 HZ2 LYS 551 88.152 13.184 5.137 940 HZ3 LYS 551 HZ3 LYS 551 89.573 12.436 5.669 941 H ARG 552 H ARG 552 93.918 13.874 1.873 942 HA ARG 552 HA ARG 552 95.400 11.619 2.710 943 HB2 ARG 552 HB2 ARG 552 97.483 11.927 1.603 944 HB3 ARG 552 HB3 ARG 552 96.251 11.895 0.350 945 HG2 ARG 552 HG2 ARG 552 96.465 14.575 0.999 946 HG3 ARG 552 HG3 ARG 552 98.126 13.983 1.057 947 HD2 ARG 552 HD2 ARG 552 96.755 12.911 -1.234 948 HD3 ARG 552 HD3 ARG 552 96.634 14.670 -1.213 949 HE ARG 552 HE ARG 552 99.288 13.941 -0.679 950 HH11 ARG 552 HH11 ARG 552 96.981 13.894 -3.290 951 HH12 ARG 552 HH12 ARG 552 98.186 14.015 -4.528 952 HH21 ARG 552 HH21 ARG 552 100.880 14.103 -2.302 953 HH22 ARG 552 HH22 ARG 552 100.402 14.133 -3.967 954 H GLY 553 H GLY 553 96.272 12.088 4.632 955 HA2 GLY 553 HA2 GLY 553 97.665 13.503 6.011 956 HA3 GLY 553 HA3 GLY 553 96.974 14.896 5.192 957 H THR 554 H THR 554 97.102 13.657 8.074 958 HA THR 554 HA THR 554 94.305 14.320 8.720 959 HB THR 554 HB THR 554 94.708 11.885 8.970 960 HG1 THR 554 HG1 THR 554 93.199 12.845 10.380 961 HG21 THR 554 HG21 THR 554 96.509 12.522 11.281 962 HG22 THR 554 HG22 THR 554 97.157 12.280 9.660 963 HG23 THR 554 HG23 THR 554 96.265 10.983 10.455 964 H GLU 555 H GLU 555 95.933 16.370 8.738 965 HA GLU 555 HA GLU 555 96.648 18.104 10.027 966 HB2 GLU 555 HB2 GLU 555 94.704 17.168 11.509 967 HB3 GLU 555 HB3 GLU 555 96.011 16.591 12.534 968 HG2 GLU 555 HG2 GLU 555 96.830 18.830 12.840 969 HG3 GLU 555 HG3 GLU 555 95.645 19.458 11.696 970 H LYS 556 H LYS 556 98.774 17.555 9.290 971 HA LYS 556 HA LYS 556 100.484 15.813 10.739 972 HB2 LYS 556 HB2 LYS 556 100.919 16.366 8.406 973 HB3 LYS 556 HB3 LYS 556 101.135 18.060 8.824 974 HG2 LYS 556 HG2 LYS 556 103.282 17.722 9.233 975 HG3 LYS 556 HG3 LYS 556 102.895 16.471 10.414 976 HD2 LYS 556 HD2 LYS 556 102.459 15.163 8.065 977 HD3 LYS 556 HD3 LYS 556 103.797 16.231 7.633 978 HE2 LYS 556 HE2 LYS 556 104.374 15.132 10.176 979 HE3 LYS 556 HE3 LYS 556 103.847 13.806 9.139 980 HZ1 LYS 556 HZ1 LYS 556 105.855 13.818 8.242 981 HZ2 LYS 556 HZ2 LYS 556 106.311 15.179 9.136 982 HZ3 LYS 556 HZ3 LYS 556 105.569 15.369 7.629 983 H LEU 557 H LEU 557 99.939 16.651 12.909 984 HA LEU 557 HA LEU 557 101.914 18.638 13.713 985 HB2 LEU 557 HB2 LEU 557 99.091 19.167 13.595 986 HB3 LEU 557 HB3 LEU 557 99.628 19.212 15.264 987 HG LEU 557 HG LEU 557 101.547 20.733 14.167 988 HD11 LEU 557 HD11 LEU 557 99.962 22.267 12.635 989 HD12 LEU 557 HD12 LEU 557 99.332 20.671 12.225 990 HD13 LEU 557 HD13 LEU 557 101.041 21.031 11.991 991 HD21 LEU 557 HD21 LEU 557 99.295 22.440 14.546 992 HD22 LEU 557 HD22 LEU 557 100.656 22.142 15.628 993 HD23 LEU 557 HD23 LEU 557 99.219 21.123 15.718 994 H ILE 558 H ILE 558 102.970 16.807 14.608 995 HA ILE 558 HA ILE 558 101.721 15.834 17.095 996 HB ILE 558 HB ILE 558 103.579 14.243 15.323 997 HG12 ILE 558 HG12 ILE 558 100.674 13.632 15.803 998 HG13 ILE 558 HG13 ILE 558 101.160 14.725 14.510 999 HG21 ILE 558 HG21 ILE 558 103.005 12.378 16.796 1000 HG22 ILE 558 HG22 ILE 558 102.020 13.460 17.781 1001 HG23 ILE 558 HG23 ILE 558 103.765 13.695 17.691 1002 HD11 ILE 558 HD11 ILE 558 102.211 11.925 14.785 1003 HD12 ILE 558 HD12 ILE 558 102.361 13.010 13.403 1004 HD13 ILE 558 HD13 ILE 558 100.785 12.346 13.836 1005 H THR 559 H THR 559 102.875 16.109 18.899 1006 HA THR 559 HA THR 559 105.349 17.537 18.816 1007 HB THR 559 HB THR 559 104.233 16.204 21.274 1008 HG1 THR 559 HG1 THR 559 103.494 18.831 20.753 1009 HG21 THR 559 HG21 THR 559 105.902 18.654 20.751 1010 HG22 THR 559 HG22 THR 559 106.340 17.212 21.667 1011 HG23 THR 559 HG23 THR 559 105.135 18.330 22.305 1012 H LYS 560 H LYS 560 107.397 16.840 19.146 1013 HA LYS 560 HA LYS 560 107.885 14.002 18.899 1014 HB2 LYS 560 HB2 LYS 560 109.248 16.373 18.176 1015 HB3 LYS 560 HB3 LYS 560 110.287 15.517 19.307 1016 HG2 LYS 560 HG2 LYS 560 110.993 14.380 17.529 1017 HG3 LYS 560 HG3 LYS 560 109.460 13.512 17.637 1018 HD2 LYS 560 HD2 LYS 560 108.444 15.050 16.063 1019 HD3 LYS 560 HD3 LYS 560 109.923 16.011 16.010 1020 HE2 LYS 560 HE2 LYS 560 109.736 13.117 15.185 1021 HE3 LYS 560 HE3 LYS 560 109.640 14.479 14.069 1022 HZ1 LYS 560 HZ1 LYS 560 111.937 14.487 15.833 1023 HZ2 LYS 560 HZ2 LYS 560 111.839 14.831 14.179 1024 HZ3 LYS 560 HZ3 LYS 560 111.909 13.226 14.706 1025 H ALA 561 H ALA 561 109.173 12.761 20.325 1026 HA ALA 561 HA ALA 561 109.825 11.968 22.352 1027 HB1 ALA 561 HB1 ALA 561 110.895 14.558 22.186 1028 HB2 ALA 561 HB2 ALA 561 111.424 13.234 23.224 1029 HB3 ALA 561 HB3 ALA 561 110.239 14.399 23.814 Start of MODEL 15 1 H1 MET 437 HT1 MET 437 114.075 28.878 -4.922 2 H2 MET 437 HT2 MET 437 115.106 28.286 -6.160 3 H3 MET 437 HT3 MET 437 114.891 29.975 -5.954 4 HA MET 437 HA MET 437 116.717 29.920 -4.791 5 HB2 MET 437 HB2 MET 437 114.734 28.584 -2.956 6 HB3 MET 437 HB3 MET 437 116.336 29.059 -2.412 7 HG2 MET 437 HG2 MET 437 115.386 31.334 -3.629 8 HG3 MET 437 HG3 MET 437 113.957 30.665 -2.846 9 HE1 MET 437 HE1 MET 437 117.578 30.512 -2.301 10 HE2 MET 437 HE2 MET 437 117.693 30.451 -0.542 11 HE3 MET 437 HE3 MET 437 117.885 31.988 -1.385 12 H HIS 438 H HIS 438 115.338 26.726 -3.985 13 HA HIS 438 HA HIS 438 117.675 25.412 -5.098 14 HB2 HIS 438 HB2 HIS 438 117.702 26.041 -2.410 15 HB3 HIS 438 HB3 HIS 438 117.112 24.382 -2.418 16 HD1 HIS 438 HD1 HIS 438 118.721 22.589 -3.549 17 HD2 HIS 438 HD2 HIS 438 120.394 26.331 -2.868 18 HE1 HIS 438 HE1 HIS 438 121.206 22.259 -3.745 19 HE2 HIS 438 HE2 HIS 438 122.202 24.520 -3.251 20 H HIS 439 H HIS 439 117.396 23.144 -5.398 21 HA HIS 439 HA HIS 439 114.593 22.263 -5.176 22 HB2 HIS 439 HB2 HIS 439 116.226 20.966 -7.249 23 HB3 HIS 439 HB3 HIS 439 114.573 21.568 -7.328 24 HD1 HIS 439 HD1 HIS 439 114.222 23.713 -8.557 25 HD2 HIS 439 HD2 HIS 439 118.220 23.070 -7.621 26 HE1 HIS 439 HE1 HIS 439 115.489 25.538 -9.733 27 HE2 HIS 439 HE2 HIS 439 117.901 25.163 -9.108 28 H HIS 440 H HIS 440 116.045 21.731 -3.031 29 HA HIS 440 HA HIS 440 116.674 20.052 -1.634 30 HB2 HIS 440 HB2 HIS 440 115.624 18.372 -3.914 31 HB3 HIS 440 HB3 HIS 440 116.214 17.680 -2.407 32 HD1 HIS 440 HD1 HIS 440 114.934 19.111 -0.234 33 HD2 HIS 440 HD2 HIS 440 112.936 18.504 -3.827 34 HE1 HIS 440 HE1 HIS 440 112.489 19.347 0.308 35 HE2 HIS 440 HE2 HIS 440 111.302 19.024 -1.891 36 H HIS 441 H HIS 441 117.540 18.833 -4.878 37 HA HIS 441 HA HIS 441 120.311 18.559 -3.917 38 HB2 HIS 441 HB2 HIS 441 118.563 16.776 -5.438 39 HB3 HIS 441 HB3 HIS 441 120.134 17.009 -6.198 40 HD1 HIS 441 HD1 HIS 441 121.973 17.063 -3.779 41 HD2 HIS 441 HD2 HIS 441 118.827 14.380 -4.202 42 HE1 HIS 441 HE1 HIS 441 122.550 15.111 -2.301 43 HE2 HIS 441 HE2 HIS 441 120.602 13.528 -2.526 44 H HIS 442 H HIS 442 122.011 19.177 -5.269 45 HA HIS 442 HA HIS 442 121.335 21.306 -7.114 46 HB2 HIS 442 HB2 HIS 442 123.191 21.479 -5.415 47 HB3 HIS 442 HB3 HIS 442 124.086 20.298 -6.367 48 HD1 HIS 442 HD1 HIS 442 125.774 22.485 -6.379 49 HD2 HIS 442 HD2 HIS 442 122.367 22.657 -8.751 50 HE1 HIS 442 HE1 HIS 442 126.217 24.303 -8.059 51 HE2 HIS 442 HE2 HIS 442 124.177 24.329 -9.538 52 H HIS 443 H HIS 443 122.239 17.995 -7.243 53 HA HIS 443 HA HIS 443 122.928 18.196 -10.090 54 HB2 HIS 443 HB2 HIS 443 123.831 16.520 -7.924 55 HB3 HIS 443 HB3 HIS 443 123.199 15.525 -9.231 56 HD1 HIS 443 HD1 HIS 443 126.262 16.827 -8.137 57 HD2 HIS 443 HD2 HIS 443 124.415 16.623 -11.854 58 HE1 HIS 443 HE1 HIS 443 128.111 17.080 -9.822 59 HE2 HIS 443 HE2 HIS 443 126.967 16.986 -12.065 60 H SER 444 H SER 444 122.185 16.060 -11.291 61 HA SER 444 HA SER 444 119.317 16.162 -11.305 62 HB2 SER 444 HB2 SER 444 119.732 14.266 -13.081 63 HB3 SER 444 HB3 SER 444 120.148 15.937 -13.457 64 HG SER 444 HG SER 444 122.025 15.067 -13.887 65 H ASN 445 H ASN 445 118.394 13.712 -11.839 66 HA ASN 445 HA ASN 445 119.314 11.830 -9.829 67 HB2 ASN 445 HB2 ASN 445 117.087 13.594 -9.356 68 HB3 ASN 445 HB3 ASN 445 116.527 11.927 -9.410 69 HD21 ASN 445 HD21 ASN 445 118.730 10.624 -8.380 70 HD22 ASN 445 HD22 ASN 445 118.929 11.069 -6.723 71 H ALA 446 H ALA 446 118.626 9.723 -10.180 72 HA ALA 446 HA ALA 446 116.885 9.245 -12.492 73 HB1 ALA 446 HB1 ALA 446 118.754 7.244 -12.738 74 HB2 ALA 446 HB2 ALA 446 119.733 8.653 -12.331 75 HB3 ALA 446 HB3 ALA 446 118.661 8.699 -13.731 76 H THR 447 H THR 447 115.354 7.813 -12.028 77 HA THR 447 HA THR 447 115.834 5.919 -9.819 78 HB THR 447 HB THR 447 113.616 6.112 -9.084 79 HG1 THR 447 HG1 THR 447 111.983 6.646 -10.351 80 HG21 THR 447 HG21 THR 447 114.129 8.062 -8.142 81 HG22 THR 447 HG22 THR 447 113.377 8.861 -9.522 82 HG23 THR 447 HG23 THR 447 115.110 8.536 -9.529 83 H GLY 448 H GLY 448 114.915 3.834 -9.996 84 HA2 GLY 448 HA2 GLY 448 113.271 2.695 -11.762 85 HA3 GLY 448 HA3 GLY 448 114.704 2.925 -12.752 86 HA PRO 449 HA PRO 449 116.276 -1.029 -11.646 87 HB2 PRO 449 HB2 PRO 449 118.829 0.446 -11.155 88 HB3 PRO 449 HB3 PRO 449 118.537 -1.009 -12.116 89 HG2 PRO 449 HG2 PRO 449 118.883 1.342 -13.308 90 HG3 PRO 449 HG3 PRO 449 117.682 0.186 -13.913 91 HD2 PRO 449 HD2 PRO 449 117.283 2.703 -12.368 92 HD3 PRO 449 HD3 PRO 449 116.256 1.966 -13.614 93 H GLN 450 H GLN 450 116.538 -2.222 -9.821 94 HA GLN 450 HA GLN 450 116.508 -2.738 -7.606 95 HB2 GLN 450 HB2 GLN 450 118.756 -1.007 -8.049 96 HB3 GLN 450 HB3 GLN 450 118.095 -0.703 -6.448 97 HG2 GLN 450 HG2 GLN 450 118.499 -3.526 -7.260 98 HG3 GLN 450 HG3 GLN 450 119.927 -2.557 -6.897 99 HE21 GLN 450 HE21 GLN 450 117.590 -4.528 -5.622 100 HE22 GLN 450 HE22 GLN 450 117.756 -4.112 -3.953 101 H PHE 451 H PHE 451 114.266 -1.492 -8.228 102 HA PHE 451 HA PHE 451 113.726 0.916 -6.843 103 HB2 PHE 451 HB2 PHE 451 111.469 0.584 -7.423 104 HB3 PHE 451 HB3 PHE 451 112.373 -0.167 -8.733 105 HD1 PHE 451 HD1 PHE 451 112.254 -2.507 -9.137 106 HD2 PHE 451 HD2 PHE 451 110.353 -0.813 -5.726 107 HE1 PHE 451 HE1 PHE 451 111.038 -4.616 -8.770 108 HE2 PHE 451 HE2 PHE 451 109.136 -2.916 -5.354 109 HZ PHE 451 HZ PHE 451 109.476 -4.821 -6.877 110 H VAL 452 H VAL 452 113.482 1.266 -4.734 111 HA VAL 452 HA VAL 452 113.682 -0.777 -2.806 112 HB VAL 452 HB VAL 452 114.217 1.708 -2.513 113 HG11 VAL 452 HG11 VAL 452 111.907 2.412 -3.281 114 HG12 VAL 452 HG12 VAL 452 112.526 3.199 -1.829 115 HG13 VAL 452 HG13 VAL 452 111.333 1.908 -1.692 116 HG21 VAL 452 HG21 VAL 452 114.203 1.463 -0.240 117 HG22 VAL 452 HG22 VAL 452 113.945 -0.212 -0.731 118 HG23 VAL 452 HG23 VAL 452 112.579 0.775 -0.211 119 H SER 453 H SER 453 112.176 -2.320 -2.590 120 HA SER 453 HA SER 453 109.433 -1.916 -3.219 121 HB2 SER 453 HB2 SER 453 109.294 -4.161 -3.155 122 HB3 SER 453 HB3 SER 453 111.051 -4.103 -3.021 123 HG SER 453 HG SER 453 110.917 -4.453 -0.880 124 H GLY 454 H GLY 454 110.716 -0.391 -0.814 125 HA2 GLY 454 HA2 GLY 454 110.199 0.032 1.423 126 HA3 GLY 454 HA3 GLY 454 108.655 0.330 0.647 127 H VAL 455 H VAL 455 110.072 -2.875 0.944 128 HA VAL 455 HA VAL 455 109.042 -4.783 1.736 129 HB VAL 455 HB VAL 455 108.634 -3.716 4.416 130 HG11 VAL 455 HG11 VAL 455 109.493 -5.705 4.978 131 HG12 VAL 455 HG12 VAL 455 110.890 -5.503 3.920 132 HG13 VAL 455 HG13 VAL 455 109.362 -6.087 3.261 133 HG21 VAL 455 HG21 VAL 455 111.065 -2.927 2.902 134 HG22 VAL 455 HG22 VAL 455 111.266 -3.450 4.573 135 HG23 VAL 455 HG23 VAL 455 110.217 -2.085 4.198 136 H ILE 456 H ILE 456 107.053 -4.963 0.782 137 HA ILE 456 HA ILE 456 104.770 -3.455 1.595 138 HB ILE 456 HB ILE 456 104.861 -6.005 -0.014 139 HG12 ILE 456 HG12 ILE 456 106.215 -4.051 -0.900 140 HG13 ILE 456 HG13 ILE 456 104.960 -4.658 -1.974 141 HG21 ILE 456 HG21 ILE 456 102.706 -4.650 -0.902 142 HG22 ILE 456 HG22 ILE 456 102.705 -4.171 0.796 143 HG23 ILE 456 HG23 ILE 456 102.644 -5.880 0.361 144 HD11 ILE 456 HD11 ILE 456 104.631 -2.412 -2.161 145 HD12 ILE 456 HD12 ILE 456 105.114 -2.090 -0.495 146 HD13 ILE 456 HD13 ILE 456 103.528 -2.782 -0.836 147 H VAL 457 H VAL 457 103.381 -3.825 3.196 148 HA VAL 457 HA VAL 457 103.448 -6.449 4.533 149 HB VAL 457 HB VAL 457 103.040 -3.687 5.643 150 HG11 VAL 457 HG11 VAL 457 102.254 -6.258 7.014 151 HG12 VAL 457 HG12 VAL 457 101.142 -5.018 6.435 152 HG13 VAL 457 HG13 VAL 457 102.265 -4.653 7.745 153 HG21 VAL 457 HG21 VAL 457 104.917 -5.956 6.050 154 HG22 VAL 457 HG22 VAL 457 104.567 -4.903 7.420 155 HG23 VAL 457 HG23 VAL 457 105.241 -4.226 5.938 156 H LYS 458 H LYS 458 101.731 -7.634 3.992 157 HA LYS 458 HA LYS 458 99.266 -6.346 3.152 158 HB2 LYS 458 HB2 LYS 458 99.972 -8.168 1.781 159 HB3 LYS 458 HB3 LYS 458 100.177 -9.220 3.174 160 HG2 LYS 458 HG2 LYS 458 97.497 -8.336 3.188 161 HG3 LYS 458 HG3 LYS 458 97.881 -8.840 1.541 162 HD2 LYS 458 HD2 LYS 458 98.721 -10.980 2.412 163 HD3 LYS 458 HD3 LYS 458 98.285 -10.474 4.045 164 HE2 LYS 458 HE2 LYS 458 95.978 -10.486 3.536 165 HE3 LYS 458 HE3 LYS 458 96.285 -10.600 1.803 166 HZ1 LYS 458 HZ1 LYS 458 95.702 -12.686 3.376 167 HZ2 LYS 458 HZ2 LYS 458 97.391 -12.757 3.382 168 HZ3 LYS 458 HZ3 LYS 458 96.549 -12.809 1.916 169 H ILE 459 H ILE 459 97.774 -5.819 4.587 170 HA ILE 459 HA ILE 459 97.473 -7.488 6.996 171 HB ILE 459 HB ILE 459 96.709 -4.586 6.656 172 HG12 ILE 459 HG12 ILE 459 98.946 -5.903 8.211 173 HG13 ILE 459 HG13 ILE 459 99.123 -4.850 6.812 174 HG21 ILE 459 HG21 ILE 459 96.043 -6.623 8.657 175 HG22 ILE 459 HG22 ILE 459 95.243 -5.097 8.278 176 HG23 ILE 459 HG23 ILE 459 96.659 -5.112 9.329 177 HD11 ILE 459 HD11 ILE 459 99.145 -3.062 8.110 178 HD12 ILE 459 HD12 ILE 459 99.127 -4.132 9.512 179 HD13 ILE 459 HD13 ILE 459 97.612 -3.522 8.849 180 H ILE 460 H ILE 460 95.688 -8.652 7.118 181 HA ILE 460 HA ILE 460 93.256 -7.658 5.808 182 HB ILE 460 HB ILE 460 94.444 -9.470 4.453 183 HG12 ILE 460 HG12 ILE 460 92.007 -8.743 4.305 184 HG13 ILE 460 HG13 ILE 460 92.395 -10.333 3.659 185 HG21 ILE 460 HG21 ILE 460 93.557 -11.801 5.336 186 HG22 ILE 460 HG22 ILE 460 93.759 -11.005 6.894 187 HG23 ILE 460 HG23 ILE 460 95.132 -11.156 5.797 188 HD11 ILE 460 HD11 ILE 460 90.974 -11.316 5.040 189 HD12 ILE 460 HD12 ILE 460 90.407 -9.705 5.477 190 HD13 ILE 460 HD13 ILE 460 91.659 -10.489 6.440 191 H SER 461 H SER 461 91.411 -7.882 6.967 192 HA SER 461 HA SER 461 91.600 -9.378 9.503 193 HB2 SER 461 HB2 SER 461 90.716 -7.637 10.682 194 HB3 SER 461 HB3 SER 461 91.411 -6.690 9.369 195 HG SER 461 HG SER 461 89.255 -7.063 8.337 196 H THR 462 H THR 462 88.958 -9.086 10.304 197 HA THR 462 HA THR 462 87.403 -10.334 8.142 198 HB THR 462 HB THR 462 86.374 -11.786 10.023 199 HG1 THR 462 HG1 THR 462 88.788 -10.896 11.208 200 HG21 THR 462 HG21 THR 462 88.619 -12.150 8.288 201 HG22 THR 462 HG22 THR 462 87.421 -13.331 8.818 202 HG23 THR 462 HG23 THR 462 88.876 -13.058 9.778 203 H GLU 463 H GLU 463 87.595 -7.731 9.926 204 HA GLU 463 HA GLU 463 85.201 -6.619 9.569 205 HB2 GLU 463 HB2 GLU 463 84.970 -8.708 11.622 206 HB3 GLU 463 HB3 GLU 463 84.324 -7.148 12.113 207 HG2 GLU 463 HG2 GLU 463 83.571 -8.323 9.475 208 HG3 GLU 463 HG3 GLU 463 82.782 -8.867 10.954 209 HA PRO 464 HA PRO 464 87.182 -5.022 13.895 210 HB2 PRO 464 HB2 PRO 464 89.825 -6.200 13.141 211 HB3 PRO 464 HB3 PRO 464 89.148 -5.895 14.745 212 HG2 PRO 464 HG2 PRO 464 89.170 -8.354 13.720 213 HG3 PRO 464 HG3 PRO 464 87.795 -7.774 14.677 214 HD2 PRO 464 HD2 PRO 464 88.011 -8.207 11.747 215 HD3 PRO 464 HD3 PRO 464 86.590 -8.309 12.804 216 H LEU 465 H LEU 465 88.935 -5.424 10.828 217 HA LEU 465 HA LEU 465 90.552 -3.262 10.740 218 HB2 LEU 465 HB2 LEU 465 89.286 -4.925 8.818 219 HB3 LEU 465 HB3 LEU 465 89.136 -3.268 8.264 220 HG LEU 465 HG LEU 465 91.823 -4.065 9.203 221 HD11 LEU 465 HD11 LEU 465 91.658 -4.844 6.485 222 HD12 LEU 465 HD12 LEU 465 90.426 -5.732 7.380 223 HD13 LEU 465 HD13 LEU 465 92.116 -5.817 7.881 224 HD21 LEU 465 HD21 LEU 465 92.368 -2.834 7.037 225 HD22 LEU 465 HD22 LEU 465 91.641 -1.896 8.343 226 HD23 LEU 465 HD23 LEU 465 90.653 -2.424 6.980 227 HA PRO 466 HA PRO 466 87.437 -0.086 11.585 228 HB2 PRO 466 HB2 PRO 466 89.708 1.510 12.446 229 HB3 PRO 466 HB3 PRO 466 88.361 0.891 13.404 230 HG2 PRO 466 HG2 PRO 466 90.916 -0.018 13.663 231 HG3 PRO 466 HG3 PRO 466 89.489 -1.014 13.997 232 HD2 PRO 466 HD2 PRO 466 91.245 -0.965 11.576 233 HD3 PRO 466 HD3 PRO 466 90.519 -2.353 12.418 234 H GLY 467 H GLY 467 90.570 0.318 9.989 235 HA2 GLY 467 HA2 GLY 467 89.838 1.357 7.631 236 HA3 GLY 467 HA3 GLY 467 89.708 2.763 8.678 237 H ARG 468 H ARG 468 91.392 3.281 6.834 238 HA ARG 468 HA ARG 468 94.007 2.263 7.037 239 HB2 ARG 468 HB2 ARG 468 94.666 4.046 5.622 240 HB3 ARG 468 HB3 ARG 468 93.030 3.623 5.134 241 HG2 ARG 468 HG2 ARG 468 92.123 5.533 6.199 242 HG3 ARG 468 HG3 ARG 468 93.643 5.875 7.028 243 HD2 ARG 468 HD2 ARG 468 94.581 6.829 5.200 244 HD3 ARG 468 HD3 ARG 468 93.754 5.750 4.078 245 HE ARG 468 HE ARG 468 92.877 8.331 4.950 246 HH11 ARG 468 HH11 ARG 468 91.818 5.218 3.803 247 HH12 ARG 468 HH12 ARG 468 90.325 5.819 3.161 248 HH21 ARG 468 HH21 ARG 468 90.917 9.133 4.109 249 HH22 ARG 468 HH22 ARG 468 89.813 8.046 3.334 250 H LYS 469 H LYS 469 92.403 4.998 8.579 251 HA LYS 469 HA LYS 469 94.641 6.130 9.826 252 HB2 LYS 469 HB2 LYS 469 93.124 7.415 11.082 253 HB3 LYS 469 HB3 LYS 469 92.295 7.100 9.564 254 HG2 LYS 469 HG2 LYS 469 91.200 5.135 10.769 255 HG3 LYS 469 HG3 LYS 469 91.794 5.878 12.255 256 HD2 LYS 469 HD2 LYS 469 90.442 7.750 12.006 257 HD3 LYS 469 HD3 LYS 469 90.236 7.493 10.273 258 HE2 LYS 469 HE2 LYS 469 88.886 5.489 10.759 259 HE3 LYS 469 HE3 LYS 469 89.051 5.818 12.483 260 HZ1 LYS 469 HZ1 LYS 469 88.120 8.158 11.568 261 HZ2 LYS 469 HZ2 LYS 469 87.143 6.926 12.193 262 HZ3 LYS 469 HZ3 LYS 469 87.344 7.077 10.521 263 H GLN 470 H GLN 470 92.354 3.669 10.978 264 HA GLN 470 HA GLN 470 93.603 3.445 13.542 265 HB2 GLN 470 HB2 GLN 470 91.189 2.645 12.450 266 HB3 GLN 470 HB3 GLN 470 92.042 1.129 12.709 267 HG2 GLN 470 HG2 GLN 470 91.739 3.221 14.842 268 HG3 GLN 470 HG3 GLN 470 90.577 1.918 14.594 269 HE21 GLN 470 HE21 GLN 470 92.700 2.715 16.694 270 HE22 GLN 470 HE22 GLN 470 93.489 1.216 17.034 271 H VAL 471 H VAL 471 93.668 1.498 10.568 272 HA VAL 471 HA VAL 471 95.324 -0.548 11.601 273 HB VAL 471 HB VAL 471 94.916 0.358 8.748 274 HG11 VAL 471 HG11 VAL 471 96.955 -0.808 8.733 275 HG12 VAL 471 HG12 VAL 471 95.743 -1.993 8.244 276 HG13 VAL 471 HG13 VAL 471 96.375 -2.005 9.890 277 HG21 VAL 471 HG21 VAL 471 93.716 -2.070 9.008 278 HG22 VAL 471 HG22 VAL 471 92.886 -0.520 9.132 279 HG23 VAL 471 HG23 VAL 471 93.414 -1.355 10.592 280 H ARG 472 H ARG 472 96.032 2.400 9.764 281 HA ARG 472 HA ARG 472 98.806 2.001 9.524 282 HB2 ARG 472 HB2 ARG 472 98.915 4.174 8.700 283 HB3 ARG 472 HB3 ARG 472 97.261 3.707 8.333 284 HG2 ARG 472 HG2 ARG 472 96.412 4.980 10.154 285 HG3 ARG 472 HG3 ARG 472 98.036 5.272 10.780 286 HD2 ARG 472 HD2 ARG 472 98.578 6.710 9.000 287 HD3 ARG 472 HD3 ARG 472 97.201 6.173 8.040 288 HE ARG 472 HE ARG 472 95.824 7.588 9.247 289 HH11 ARG 472 HH11 ARG 472 99.020 7.514 10.631 290 HH12 ARG 472 HH12 ARG 472 98.748 8.884 11.655 291 HH21 ARG 472 HH21 ARG 472 95.453 9.388 10.597 292 HH22 ARG 472 HH22 ARG 472 96.720 9.949 11.637 293 H ASP 473 H ASP 473 96.866 3.704 11.946 294 HA ASP 473 HA ASP 473 99.018 4.678 13.480 295 HB2 ASP 473 HB2 ASP 473 96.745 5.554 13.720 296 HB3 ASP 473 HB3 ASP 473 96.194 3.997 14.331 297 H THR 474 H THR 474 97.117 1.701 13.667 298 HA THR 474 HA THR 474 98.201 0.650 16.014 299 HB THR 474 HB THR 474 97.759 -1.603 14.548 300 HG1 THR 474 HG1 THR 474 95.712 0.050 13.591 301 HG21 THR 474 HG21 THR 474 95.927 0.180 16.104 302 HG22 THR 474 HG22 THR 474 96.613 -1.380 16.554 303 HG23 THR 474 HG23 THR 474 95.316 -1.299 15.361 304 H LEU 475 H LEU 475 98.962 -0.790 12.858 305 HA LEU 475 HA LEU 475 101.258 -2.055 13.504 306 HB2 LEU 475 HB2 LEU 475 101.981 -1.828 11.175 307 HB3 LEU 475 HB3 LEU 475 100.279 -2.224 11.294 308 HG LEU 475 HG LEU 475 100.113 0.467 11.144 309 HD11 LEU 475 HD11 LEU 475 102.649 0.491 10.868 310 HD12 LEU 475 HD12 LEU 475 101.696 1.397 9.692 311 HD13 LEU 475 HD13 LEU 475 102.358 -0.179 9.262 312 HD21 LEU 475 HD21 LEU 475 98.868 -1.104 9.783 313 HD22 LEU 475 HD22 LEU 475 100.313 -1.468 8.841 314 HD23 LEU 475 HD23 LEU 475 99.593 0.140 8.765 315 H ALA 476 H ALA 476 100.955 1.387 12.728 316 HA ALA 476 HA ALA 476 103.736 1.932 12.771 317 HB1 ALA 476 HB1 ALA 476 101.310 3.682 13.010 318 HB2 ALA 476 HB2 ALA 476 102.432 3.524 11.658 319 HB3 ALA 476 HB3 ALA 476 102.944 4.331 13.139 320 H ALA 477 H ALA 477 101.332 1.622 15.259 321 HA ALA 477 HA ALA 477 102.801 2.999 17.289 322 HB1 ALA 477 HB1 ALA 477 101.161 1.364 18.697 323 HB2 ALA 477 HB2 ALA 477 100.314 1.440 17.151 324 HB3 ALA 477 HB3 ALA 477 100.679 2.924 18.030 325 H ILE 478 H ILE 478 102.710 -0.263 16.060 326 HA ILE 478 HA ILE 478 104.262 -1.348 18.253 327 HB ILE 478 HB ILE 478 103.216 -2.494 15.680 328 HG12 ILE 478 HG12 ILE 478 102.497 -4.171 17.687 329 HG13 ILE 478 HG13 ILE 478 102.603 -2.649 18.566 330 HG21 ILE 478 HG21 ILE 478 104.227 -4.694 16.620 331 HG22 ILE 478 HG22 ILE 478 105.353 -3.617 17.448 332 HG23 ILE 478 HG23 ILE 478 105.250 -3.601 15.687 333 HD11 ILE 478 HD11 ILE 478 101.192 -2.175 16.154 334 HD12 ILE 478 HD12 ILE 478 100.610 -2.078 17.817 335 HD13 ILE 478 HD13 ILE 478 100.506 -3.602 16.934 336 H SER 479 H SER 479 104.793 -0.135 15.026 337 HA SER 479 HA SER 479 107.637 0.035 15.507 338 HB2 SER 479 HB2 SER 479 108.399 -1.432 13.898 339 HB3 SER 479 HB3 SER 479 106.946 -2.289 14.415 340 HG SER 479 HG SER 479 107.184 -2.042 12.098 341 H GLU 480 H GLU 480 108.717 1.399 13.957 342 HA GLU 480 HA GLU 480 106.981 3.461 12.954 343 HB2 GLU 480 HB2 GLU 480 109.147 3.963 14.046 344 HB3 GLU 480 HB3 GLU 480 109.982 3.192 12.704 345 HG2 GLU 480 HG2 GLU 480 108.894 4.870 11.192 346 HG3 GLU 480 HG3 GLU 480 108.329 5.701 12.640 347 H VAL 481 H VAL 481 105.980 3.283 11.071 348 HA VAL 481 HA VAL 481 107.303 1.841 8.871 349 HB VAL 481 HB VAL 481 104.956 1.914 7.844 350 HG11 VAL 481 HG11 VAL 481 106.136 -0.052 8.954 351 HG12 VAL 481 HG12 VAL 481 104.379 -0.137 8.833 352 HG13 VAL 481 HG13 VAL 481 105.138 0.292 10.366 353 HG21 VAL 481 HG21 VAL 481 103.761 1.996 10.511 354 HG22 VAL 481 HG22 VAL 481 103.201 2.699 8.994 355 HG23 VAL 481 HG23 VAL 481 104.404 3.545 9.967 356 H LEU 482 H LEU 482 106.549 2.711 6.643 357 HA LEU 482 HA LEU 482 107.216 5.551 6.609 358 HB2 LEU 482 HB2 LEU 482 108.309 3.685 5.164 359 HB3 LEU 482 HB3 LEU 482 106.875 3.846 4.168 360 HG LEU 482 HG LEU 482 108.697 5.157 3.246 361 HD11 LEU 482 HD11 LEU 482 107.035 7.333 4.326 362 HD12 LEU 482 HD12 LEU 482 106.161 6.006 3.560 363 HD13 LEU 482 HD13 LEU 482 107.390 6.892 2.656 364 HD21 LEU 482 HD21 LEU 482 110.025 6.563 4.409 365 HD22 LEU 482 HD22 LEU 482 109.526 5.558 5.769 366 HD23 LEU 482 HD23 LEU 482 108.720 7.098 5.469 367 H TYR 483 H TYR 483 104.979 3.500 4.726 368 HA TYR 483 HA TYR 483 102.858 5.465 5.170 369 HB2 TYR 483 HB2 TYR 483 103.955 6.230 3.128 370 HB3 TYR 483 HB3 TYR 483 103.787 4.628 2.417 371 HD1 TYR 483 HD1 TYR 483 102.227 7.814 2.955 372 HD2 TYR 483 HD2 TYR 483 101.454 3.750 1.966 373 HE1 TYR 483 HE1 TYR 483 100.039 8.460 2.036 374 HE2 TYR 483 HE2 TYR 483 99.266 4.383 1.044 375 HH TYR 483 HH TYR 483 97.658 6.120 1.146 376 H VAL 484 H VAL 484 100.805 4.645 5.100 377 HA VAL 484 HA VAL 484 100.586 1.742 4.636 378 HB VAL 484 HB VAL 484 98.890 3.457 6.456 379 HG11 VAL 484 HG11 VAL 484 98.689 0.691 7.031 380 HG12 VAL 484 HG12 VAL 484 98.426 0.899 5.300 381 HG13 VAL 484 HG13 VAL 484 97.431 1.784 6.456 382 HG21 VAL 484 HG21 VAL 484 100.499 1.306 7.619 383 HG22 VAL 484 HG22 VAL 484 100.239 2.959 8.177 384 HG23 VAL 484 HG23 VAL 484 101.444 2.627 6.932 385 H ASP 485 H ASP 485 99.596 1.309 2.771 386 HA ASP 485 HA ASP 485 97.564 3.172 1.770 387 HB2 ASP 485 HB2 ASP 485 99.415 2.676 0.242 388 HB3 ASP 485 HB3 ASP 485 99.048 0.957 0.340 389 H LEU 486 H LEU 486 95.689 2.584 2.780 390 HA LEU 486 HA LEU 486 94.878 -0.233 2.654 391 HB2 LEU 486 HB2 LEU 486 94.606 0.546 4.846 392 HB3 LEU 486 HB3 LEU 486 93.987 2.097 4.318 393 HG LEU 486 HG LEU 486 92.365 0.376 5.375 394 HD11 LEU 486 HD11 LEU 486 91.331 1.399 2.786 395 HD12 LEU 486 HD12 LEU 486 91.956 2.559 3.958 396 HD13 LEU 486 HD13 LEU 486 90.628 1.487 4.400 397 HD21 LEU 486 HD21 LEU 486 93.265 -1.106 3.156 398 HD22 LEU 486 HD22 LEU 486 91.587 -0.669 2.830 399 HD23 LEU 486 HD23 LEU 486 92.002 -1.535 4.309 400 H LEU 487 H LEU 487 93.307 -0.911 1.314 401 HA LEU 487 HA LEU 487 92.363 0.704 -0.763 402 HB2 LEU 487 HB2 LEU 487 91.678 -1.991 0.291 403 HB3 LEU 487 HB3 LEU 487 90.547 -1.241 -0.819 404 HG LEU 487 HG LEU 487 93.096 -0.948 -1.984 405 HD11 LEU 487 HD11 LEU 487 92.621 -3.723 -0.910 406 HD12 LEU 487 HD12 LEU 487 93.982 -2.660 -0.550 407 HD13 LEU 487 HD13 LEU 487 93.784 -3.319 -2.174 408 HD21 LEU 487 HD21 LEU 487 90.688 -2.652 -2.549 409 HD22 LEU 487 HD22 LEU 487 92.100 -2.640 -3.605 410 HD23 LEU 487 HD23 LEU 487 91.188 -1.154 -3.336 411 H GLU 488 H GLU 488 91.148 2.447 -0.474 412 HA GLU 488 HA GLU 488 89.568 3.150 1.630 413 HB2 GLU 488 HB2 GLU 488 88.412 4.692 0.124 414 HB3 GLU 488 HB3 GLU 488 90.140 4.673 -0.197 415 HG2 GLU 488 HG2 GLU 488 89.498 2.902 -1.998 416 HG3 GLU 488 HG3 GLU 488 87.893 3.619 -1.844 417 H GLY 489 H GLY 489 87.793 2.362 2.529 418 HA2 GLY 489 HA2 GLY 489 85.721 1.392 2.763 419 HA3 GLY 489 HA3 GLY 489 85.527 1.525 1.021 420 H ASP 490 H ASP 490 88.355 -0.116 1.927 421 HA ASP 490 HA ASP 490 87.030 -2.693 1.401 422 HB2 ASP 490 HB2 ASP 490 88.836 -1.661 -0.217 423 HB3 ASP 490 HB3 ASP 490 89.964 -2.312 0.970 424 H THR 491 H THR 491 88.211 -4.600 2.321 425 HA THR 491 HA THR 491 88.958 -4.003 5.095 426 HB THR 491 HB THR 491 88.236 -6.142 5.710 427 HG1 THR 491 HG1 THR 491 89.192 -7.462 4.186 428 HG21 THR 491 HG21 THR 491 86.313 -4.825 5.212 429 HG22 THR 491 HG22 THR 491 86.008 -6.446 4.590 430 HG23 THR 491 HG23 THR 491 86.463 -5.150 3.485 431 H GLU 492 H GLU 492 90.625 -4.141 2.449 432 HA GLU 492 HA GLU 492 92.778 -5.789 3.598 433 HB2 GLU 492 HB2 GLU 492 92.849 -5.333 0.683 434 HB3 GLU 492 HB3 GLU 492 93.242 -6.773 1.608 435 HG2 GLU 492 HG2 GLU 492 91.137 -7.605 1.480 436 HG3 GLU 492 HG3 GLU 492 90.384 -6.012 1.439 437 H CYS 493 H CYS 493 94.432 -4.582 4.245 438 HA CYS 493 HA CYS 493 95.043 -2.131 2.734 439 HB2 CYS 493 HB2 CYS 493 94.287 -1.298 4.777 440 HB3 CYS 493 HB3 CYS 493 94.986 -2.629 5.691 441 HG CYS 493 HG CYS 493 96.258 -0.082 5.588 442 H HIS 494 H HIS 494 97.149 -1.708 2.254 443 HA HIS 494 HA HIS 494 99.156 -3.670 3.130 444 HB2 HIS 494 HB2 HIS 494 98.749 -2.600 0.331 445 HB3 HIS 494 HB3 HIS 494 100.177 -3.494 0.844 446 HD1 HIS 494 HD1 HIS 494 96.428 -4.124 1.151 447 HD2 HIS 494 HD2 HIS 494 99.939 -6.060 0.063 448 HE1 HIS 494 HE1 HIS 494 95.742 -6.463 0.537 449 HE2 HIS 494 HE2 HIS 494 97.899 -7.649 0.003 450 H ALA 495 H ALA 495 100.498 -2.563 4.400 451 HA ALA 495 HA ALA 495 101.113 0.218 3.714 452 HB1 ALA 495 HB1 ALA 495 102.150 0.178 6.074 453 HB2 ALA 495 HB2 ALA 495 101.239 -1.318 6.276 454 HB3 ALA 495 HB3 ALA 495 100.394 0.186 5.914 455 H ARG 496 H ARG 496 103.075 0.899 3.174 456 HA ARG 496 HA ARG 496 105.144 -1.080 2.691 457 HB2 ARG 496 HB2 ARG 496 104.683 1.767 1.884 458 HB3 ARG 496 HB3 ARG 496 106.310 1.106 1.804 459 HG2 ARG 496 HG2 ARG 496 105.802 -0.318 0.094 460 HG3 ARG 496 HG3 ARG 496 104.101 -0.437 0.553 461 HD2 ARG 496 HD2 ARG 496 104.797 0.896 -1.580 462 HD3 ARG 496 HD3 ARG 496 103.534 1.517 -0.518 463 HE ARG 496 HE ARG 496 106.054 2.519 0.274 464 HH11 ARG 496 HH11 ARG 496 103.650 2.842 -2.224 465 HH12 ARG 496 HH12 ARG 496 104.046 4.491 -2.575 466 HH21 ARG 496 HH21 ARG 496 106.583 4.695 -0.176 467 HH22 ARG 496 HH22 ARG 496 105.714 5.546 -1.410 468 H PHE 497 H PHE 497 106.898 -1.348 3.909 469 HA PHE 497 HA PHE 497 107.261 0.427 6.217 470 HB2 PHE 497 HB2 PHE 497 108.141 -2.405 5.664 471 HB3 PHE 497 HB3 PHE 497 108.763 -1.474 7.024 472 HD1 PHE 497 HD1 PHE 497 107.875 -2.430 8.930 473 HD2 PHE 497 HD2 PHE 497 105.330 -1.683 5.602 474 HE1 PHE 497 HE1 PHE 497 105.924 -3.098 10.272 475 HE2 PHE 497 HE2 PHE 497 103.381 -2.345 6.935 476 HZ PHE 497 HZ PHE 497 103.672 -3.055 9.277 477 H LYS 498 H LYS 498 109.265 1.336 6.708 478 HA LYS 498 HA LYS 498 110.892 1.945 4.434 479 HB2 LYS 498 HB2 LYS 498 111.884 3.565 5.745 480 HB3 LYS 498 HB3 LYS 498 110.319 3.408 6.530 481 HG2 LYS 498 HG2 LYS 498 111.393 3.073 8.435 482 HG3 LYS 498 HG3 LYS 498 111.960 1.533 7.788 483 HD2 LYS 498 HD2 LYS 498 114.050 2.290 7.633 484 HD3 LYS 498 HD3 LYS 498 113.524 3.730 6.760 485 HE2 LYS 498 HE2 LYS 498 114.174 4.863 8.573 486 HE3 LYS 498 HE3 LYS 498 112.701 4.250 9.324 487 HZ1 LYS 498 HZ1 LYS 498 114.229 3.565 10.839 488 HZ2 LYS 498 HZ2 LYS 498 115.474 3.407 9.706 489 HZ3 LYS 498 HZ3 LYS 498 114.276 2.218 9.816 490 H THR 499 H THR 499 110.928 -0.450 6.865 491 HA THR 499 HA THR 499 113.471 -1.457 5.836 492 HB THR 499 HB THR 499 113.718 -2.174 8.444 493 HG1 THR 499 HG1 THR 499 113.205 0.546 8.767 494 HG21 THR 499 HG21 THR 499 115.122 -0.661 6.605 495 HG22 THR 499 HG22 THR 499 115.691 -1.160 8.197 496 HG23 THR 499 HG23 THR 499 114.938 0.421 7.984 497 HA PRO 500 HA PRO 500 111.282 -5.284 5.917 498 HB2 PRO 500 HB2 PRO 500 113.327 -7.027 5.855 499 HB3 PRO 500 HB3 PRO 500 112.948 -5.985 4.479 500 HG2 PRO 500 HG2 PRO 500 115.042 -5.632 6.591 501 HG3 PRO 500 HG3 PRO 500 115.182 -5.425 4.835 502 HD2 PRO 500 HD2 PRO 500 114.836 -3.340 6.548 503 HD3 PRO 500 HD3 PRO 500 114.226 -3.332 4.880 504 H GLU 501 H GLU 501 113.950 -4.942 8.223 505 HA GLU 501 HA GLU 501 113.264 -7.078 9.905 506 HB2 GLU 501 HB2 GLU 501 114.530 -5.664 11.658 507 HB3 GLU 501 HB3 GLU 501 115.407 -6.234 10.245 508 HG2 GLU 501 HG2 GLU 501 115.688 -4.157 9.406 509 HG3 GLU 501 HG3 GLU 501 114.142 -3.578 10.024 510 H ASP 502 H ASP 502 112.234 -3.697 9.893 511 HA ASP 502 HA ASP 502 110.859 -3.739 12.349 512 HB2 ASP 502 HB2 ASP 502 111.200 -1.913 10.149 513 HB3 ASP 502 HB3 ASP 502 109.512 -1.938 10.651 514 H ALA 503 H ALA 503 109.894 -4.643 9.091 515 HA ALA 503 HA ALA 503 107.122 -4.878 9.610 516 HB1 ALA 503 HB1 ALA 503 106.924 -5.883 7.505 517 HB2 ALA 503 HB2 ALA 503 108.575 -6.504 7.546 518 HB3 ALA 503 HB3 ALA 503 108.287 -4.776 7.337 519 H GLN 504 H GLN 504 109.796 -7.195 9.733 520 HA GLN 504 HA GLN 504 108.258 -9.486 10.271 521 HB2 GLN 504 HB2 GLN 504 110.884 -9.037 9.784 522 HB3 GLN 504 HB3 GLN 504 110.936 -9.326 11.517 523 HG2 GLN 504 HG2 GLN 504 110.186 -11.503 11.310 524 HG3 GLN 504 HG3 GLN 504 109.486 -11.217 9.717 525 HE21 GLN 504 HE21 GLN 504 110.519 -12.719 8.539 526 HE22 GLN 504 HE22 GLN 504 112.232 -12.797 8.330 527 H ALA 505 H ALA 505 109.736 -7.086 12.398 528 HA ALA 505 HA ALA 505 109.156 -8.388 14.830 529 HB1 ALA 505 HB1 ALA 505 109.537 -6.157 15.861 530 HB2 ALA 505 HB2 ALA 505 109.665 -5.483 14.236 531 HB3 ALA 505 HB3 ALA 505 110.830 -6.687 14.785 532 H VAL 506 H VAL 506 107.331 -5.978 12.960 533 HA VAL 506 HA VAL 506 105.330 -5.574 14.927 534 HB VAL 506 HB VAL 506 105.719 -3.958 13.131 535 HG11 VAL 506 HG11 VAL 506 104.655 -6.144 11.355 536 HG12 VAL 506 HG12 VAL 506 106.231 -5.358 11.276 537 HG13 VAL 506 HG13 VAL 506 104.775 -4.455 10.865 538 HG21 VAL 506 HG21 VAL 506 103.245 -3.781 12.385 539 HG22 VAL 506 HG22 VAL 506 103.637 -3.646 14.099 540 HG23 VAL 506 HG23 VAL 506 102.998 -5.159 13.458 541 H ILE 507 H ILE 507 105.479 -7.694 12.084 542 HA ILE 507 HA ILE 507 102.840 -8.682 12.336 543 HB ILE 507 HB ILE 507 103.761 -10.660 10.989 544 HG12 ILE 507 HG12 ILE 507 105.991 -9.301 9.900 545 HG13 ILE 507 HG13 ILE 507 106.206 -9.312 11.646 546 HG21 ILE 507 HG21 ILE 507 103.166 -9.537 9.139 547 HG22 ILE 507 HG22 ILE 507 104.335 -8.246 9.419 548 HG23 ILE 507 HG23 ILE 507 102.790 -8.238 10.271 549 HD11 ILE 507 HD11 ILE 507 105.893 -11.661 9.812 550 HD12 ILE 507 HD12 ILE 507 105.768 -11.788 11.566 551 HD13 ILE 507 HD13 ILE 507 107.273 -11.240 10.825 552 H ASN 508 H ASN 508 105.905 -9.683 13.697 553 HA ASN 508 HA ASN 508 104.964 -12.164 14.759 554 HB2 ASN 508 HB2 ASN 508 107.358 -10.456 15.470 555 HB3 ASN 508 HB3 ASN 508 107.042 -12.039 16.175 556 HD21 ASN 508 HD21 ASN 508 109.296 -11.172 14.588 557 HD22 ASN 508 HD22 ASN 508 109.345 -12.199 13.200 558 H ALA 509 H ALA 509 105.308 -8.892 15.996 559 HA ALA 509 HA ALA 509 104.438 -9.524 18.651 560 HB1 ALA 509 HB1 ALA 509 104.391 -6.764 17.490 561 HB2 ALA 509 HB2 ALA 509 105.916 -7.557 17.895 562 HB3 ALA 509 HB3 ALA 509 104.710 -7.271 19.150 563 H TYR 510 H TYR 510 102.879 -8.730 15.682 564 HA TYR 510 HA TYR 510 100.533 -7.560 16.630 565 HB2 TYR 510 HB2 TYR 510 101.513 -8.532 14.135 566 HB3 TYR 510 HB3 TYR 510 99.864 -9.113 14.372 567 HD1 TYR 510 HD1 TYR 510 98.680 -7.776 12.822 568 HD2 TYR 510 HD2 TYR 510 101.304 -5.945 15.630 569 HE1 TYR 510 HE1 TYR 510 97.800 -5.567 12.194 570 HE2 TYR 510 HE2 TYR 510 100.434 -3.731 15.002 571 HH TYR 510 HH TYR 510 99.017 -2.965 12.427 572 H THR 511 H THR 511 101.589 -10.698 17.224 573 HA THR 511 HA THR 511 99.282 -12.232 17.023 574 HB THR 511 HB THR 511 100.171 -13.615 18.843 575 HG1 THR 511 HG1 THR 511 101.661 -11.312 19.369 576 HG21 THR 511 HG21 THR 511 102.725 -13.039 17.580 577 HG22 THR 511 HG22 THR 511 101.398 -13.120 16.419 578 HG23 THR 511 HG23 THR 511 101.720 -14.485 17.489 579 H GLU 512 H GLU 512 100.284 -9.878 19.395 580 HA GLU 512 HA GLU 512 98.445 -10.303 21.416 581 HB2 GLU 512 HB2 GLU 512 98.983 -8.186 22.219 582 HB3 GLU 512 HB3 GLU 512 100.400 -8.619 21.272 583 HG2 GLU 512 HG2 GLU 512 99.758 -7.204 19.490 584 HG3 GLU 512 HG3 GLU 512 98.149 -6.963 20.171 585 H ILE 513 H ILE 513 98.031 -8.474 18.408 586 HA ILE 513 HA ILE 513 95.668 -7.187 18.841 587 HB ILE 513 HB ILE 513 96.298 -8.721 16.317 588 HG12 ILE 513 HG12 ILE 513 98.181 -7.321 16.827 589 HG13 ILE 513 HG13 ILE 513 97.257 -6.526 15.558 590 HG21 ILE 513 HG21 ILE 513 94.999 -6.307 15.743 591 HG22 ILE 513 HG22 ILE 513 94.112 -7.022 17.088 592 HG23 ILE 513 HG23 ILE 513 94.345 -7.937 15.602 593 HD11 ILE 513 HD11 ILE 513 96.201 -5.515 17.910 594 HD12 ILE 513 HD12 ILE 513 97.321 -4.705 16.815 595 HD13 ILE 513 HD13 ILE 513 97.938 -5.602 18.203 596 H ASN 514 H ASN 514 96.041 -10.606 17.907 597 HA ASN 514 HA ASN 514 93.423 -11.336 17.601 598 HB2 ASN 514 HB2 ASN 514 95.208 -12.908 17.191 599 HB3 ASN 514 HB3 ASN 514 95.671 -12.892 18.890 600 HD21 ASN 514 HD21 ASN 514 92.560 -13.208 17.215 601 HD22 ASN 514 HD22 ASN 514 92.107 -14.689 17.978 602 H LYS 515 H LYS 515 95.139 -10.683 20.585 603 HA LYS 515 HA LYS 515 93.422 -11.819 22.442 604 HB2 LYS 515 HB2 LYS 515 94.863 -9.177 22.733 605 HB3 LYS 515 HB3 LYS 515 94.295 -10.208 24.039 606 HG2 LYS 515 HG2 LYS 515 96.423 -10.947 22.039 607 HG3 LYS 515 HG3 LYS 515 96.712 -10.388 23.688 608 HD2 LYS 515 HD2 LYS 515 95.609 -12.328 24.591 609 HD3 LYS 515 HD3 LYS 515 95.122 -12.852 22.977 610 HE2 LYS 515 HE2 LYS 515 97.063 -13.888 22.660 611 HE3 LYS 515 HE3 LYS 515 97.965 -12.435 23.084 612 HZ1 LYS 515 HZ1 LYS 515 98.318 -13.160 25.166 613 HZ2 LYS 515 HZ2 LYS 515 98.028 -14.688 24.502 614 HZ3 LYS 515 HZ3 LYS 515 96.789 -13.870 25.313 615 H LYS 516 H LYS 516 93.003 -9.026 20.449 616 HA LYS 516 HA LYS 516 90.420 -8.483 21.767 617 HB2 LYS 516 HB2 LYS 516 92.349 -6.696 21.795 618 HB3 LYS 516 HB3 LYS 516 91.829 -6.400 20.142 619 HG2 LYS 516 HG2 LYS 516 90.729 -4.841 21.577 620 HG3 LYS 516 HG3 LYS 516 89.533 -5.998 20.989 621 HD2 LYS 516 HD2 LYS 516 90.880 -6.649 23.544 622 HD3 LYS 516 HD3 LYS 516 89.746 -5.298 23.566 623 HE2 LYS 516 HE2 LYS 516 88.763 -7.663 22.149 624 HE3 LYS 516 HE3 LYS 516 89.079 -7.932 23.862 625 HZ1 LYS 516 HZ1 LYS 516 87.774 -5.592 23.911 626 HZ2 LYS 516 HZ2 LYS 516 87.030 -7.098 24.107 627 HZ3 LYS 516 HZ3 LYS 516 87.025 -6.345 22.592 628 H HIS 517 H HIS 517 92.200 -8.610 18.729 629 HA HIS 517 HA HIS 517 89.815 -9.455 17.332 630 HB2 HIS 517 HB2 HIS 517 91.309 -7.080 16.230 631 HB3 HIS 517 HB3 HIS 517 89.758 -7.728 15.710 632 HD1 HIS 517 HD1 HIS 517 87.713 -7.294 17.370 633 HD2 HIS 517 HD2 HIS 517 91.176 -5.136 18.155 634 HE1 HIS 517 HE1 HIS 517 87.009 -5.427 18.901 635 HE2 HIS 517 HE2 HIS 517 89.104 -4.081 19.289 636 H CYS 518 H CYS 518 90.348 -10.984 15.890 637 HA CYS 518 HA CYS 518 93.036 -11.802 15.553 638 HB2 CYS 518 HB2 CYS 518 90.856 -12.636 13.669 639 HB3 CYS 518 HB3 CYS 518 92.191 -13.587 14.311 640 HG CYS 518 HG CYS 518 89.477 -13.157 15.667 641 H TRP 519 H TRP 519 94.545 -10.977 14.241 642 HA TRP 519 HA TRP 519 93.649 -9.690 11.748 643 HB2 TRP 519 HB2 TRP 519 94.791 -8.352 13.876 644 HB3 TRP 519 HB3 TRP 519 96.142 -8.598 12.772 645 HD1 TRP 519 HD1 TRP 519 93.680 -8.462 10.347 646 HE1 TRP 519 HE1 TRP 519 93.165 -6.109 9.501 647 HE3 TRP 519 HE3 TRP 519 95.755 -5.759 14.155 648 HZ2 TRP 519 HZ2 TRP 519 93.562 -3.428 10.334 649 HZ3 TRP 519 HZ3 TRP 519 95.644 -3.303 14.055 650 HH2 TRP 519 HH2 TRP 519 94.573 -2.164 12.180 651 H LYS 520 H LYS 520 94.929 -9.850 9.974 652 HA LYS 520 HA LYS 520 96.945 -11.987 10.061 653 HB2 LYS 520 HB2 LYS 520 95.549 -11.026 7.597 654 HB3 LYS 520 HB3 LYS 520 96.290 -12.594 7.896 655 HG2 LYS 520 HG2 LYS 520 93.723 -11.540 9.063 656 HG3 LYS 520 HG3 LYS 520 93.905 -12.844 7.885 657 HD2 LYS 520 HD2 LYS 520 94.258 -14.345 9.497 658 HD3 LYS 520 HD3 LYS 520 95.499 -13.335 10.244 659 HE2 LYS 520 HE2 LYS 520 94.093 -12.569 11.810 660 HE3 LYS 520 HE3 LYS 520 92.781 -12.346 10.653 661 HZ1 LYS 520 HZ1 LYS 520 93.571 -14.932 11.884 662 HZ2 LYS 520 HZ2 LYS 520 92.304 -14.707 10.786 663 HZ3 LYS 520 HZ3 LYS 520 92.226 -14.002 12.322 664 H LEU 521 H LEU 521 98.972 -11.616 9.337 665 HA LEU 521 HA LEU 521 99.507 -9.151 7.846 666 HB2 LEU 521 HB2 LEU 521 101.447 -9.967 9.959 667 HB3 LEU 521 HB3 LEU 521 101.158 -8.384 9.263 668 HG LEU 521 HG LEU 521 100.422 -8.296 11.518 669 HD11 LEU 521 HD11 LEU 521 98.685 -7.872 9.359 670 HD12 LEU 521 HD12 LEU 521 98.613 -7.143 10.962 671 HD13 LEU 521 HD13 LEU 521 97.718 -8.626 10.627 672 HD21 LEU 521 HD21 LEU 521 98.322 -10.279 11.481 673 HD22 LEU 521 HD22 LEU 521 99.624 -10.037 12.645 674 HD23 LEU 521 HD23 LEU 521 99.903 -11.008 11.199 675 H GLU 522 H GLU 522 100.769 -9.509 6.117 676 HA GLU 522 HA GLU 522 102.612 -11.791 6.150 677 HB2 GLU 522 HB2 GLU 522 100.199 -12.042 4.943 678 HB3 GLU 522 HB3 GLU 522 101.150 -11.392 3.614 679 HG2 GLU 522 HG2 GLU 522 102.113 -13.349 3.255 680 HG3 GLU 522 HG3 GLU 522 102.585 -13.496 4.947 681 H ILE 523 H ILE 523 104.533 -11.370 5.258 682 HA ILE 523 HA ILE 523 104.940 -8.749 4.036 683 HB ILE 523 HB ILE 523 106.852 -10.828 5.091 684 HG12 ILE 523 HG12 ILE 523 106.786 -7.956 5.917 685 HG13 ILE 523 HG13 ILE 523 105.525 -9.032 6.509 686 HG21 ILE 523 HG21 ILE 523 107.837 -9.903 3.080 687 HG22 ILE 523 HG22 ILE 523 108.679 -9.293 4.505 688 HG23 ILE 523 HG23 ILE 523 107.526 -8.265 3.654 689 HD11 ILE 523 HD11 ILE 523 107.446 -10.550 7.252 690 HD12 ILE 523 HD12 ILE 523 107.143 -9.077 8.172 691 HD13 ILE 523 HD13 ILE 523 108.470 -9.136 7.012 692 H LEU 524 H LEU 524 104.794 -8.587 1.895 693 HA LEU 524 HA LEU 524 104.728 -10.775 0.131 694 HB2 LEU 524 HB2 LEU 524 105.066 -7.822 -0.278 695 HB3 LEU 524 HB3 LEU 524 105.123 -8.935 -1.630 696 HG LEU 524 HG LEU 524 102.898 -7.824 -1.219 697 HD11 LEU 524 HD11 LEU 524 102.264 -10.657 -0.938 698 HD12 LEU 524 HD12 LEU 524 103.513 -10.329 -2.139 699 HD13 LEU 524 HD13 LEU 524 101.938 -9.546 -2.268 700 HD21 LEU 524 HD21 LEU 524 101.525 -8.531 0.578 701 HD22 LEU 524 HD22 LEU 524 103.071 -8.061 1.285 702 HD23 LEU 524 HD23 LEU 524 102.683 -9.767 1.069 703 H SER 525 H SER 525 106.211 -11.605 -1.314 704 HA SER 525 HA SER 525 108.936 -10.585 -1.293 705 HB2 SER 525 HB2 SER 525 109.956 -12.606 -0.560 706 HB3 SER 525 HB3 SER 525 108.669 -12.271 0.599 707 HG SER 525 HG SER 525 108.426 -14.380 0.069 708 H GLY 526 H GLY 526 110.327 -11.686 -2.883 709 HA2 GLY 526 HA2 GLY 526 110.718 -12.267 -5.067 710 HA3 GLY 526 HA3 GLY 526 109.501 -13.500 -4.788 711 H ASP 527 H ASP 527 108.546 -13.440 -6.764 712 HA ASP 527 HA ASP 527 107.928 -11.185 -8.266 713 HB2 ASP 527 HB2 ASP 527 107.162 -14.015 -8.262 714 HB3 ASP 527 HB3 ASP 527 105.919 -12.953 -8.920 715 H HIS 528 H HIS 528 106.239 -12.609 -5.552 716 HA HIS 528 HA HIS 528 103.745 -11.358 -5.947 717 HB2 HIS 528 HB2 HIS 528 104.458 -13.239 -4.281 718 HB3 HIS 528 HB3 HIS 528 104.828 -11.897 -3.203 719 HD1 HIS 528 HD1 HIS 528 102.895 -12.834 -1.660 720 HD2 HIS 528 HD2 HIS 528 101.675 -11.386 -5.359 721 HE1 HIS 528 HE1 HIS 528 100.405 -12.534 -1.476 722 HE2 HIS 528 HE2 HIS 528 99.683 -11.682 -3.735 723 H GLU 529 H GLU 529 106.598 -10.369 -4.062 724 HA GLU 529 HA GLU 529 105.460 -7.929 -3.155 725 HB2 GLU 529 HB2 GLU 529 107.261 -8.630 -1.862 726 HB3 GLU 529 HB3 GLU 529 108.233 -9.058 -3.264 727 HG2 GLU 529 HG2 GLU 529 108.558 -6.689 -3.760 728 HG3 GLU 529 HG3 GLU 529 107.582 -6.262 -2.355 729 H GLN 530 H GLN 530 107.613 -8.760 -5.831 730 HA GLN 530 HA GLN 530 107.984 -6.142 -6.799 731 HB2 GLN 530 HB2 GLN 530 109.098 -7.098 -8.570 732 HB3 GLN 530 HB3 GLN 530 109.181 -8.409 -7.400 733 HG2 GLN 530 HG2 GLN 530 108.500 -9.592 -9.202 734 HG3 GLN 530 HG3 GLN 530 106.920 -9.107 -8.590 735 HE21 GLN 530 HE21 GLN 530 105.900 -9.167 -10.553 736 HE22 GLN 530 HE22 GLN 530 106.228 -8.044 -11.824 737 H ARG 531 H ARG 531 105.525 -8.581 -7.446 738 HA ARG 531 HA ARG 531 104.277 -7.333 -9.622 739 HB2 ARG 531 HB2 ARG 531 103.737 -9.607 -9.119 740 HB3 ARG 531 HB3 ARG 531 103.206 -9.187 -7.496 741 HG2 ARG 531 HG2 ARG 531 101.795 -7.887 -9.747 742 HG3 ARG 531 HG3 ARG 531 101.517 -9.613 -9.505 743 HD2 ARG 531 HD2 ARG 531 101.428 -8.182 -7.000 744 HD3 ARG 531 HD3 ARG 531 100.290 -7.498 -8.160 745 HE ARG 531 HE ARG 531 100.239 -10.385 -7.865 746 HH11 ARG 531 HH11 ARG 531 98.874 -7.313 -6.954 747 HH12 ARG 531 HH12 ARG 531 97.368 -7.991 -6.433 748 HH21 ARG 531 HH21 ARG 531 98.261 -11.289 -7.180 749 HH22 ARG 531 HH22 ARG 531 97.020 -10.251 -6.560 750 H TYR 532 H TYR 532 103.405 -7.225 -6.159 751 HA TYR 532 HA TYR 532 101.289 -5.454 -6.328 752 HB2 TYR 532 HB2 TYR 532 101.831 -6.593 -4.257 753 HB3 TYR 532 HB3 TYR 532 103.363 -5.732 -4.145 754 HD1 TYR 532 HD1 TYR 532 103.334 -3.255 -3.747 755 HD2 TYR 532 HD2 TYR 532 99.837 -5.649 -3.411 756 HE1 TYR 532 HE1 TYR 532 102.250 -1.476 -2.436 757 HE2 TYR 532 HE2 TYR 532 98.742 -3.880 -2.101 758 HH TYR 532 HH TYR 532 100.034 -0.722 -1.833 759 H TRP 533 H TRP 533 104.754 -4.757 -6.068 760 HA TRP 533 HA TRP 533 104.498 -1.959 -5.927 761 HB2 TRP 533 HB2 TRP 533 106.712 -3.844 -6.589 762 HB3 TRP 533 HB3 TRP 533 106.916 -2.140 -7.001 763 HD1 TRP 533 HD1 TRP 533 107.256 -4.493 -4.156 764 HE1 TRP 533 HE1 TRP 533 107.683 -3.205 -1.970 765 HE3 TRP 533 HE3 TRP 533 106.154 0.229 -5.771 766 HZ2 TRP 533 HZ2 TRP 533 107.564 -0.532 -1.051 767 HZ3 TRP 533 HZ3 TRP 533 106.335 2.095 -4.179 768 HH2 TRP 533 HH2 TRP 533 107.027 1.721 -1.868 769 H GLN 534 H GLN 534 104.736 -4.182 -8.660 770 HA GLN 534 HA GLN 534 105.084 -2.396 -10.740 771 HB2 GLN 534 HB2 GLN 534 103.374 -4.890 -10.632 772 HB3 GLN 534 HB3 GLN 534 103.748 -4.025 -12.115 773 HG2 GLN 534 HG2 GLN 534 105.477 -5.736 -10.426 774 HG3 GLN 534 HG3 GLN 534 105.355 -5.626 -12.181 775 HE21 GLN 534 HE21 GLN 534 106.642 -4.097 -9.305 776 HE22 GLN 534 HE22 GLN 534 107.893 -3.212 -10.103 777 H LYS 535 H LYS 535 102.121 -3.341 -9.063 778 HA LYS 535 HA LYS 535 100.340 -1.783 -10.591 779 HB2 LYS 535 HB2 LYS 535 99.057 -3.165 -9.345 780 HB3 LYS 535 HB3 LYS 535 100.267 -3.302 -8.081 781 HG2 LYS 535 HG2 LYS 535 98.681 -0.788 -8.303 782 HG3 LYS 535 HG3 LYS 535 97.938 -2.226 -7.597 783 HD2 LYS 535 HD2 LYS 535 100.631 -1.647 -6.599 784 HD3 LYS 535 HD3 LYS 535 99.440 -0.399 -6.230 785 HE2 LYS 535 HE2 LYS 535 99.201 -3.339 -5.601 786 HE3 LYS 535 HE3 LYS 535 99.545 -2.053 -4.445 787 HZ1 LYS 535 HZ1 LYS 535 97.085 -3.002 -5.045 788 HZ2 LYS 535 HZ2 LYS 535 97.161 -1.599 -5.986 789 HZ3 LYS 535 HZ3 LYS 535 97.401 -1.508 -4.314 790 H ILE 536 H ILE 536 102.278 -1.118 -7.718 791 HA ILE 536 HA ILE 536 101.241 1.424 -7.109 792 HB ILE 536 HB ILE 536 104.005 0.290 -6.657 793 HG12 ILE 536 HG12 ILE 536 101.590 0.607 -4.861 794 HG13 ILE 536 HG13 ILE 536 102.275 -0.905 -5.449 795 HG21 ILE 536 HG21 ILE 536 104.006 2.766 -6.725 796 HG22 ILE 536 HG22 ILE 536 104.423 2.110 -5.142 797 HG23 ILE 536 HG23 ILE 536 102.813 2.769 -5.425 798 HD11 ILE 536 HD11 ILE 536 102.854 0.429 -3.062 799 HD12 ILE 536 HD12 ILE 536 104.284 0.605 -4.079 800 HD13 ILE 536 HD13 ILE 536 103.649 -1.001 -3.721 801 H LEU 537 H LEU 537 104.172 0.552 -8.944 802 HA LEU 537 HA LEU 537 104.831 3.146 -9.769 803 HB2 LEU 537 HB2 LEU 537 105.518 0.395 -10.665 804 HB3 LEU 537 HB3 LEU 537 105.884 1.715 -11.759 805 HG LEU 537 HG LEU 537 107.867 1.403 -10.574 806 HD11 LEU 537 HD11 LEU 537 108.238 3.479 -9.776 807 HD12 LEU 537 HD12 LEU 537 106.845 3.430 -8.693 808 HD13 LEU 537 HD13 LEU 537 106.618 3.771 -10.408 809 HD21 LEU 537 HD21 LEU 537 108.046 0.486 -8.542 810 HD22 LEU 537 HD22 LEU 537 106.320 0.153 -8.698 811 HD23 LEU 537 HD23 LEU 537 106.866 1.592 -7.837 812 H VAL 538 H VAL 538 103.283 0.565 -11.689 813 HA VAL 538 HA VAL 538 102.677 2.077 -13.927 814 HB VAL 538 HB VAL 538 101.255 -0.304 -12.747 815 HG11 VAL 538 HG11 VAL 538 99.548 0.707 -13.994 816 HG12 VAL 538 HG12 VAL 538 100.247 -0.485 -15.088 817 HG13 VAL 538 HG13 VAL 538 100.659 1.220 -15.264 818 HG21 VAL 538 HG21 VAL 538 102.430 -0.781 -15.283 819 HG22 VAL 538 HG22 VAL 538 102.886 -1.454 -13.718 820 HG23 VAL 538 HG23 VAL 538 103.620 0.048 -14.281 821 H ASP 539 H ASP 539 100.867 1.728 -10.912 822 HA ASP 539 HA ASP 539 98.511 3.020 -11.740 823 HB2 ASP 539 HB2 ASP 539 98.359 1.833 -9.714 824 HB3 ASP 539 HB3 ASP 539 99.802 2.596 -9.055 825 H ARG 540 H ARG 540 101.536 4.253 -10.405 826 HA ARG 540 HA ARG 540 100.711 6.919 -10.038 827 HB2 ARG 540 HB2 ARG 540 103.448 5.750 -10.560 828 HB3 ARG 540 HB3 ARG 540 103.168 7.433 -10.135 829 HG2 ARG 540 HG2 ARG 540 102.416 5.068 -8.429 830 HG3 ARG 540 HG3 ARG 540 103.850 6.073 -8.211 831 HD2 ARG 540 HD2 ARG 540 102.546 7.973 -7.664 832 HD3 ARG 540 HD3 ARG 540 101.060 7.195 -8.203 833 HE ARG 540 HE ARG 540 100.864 6.290 -6.125 834 HH11 ARG 540 HH11 ARG 540 104.210 7.092 -6.664 835 HH12 ARG 540 HH12 ARG 540 104.706 6.664 -5.061 836 HH21 ARG 540 HH21 ARG 540 101.505 5.723 -4.011 837 HH22 ARG 540 HH22 ARG 540 103.168 5.884 -3.551 838 H GLN 541 H GLN 541 102.125 5.221 -12.791 839 HA GLN 541 HA GLN 541 102.526 7.451 -14.452 840 HB2 GLN 541 HB2 GLN 541 102.156 4.518 -14.948 841 HB3 GLN 541 HB3 GLN 541 102.200 5.633 -16.306 842 HG2 GLN 541 HG2 GLN 541 104.390 4.805 -16.040 843 HG3 GLN 541 HG3 GLN 541 104.402 6.458 -15.427 844 HE21 GLN 541 HE21 GLN 541 105.549 3.487 -14.856 845 HE22 GLN 541 HE22 GLN 541 105.740 3.548 -13.140 846 H ALA 542 H ALA 542 99.736 5.317 -14.030 847 HA ALA 542 HA ALA 542 98.156 6.405 -16.086 848 HB1 ALA 542 HB1 ALA 542 97.033 5.226 -13.563 849 HB2 ALA 542 HB2 ALA 542 97.773 4.235 -14.820 850 HB3 ALA 542 HB3 ALA 542 96.348 5.207 -15.187 851 H LYS 543 H LYS 543 98.607 7.310 -12.717 852 HA LYS 543 HA LYS 543 96.487 9.085 -12.419 853 HB2 LYS 543 HB2 LYS 543 98.771 8.355 -10.942 854 HB3 LYS 543 HB3 LYS 543 98.839 10.105 -11.104 855 HG2 LYS 543 HG2 LYS 543 97.018 10.435 -9.803 856 HG3 LYS 543 HG3 LYS 543 96.230 8.950 -10.337 857 HD2 LYS 543 HD2 LYS 543 97.051 9.073 -7.908 858 HD3 LYS 543 HD3 LYS 543 97.443 7.628 -8.841 859 HE2 LYS 543 HE2 LYS 543 99.670 8.194 -9.034 860 HE3 LYS 543 HE3 LYS 543 99.360 9.915 -8.806 861 HZ1 LYS 543 HZ1 LYS 543 98.756 9.337 -6.456 862 HZ2 LYS 543 HZ2 LYS 543 100.390 9.141 -6.847 863 HZ3 LYS 543 HZ3 LYS 543 99.379 7.789 -6.741 864 H LEU 544 H LEU 544 99.625 9.533 -13.943 865 HA LEU 544 HA LEU 544 99.600 12.315 -14.198 866 HB2 LEU 544 HB2 LEU 544 101.294 10.293 -14.949 867 HB3 LEU 544 HB3 LEU 544 100.714 10.874 -16.497 868 HG LEU 544 HG LEU 544 102.481 12.269 -16.316 869 HD11 LEU 544 HD11 LEU 544 100.387 13.662 -16.084 870 HD12 LEU 544 HD12 LEU 544 101.887 14.425 -15.554 871 HD13 LEU 544 HD13 LEU 544 100.759 13.774 -14.364 872 HD21 LEU 544 HD21 LEU 544 103.223 11.117 -14.226 873 HD22 LEU 544 HD22 LEU 544 102.277 12.291 -13.311 874 HD23 LEU 544 HD23 LEU 544 103.632 12.830 -14.304 875 H ASN 545 H ASN 545 97.629 9.966 -15.668 876 HA ASN 545 HA ASN 545 96.710 11.930 -17.664 877 HB2 ASN 545 HB2 ASN 545 97.473 9.178 -17.971 878 HB3 ASN 545 HB3 ASN 545 95.768 9.358 -18.377 879 HD21 ASN 545 HD21 ASN 545 98.623 11.419 -18.812 880 HD22 ASN 545 HD22 ASN 545 98.423 11.629 -20.514 881 H GLN 546 H GLN 546 95.663 9.269 -15.558 882 HA GLN 546 HA GLN 546 92.970 10.459 -15.520 883 HB2 GLN 546 HB2 GLN 546 93.909 7.722 -15.734 884 HB3 GLN 546 HB3 GLN 546 92.804 7.914 -14.380 885 HG2 GLN 546 HG2 GLN 546 91.591 9.291 -16.459 886 HG3 GLN 546 HG3 GLN 546 92.264 7.848 -17.215 887 HE21 GLN 546 HE21 GLN 546 89.745 9.122 -15.381 888 HE22 GLN 546 HE22 GLN 546 88.959 7.641 -14.965 889 HA PRO 547 HA PRO 547 94.906 10.985 -11.281 890 HB2 PRO 547 HB2 PRO 547 94.522 13.659 -11.092 891 HB3 PRO 547 HB3 PRO 547 95.958 12.951 -11.841 892 HG2 PRO 547 HG2 PRO 547 93.493 14.049 -13.139 893 HG3 PRO 547 HG3 PRO 547 95.192 14.270 -13.597 894 HD2 PRO 547 HD2 PRO 547 93.551 12.501 -14.841 895 HD3 PRO 547 HD3 PRO 547 95.297 12.233 -14.666 896 H ARG 548 H ARG 548 93.732 12.783 -9.602 897 HA ARG 548 HA ARG 548 91.872 13.258 -8.368 898 HB2 ARG 548 HB2 ARG 548 90.895 13.158 -11.023 899 HB3 ARG 548 HB3 ARG 548 89.756 12.260 -10.029 900 HG2 ARG 548 HG2 ARG 548 90.407 14.634 -8.636 901 HG3 ARG 548 HG3 ARG 548 90.049 15.071 -10.308 902 HD2 ARG 548 HD2 ARG 548 88.294 13.393 -8.519 903 HD3 ARG 548 HD3 ARG 548 88.041 15.097 -8.884 904 HE ARG 548 HE ARG 548 87.615 12.835 -10.678 905 HH11 ARG 548 HH11 ARG 548 87.651 16.295 -10.219 906 HH12 ARG 548 HH12 ARG 548 86.699 16.617 -11.627 907 HH21 ARG 548 HH21 ARG 548 86.368 13.260 -12.538 908 HH22 ARG 548 HH22 ARG 548 85.972 14.896 -12.945 909 H GLU 549 H GLU 549 89.797 12.070 -7.503 910 HA GLU 549 HA GLU 549 88.887 10.262 -6.459 911 HB2 GLU 549 HB2 GLU 549 89.768 9.262 -8.955 912 HB3 GLU 549 HB3 GLU 549 90.245 8.083 -7.743 913 HG2 GLU 549 HG2 GLU 549 87.971 7.792 -8.833 914 HG3 GLU 549 HG3 GLU 549 88.047 7.697 -7.075 915 H LYS 550 H LYS 550 89.540 8.239 -5.181 916 HA LYS 550 HA LYS 550 90.802 7.285 -3.546 917 HB2 LYS 550 HB2 LYS 550 92.946 8.231 -5.424 918 HB3 LYS 550 HB3 LYS 550 93.364 7.486 -3.889 919 HG2 LYS 550 HG2 LYS 550 91.590 5.687 -4.858 920 HG3 LYS 550 HG3 LYS 550 92.318 6.284 -6.350 921 HD2 LYS 550 HD2 LYS 550 94.356 5.403 -5.868 922 HD3 LYS 550 HD3 LYS 550 94.166 5.645 -4.130 923 HE2 LYS 550 HE2 LYS 550 93.971 3.389 -4.155 924 HE3 LYS 550 HE3 LYS 550 92.288 3.785 -4.498 925 HZ1 LYS 550 HZ1 LYS 550 92.975 3.666 -6.925 926 HZ2 LYS 550 HZ2 LYS 550 92.873 2.200 -6.087 927 HZ3 LYS 550 HZ3 LYS 550 94.385 2.899 -6.386 928 H LYS 551 H LYS 551 91.285 7.899 -1.519 929 HA LYS 551 HA LYS 551 91.798 9.211 0.268 930 HB2 LYS 551 HB2 LYS 551 93.972 9.527 -0.734 931 HB3 LYS 551 HB3 LYS 551 93.341 10.760 -1.817 932 HG2 LYS 551 HG2 LYS 551 92.681 11.766 0.634 933 HG3 LYS 551 HG3 LYS 551 94.218 10.963 0.959 934 HD2 LYS 551 HD2 LYS 551 93.665 13.088 -1.105 935 HD3 LYS 551 HD3 LYS 551 94.677 13.229 0.333 936 HE2 LYS 551 HE2 LYS 551 95.986 11.245 -0.728 937 HE3 LYS 551 HE3 LYS 551 95.201 11.764 -2.219 938 HZ1 LYS 551 HZ1 LYS 551 96.272 14.004 -0.887 939 HZ2 LYS 551 HZ2 LYS 551 96.664 13.394 -2.414 940 HZ3 LYS 551 HZ3 LYS 551 97.479 12.828 -1.044 941 H ARG 552 H ARG 552 89.370 9.588 -0.169 942 HA ARG 552 HA ARG 552 88.618 12.191 -1.109 943 HB2 ARG 552 HB2 ARG 552 87.269 9.765 -0.198 944 HB3 ARG 552 HB3 ARG 552 86.469 11.235 0.340 945 HG2 ARG 552 HG2 ARG 552 86.410 12.022 -1.998 946 HG3 ARG 552 HG3 ARG 552 87.124 10.488 -2.501 947 HD2 ARG 552 HD2 ARG 552 84.832 10.061 -0.802 948 HD3 ARG 552 HD3 ARG 552 84.412 11.069 -2.185 949 HE ARG 552 HE ARG 552 85.859 8.973 -3.217 950 HH11 ARG 552 HH11 ARG 552 82.944 9.335 -1.348 951 HH12 ARG 552 HH12 ARG 552 82.192 7.917 -2.002 952 HH21 ARG 552 HH21 ARG 552 84.883 7.102 -4.083 953 HH22 ARG 552 HH22 ARG 552 83.296 6.647 -3.558 954 H GLY 553 H GLY 553 89.612 10.844 1.900 955 HA2 GLY 553 HA2 GLY 553 90.366 12.711 3.445 956 HA3 GLY 553 HA3 GLY 553 88.705 13.271 3.317 957 H THR 554 H THR 554 89.466 12.917 5.791 958 HA THR 554 HA THR 554 88.258 10.349 6.577 959 HB THR 554 HB THR 554 89.898 9.821 8.027 960 HG1 THR 554 HG1 THR 554 91.029 11.416 9.276 961 HG21 THR 554 HG21 THR 554 92.065 10.341 7.268 962 HG22 THR 554 HG22 THR 554 91.562 11.917 6.657 963 HG23 THR 554 HG23 THR 554 91.039 10.445 5.838 964 H GLU 555 H GLU 555 87.630 13.462 6.416 965 HA GLU 555 HA GLU 555 86.762 13.955 9.137 966 HB2 GLU 555 HB2 GLU 555 86.702 15.525 6.581 967 HB3 GLU 555 HB3 GLU 555 85.727 16.032 7.953 968 HG2 GLU 555 HG2 GLU 555 87.624 16.415 9.290 969 HG3 GLU 555 HG3 GLU 555 88.681 15.553 8.173 970 H LYS 556 H LYS 556 85.545 11.694 8.353 971 HA LYS 556 HA LYS 556 82.755 12.550 8.023 972 HB2 LYS 556 HB2 LYS 556 82.612 10.176 6.806 973 HB3 LYS 556 HB3 LYS 556 82.936 11.667 5.933 974 HG2 LYS 556 HG2 LYS 556 85.404 11.140 6.279 975 HG3 LYS 556 HG3 LYS 556 84.868 9.525 6.751 976 HD2 LYS 556 HD2 LYS 556 84.906 9.005 4.582 977 HD3 LYS 556 HD3 LYS 556 83.487 10.038 4.403 978 HE2 LYS 556 HE2 LYS 556 86.369 10.858 4.065 979 HE3 LYS 556 HE3 LYS 556 85.173 10.665 2.785 980 HZ1 LYS 556 HZ1 LYS 556 84.075 12.573 3.402 981 HZ2 LYS 556 HZ2 LYS 556 85.679 13.005 3.716 982 HZ3 LYS 556 HZ3 LYS 556 84.663 12.547 4.988 983 H LEU 557 H LEU 557 81.206 10.789 8.670 984 HA LEU 557 HA LEU 557 80.368 9.383 10.244 985 HB2 LEU 557 HB2 LEU 557 83.165 8.384 9.948 986 HB3 LEU 557 HB3 LEU 557 82.169 7.748 11.243 987 HG LEU 557 HG LEU 557 80.786 7.716 8.683 988 HD11 LEU 557 HD11 LEU 557 83.140 7.421 7.918 989 HD12 LEU 557 HD12 LEU 557 82.088 6.044 7.586 990 HD13 LEU 557 HD13 LEU 557 83.231 5.977 8.927 991 HD21 LEU 557 HD21 LEU 557 80.909 6.262 11.115 992 HD22 LEU 557 HD22 LEU 557 81.235 5.141 9.793 993 HD23 LEU 557 HD23 LEU 557 79.753 6.098 9.793 994 H ILE 558 H ILE 558 81.730 11.994 10.936 995 HA ILE 558 HA ILE 558 81.998 13.259 12.811 996 HB ILE 558 HB ILE 558 81.143 10.898 14.468 997 HG12 ILE 558 HG12 ILE 558 79.268 12.893 13.192 998 HG13 ILE 558 HG13 ILE 558 79.617 11.323 12.474 999 HG21 ILE 558 HG21 ILE 558 81.895 13.466 15.133 1000 HG22 ILE 558 HG22 ILE 558 80.976 12.355 16.147 1001 HG23 ILE 558 HG23 ILE 558 80.133 13.537 15.146 1002 HD11 ILE 558 HD11 ILE 558 78.731 10.213 14.443 1003 HD12 ILE 558 HD12 ILE 558 77.538 11.305 13.740 1004 HD13 ILE 558 HD13 ILE 558 78.415 11.777 15.195 1005 H THR 559 H THR 559 83.589 13.716 14.318 1006 HA THR 559 HA THR 559 85.680 11.657 14.599 1007 HB THR 559 HB THR 559 86.247 14.579 14.946 1008 HG1 THR 559 HG1 THR 559 86.772 13.528 12.436 1009 HG21 THR 559 HG21 THR 559 88.433 13.721 13.874 1010 HG22 THR 559 HG22 THR 559 87.806 12.115 14.248 1011 HG23 THR 559 HG23 THR 559 88.084 13.277 15.546 1012 H LYS 560 H LYS 560 84.008 11.162 16.437 1013 HA LYS 560 HA LYS 560 84.979 12.532 18.855 1014 HB2 LYS 560 HB2 LYS 560 82.746 13.295 18.589 1015 HB3 LYS 560 HB3 LYS 560 82.168 11.688 18.171 1016 HG2 LYS 560 HG2 LYS 560 82.926 11.049 20.555 1017 HG3 LYS 560 HG3 LYS 560 82.908 12.790 20.847 1018 HD2 LYS 560 HD2 LYS 560 80.766 12.218 21.463 1019 HD3 LYS 560 HD3 LYS 560 80.528 12.642 19.766 1020 HE2 LYS 560 HE2 LYS 560 80.867 10.180 19.255 1021 HE3 LYS 560 HE3 LYS 560 80.728 9.901 20.991 1022 HZ1 LYS 560 HZ1 LYS 560 78.675 10.227 19.112 1023 HZ2 LYS 560 HZ2 LYS 560 78.592 11.517 20.202 1024 HZ3 LYS 560 HZ3 LYS 560 78.540 9.926 20.772 1025 H ALA 561 H ALA 561 83.327 9.585 17.708 1026 HA ALA 561 HA ALA 561 84.816 8.083 19.760 1027 HB1 ALA 561 HB1 ALA 561 83.040 6.479 19.840 1028 HB2 ALA 561 HB2 ALA 561 82.211 7.257 18.492 1029 HB3 ALA 561 HB3 ALA 561 82.343 8.086 20.043 Start of MODEL 16 1 H1 MET 437 HT1 MET 437 105.565 -14.439 -17.668 2 H2 MET 437 HT2 MET 437 106.745 -14.226 -16.440 3 H3 MET 437 HT3 MET 437 106.520 -13.017 -17.636 4 HA MET 437 HA MET 437 104.698 -13.803 -15.470 5 HB2 MET 437 HB2 MET 437 105.601 -11.028 -16.096 6 HB3 MET 437 HB3 MET 437 105.208 -11.751 -14.543 7 HG2 MET 437 HG2 MET 437 107.335 -13.135 -14.861 8 HG3 MET 437 HG3 MET 437 107.736 -11.977 -16.129 9 HE1 MET 437 HE1 MET 437 108.058 -8.670 -14.462 10 HE2 MET 437 HE2 MET 437 106.381 -9.110 -14.140 11 HE3 MET 437 HE3 MET 437 107.116 -9.514 -15.692 12 H HIS 438 H HIS 438 104.939 -12.710 -18.704 13 HA HIS 438 HA HIS 438 102.142 -12.656 -19.079 14 HB2 HIS 438 HB2 HIS 438 103.449 -10.110 -18.392 15 HB3 HIS 438 HB3 HIS 438 102.461 -10.050 -19.847 16 HD1 HIS 438 HD1 HIS 438 99.972 -11.404 -19.292 17 HD2 HIS 438 HD2 HIS 438 101.981 -9.380 -16.270 18 HE1 HIS 438 HE1 HIS 438 98.235 -10.914 -17.540 19 HE2 HIS 438 HE2 HIS 438 99.492 -9.766 -15.684 20 H HIS 439 H HIS 439 101.591 -11.743 -21.317 21 HA HIS 439 HA HIS 439 103.319 -12.961 -23.208 22 HB2 HIS 439 HB2 HIS 439 100.716 -11.581 -23.252 23 HB3 HIS 439 HB3 HIS 439 101.648 -11.444 -24.739 24 HD1 HIS 439 HD1 HIS 439 98.993 -13.282 -23.801 25 HD2 HIS 439 HD2 HIS 439 102.792 -14.465 -24.996 26 HE1 HIS 439 HE1 HIS 439 98.737 -15.649 -24.607 27 HE2 HIS 439 HE2 HIS 439 101.058 -16.364 -25.276 28 H HIS 440 H HIS 440 103.977 -11.748 -25.249 29 HA HIS 440 HA HIS 440 105.232 -10.161 -26.289 30 HB2 HIS 440 HB2 HIS 440 103.371 -8.696 -24.805 31 HB3 HIS 440 HB3 HIS 440 104.925 -7.958 -24.431 32 HD1 HIS 440 HD1 HIS 440 104.982 -5.908 -25.830 33 HD2 HIS 440 HD2 HIS 440 103.676 -9.223 -27.969 34 HE1 HIS 440 HE1 HIS 440 104.746 -5.124 -28.207 35 HE2 HIS 440 HE2 HIS 440 104.052 -7.173 -29.500 36 H HIS 441 H HIS 441 107.267 -9.059 -26.120 37 HA HIS 441 HA HIS 441 108.771 -8.487 -23.932 38 HB2 HIS 441 HB2 HIS 441 110.181 -10.587 -23.688 39 HB3 HIS 441 HB3 HIS 441 108.557 -10.670 -23.013 40 HD1 HIS 441 HD1 HIS 441 107.940 -13.067 -23.303 41 HD2 HIS 441 HD2 HIS 441 109.583 -11.438 -26.756 42 HE1 HIS 441 HE1 HIS 441 107.710 -14.849 -25.063 43 HE2 HIS 441 HE2 HIS 441 108.643 -13.813 -27.161 44 H HIS 442 H HIS 442 108.833 -7.314 -26.225 45 HA HIS 442 HA HIS 442 111.358 -8.160 -27.484 46 HB2 HIS 442 HB2 HIS 442 108.872 -8.163 -28.726 47 HB3 HIS 442 HB3 HIS 442 109.611 -6.661 -29.269 48 HD1 HIS 442 HD1 HIS 442 111.789 -6.863 -30.697 49 HD2 HIS 442 HD2 HIS 442 109.983 -10.487 -29.762 50 HE1 HIS 442 HE1 HIS 442 112.856 -8.558 -32.218 51 HE2 HIS 442 HE2 HIS 442 111.730 -10.740 -31.653 52 H HIS 443 H HIS 443 111.027 -6.278 -25.345 53 HA HIS 443 HA HIS 443 112.319 -4.001 -26.584 54 HB2 HIS 443 HB2 HIS 443 109.668 -3.809 -25.182 55 HB3 HIS 443 HB3 HIS 443 110.783 -2.447 -25.187 56 HD1 HIS 443 HD1 HIS 443 107.966 -3.577 -26.940 57 HD2 HIS 443 HD2 HIS 443 111.612 -1.976 -28.122 58 HE1 HIS 443 HE1 HIS 443 107.593 -2.706 -29.269 59 HE2 HIS 443 HE2 HIS 443 109.835 -1.815 -29.995 60 H SER 444 H SER 444 110.840 -4.947 -23.476 61 HA SER 444 HA SER 444 112.848 -3.705 -21.908 62 HB2 SER 444 HB2 SER 444 110.467 -5.361 -21.436 63 HB3 SER 444 HB3 SER 444 111.744 -5.583 -20.241 64 HG SER 444 HG SER 444 110.474 -3.897 -19.556 65 H ASN 445 H ASN 445 114.864 -4.441 -22.610 66 HA ASN 445 HA ASN 445 115.656 -7.060 -23.029 67 HB2 ASN 445 HB2 ASN 445 117.024 -4.519 -22.392 68 HB3 ASN 445 HB3 ASN 445 117.934 -5.981 -22.025 69 HD21 ASN 445 HD21 ASN 445 115.907 -4.652 -24.618 70 HD22 ASN 445 HD22 ASN 445 116.912 -5.196 -25.913 71 H ALA 446 H ALA 446 116.769 -5.301 -20.154 72 HA ALA 446 HA ALA 446 115.898 -7.490 -18.436 73 HB1 ALA 446 HB1 ALA 446 118.033 -8.325 -18.932 74 HB2 ALA 446 HB2 ALA 446 118.221 -7.515 -17.376 75 HB3 ALA 446 HB3 ALA 446 118.772 -6.725 -18.854 76 H THR 447 H THR 447 114.744 -6.455 -16.942 77 HA THR 447 HA THR 447 115.255 -3.735 -16.203 78 HB THR 447 HB THR 447 113.543 -4.886 -14.280 79 HG1 THR 447 HG1 THR 447 112.491 -6.411 -15.290 80 HG21 THR 447 HG21 THR 447 113.275 -2.663 -15.170 81 HG22 THR 447 HG22 THR 447 111.809 -3.589 -15.497 82 HG23 THR 447 HG23 THR 447 112.979 -3.304 -16.786 83 H GLY 448 H GLY 448 115.997 -2.931 -14.240 84 HA2 GLY 448 HA2 GLY 448 117.910 -4.618 -12.891 85 HA3 GLY 448 HA3 GLY 448 117.614 -2.914 -12.577 86 HA PRO 449 HA PRO 449 114.871 -5.653 -9.737 87 HB2 PRO 449 HB2 PRO 449 116.104 -7.827 -8.798 88 HB3 PRO 449 HB3 PRO 449 115.309 -7.839 -10.378 89 HG2 PRO 449 HG2 PRO 449 118.215 -7.584 -9.720 90 HG3 PRO 449 HG3 PRO 449 117.436 -8.511 -11.015 91 HD2 PRO 449 HD2 PRO 449 118.599 -6.018 -11.334 92 HD3 PRO 449 HD3 PRO 449 117.374 -6.710 -12.414 93 H GLN 450 H GLN 450 115.911 -3.503 -8.877 94 HA GLN 450 HA GLN 450 117.004 -4.130 -6.247 95 HB2 GLN 450 HB2 GLN 450 118.516 -2.867 -8.388 96 HB3 GLN 450 HB3 GLN 450 118.419 -1.842 -6.961 97 HG2 GLN 450 HG2 GLN 450 120.406 -3.225 -6.903 98 HG3 GLN 450 HG3 GLN 450 119.308 -3.650 -5.592 99 HE21 GLN 450 HE21 GLN 450 119.248 -5.736 -5.244 100 HE22 GLN 450 HE22 GLN 450 119.345 -6.979 -6.438 101 H PHE 451 H PHE 451 114.451 -3.171 -7.354 102 HA PHE 451 HA PHE 451 114.240 -0.393 -6.605 103 HB2 PHE 451 HB2 PHE 451 111.955 -0.556 -7.276 104 HB3 PHE 451 HB3 PHE 451 112.898 -1.484 -8.439 105 HD1 PHE 451 HD1 PHE 451 112.860 -3.948 -8.378 106 HD2 PHE 451 HD2 PHE 451 110.339 -1.600 -5.880 107 HE1 PHE 451 HE1 PHE 451 111.444 -5.917 -7.962 108 HE2 PHE 451 HE2 PHE 451 108.920 -3.566 -5.460 109 HZ PHE 451 HZ PHE 451 109.471 -5.727 -6.500 110 H VAL 452 H VAL 452 114.323 0.123 -4.500 111 HA VAL 452 HA VAL 452 113.968 -1.457 -2.304 112 HB VAL 452 HB VAL 452 114.751 0.897 -2.226 113 HG11 VAL 452 HG11 VAL 452 112.516 1.523 -3.601 114 HG12 VAL 452 HG12 VAL 452 113.461 2.689 -2.674 115 HG13 VAL 452 HG13 VAL 452 112.017 1.962 -1.967 116 HG21 VAL 452 HG21 VAL 452 112.543 0.938 -0.282 117 HG22 VAL 452 HG22 VAL 452 114.285 1.047 -0.028 118 HG23 VAL 452 HG23 VAL 452 113.526 -0.525 -0.279 119 H SER 453 H SER 453 112.308 -2.921 -2.346 120 HA SER 453 HA SER 453 109.638 -2.241 -3.058 121 HB2 SER 453 HB2 SER 453 109.163 -4.478 -2.818 122 HB3 SER 453 HB3 SER 453 110.908 -4.551 -3.051 123 HG SER 453 HG SER 453 111.087 -4.582 -0.736 124 H GLY 454 H GLY 454 110.990 -0.885 -0.590 125 HA2 GLY 454 HA2 GLY 454 110.443 -0.449 1.636 126 HA3 GLY 454 HA3 GLY 454 108.969 0.025 0.814 127 H VAL 455 H VAL 455 110.030 -3.320 1.107 128 HA VAL 455 HA VAL 455 108.785 -5.120 1.838 129 HB VAL 455 HB VAL 455 108.306 -4.087 4.498 130 HG11 VAL 455 HG11 VAL 455 108.865 -6.189 4.924 131 HG12 VAL 455 HG12 VAL 455 110.501 -5.903 4.332 132 HG13 VAL 455 HG13 VAL 455 109.237 -6.418 3.216 133 HG21 VAL 455 HG21 VAL 455 110.473 -3.406 5.146 134 HG22 VAL 455 HG22 VAL 455 110.097 -2.482 3.693 135 HG23 VAL 455 HG23 VAL 455 111.170 -3.877 3.597 136 H ILE 456 H ILE 456 106.841 -5.073 0.759 137 HA ILE 456 HA ILE 456 104.691 -3.359 1.599 138 HB ILE 456 HB ILE 456 104.855 -5.581 -0.425 139 HG12 ILE 456 HG12 ILE 456 105.868 -3.711 -1.346 140 HG13 ILE 456 HG13 ILE 456 104.202 -3.516 -1.874 141 HG21 ILE 456 HG21 ILE 456 102.558 -4.809 -1.123 142 HG22 ILE 456 HG22 ILE 456 102.458 -3.974 0.426 143 HG23 ILE 456 HG23 ILE 456 102.630 -5.728 0.380 144 HD11 ILE 456 HD11 ILE 456 105.620 -2.064 0.331 145 HD12 ILE 456 HD12 ILE 456 103.868 -2.024 0.124 146 HD13 ILE 456 HD13 ILE 456 104.922 -1.400 -1.146 147 H VAL 457 H VAL 457 104.261 -3.897 3.726 148 HA VAL 457 HA VAL 457 103.664 -6.567 4.551 149 HB VAL 457 HB VAL 457 103.143 -3.914 5.897 150 HG11 VAL 457 HG11 VAL 457 101.983 -4.932 7.496 151 HG12 VAL 457 HG12 VAL 457 103.208 -6.188 7.664 152 HG13 VAL 457 HG13 VAL 457 101.928 -6.360 6.463 153 HG21 VAL 457 HG21 VAL 457 104.990 -5.021 7.417 154 HG22 VAL 457 HG22 VAL 457 105.422 -4.130 5.957 155 HG23 VAL 457 HG23 VAL 457 105.366 -5.891 5.931 156 H LYS 458 H LYS 458 101.830 -7.648 4.315 157 HA LYS 458 HA LYS 458 99.451 -6.236 3.368 158 HB2 LYS 458 HB2 LYS 458 100.048 -8.072 1.977 159 HB3 LYS 458 HB3 LYS 458 100.261 -9.139 3.357 160 HG2 LYS 458 HG2 LYS 458 97.710 -8.611 3.737 161 HG3 LYS 458 HG3 LYS 458 97.766 -8.249 2.011 162 HD2 LYS 458 HD2 LYS 458 99.057 -10.573 1.966 163 HD3 LYS 458 HD3 LYS 458 98.107 -10.834 3.431 164 HE2 LYS 458 HE2 LYS 458 96.152 -9.932 1.912 165 HE3 LYS 458 HE3 LYS 458 97.208 -10.483 0.612 166 HZ1 LYS 458 HZ1 LYS 458 96.663 -12.302 2.847 167 HZ2 LYS 458 HZ2 LYS 458 96.984 -12.656 1.225 168 HZ3 LYS 458 HZ3 LYS 458 95.460 -12.078 1.677 169 H ILE 459 H ILE 459 97.854 -5.771 4.712 170 HA ILE 459 HA ILE 459 97.577 -7.367 7.169 171 HB ILE 459 HB ILE 459 96.403 -4.624 6.908 172 HG12 ILE 459 HG12 ILE 459 99.269 -5.359 7.297 173 HG13 ILE 459 HG13 ILE 459 98.571 -3.957 6.494 174 HG21 ILE 459 HG21 ILE 459 96.395 -4.665 9.277 175 HG22 ILE 459 HG22 ILE 459 97.470 -6.061 9.327 176 HG23 ILE 459 HG23 ILE 459 95.813 -6.248 8.757 177 HD11 ILE 459 HD11 ILE 459 99.787 -3.399 8.558 178 HD12 ILE 459 HD12 ILE 459 98.634 -4.369 9.474 179 HD13 ILE 459 HD13 ILE 459 98.088 -2.930 8.614 180 H ILE 460 H ILE 460 95.859 -8.618 7.250 181 HA ILE 460 HA ILE 460 93.395 -7.713 5.940 182 HB ILE 460 HB ILE 460 94.554 -9.437 4.520 183 HG12 ILE 460 HG12 ILE 460 91.978 -8.940 4.783 184 HG13 ILE 460 HG13 ILE 460 92.539 -10.280 3.788 185 HG21 ILE 460 HG21 ILE 460 94.101 -11.069 6.974 186 HG22 ILE 460 HG22 ILE 460 95.500 -11.004 5.904 187 HG23 ILE 460 HG23 ILE 460 94.034 -11.836 5.389 188 HD11 ILE 460 HD11 ILE 460 90.600 -10.703 5.381 189 HD12 ILE 460 HD12 ILE 460 91.808 -10.662 6.664 190 HD13 ILE 460 HD13 ILE 460 91.926 -11.866 5.383 191 H SER 461 H SER 461 91.590 -7.940 7.116 192 HA SER 461 HA SER 461 91.845 -9.364 9.681 193 HB2 SER 461 HB2 SER 461 90.317 -7.801 10.652 194 HB3 SER 461 HB3 SER 461 91.512 -6.857 9.763 195 HG SER 461 HG SER 461 89.200 -6.313 9.460 196 H THR 462 H THR 462 89.224 -9.441 10.445 197 HA THR 462 HA THR 462 88.217 -11.526 8.701 198 HB THR 462 HB THR 462 86.438 -11.663 10.588 199 HG1 THR 462 HG1 THR 462 87.222 -10.829 12.584 200 HG21 THR 462 HG21 THR 462 88.743 -12.982 10.142 201 HG22 THR 462 HG22 THR 462 87.661 -13.335 11.490 202 HG23 THR 462 HG23 THR 462 89.075 -12.311 11.739 203 H GLU 463 H GLU 463 87.603 -8.223 9.423 204 HA GLU 463 HA GLU 463 86.017 -7.574 7.357 205 HB2 GLU 463 HB2 GLU 463 84.554 -9.244 9.240 206 HB3 GLU 463 HB3 GLU 463 83.745 -7.712 8.936 207 HG2 GLU 463 HG2 GLU 463 84.714 -9.010 6.514 208 HG3 GLU 463 HG3 GLU 463 83.536 -9.972 7.406 209 HA PRO 464 HA PRO 464 84.764 -4.792 11.321 210 HB2 PRO 464 HB2 PRO 464 87.169 -5.727 12.836 211 HB3 PRO 464 HB3 PRO 464 85.605 -5.171 13.442 212 HG2 PRO 464 HG2 PRO 464 86.194 -7.770 13.373 213 HG3 PRO 464 HG3 PRO 464 84.561 -7.192 12.991 214 HD2 PRO 464 HD2 PRO 464 86.676 -8.223 11.176 215 HD3 PRO 464 HD3 PRO 464 84.911 -8.302 11.017 216 H LEU 465 H LEU 465 88.272 -5.461 11.227 217 HA LEU 465 HA LEU 465 90.012 -3.960 11.014 218 HB2 LEU 465 HB2 LEU 465 88.866 -4.644 8.620 219 HB3 LEU 465 HB3 LEU 465 88.896 -2.893 8.519 220 HG LEU 465 HG LEU 465 91.441 -3.870 9.454 221 HD11 LEU 465 HD11 LEU 465 91.666 -5.744 8.278 222 HD12 LEU 465 HD12 LEU 465 91.655 -4.734 6.833 223 HD13 LEU 465 HD13 LEU 465 90.159 -5.468 7.406 224 HD21 LEU 465 HD21 LEU 465 90.962 -2.635 6.779 225 HD22 LEU 465 HD22 LEU 465 92.269 -2.357 7.930 226 HD23 LEU 465 HD23 LEU 465 90.666 -1.691 8.239 227 HA PRO 466 HA PRO 466 88.159 -0.410 13.213 228 HB2 PRO 466 HB2 PRO 466 91.054 0.224 12.768 229 HB3 PRO 466 HB3 PRO 466 90.061 0.482 14.206 230 HG2 PRO 466 HG2 PRO 466 91.760 -1.629 13.919 231 HG3 PRO 466 HG3 PRO 466 90.297 -1.680 14.914 232 HD2 PRO 466 HD2 PRO 466 90.873 -3.094 12.448 233 HD3 PRO 466 HD3 PRO 466 89.485 -3.281 13.537 234 H GLY 467 H GLY 467 90.676 0.090 10.728 235 HA2 GLY 467 HA2 GLY 467 89.397 1.193 8.673 236 HA3 GLY 467 HA3 GLY 467 89.327 2.513 9.832 237 H ARG 468 H ARG 468 90.571 3.329 7.734 238 HA ARG 468 HA ARG 468 93.277 2.598 7.418 239 HB2 ARG 468 HB2 ARG 468 93.505 4.606 6.101 240 HB3 ARG 468 HB3 ARG 468 91.949 3.873 5.740 241 HG2 ARG 468 HG2 ARG 468 91.029 5.505 7.519 242 HG3 ARG 468 HG3 ARG 468 92.548 6.367 7.272 243 HD2 ARG 468 HD2 ARG 468 90.671 5.615 5.039 244 HD3 ARG 468 HD3 ARG 468 90.623 7.167 5.873 245 HE ARG 468 HE ARG 468 93.236 6.734 4.974 246 HH11 ARG 468 HH11 ARG 468 90.053 7.307 3.685 247 HH12 ARG 468 HH12 ARG 468 90.632 8.095 2.256 248 HH21 ARG 468 HH21 ARG 468 94.010 7.776 3.094 249 HH22 ARG 468 HH22 ARG 468 92.879 8.362 1.921 250 H LYS 469 H LYS 469 91.692 5.119 9.321 251 HA LYS 469 HA LYS 469 94.024 6.354 10.301 252 HB2 LYS 469 HB2 LYS 469 92.438 7.136 12.155 253 HB3 LYS 469 HB3 LYS 469 92.041 7.593 10.505 254 HG2 LYS 469 HG2 LYS 469 90.797 5.099 11.061 255 HG3 LYS 469 HG3 LYS 469 90.442 6.211 12.384 256 HD2 LYS 469 HD2 LYS 469 90.201 7.236 9.607 257 HD3 LYS 469 HD3 LYS 469 88.963 6.116 10.179 258 HE2 LYS 469 HE2 LYS 469 88.807 7.640 12.232 259 HE3 LYS 469 HE3 LYS 469 89.706 8.813 11.269 260 HZ1 LYS 469 HZ1 LYS 469 87.061 8.666 11.280 261 HZ2 LYS 469 HZ2 LYS 469 87.382 7.612 9.997 262 HZ3 LYS 469 HZ3 LYS 469 87.944 9.207 9.942 263 H GLN 470 H GLN 470 91.976 3.795 11.662 264 HA GLN 470 HA GLN 470 93.547 3.533 14.034 265 HB2 GLN 470 HB2 GLN 470 91.254 2.057 12.821 266 HB3 GLN 470 HB3 GLN 470 92.171 1.283 14.106 267 HG2 GLN 470 HG2 GLN 470 91.094 4.052 14.443 268 HG3 GLN 470 HG3 GLN 470 90.069 2.642 14.703 269 HE21 GLN 470 HE21 GLN 470 91.539 0.879 15.977 270 HE22 GLN 470 HE22 GLN 470 92.150 1.499 17.470 271 H VAL 471 H VAL 471 93.274 1.694 11.009 272 HA VAL 471 HA VAL 471 95.039 -0.371 11.717 273 HB VAL 471 HB VAL 471 94.436 0.749 8.977 274 HG11 VAL 471 HG11 VAL 471 95.938 -0.643 8.124 275 HG12 VAL 471 HG12 VAL 471 95.185 -2.005 8.956 276 HG13 VAL 471 HG13 VAL 471 96.445 -1.068 9.759 277 HG21 VAL 471 HG21 VAL 471 92.602 -0.295 10.511 278 HG22 VAL 471 HG22 VAL 471 93.366 -1.818 10.059 279 HG23 VAL 471 HG23 VAL 471 92.703 -0.761 8.813 280 H ARG 472 H ARG 472 95.599 2.749 10.135 281 HA ARG 472 HA ARG 472 98.347 2.388 9.640 282 HB2 ARG 472 HB2 ARG 472 98.440 4.734 9.219 283 HB3 ARG 472 HB3 ARG 472 96.876 4.171 8.643 284 HG2 ARG 472 HG2 ARG 472 95.764 5.093 10.534 285 HG3 ARG 472 HG3 ARG 472 97.297 5.455 11.329 286 HD2 ARG 472 HD2 ARG 472 97.348 6.677 8.779 287 HD3 ARG 472 HD3 ARG 472 95.793 7.062 9.517 288 HE ARG 472 HE ARG 472 98.035 7.441 11.276 289 HH11 ARG 472 HH11 ARG 472 96.057 8.887 8.805 290 HH12 ARG 472 HH12 ARG 472 96.411 10.512 9.289 291 HH21 ARG 472 HH21 ARG 472 98.512 9.577 11.923 292 HH22 ARG 472 HH22 ARG 472 97.807 10.904 11.061 293 H ASP 473 H ASP 473 96.607 3.820 12.382 294 HA ASP 473 HA ASP 473 98.927 4.584 13.820 295 HB2 ASP 473 HB2 ASP 473 96.023 4.359 14.399 296 HB3 ASP 473 HB3 ASP 473 97.108 4.352 15.786 297 H THR 474 H THR 474 97.067 1.626 13.649 298 HA THR 474 HA THR 474 98.092 0.363 15.957 299 HB THR 474 HB THR 474 97.533 -1.771 14.479 300 HG1 THR 474 HG1 THR 474 97.079 -0.938 12.518 301 HG21 THR 474 HG21 THR 474 95.040 -1.265 15.015 302 HG22 THR 474 HG22 THR 474 95.688 0.171 15.808 303 HG23 THR 474 HG23 THR 474 96.195 -1.433 16.336 304 H LEU 475 H LEU 475 98.971 -0.087 12.527 305 HA LEU 475 HA LEU 475 101.161 -1.779 13.034 306 HB2 LEU 475 HB2 LEU 475 101.895 -1.086 10.719 307 HB3 LEU 475 HB3 LEU 475 100.292 -1.783 10.840 308 HG LEU 475 HG LEU 475 99.680 0.842 11.058 309 HD11 LEU 475 HD11 LEU 475 101.747 0.924 8.920 310 HD12 LEU 475 HD12 LEU 475 102.248 1.166 10.594 311 HD13 LEU 475 HD13 LEU 475 101.048 2.236 9.869 312 HD21 LEU 475 HD21 LEU 475 99.774 0.366 8.301 313 HD22 LEU 475 HD22 LEU 475 98.416 0.093 9.394 314 HD23 LEU 475 HD23 LEU 475 99.553 -1.213 9.055 315 H ALA 476 H ALA 476 100.885 1.721 12.678 316 HA ALA 476 HA ALA 476 103.676 2.230 12.835 317 HB1 ALA 476 HB1 ALA 476 102.554 4.554 13.691 318 HB2 ALA 476 HB2 ALA 476 101.222 3.838 12.783 319 HB3 ALA 476 HB3 ALA 476 102.778 4.110 11.999 320 H ALA 477 H ALA 477 101.201 1.595 15.170 321 HA ALA 477 HA ALA 477 102.542 2.756 17.409 322 HB1 ALA 477 HB1 ALA 477 100.934 1.224 18.709 323 HB2 ALA 477 HB2 ALA 477 100.231 0.870 17.130 324 HB3 ALA 477 HB3 ALA 477 100.251 2.526 17.736 325 H ILE 478 H ILE 478 102.612 -0.350 15.808 326 HA ILE 478 HA ILE 478 104.075 -1.635 17.949 327 HB ILE 478 HB ILE 478 103.335 -2.498 15.159 328 HG12 ILE 478 HG12 ILE 478 102.415 -4.391 16.878 329 HG13 ILE 478 HG13 ILE 478 102.356 -2.966 17.910 330 HG21 ILE 478 HG21 ILE 478 104.299 -4.764 16.331 331 HG22 ILE 478 HG22 ILE 478 105.446 -3.550 16.897 332 HG23 ILE 478 HG23 ILE 478 105.182 -3.774 15.168 333 HD11 ILE 478 HD11 ILE 478 100.425 -3.775 16.130 334 HD12 ILE 478 HD12 ILE 478 101.247 -2.467 15.279 335 HD13 ILE 478 HD13 ILE 478 100.555 -2.183 16.876 336 H SER 479 H SER 479 104.778 -0.021 14.933 337 HA SER 479 HA SER 479 107.518 0.358 15.658 338 HB2 SER 479 HB2 SER 479 106.980 -1.350 13.218 339 HB3 SER 479 HB3 SER 479 108.555 -0.839 13.824 340 HG SER 479 HG SER 479 108.469 -2.321 15.340 341 H GLU 480 H GLU 480 108.710 1.578 13.922 342 HA GLU 480 HA GLU 480 107.009 3.656 12.924 343 HB2 GLU 480 HB2 GLU 480 109.530 3.676 13.790 344 HB3 GLU 480 HB3 GLU 480 109.856 3.472 12.074 345 HG2 GLU 480 HG2 GLU 480 109.488 5.618 11.694 346 HG3 GLU 480 HG3 GLU 480 107.899 5.528 12.452 347 H VAL 481 H VAL 481 105.892 3.504 11.105 348 HA VAL 481 HA VAL 481 106.951 1.855 8.910 349 HB VAL 481 HB VAL 481 104.575 2.032 8.016 350 HG11 VAL 481 HG11 VAL 481 104.599 0.646 10.664 351 HG12 VAL 481 HG12 VAL 481 105.683 0.116 9.378 352 HG13 VAL 481 HG13 VAL 481 103.938 0.105 9.121 353 HG21 VAL 481 HG21 VAL 481 104.245 3.921 9.931 354 HG22 VAL 481 HG22 VAL 481 103.566 2.506 10.736 355 HG23 VAL 481 HG23 VAL 481 102.923 3.028 9.177 356 H LEU 482 H LEU 482 106.596 2.632 6.707 357 HA LEU 482 HA LEU 482 107.281 5.435 6.498 358 HB2 LEU 482 HB2 LEU 482 108.003 3.202 5.088 359 HB3 LEU 482 HB3 LEU 482 106.831 3.941 4.014 360 HG LEU 482 HG LEU 482 109.472 5.016 4.937 361 HD11 LEU 482 HD11 LEU 482 109.601 3.820 2.910 362 HD12 LEU 482 HD12 LEU 482 109.602 5.527 2.466 363 HD13 LEU 482 HD13 LEU 482 108.133 4.569 2.284 364 HD21 LEU 482 HD21 LEU 482 107.057 6.560 4.092 365 HD22 LEU 482 HD22 LEU 482 108.670 7.134 3.669 366 HD23 LEU 482 HD23 LEU 482 108.228 6.916 5.362 367 H TYR 483 H TYR 483 105.025 3.472 4.566 368 HA TYR 483 HA TYR 483 102.962 5.520 4.949 369 HB2 TYR 483 HB2 TYR 483 104.097 6.178 2.902 370 HB3 TYR 483 HB3 TYR 483 103.934 4.550 2.254 371 HD1 TYR 483 HD1 TYR 483 101.488 3.668 2.010 372 HD2 TYR 483 HD2 TYR 483 102.512 7.780 2.363 373 HE1 TYR 483 HE1 TYR 483 99.338 4.283 0.991 374 HE2 TYR 483 HE2 TYR 483 100.364 8.409 1.343 375 HH TYR 483 HH TYR 483 97.917 7.040 1.220 376 H VAL 484 H VAL 484 100.893 4.742 4.968 377 HA VAL 484 HA VAL 484 100.619 1.828 4.648 378 HB VAL 484 HB VAL 484 100.147 2.677 6.910 379 HG11 VAL 484 HG11 VAL 484 98.888 4.465 7.329 380 HG12 VAL 484 HG12 VAL 484 97.591 3.899 6.277 381 HG13 VAL 484 HG13 VAL 484 98.953 4.791 5.598 382 HG21 VAL 484 HG21 VAL 484 97.570 1.776 5.648 383 HG22 VAL 484 HG22 VAL 484 98.182 1.426 7.265 384 HG23 VAL 484 HG23 VAL 484 98.951 0.698 5.855 385 H ASP 485 H ASP 485 99.666 1.220 2.828 386 HA ASP 485 HA ASP 485 97.745 3.018 1.534 387 HB2 ASP 485 HB2 ASP 485 98.678 0.532 0.193 388 HB3 ASP 485 HB3 ASP 485 98.355 2.124 -0.487 389 H LEU 486 H LEU 486 95.890 2.586 2.733 390 HA LEU 486 HA LEU 486 94.934 -0.180 2.820 391 HB2 LEU 486 HB2 LEU 486 94.697 0.819 4.919 392 HB3 LEU 486 HB3 LEU 486 94.168 2.346 4.241 393 HG LEU 486 HG LEU 486 92.450 0.844 5.462 394 HD11 LEU 486 HD11 LEU 486 91.647 1.787 2.726 395 HD12 LEU 486 HD12 LEU 486 92.037 2.903 4.034 396 HD13 LEU 486 HD13 LEU 486 90.695 1.773 4.209 397 HD21 LEU 486 HD21 LEU 486 91.566 -0.436 3.083 398 HD22 LEU 486 HD22 LEU 486 92.022 -1.161 4.623 399 HD23 LEU 486 HD23 LEU 486 93.241 -0.902 3.377 400 H LEU 487 H LEU 487 93.359 -0.923 1.517 401 HA LEU 487 HA LEU 487 92.427 0.665 -0.642 402 HB2 LEU 487 HB2 LEU 487 91.689 -2.061 0.382 403 HB3 LEU 487 HB3 LEU 487 90.855 -1.337 -0.980 404 HG LEU 487 HG LEU 487 93.812 -1.417 -1.138 405 HD11 LEU 487 HD11 LEU 487 93.925 -3.587 -0.612 406 HD12 LEU 487 HD12 LEU 487 93.156 -3.857 -2.176 407 HD13 LEU 487 HD13 LEU 487 92.177 -3.800 -0.710 408 HD21 LEU 487 HD21 LEU 487 92.957 -0.596 -3.083 409 HD22 LEU 487 HD22 LEU 487 91.459 -1.517 -2.944 410 HD23 LEU 487 HD23 LEU 487 92.938 -2.314 -3.478 411 H GLU 488 H GLU 488 91.262 2.423 -0.008 412 HA GLU 488 HA GLU 488 89.505 2.829 1.986 413 HB2 GLU 488 HB2 GLU 488 90.177 4.248 -0.197 414 HB3 GLU 488 HB3 GLU 488 88.543 3.786 -0.652 415 HG2 GLU 488 HG2 GLU 488 88.104 4.638 1.860 416 HG3 GLU 488 HG3 GLU 488 89.481 5.650 1.422 417 H GLY 489 H GLY 489 87.647 2.012 2.679 418 HA2 GLY 489 HA2 GLY 489 85.575 1.003 2.672 419 HA3 GLY 489 HA3 GLY 489 85.578 1.121 0.919 420 H ASP 490 H ASP 490 88.377 -0.378 1.972 421 HA ASP 490 HA ASP 490 87.199 -3.029 1.460 422 HB2 ASP 490 HB2 ASP 490 89.137 -1.821 -0.002 423 HB3 ASP 490 HB3 ASP 490 90.120 -2.695 1.168 424 H THR 491 H THR 491 88.455 -4.850 2.462 425 HA THR 491 HA THR 491 89.068 -4.153 5.248 426 HB THR 491 HB THR 491 88.621 -6.473 5.801 427 HG1 THR 491 HG1 THR 491 89.063 -7.809 4.189 428 HG21 THR 491 HG21 THR 491 86.670 -5.120 5.811 429 HG22 THR 491 HG22 THR 491 86.231 -6.632 5.016 430 HG23 THR 491 HG23 THR 491 86.534 -5.186 4.054 431 H GLU 492 H GLU 492 90.820 -4.268 2.649 432 HA GLU 492 HA GLU 492 93.030 -5.745 3.921 433 HB2 GLU 492 HB2 GLU 492 92.321 -5.628 0.989 434 HB3 GLU 492 HB3 GLU 492 93.837 -6.271 1.608 435 HG2 GLU 492 HG2 GLU 492 91.991 -7.647 3.074 436 HG3 GLU 492 HG3 GLU 492 91.179 -7.470 1.519 437 H CYS 493 H CYS 493 94.740 -4.534 4.357 438 HA CYS 493 HA CYS 493 95.246 -2.145 2.715 439 HB2 CYS 493 HB2 CYS 493 94.492 -1.216 4.733 440 HB3 CYS 493 HB3 CYS 493 95.273 -2.459 5.703 441 HG CYS 493 HG CYS 493 96.476 0.024 5.605 442 H HIS 494 H HIS 494 97.398 -1.681 2.269 443 HA HIS 494 HA HIS 494 99.359 -3.698 3.150 444 HB2 HIS 494 HB2 HIS 494 98.978 -2.540 0.386 445 HB3 HIS 494 HB3 HIS 494 100.421 -3.424 0.872 446 HD1 HIS 494 HD1 HIS 494 96.714 -4.177 1.324 447 HD2 HIS 494 HD2 HIS 494 100.187 -5.912 -0.159 448 HE1 HIS 494 HE1 HIS 494 96.048 -6.485 0.581 449 HE2 HIS 494 HE2 HIS 494 98.186 -7.551 -0.218 450 H ALA 495 H ALA 495 100.524 -2.555 4.601 451 HA ALA 495 HA ALA 495 101.257 0.195 4.020 452 HB1 ALA 495 HB1 ALA 495 101.071 -1.455 6.418 453 HB2 ALA 495 HB2 ALA 495 100.883 0.287 6.218 454 HB3 ALA 495 HB3 ALA 495 102.493 -0.413 6.381 455 H ARG 496 H ARG 496 103.147 0.855 3.308 456 HA ARG 496 HA ARG 496 105.216 -1.081 2.697 457 HB2 ARG 496 HB2 ARG 496 105.781 1.747 2.150 458 HB3 ARG 496 HB3 ARG 496 105.847 0.357 1.074 459 HG2 ARG 496 HG2 ARG 496 103.264 0.499 1.128 460 HG3 ARG 496 HG3 ARG 496 103.539 2.138 1.720 461 HD2 ARG 496 HD2 ARG 496 105.242 1.655 -0.520 462 HD3 ARG 496 HD3 ARG 496 103.590 1.210 -0.948 463 HE ARG 496 HE ARG 496 102.964 3.429 -0.765 464 HH11 ARG 496 HH11 ARG 496 106.219 2.983 0.378 465 HH12 ARG 496 HH12 ARG 496 106.571 4.677 0.438 466 HH21 ARG 496 HH21 ARG 496 103.415 5.672 -0.690 467 HH22 ARG 496 HH22 ARG 496 104.977 6.206 -0.168 468 H PHE 497 H PHE 497 106.912 -1.442 3.942 469 HA PHE 497 HA PHE 497 107.518 0.433 6.123 470 HB2 PHE 497 HB2 PHE 497 108.129 -2.498 5.742 471 HB3 PHE 497 HB3 PHE 497 108.861 -1.536 7.022 472 HD1 PHE 497 HD1 PHE 497 107.928 -2.054 9.051 473 HD2 PHE 497 HD2 PHE 497 105.408 -1.771 5.637 474 HE1 PHE 497 HE1 PHE 497 105.963 -2.459 10.475 475 HE2 PHE 497 HE2 PHE 497 103.437 -2.175 7.051 476 HZ PHE 497 HZ PHE 497 103.712 -2.519 9.475 477 H LYS 498 H LYS 498 109.641 1.144 6.492 478 HA LYS 498 HA LYS 498 111.196 1.473 4.110 479 HB2 LYS 498 HB2 LYS 498 110.864 2.951 6.381 480 HB3 LYS 498 HB3 LYS 498 112.443 2.231 6.666 481 HG2 LYS 498 HG2 LYS 498 112.676 3.081 4.086 482 HG3 LYS 498 HG3 LYS 498 111.639 4.322 4.790 483 HD2 LYS 498 HD2 LYS 498 113.674 3.806 6.669 484 HD3 LYS 498 HD3 LYS 498 114.461 3.935 5.095 485 HE2 LYS 498 HE2 LYS 498 112.477 5.952 6.123 486 HE3 LYS 498 HE3 LYS 498 114.215 6.092 6.381 487 HZ1 LYS 498 HZ1 LYS 498 113.148 5.730 3.659 488 HZ2 LYS 498 HZ2 LYS 498 114.602 6.442 4.147 489 HZ3 LYS 498 HZ3 LYS 498 113.142 7.265 4.372 490 H THR 499 H THR 499 111.179 -0.833 6.641 491 HA THR 499 HA THR 499 113.620 -2.013 5.547 492 HB THR 499 HB THR 499 114.265 -2.580 7.999 493 HG1 THR 499 HG1 THR 499 112.822 -0.155 8.410 494 HG21 THR 499 HG21 THR 499 114.680 0.291 7.240 495 HG22 THR 499 HG22 THR 499 115.411 -1.015 6.306 496 HG23 THR 499 HG23 THR 499 115.803 -0.827 8.016 497 HA PRO 500 HA PRO 500 111.359 -5.773 5.982 498 HB2 PRO 500 HB2 PRO 500 113.398 -7.552 6.030 499 HB3 PRO 500 HB3 PRO 500 112.934 -6.681 4.565 500 HG2 PRO 500 HG2 PRO 500 115.166 -6.118 6.476 501 HG3 PRO 500 HG3 PRO 500 115.172 -6.071 4.704 502 HD2 PRO 500 HD2 PRO 500 114.963 -3.841 6.242 503 HD3 PRO 500 HD3 PRO 500 114.230 -3.975 4.632 504 H GLU 501 H GLU 501 114.124 -5.316 8.157 505 HA GLU 501 HA GLU 501 113.439 -7.261 10.059 506 HB2 GLU 501 HB2 GLU 501 114.768 -5.678 11.630 507 HB3 GLU 501 HB3 GLU 501 115.604 -6.439 10.282 508 HG2 GLU 501 HG2 GLU 501 115.702 -4.469 9.063 509 HG3 GLU 501 HG3 GLU 501 114.402 -3.718 9.987 510 H ASP 502 H ASP 502 112.473 -3.898 9.686 511 HA ASP 502 HA ASP 502 111.142 -3.595 12.146 512 HB2 ASP 502 HB2 ASP 502 111.531 -2.065 9.768 513 HB3 ASP 502 HB3 ASP 502 109.811 -2.060 10.144 514 H ALA 503 H ALA 503 110.035 -4.707 8.971 515 HA ALA 503 HA ALA 503 107.305 -4.967 9.678 516 HB1 ALA 503 HB1 ALA 503 108.509 -4.984 7.331 517 HB2 ALA 503 HB2 ALA 503 106.966 -5.801 7.583 518 HB3 ALA 503 HB3 ALA 503 108.466 -6.729 7.587 519 H GLN 504 H GLN 504 110.021 -7.251 9.672 520 HA GLN 504 HA GLN 504 108.636 -9.583 10.273 521 HB2 GLN 504 HB2 GLN 504 110.967 -9.712 9.724 522 HB3 GLN 504 HB3 GLN 504 111.405 -8.684 11.082 523 HG2 GLN 504 HG2 GLN 504 110.471 -10.510 12.574 524 HG3 GLN 504 HG3 GLN 504 110.447 -11.526 11.135 525 HE21 GLN 504 HE21 GLN 504 112.236 -12.591 10.619 526 HE22 GLN 504 HE22 GLN 504 113.800 -12.320 11.302 527 H ALA 505 H ALA 505 109.895 -7.083 12.422 528 HA ALA 505 HA ALA 505 109.174 -8.334 14.843 529 HB1 ALA 505 HB1 ALA 505 109.100 -5.433 14.970 530 HB2 ALA 505 HB2 ALA 505 110.540 -6.038 14.151 531 HB3 ALA 505 HB3 ALA 505 110.165 -6.575 15.789 532 H VAL 506 H VAL 506 107.450 -6.126 12.694 533 HA VAL 506 HA VAL 506 105.259 -5.650 14.422 534 HB VAL 506 HB VAL 506 105.194 -5.536 11.412 535 HG11 VAL 506 HG11 VAL 506 103.124 -5.279 13.061 536 HG12 VAL 506 HG12 VAL 506 103.288 -4.312 11.594 537 HG13 VAL 506 HG13 VAL 506 103.742 -3.630 13.155 538 HG21 VAL 506 HG21 VAL 506 105.622 -2.971 12.510 539 HG22 VAL 506 HG22 VAL 506 106.698 -3.903 11.469 540 HG23 VAL 506 HG23 VAL 506 106.825 -4.047 13.223 541 H ILE 507 H ILE 507 105.726 -7.994 11.775 542 HA ILE 507 HA ILE 507 103.100 -9.038 11.911 543 HB ILE 507 HB ILE 507 103.983 -10.976 10.663 544 HG12 ILE 507 HG12 ILE 507 106.605 -9.814 10.155 545 HG13 ILE 507 HG13 ILE 507 106.396 -10.303 11.831 546 HG21 ILE 507 HG21 ILE 507 105.216 -8.752 9.205 547 HG22 ILE 507 HG22 ILE 507 103.585 -8.434 9.796 548 HG23 ILE 507 HG23 ILE 507 103.888 -9.816 8.742 549 HD11 ILE 507 HD11 ILE 507 105.911 -12.542 11.193 550 HD12 ILE 507 HD12 ILE 507 107.387 -12.040 10.370 551 HD13 ILE 507 HD13 ILE 507 105.861 -12.097 9.488 552 H ASN 508 H ASN 508 106.073 -9.840 13.568 553 HA ASN 508 HA ASN 508 105.113 -12.272 14.732 554 HB2 ASN 508 HB2 ASN 508 107.413 -10.453 15.480 555 HB3 ASN 508 HB3 ASN 508 107.069 -11.975 16.297 556 HD21 ASN 508 HD21 ASN 508 109.302 -10.928 14.536 557 HD22 ASN 508 HD22 ASN 508 109.527 -12.177 13.362 558 H ALA 509 H ALA 509 105.283 -8.914 15.696 559 HA ALA 509 HA ALA 509 104.239 -9.334 18.332 560 HB1 ALA 509 HB1 ALA 509 104.620 -7.127 18.693 561 HB2 ALA 509 HB2 ALA 509 104.062 -6.653 17.088 562 HB3 ALA 509 HB3 ALA 509 105.672 -7.345 17.294 563 H TYR 510 H TYR 510 102.895 -8.771 15.198 564 HA TYR 510 HA TYR 510 100.448 -7.638 15.883 565 HB2 TYR 510 HB2 TYR 510 101.639 -8.743 13.540 566 HB3 TYR 510 HB3 TYR 510 99.996 -9.364 13.696 567 HD1 TYR 510 HD1 TYR 510 98.950 -8.158 11.921 568 HD2 TYR 510 HD2 TYR 510 101.183 -6.088 14.892 569 HE1 TYR 510 HE1 TYR 510 98.067 -6.020 11.087 570 HE2 TYR 510 HE2 TYR 510 100.305 -3.942 14.064 571 HH TYR 510 HH TYR 510 98.656 -3.004 12.765 572 H THR 511 H THR 511 101.569 -10.806 16.511 573 HA THR 511 HA THR 511 99.210 -12.289 16.404 574 HB THR 511 HB THR 511 101.295 -13.414 16.883 575 HG1 THR 511 HG1 THR 511 100.612 -14.277 19.154 576 HG21 THR 511 HG21 THR 511 101.354 -11.952 19.519 577 HG22 THR 511 HG22 THR 511 102.336 -11.524 18.119 578 HG23 THR 511 HG23 THR 511 102.556 -13.087 18.904 579 H GLU 512 H GLU 512 100.459 -10.021 18.728 580 HA GLU 512 HA GLU 512 98.720 -10.419 20.863 581 HB2 GLU 512 HB2 GLU 512 100.594 -9.014 21.201 582 HB3 GLU 512 HB3 GLU 512 100.152 -7.969 19.858 583 HG2 GLU 512 HG2 GLU 512 98.093 -7.355 21.194 584 HG3 GLU 512 HG3 GLU 512 98.860 -8.167 22.558 585 H ILE 513 H ILE 513 98.322 -8.464 17.947 586 HA ILE 513 HA ILE 513 96.130 -6.967 18.446 587 HB ILE 513 HB ILE 513 96.478 -8.640 15.955 588 HG12 ILE 513 HG12 ILE 513 98.472 -7.284 16.500 589 HG13 ILE 513 HG13 ILE 513 97.668 -6.717 15.038 590 HG21 ILE 513 HG21 ILE 513 94.824 -6.206 16.564 591 HG22 ILE 513 HG22 ILE 513 94.292 -7.761 15.926 592 HG23 ILE 513 HG23 ILE 513 95.249 -6.676 14.918 593 HD11 ILE 513 HD11 ILE 513 97.147 -5.476 17.715 594 HD12 ILE 513 HD12 ILE 513 96.822 -4.820 16.109 595 HD13 ILE 513 HD13 ILE 513 98.483 -4.966 16.683 596 H ASN 514 H ASN 514 96.108 -10.435 17.681 597 HA ASN 514 HA ASN 514 93.447 -10.970 17.487 598 HB2 ASN 514 HB2 ASN 514 95.201 -12.675 17.262 599 HB3 ASN 514 HB3 ASN 514 95.484 -12.620 19.000 600 HD21 ASN 514 HD21 ASN 514 92.408 -12.526 17.285 601 HD22 ASN 514 HD22 ASN 514 91.792 -14.000 17.942 602 H LYS 515 H LYS 515 95.202 -10.058 20.358 603 HA LYS 515 HA LYS 515 93.616 -10.925 22.408 604 HB2 LYS 515 HB2 LYS 515 94.382 -9.042 23.694 605 HB3 LYS 515 HB3 LYS 515 95.693 -9.566 22.647 606 HG2 LYS 515 HG2 LYS 515 95.877 -7.492 21.906 607 HG3 LYS 515 HG3 LYS 515 94.263 -7.626 21.206 608 HD2 LYS 515 HD2 LYS 515 93.291 -6.448 22.884 609 HD3 LYS 515 HD3 LYS 515 94.403 -7.066 24.107 610 HE2 LYS 515 HE2 LYS 515 94.625 -4.619 23.617 611 HE3 LYS 515 HE3 LYS 515 96.110 -5.553 23.434 612 HZ1 LYS 515 HZ1 LYS 515 95.823 -5.558 21.070 613 HZ2 LYS 515 HZ2 LYS 515 95.727 -3.960 21.615 614 HZ3 LYS 515 HZ3 LYS 515 94.317 -4.795 21.191 615 H LYS 516 H LYS 516 92.860 -8.569 19.992 616 HA LYS 516 HA LYS 516 90.235 -8.151 21.259 617 HB2 LYS 516 HB2 LYS 516 91.805 -6.131 21.244 618 HB3 LYS 516 HB3 LYS 516 91.586 -6.111 19.500 619 HG2 LYS 516 HG2 LYS 516 90.024 -4.579 20.246 620 HG3 LYS 516 HG3 LYS 516 89.069 -6.047 20.032 621 HD2 LYS 516 HD2 LYS 516 90.305 -5.409 22.685 622 HD3 LYS 516 HD3 LYS 516 88.784 -4.657 22.201 623 HE2 LYS 516 HE2 LYS 516 88.182 -7.185 21.621 624 HE3 LYS 516 HE3 LYS 516 89.383 -7.483 22.876 625 HZ1 LYS 516 HZ1 LYS 516 87.875 -5.579 24.008 626 HZ2 LYS 516 HZ2 LYS 516 87.640 -7.238 24.240 627 HZ3 LYS 516 HZ3 LYS 516 86.711 -6.404 23.099 628 H HIS 517 H HIS 517 92.078 -8.448 18.277 629 HA HIS 517 HA HIS 517 89.800 -9.656 16.969 630 HB2 HIS 517 HB2 HIS 517 91.048 -7.473 15.381 631 HB3 HIS 517 HB3 HIS 517 89.402 -8.095 15.338 632 HD1 HIS 517 HD1 HIS 517 87.667 -6.909 16.749 633 HD2 HIS 517 HD2 HIS 517 91.532 -5.549 17.438 634 HE1 HIS 517 HE1 HIS 517 87.411 -4.851 18.172 635 HE2 HIS 517 HE2 HIS 517 89.756 -3.988 18.489 636 H CYS 518 H CYS 518 90.462 -11.264 15.686 637 HA CYS 518 HA CYS 518 93.198 -11.937 15.491 638 HB2 CYS 518 HB2 CYS 518 91.002 -13.399 15.305 639 HB3 CYS 518 HB3 CYS 518 91.204 -13.088 13.585 640 HG CYS 518 HG CYS 518 93.402 -14.401 13.615 641 H TRP 519 H TRP 519 94.457 -10.449 14.458 642 HA TRP 519 HA TRP 519 93.677 -9.656 11.747 643 HB2 TRP 519 HB2 TRP 519 94.569 -8.099 13.798 644 HB3 TRP 519 HB3 TRP 519 96.060 -8.387 12.901 645 HD1 TRP 519 HD1 TRP 519 93.476 -8.473 10.380 646 HE1 TRP 519 HE1 TRP 519 93.205 -6.220 9.207 647 HE3 TRP 519 HE3 TRP 519 96.053 -5.539 13.680 648 HZ2 TRP 519 HZ2 TRP 519 93.979 -3.518 9.622 649 HZ3 TRP 519 HZ3 TRP 519 96.241 -3.132 13.216 650 HH2 TRP 519 HH2 TRP 519 95.227 -2.147 11.227 651 H LYS 520 H LYS 520 95.050 -9.835 10.014 652 HA LYS 520 HA LYS 520 97.161 -11.860 10.317 653 HB2 LYS 520 HB2 LYS 520 95.902 -11.122 7.711 654 HB3 LYS 520 HB3 LYS 520 96.637 -12.647 8.189 655 HG2 LYS 520 HG2 LYS 520 94.064 -11.610 9.350 656 HG3 LYS 520 HG3 LYS 520 94.143 -12.675 7.944 657 HD2 LYS 520 HD2 LYS 520 94.316 -14.447 9.274 658 HD3 LYS 520 HD3 LYS 520 95.774 -13.774 10.005 659 HE2 LYS 520 HE2 LYS 520 93.915 -14.301 11.611 660 HE3 LYS 520 HE3 LYS 520 94.520 -12.646 11.675 661 HZ1 LYS 520 HZ1 LYS 520 92.034 -12.925 11.709 662 HZ2 LYS 520 HZ2 LYS 520 92.136 -13.409 10.091 663 HZ3 LYS 520 HZ3 LYS 520 92.633 -11.857 10.541 664 H LEU 521 H LEU 521 99.206 -11.458 9.648 665 HA LEU 521 HA LEU 521 99.725 -9.037 8.076 666 HB2 LEU 521 HB2 LEU 521 100.117 -8.993 10.742 667 HB3 LEU 521 HB3 LEU 521 101.667 -9.630 10.227 668 HG LEU 521 HG LEU 521 102.122 -7.683 8.908 669 HD11 LEU 521 HD11 LEU 521 100.132 -7.073 7.893 670 HD12 LEU 521 HD12 LEU 521 100.396 -5.767 9.048 671 HD13 LEU 521 HD13 LEU 521 99.244 -7.050 9.416 672 HD21 LEU 521 HD21 LEU 521 101.673 -7.601 11.706 673 HD22 LEU 521 HD22 LEU 521 101.191 -6.044 11.033 674 HD23 LEU 521 HD23 LEU 521 102.819 -6.663 10.749 675 H GLU 522 H GLU 522 100.696 -9.716 6.287 676 HA GLU 522 HA GLU 522 102.810 -11.755 6.520 677 HB2 GLU 522 HB2 GLU 522 100.404 -12.178 5.268 678 HB3 GLU 522 HB3 GLU 522 101.427 -11.664 3.933 679 HG2 GLU 522 HG2 GLU 522 103.047 -13.453 5.153 680 HG3 GLU 522 HG3 GLU 522 101.463 -14.143 5.500 681 H ILE 523 H ILE 523 104.693 -11.325 5.478 682 HA ILE 523 HA ILE 523 104.954 -8.689 4.271 683 HB ILE 523 HB ILE 523 106.992 -10.742 5.126 684 HG12 ILE 523 HG12 ILE 523 106.659 -7.898 6.073 685 HG13 ILE 523 HG13 ILE 523 105.762 -9.230 6.796 686 HG21 ILE 523 HG21 ILE 523 108.737 -9.231 4.443 687 HG22 ILE 523 HG22 ILE 523 107.551 -8.051 3.887 688 HG23 ILE 523 HG23 ILE 523 107.716 -9.595 3.052 689 HD11 ILE 523 HD11 ILE 523 107.638 -8.871 8.164 690 HD12 ILE 523 HD12 ILE 523 108.728 -8.786 6.780 691 HD13 ILE 523 HD13 ILE 523 107.993 -10.324 7.230 692 H LEU 524 H LEU 524 104.803 -8.406 2.159 693 HA LEU 524 HA LEU 524 104.564 -10.486 0.290 694 HB2 LEU 524 HB2 LEU 524 104.776 -7.540 0.185 695 HB3 LEU 524 HB3 LEU 524 105.193 -8.396 -1.288 696 HG LEU 524 HG LEU 524 102.819 -7.639 -1.174 697 HD11 LEU 524 HD11 LEU 524 102.312 -10.451 -1.302 698 HD12 LEU 524 HD12 LEU 524 103.878 -10.095 -2.031 699 HD13 LEU 524 HD13 LEU 524 102.429 -9.277 -2.613 700 HD21 LEU 524 HD21 LEU 524 102.700 -8.206 1.332 701 HD22 LEU 524 HD22 LEU 524 102.371 -9.853 0.794 702 HD23 LEU 524 HD23 LEU 524 101.288 -8.542 0.330 703 H SER 525 H SER 525 105.953 -11.478 -1.067 704 HA SER 525 HA SER 525 108.680 -10.513 -1.343 705 HB2 SER 525 HB2 SER 525 109.765 -12.318 -0.381 706 HB3 SER 525 HB3 SER 525 108.370 -12.174 0.687 707 HG SER 525 HG SER 525 108.929 -14.337 -0.241 708 H GLY 526 H GLY 526 109.927 -11.770 -2.933 709 HA2 GLY 526 HA2 GLY 526 110.141 -12.535 -5.086 710 HA3 GLY 526 HA3 GLY 526 108.916 -13.705 -4.624 711 H ASP 527 H ASP 527 108.258 -13.571 -6.871 712 HA ASP 527 HA ASP 527 107.451 -11.458 -8.334 713 HB2 ASP 527 HB2 ASP 527 106.285 -14.194 -8.001 714 HB3 ASP 527 HB3 ASP 527 105.436 -13.022 -9.007 715 H HIS 528 H HIS 528 105.898 -12.686 -5.459 716 HA HIS 528 HA HIS 528 103.440 -11.326 -5.713 717 HB2 HIS 528 HB2 HIS 528 104.442 -13.148 -3.955 718 HB3 HIS 528 HB3 HIS 528 104.478 -11.685 -2.976 719 HD1 HIS 528 HD1 HIS 528 102.607 -12.999 -1.555 720 HD2 HIS 528 HD2 HIS 528 101.489 -11.740 -5.353 721 HE1 HIS 528 HE1 HIS 528 100.094 -13.108 -1.587 722 HE2 HIS 528 HE2 HIS 528 99.437 -12.283 -3.875 723 H GLU 529 H GLU 529 106.484 -10.436 -4.094 724 HA GLU 529 HA GLU 529 105.540 -7.946 -3.123 725 HB2 GLU 529 HB2 GLU 529 107.625 -7.700 -2.242 726 HB3 GLU 529 HB3 GLU 529 107.741 -9.410 -2.622 727 HG2 GLU 529 HG2 GLU 529 108.819 -8.805 -4.773 728 HG3 GLU 529 HG3 GLU 529 108.800 -7.119 -4.260 729 H GLN 530 H GLN 530 107.373 -8.882 -5.997 730 HA GLN 530 HA GLN 530 107.685 -6.287 -7.055 731 HB2 GLN 530 HB2 GLN 530 108.672 -7.300 -8.846 732 HB3 GLN 530 HB3 GLN 530 108.728 -8.650 -7.721 733 HG2 GLN 530 HG2 GLN 530 107.893 -9.703 -9.550 734 HG3 GLN 530 HG3 GLN 530 106.384 -9.198 -8.792 735 HE21 GLN 530 HE21 GLN 530 106.107 -9.727 -11.311 736 HE22 GLN 530 HE22 GLN 530 106.037 -8.309 -12.296 737 H ARG 531 H ARG 531 105.150 -8.696 -7.389 738 HA ARG 531 HA ARG 531 103.689 -7.547 -9.468 739 HB2 ARG 531 HB2 ARG 531 102.900 -9.640 -9.007 740 HB3 ARG 531 HB3 ARG 531 103.128 -9.463 -7.274 741 HG2 ARG 531 HG2 ARG 531 100.757 -9.694 -8.010 742 HG3 ARG 531 HG3 ARG 531 101.093 -8.253 -7.047 743 HD2 ARG 531 HD2 ARG 531 100.083 -7.103 -8.668 744 HD3 ARG 531 HD3 ARG 531 101.526 -7.408 -9.635 745 HE ARG 531 HE ARG 531 100.284 -8.799 -10.946 746 HH11 ARG 531 HH11 ARG 531 98.648 -8.403 -7.896 747 HH12 ARG 531 HH12 ARG 531 97.247 -9.297 -8.386 748 HH21 ARG 531 HH21 ARG 531 98.445 -9.980 -11.596 749 HH22 ARG 531 HH22 ARG 531 97.132 -10.193 -10.487 750 H TYR 532 H TYR 532 103.175 -7.181 -5.949 751 HA TYR 532 HA TYR 532 101.105 -5.306 -6.128 752 HB2 TYR 532 HB2 TYR 532 101.625 -6.499 -4.062 753 HB3 TYR 532 HB3 TYR 532 103.177 -5.676 -3.954 754 HD1 TYR 532 HD1 TYR 532 103.178 -3.159 -3.623 755 HD2 TYR 532 HD2 TYR 532 99.690 -5.545 -3.141 756 HE1 TYR 532 HE1 TYR 532 102.140 -1.366 -2.295 757 HE2 TYR 532 HE2 TYR 532 98.641 -3.755 -1.821 758 HH TYR 532 HH TYR 532 99.595 -0.684 -1.801 759 H TRP 533 H TRP 533 104.614 -4.836 -5.869 760 HA TRP 533 HA TRP 533 104.550 -2.028 -5.744 761 HB2 TRP 533 HB2 TRP 533 106.625 -4.061 -6.421 762 HB3 TRP 533 HB3 TRP 533 106.944 -2.376 -6.829 763 HD1 TRP 533 HD1 TRP 533 107.326 -4.742 -4.062 764 HE1 TRP 533 HE1 TRP 533 107.814 -3.513 -1.857 765 HE3 TRP 533 HE3 TRP 533 106.115 0.015 -5.492 766 HZ2 TRP 533 HZ2 TRP 533 107.698 -0.878 -0.851 767 HZ3 TRP 533 HZ3 TRP 533 106.331 1.831 -3.846 768 HH2 TRP 533 HH2 TRP 533 107.109 1.392 -1.574 769 H GLN 534 H GLN 534 104.723 -4.270 -8.471 770 HA GLN 534 HA GLN 534 105.144 -2.487 -10.544 771 HB2 GLN 534 HB2 GLN 534 103.606 -5.063 -10.356 772 HB3 GLN 534 HB3 GLN 534 103.620 -4.145 -11.856 773 HG2 GLN 534 HG2 GLN 534 106.080 -5.121 -10.427 774 HG3 GLN 534 HG3 GLN 534 105.306 -5.947 -11.779 775 HE21 GLN 534 HE21 GLN 534 107.514 -3.568 -10.835 776 HE22 GLN 534 HE22 GLN 534 107.854 -2.913 -12.396 777 H LYS 535 H LYS 535 102.153 -3.349 -8.877 778 HA LYS 535 HA LYS 535 100.402 -1.850 -10.493 779 HB2 LYS 535 HB2 LYS 535 98.788 -2.556 -9.070 780 HB3 LYS 535 HB3 LYS 535 100.057 -3.615 -8.476 781 HG2 LYS 535 HG2 LYS 535 100.575 -1.696 -6.828 782 HG3 LYS 535 HG3 LYS 535 98.963 -1.117 -7.253 783 HD2 LYS 535 HD2 LYS 535 97.944 -3.114 -6.472 784 HD3 LYS 535 HD3 LYS 535 99.502 -3.930 -6.328 785 HE2 LYS 535 HE2 LYS 535 98.465 -3.129 -4.170 786 HE3 LYS 535 HE3 LYS 535 100.126 -2.619 -4.466 787 HZ1 LYS 535 HZ1 LYS 535 98.796 -0.792 -3.643 788 HZ2 LYS 535 HZ2 LYS 535 97.695 -0.972 -4.913 789 HZ3 LYS 535 HZ3 LYS 535 99.280 -0.480 -5.234 790 H ILE 536 H ILE 536 102.271 -1.050 -7.597 791 HA ILE 536 HA ILE 536 101.198 1.534 -7.199 792 HB ILE 536 HB ILE 536 103.965 0.550 -6.494 793 HG12 ILE 536 HG12 ILE 536 101.453 0.593 -4.807 794 HG13 ILE 536 HG13 ILE 536 102.151 -0.849 -5.540 795 HG21 ILE 536 HG21 ILE 536 104.338 2.633 -5.828 796 HG22 ILE 536 HG22 ILE 536 103.062 2.428 -4.628 797 HG23 ILE 536 HG23 ILE 536 102.682 3.103 -6.212 798 HD11 ILE 536 HD11 ILE 536 104.190 0.442 -4.064 799 HD12 ILE 536 HD12 ILE 536 103.432 -1.121 -3.762 800 HD13 ILE 536 HD13 ILE 536 102.756 0.342 -3.043 801 H LEU 537 H LEU 537 104.250 0.518 -8.730 802 HA LEU 537 HA LEU 537 105.062 3.043 -9.595 803 HB2 LEU 537 HB2 LEU 537 105.658 0.267 -10.574 804 HB3 LEU 537 HB3 LEU 537 106.345 1.674 -11.362 805 HG LEU 537 HG LEU 537 106.749 1.737 -8.481 806 HD11 LEU 537 HD11 LEU 537 108.584 -0.235 -9.500 807 HD12 LEU 537 HD12 LEU 537 106.921 -0.814 -9.585 808 HD13 LEU 537 HD13 LEU 537 107.588 -0.271 -8.046 809 HD21 LEU 537 HD21 LEU 537 108.655 2.750 -9.092 810 HD22 LEU 537 HD22 LEU 537 107.907 2.824 -10.687 811 HD23 LEU 537 HD23 LEU 537 109.038 1.526 -10.302 812 H VAL 538 H VAL 538 103.444 0.492 -11.511 813 HA VAL 538 HA VAL 538 103.140 1.964 -13.852 814 HB VAL 538 HB VAL 538 101.475 -0.274 -12.711 815 HG11 VAL 538 HG11 VAL 538 101.163 1.199 -15.309 816 HG12 VAL 538 HG12 VAL 538 99.933 0.802 -14.110 817 HG13 VAL 538 HG13 VAL 538 100.628 -0.470 -15.114 818 HG21 VAL 538 HG21 VAL 538 103.544 -1.137 -13.300 819 HG22 VAL 538 HG22 VAL 538 103.713 -0.058 -14.687 820 HG23 VAL 538 HG23 VAL 538 102.585 -1.413 -14.754 821 H ASP 539 H ASP 539 101.054 1.806 -10.995 822 HA ASP 539 HA ASP 539 98.907 3.287 -12.075 823 HB2 ASP 539 HB2 ASP 539 98.892 1.889 -9.951 824 HB3 ASP 539 HB3 ASP 539 99.698 3.242 -9.161 825 H ARG 540 H ARG 540 101.865 4.224 -10.413 826 HA ARG 540 HA ARG 540 101.249 6.940 -10.029 827 HB2 ARG 540 HB2 ARG 540 103.856 5.457 -10.309 828 HB3 ARG 540 HB3 ARG 540 103.802 7.194 -10.044 829 HG2 ARG 540 HG2 ARG 540 102.288 5.416 -8.199 830 HG3 ARG 540 HG3 ARG 540 104.042 5.521 -8.042 831 HD2 ARG 540 HD2 ARG 540 102.392 8.010 -8.207 832 HD3 ARG 540 HD3 ARG 540 102.526 7.136 -6.681 833 HE ARG 540 HE ARG 540 105.104 7.449 -7.557 834 HH11 ARG 540 HH11 ARG 540 102.446 9.583 -6.837 835 HH12 ARG 540 HH12 ARG 540 103.465 10.886 -6.321 836 HH21 ARG 540 HH21 ARG 540 106.452 9.154 -6.875 837 HH22 ARG 540 HH22 ARG 540 105.742 10.642 -6.342 838 H GLN 541 H GLN 541 102.724 5.202 -12.726 839 HA GLN 541 HA GLN 541 103.388 7.449 -14.288 840 HB2 GLN 541 HB2 GLN 541 102.767 4.594 -15.054 841 HB3 GLN 541 HB3 GLN 541 103.319 5.803 -16.205 842 HG2 GLN 541 HG2 GLN 541 105.437 5.883 -15.318 843 HG3 GLN 541 HG3 GLN 541 104.912 5.304 -13.737 844 HE21 GLN 541 HE21 GLN 541 105.498 3.318 -13.276 845 HE22 GLN 541 HE22 GLN 541 105.794 2.048 -14.410 846 H ALA 542 H ALA 542 100.469 5.479 -14.064 847 HA ALA 542 HA ALA 542 99.074 6.626 -16.217 848 HB1 ALA 542 HB1 ALA 542 98.087 4.680 -15.517 849 HB2 ALA 542 HB2 ALA 542 97.025 5.869 -14.763 850 HB3 ALA 542 HB3 ALA 542 98.273 5.069 -13.807 851 H LYS 543 H LYS 543 99.400 7.592 -12.846 852 HA LYS 543 HA LYS 543 97.395 9.379 -12.476 853 HB2 LYS 543 HB2 LYS 543 98.640 10.303 -10.784 854 HB3 LYS 543 HB3 LYS 543 99.533 8.809 -11.035 855 HG2 LYS 543 HG2 LYS 543 100.951 10.242 -12.675 856 HG3 LYS 543 HG3 LYS 543 100.270 11.604 -11.781 857 HD2 LYS 543 HD2 LYS 543 101.305 10.982 -9.799 858 HD3 LYS 543 HD3 LYS 543 101.511 9.307 -10.317 859 HE2 LYS 543 HE2 LYS 543 103.403 9.760 -11.497 860 HE3 LYS 543 HE3 LYS 543 102.886 11.396 -11.903 861 HZ1 LYS 543 HZ1 LYS 543 103.387 12.077 -9.640 862 HZ2 LYS 543 HZ2 LYS 543 104.756 11.410 -10.376 863 HZ3 LYS 543 HZ3 LYS 543 103.878 10.506 -9.249 864 H LEU 544 H LEU 544 100.167 9.767 -14.575 865 HA LEU 544 HA LEU 544 100.145 12.479 -15.068 866 HB2 LEU 544 HB2 LEU 544 101.324 10.212 -16.217 867 HB3 LEU 544 HB3 LEU 544 100.481 11.008 -17.533 868 HG LEU 544 HG LEU 544 101.886 13.015 -16.101 869 HD11 LEU 544 HD11 LEU 544 103.285 11.255 -15.179 870 HD12 LEU 544 HD12 LEU 544 104.189 12.225 -16.341 871 HD13 LEU 544 HD13 LEU 544 103.592 10.631 -16.800 872 HD21 LEU 544 HD21 LEU 544 102.039 13.658 -18.218 873 HD22 LEU 544 HD22 LEU 544 101.493 12.073 -18.762 874 HD23 LEU 544 HD23 LEU 544 103.212 12.374 -18.512 875 H ASN 545 H ASN 545 97.890 10.043 -16.103 876 HA ASN 545 HA ASN 545 96.441 12.059 -17.685 877 HB2 ASN 545 HB2 ASN 545 97.226 9.557 -18.470 878 HB3 ASN 545 HB3 ASN 545 95.579 9.253 -17.927 879 HD21 ASN 545 HD21 ASN 545 97.052 12.050 -19.522 880 HD22 ASN 545 HD22 ASN 545 95.996 12.045 -20.889 881 H GLN 546 H GLN 546 94.200 12.295 -17.395 882 HA GLN 546 HA GLN 546 92.255 12.420 -16.220 883 HB2 GLN 546 HB2 GLN 546 92.912 9.736 -16.223 884 HB3 GLN 546 HB3 GLN 546 92.657 10.079 -14.517 885 HG2 GLN 546 HG2 GLN 546 90.530 9.578 -15.048 886 HG3 GLN 546 HG3 GLN 546 90.492 11.279 -15.513 887 HE21 GLN 546 HE21 GLN 546 89.247 11.410 -17.243 888 HE22 GLN 546 HE22 GLN 546 89.372 10.427 -18.656 889 HA PRO 547 HA PRO 547 94.914 14.040 -12.669 890 HB2 PRO 547 HB2 PRO 547 93.936 16.606 -12.990 891 HB3 PRO 547 HB3 PRO 547 95.449 16.009 -13.679 892 HG2 PRO 547 HG2 PRO 547 92.765 16.303 -14.959 893 HG3 PRO 547 HG3 PRO 547 94.373 16.626 -15.635 894 HD2 PRO 547 HD2 PRO 547 93.011 14.398 -16.253 895 HD3 PRO 547 HD3 PRO 547 94.778 14.385 -16.070 896 H ARG 548 H ARG 548 93.883 13.311 -10.912 897 HA ARG 548 HA ARG 548 91.152 13.295 -10.427 898 HB2 ARG 548 HB2 ARG 548 92.821 11.990 -9.146 899 HB3 ARG 548 HB3 ARG 548 93.363 13.473 -8.372 900 HG2 ARG 548 HG2 ARG 548 91.483 13.646 -7.071 901 HG3 ARG 548 HG3 ARG 548 90.487 12.723 -8.197 902 HD2 ARG 548 HD2 ARG 548 90.895 10.837 -7.095 903 HD3 ARG 548 HD3 ARG 548 92.636 11.089 -7.228 904 HE ARG 548 HE ARG 548 92.650 11.773 -5.051 905 HH11 ARG 548 HH11 ARG 548 89.400 11.998 -6.276 906 HH12 ARG 548 HH12 ARG 548 88.708 12.402 -4.739 907 HH21 ARG 548 HH21 ARG 548 91.752 12.303 -3.021 908 HH22 ARG 548 HH22 ARG 548 90.047 12.576 -2.889 909 H GLU 549 H GLU 549 89.990 15.119 -10.684 910 HA GLU 549 HA GLU 549 90.711 17.412 -8.982 911 HB2 GLU 549 HB2 GLU 549 90.179 17.290 -11.850 912 HB3 GLU 549 HB3 GLU 549 89.181 18.479 -11.023 913 HG2 GLU 549 HG2 GLU 549 92.183 18.326 -10.878 914 HG3 GLU 549 HG3 GLU 549 91.262 19.432 -11.897 915 H LYS 550 H LYS 550 89.280 17.631 -7.404 916 HA LYS 550 HA LYS 550 87.354 17.260 -6.191 917 HB2 LYS 550 HB2 LYS 550 87.034 19.246 -8.227 918 HB3 LYS 550 HB3 LYS 550 85.496 18.428 -7.991 919 HG2 LYS 550 HG2 LYS 550 85.892 18.834 -5.489 920 HG3 LYS 550 HG3 LYS 550 87.114 19.993 -6.017 921 HD2 LYS 550 HD2 LYS 550 85.450 21.229 -7.265 922 HD3 LYS 550 HD3 LYS 550 84.220 20.025 -6.873 923 HE2 LYS 550 HE2 LYS 550 84.597 22.312 -5.485 924 HE3 LYS 550 HE3 LYS 550 83.899 20.845 -4.800 925 HZ1 LYS 550 HZ1 LYS 550 86.749 21.667 -4.645 926 HZ2 LYS 550 HZ2 LYS 550 86.126 20.215 -4.042 927 HZ3 LYS 550 HZ3 LYS 550 85.629 21.686 -3.374 928 H LYS 551 H LYS 551 87.444 14.922 -6.595 929 HA LYS 551 HA LYS 551 85.652 13.860 -8.607 930 HB2 LYS 551 HB2 LYS 551 87.715 12.795 -6.799 931 HB3 LYS 551 HB3 LYS 551 86.347 11.723 -7.055 932 HG2 LYS 551 HG2 LYS 551 87.358 12.897 -9.521 933 HG3 LYS 551 HG3 LYS 551 88.552 11.922 -8.662 934 HD2 LYS 551 HD2 LYS 551 85.817 11.074 -9.600 935 HD3 LYS 551 HD3 LYS 551 87.380 10.485 -10.171 936 HE2 LYS 551 HE2 LYS 551 87.570 9.967 -7.518 937 HE3 LYS 551 HE3 LYS 551 85.839 9.756 -7.775 938 HZ1 LYS 551 HZ1 LYS 551 86.220 8.078 -9.353 939 HZ2 LYS 551 HZ2 LYS 551 87.275 7.726 -8.079 940 HZ3 LYS 551 HZ3 LYS 551 87.866 8.446 -9.491 941 H ARG 552 H ARG 552 83.595 14.507 -8.023 942 HA ARG 552 HA ARG 552 82.448 14.535 -5.517 943 HB2 ARG 552 HB2 ARG 552 80.268 14.013 -6.817 944 HB3 ARG 552 HB3 ARG 552 81.142 15.493 -7.186 945 HG2 ARG 552 HG2 ARG 552 81.087 14.880 -9.313 946 HG3 ARG 552 HG3 ARG 552 82.229 13.599 -8.902 947 HD2 ARG 552 HD2 ARG 552 80.545 11.999 -8.698 948 HD3 ARG 552 HD3 ARG 552 79.281 13.217 -8.533 949 HE ARG 552 HE ARG 552 80.185 12.067 -10.940 950 HH11 ARG 552 HH11 ARG 552 79.227 15.129 -9.587 951 HH12 ARG 552 HH12 ARG 552 78.701 15.783 -11.104 952 HH21 ARG 552 HH21 ARG 552 79.499 12.917 -12.943 953 HH22 ARG 552 HH22 ARG 552 78.856 14.524 -13.011 954 H GLY 553 H GLY 553 81.802 13.045 -4.087 955 HA2 GLY 553 HA2 GLY 553 81.435 10.277 -5.022 956 HA3 GLY 553 HA3 GLY 553 82.507 10.603 -3.670 957 H THR 554 H THR 554 80.670 8.886 -3.057 958 HA THR 554 HA THR 554 78.176 10.001 -2.219 959 HB THR 554 HB THR 554 78.467 7.706 -0.728 960 HG1 THR 554 HG1 THR 554 79.658 7.157 -3.248 961 HG21 THR 554 HG21 THR 554 77.552 6.973 -3.319 962 HG22 THR 554 HG22 THR 554 77.000 8.612 -2.975 963 HG23 THR 554 HG23 THR 554 76.606 7.298 -1.867 964 H GLU 555 H GLU 555 79.721 11.785 -1.154 965 HA GLU 555 HA GLU 555 79.859 11.094 1.705 966 HB2 GLU 555 HB2 GLU 555 82.003 11.864 0.052 967 HB3 GLU 555 HB3 GLU 555 81.631 13.269 1.042 968 HG2 GLU 555 HG2 GLU 555 83.126 12.211 2.390 969 HG3 GLU 555 HG3 GLU 555 81.624 11.504 2.982 970 H LYS 556 H LYS 556 77.882 11.961 2.222 971 HA LYS 556 HA LYS 556 77.441 14.797 1.602 972 HB2 LYS 556 HB2 LYS 556 75.613 12.521 2.282 973 HB3 LYS 556 HB3 LYS 556 75.087 14.176 2.547 974 HG2 LYS 556 HG2 LYS 556 74.865 14.603 0.341 975 HG3 LYS 556 HG3 LYS 556 76.232 13.579 -0.106 976 HD2 LYS 556 HD2 LYS 556 73.903 12.160 1.001 977 HD3 LYS 556 HD3 LYS 556 73.634 12.947 -0.555 978 HE2 LYS 556 HE2 LYS 556 75.102 11.589 -1.652 979 HE3 LYS 556 HE3 LYS 556 76.117 11.356 -0.229 980 HZ1 LYS 556 HZ1 LYS 556 74.372 9.917 0.692 981 HZ2 LYS 556 HZ2 LYS 556 74.987 9.320 -0.767 982 HZ3 LYS 556 HZ3 LYS 556 73.481 10.088 -0.737 983 H LEU 557 H LEU 557 78.491 15.936 3.153 984 HA LEU 557 HA LEU 557 78.933 15.262 5.788 985 HB2 LEU 557 HB2 LEU 557 79.427 17.456 4.201 986 HB3 LEU 557 HB3 LEU 557 78.342 18.103 5.418 987 HG LEU 557 HG LEU 557 79.850 17.392 7.192 988 HD11 LEU 557 HD11 LEU 557 81.428 16.220 4.919 989 HD12 LEU 557 HD12 LEU 557 80.818 15.412 6.362 990 HD13 LEU 557 HD13 LEU 557 82.142 16.568 6.494 991 HD21 LEU 557 HD21 LEU 557 80.754 19.398 6.907 992 HD22 LEU 557 HD22 LEU 557 80.461 19.328 5.169 993 HD23 LEU 557 HD23 LEU 557 81.953 18.668 5.839 994 H ILE 558 H ILE 558 77.773 15.247 7.626 995 HA ILE 558 HA ILE 558 75.026 16.308 7.518 996 HB ILE 558 HB ILE 558 75.946 13.813 8.949 997 HG12 ILE 558 HG12 ILE 558 75.631 13.846 6.362 998 HG13 ILE 558 HG13 ILE 558 74.898 12.548 7.299 999 HG21 ILE 558 HG21 ILE 558 73.312 15.252 8.865 1000 HG22 ILE 558 HG22 ILE 558 74.250 14.751 10.273 1001 HG23 ILE 558 HG23 ILE 558 73.434 13.542 9.280 1002 HD11 ILE 558 HD11 ILE 558 73.275 13.242 5.751 1003 HD12 ILE 558 HD12 ILE 558 73.565 14.949 6.091 1004 HD13 ILE 558 HD13 ILE 558 72.784 13.928 7.299 1005 H THR 559 H THR 559 75.505 18.228 8.565 1006 HA THR 559 HA THR 559 76.616 18.018 11.281 1007 HB THR 559 HB THR 559 77.167 20.345 11.173 1008 HG1 THR 559 HG1 THR 559 75.583 21.358 10.063 1009 HG21 THR 559 HG21 THR 559 77.984 18.580 8.958 1010 HG22 THR 559 HG22 THR 559 78.963 19.438 10.149 1011 HG23 THR 559 HG23 THR 559 78.335 20.295 8.742 1012 H LYS 560 H LYS 560 73.828 18.997 9.425 1013 HA LYS 560 HA LYS 560 71.728 19.641 10.014 1014 HB2 LYS 560 HB2 LYS 560 72.568 18.279 12.574 1015 HB3 LYS 560 HB3 LYS 560 70.940 18.883 12.295 1016 HG2 LYS 560 HG2 LYS 560 71.024 17.414 10.164 1017 HG3 LYS 560 HG3 LYS 560 72.358 16.604 10.987 1018 HD2 LYS 560 HD2 LYS 560 70.272 16.905 12.870 1019 HD3 LYS 560 HD3 LYS 560 69.549 16.288 11.382 1020 HE2 LYS 560 HE2 LYS 560 70.404 14.267 11.737 1021 HE3 LYS 560 HE3 LYS 560 72.025 14.936 11.923 1022 HZ1 LYS 560 HZ1 LYS 560 71.890 14.398 14.054 1023 HZ2 LYS 560 HZ2 LYS 560 70.265 13.949 13.912 1024 HZ3 LYS 560 HZ3 LYS 560 70.672 15.556 14.247 1025 H ALA 561 H ALA 561 72.824 21.823 9.842 1026 HA ALA 561 HA ALA 561 73.510 23.287 12.156 1027 HB1 ALA 561 HB1 ALA 561 74.215 24.720 10.620 1028 HB2 ALA 561 HB2 ALA 561 72.547 25.061 10.157 1029 HB3 ALA 561 HB3 ALA 561 73.435 23.759 9.364 Start of MODEL 17 1 H1 MET 437 HT1 MET 437 123.237 21.917 7.862 2 H2 MET 437 HT2 MET 437 124.165 20.799 6.949 3 H3 MET 437 HT3 MET 437 124.947 22.025 7.861 4 HA MET 437 HA MET 437 124.413 21.061 9.859 5 HB2 MET 437 HB2 MET 437 122.547 19.323 8.231 6 HB3 MET 437 HB3 MET 437 122.883 19.077 9.939 7 HG2 MET 437 HG2 MET 437 122.153 21.648 10.005 8 HG3 MET 437 HG3 MET 437 121.226 21.117 8.604 9 HE1 MET 437 HE1 MET 437 118.458 19.137 9.759 10 HE2 MET 437 HE2 MET 437 119.857 18.131 9.381 11 HE3 MET 437 HE3 MET 437 119.558 19.606 8.463 12 H HIS 438 H HIS 438 125.242 19.016 10.762 13 HA HIS 438 HA HIS 438 127.557 18.155 9.404 14 HB2 HIS 438 HB2 HIS 438 126.185 17.490 11.938 15 HB3 HIS 438 HB3 HIS 438 127.222 16.227 11.284 16 HD1 HIS 438 HD1 HIS 438 127.347 19.032 13.463 17 HD2 HIS 438 HD2 HIS 438 129.940 17.405 10.653 18 HE1 HIS 438 HE1 HIS 438 129.620 19.942 14.040 19 HE2 HIS 438 HE2 HIS 438 131.184 18.886 12.371 20 H HIS 439 H HIS 439 128.035 15.745 9.098 21 HA HIS 439 HA HIS 439 127.526 13.675 8.225 22 HB2 HIS 439 HB2 HIS 439 125.212 14.158 9.413 23 HB3 HIS 439 HB3 HIS 439 124.665 14.394 7.757 24 HD1 HIS 439 HD1 HIS 439 126.040 12.161 6.284 25 HD2 HIS 439 HD2 HIS 439 124.360 11.671 10.052 26 HE1 HIS 439 HE1 HIS 439 125.582 9.698 6.500 27 HE2 HIS 439 HE2 HIS 439 124.484 9.439 8.753 28 H HIS 440 H HIS 440 128.837 14.830 6.550 29 HA HIS 440 HA HIS 440 127.283 15.518 4.159 30 HB2 HIS 440 HB2 HIS 440 129.119 17.050 5.093 31 HB3 HIS 440 HB3 HIS 440 130.260 15.857 4.484 32 HD1 HIS 440 HD1 HIS 440 131.215 16.687 2.367 33 HD2 HIS 440 HD2 HIS 440 127.175 17.605 2.693 34 HE1 HIS 440 HE1 HIS 440 130.610 17.835 0.213 35 HE2 HIS 440 HE2 HIS 440 128.147 18.328 0.409 36 H HIS 441 H HIS 441 127.697 14.543 2.157 37 HA HIS 441 HA HIS 441 128.398 12.932 0.685 38 HB2 HIS 441 HB2 HIS 441 130.496 12.965 2.598 39 HB3 HIS 441 HB3 HIS 441 130.095 11.278 2.295 40 HD1 HIS 441 HD1 HIS 441 129.338 11.863 -0.788 41 HD2 HIS 441 HD2 HIS 441 132.885 12.814 1.159 42 HE1 HIS 441 HE1 HIS 441 131.072 12.049 -2.600 43 HE2 HIS 441 HE2 HIS 441 133.227 12.538 -1.390 44 H HIS 442 H HIS 442 128.106 10.586 0.337 45 HA HIS 442 HA HIS 442 126.450 9.336 2.422 46 HB2 HIS 442 HB2 HIS 442 125.496 10.319 -0.016 47 HB3 HIS 442 HB3 HIS 442 125.610 8.577 -0.246 48 HD1 HIS 442 HD1 HIS 442 122.876 9.065 -0.364 49 HD2 HIS 442 HD2 HIS 442 124.725 9.177 3.355 50 HE1 HIS 442 HE1 HIS 442 121.026 8.787 1.316 51 HE2 HIS 442 HE2 HIS 442 122.160 8.925 3.561 52 H HIS 443 H HIS 443 126.686 7.159 2.695 53 HA HIS 443 HA HIS 443 129.078 5.974 1.698 54 HB2 HIS 443 HB2 HIS 443 127.056 5.355 3.699 55 HB3 HIS 443 HB3 HIS 443 127.580 3.920 2.823 56 HD1 HIS 443 HD1 HIS 443 128.231 4.867 5.881 57 HD2 HIS 443 HD2 HIS 443 130.791 4.808 2.609 58 HE1 HIS 443 HE1 HIS 443 130.552 4.755 6.845 59 HE2 HIS 443 HE2 HIS 443 132.082 4.664 4.846 60 H SER 444 H SER 444 128.054 6.494 -0.587 61 HA SER 444 HA SER 444 126.119 4.971 -1.787 62 HB2 SER 444 HB2 SER 444 128.366 5.164 -3.578 63 HB3 SER 444 HB3 SER 444 126.845 6.056 -3.607 64 HG SER 444 HG SER 444 129.291 6.739 -2.409 65 H ASN 445 H ASN 445 125.828 2.844 -1.709 66 HA ASN 445 HA ASN 445 127.836 0.970 -1.103 67 HB2 ASN 445 HB2 ASN 445 125.004 0.836 -2.000 68 HB3 ASN 445 HB3 ASN 445 125.980 -0.615 -2.203 69 HD21 ASN 445 HD21 ASN 445 124.510 -1.565 -0.673 70 HD22 ASN 445 HD22 ASN 445 124.755 -1.317 1.019 71 H ALA 446 H ALA 446 125.941 0.527 -4.031 72 HA ALA 446 HA ALA 446 127.824 1.065 -5.974 73 HB1 ALA 446 HB1 ALA 446 128.552 -1.244 -4.461 74 HB2 ALA 446 HB2 ALA 446 129.388 -0.499 -5.823 75 HB3 ALA 446 HB3 ALA 446 128.158 -1.729 -6.110 76 H THR 447 H THR 447 125.440 -1.332 -4.930 77 HA THR 447 HA THR 447 124.537 -2.255 -7.367 78 HB THR 447 HB THR 447 122.244 -2.399 -6.189 79 HG1 THR 447 HG1 THR 447 122.110 -1.408 -4.333 80 HG21 THR 447 HG21 THR 447 123.203 -4.434 -6.078 81 HG22 THR 447 HG22 THR 447 123.486 -4.003 -4.391 82 HG23 THR 447 HG23 THR 447 124.766 -3.784 -5.583 83 H GLY 448 H GLY 448 122.324 -1.725 -8.337 84 HA2 GLY 448 HA2 GLY 448 121.656 1.116 -8.247 85 HA3 GLY 448 HA3 GLY 448 122.244 0.494 -9.782 86 HA PRO 449 HA PRO 449 118.275 -0.891 -11.038 87 HB2 PRO 449 HB2 PRO 449 118.678 -3.575 -11.595 88 HB3 PRO 449 HB3 PRO 449 119.052 -2.245 -12.694 89 HG2 PRO 449 HG2 PRO 449 120.864 -3.772 -10.878 90 HG3 PRO 449 HG3 PRO 449 121.165 -3.168 -12.517 91 HD2 PRO 449 HD2 PRO 449 122.155 -1.924 -10.352 92 HD3 PRO 449 HD3 PRO 449 121.606 -1.017 -11.777 93 H GLN 450 H GLN 450 117.357 -0.620 -8.921 94 HA GLN 450 HA GLN 450 116.086 -2.962 -7.952 95 HB2 GLN 450 HB2 GLN 450 118.581 -2.709 -6.902 96 HB3 GLN 450 HB3 GLN 450 117.638 -1.804 -5.726 97 HG2 GLN 450 HG2 GLN 450 116.609 -4.458 -6.542 98 HG3 GLN 450 HG3 GLN 450 118.051 -4.418 -5.528 99 HE21 GLN 450 HE21 GLN 450 114.690 -4.245 -5.612 100 HE22 GLN 450 HE22 GLN 450 114.419 -3.791 -3.967 101 H PHE 451 H PHE 451 114.124 -2.161 -7.688 102 HA PHE 451 HA PHE 451 113.727 0.586 -6.839 103 HB2 PHE 451 HB2 PHE 451 111.372 0.186 -7.344 104 HB3 PHE 451 HB3 PHE 451 112.385 -0.347 -8.683 105 HD1 PHE 451 HD1 PHE 451 109.940 -1.308 -6.229 106 HD2 PHE 451 HD2 PHE 451 112.844 -2.792 -8.963 107 HE1 PHE 451 HE1 PHE 451 108.887 -3.528 -6.134 108 HE2 PHE 451 HE2 PHE 451 111.797 -5.017 -8.873 109 HZ PHE 451 HZ PHE 451 109.815 -5.387 -7.457 110 H VAL 452 H VAL 452 113.821 0.996 -4.718 111 HA VAL 452 HA VAL 452 113.686 -0.706 -2.598 112 HB VAL 452 HB VAL 452 112.756 1.253 -1.263 113 HG11 VAL 452 HG11 VAL 452 115.261 0.726 -2.168 114 HG12 VAL 452 HG12 VAL 452 114.859 2.012 -1.030 115 HG13 VAL 452 HG13 VAL 452 115.026 2.375 -2.748 116 HG21 VAL 452 HG21 VAL 452 112.263 2.193 -3.956 117 HG22 VAL 452 HG22 VAL 452 113.233 3.341 -3.031 118 HG23 VAL 452 HG23 VAL 452 111.665 2.816 -2.418 119 H SER 453 H SER 453 112.189 -2.319 -2.568 120 HA SER 453 HA SER 453 109.453 -1.935 -3.240 121 HB2 SER 453 HB2 SER 453 109.333 -4.184 -3.192 122 HB3 SER 453 HB3 SER 453 111.088 -4.106 -3.042 123 HG SER 453 HG SER 453 109.157 -4.703 -1.130 124 H GLY 454 H GLY 454 110.681 -0.422 -0.803 125 HA2 GLY 454 HA2 GLY 454 110.121 -0.025 1.428 126 HA3 GLY 454 HA3 GLY 454 108.590 0.269 0.625 127 H VAL 455 H VAL 455 110.024 -2.930 0.926 128 HA VAL 455 HA VAL 455 108.973 -4.850 1.674 129 HB VAL 455 HB VAL 455 108.629 -3.663 4.353 130 HG11 VAL 455 HG11 VAL 455 110.563 -5.825 3.769 131 HG12 VAL 455 HG12 VAL 455 108.864 -6.163 3.436 132 HG13 VAL 455 HG13 VAL 455 109.367 -5.687 5.058 133 HG21 VAL 455 HG21 VAL 455 110.428 -2.310 4.103 134 HG22 VAL 455 HG22 VAL 455 111.079 -3.239 2.753 135 HG23 VAL 455 HG23 VAL 455 111.306 -3.809 4.406 136 H ILE 456 H ILE 456 106.982 -5.043 0.741 137 HA ILE 456 HA ILE 456 104.703 -3.532 1.557 138 HB ILE 456 HB ILE 456 104.682 -6.136 0.037 139 HG12 ILE 456 HG12 ILE 456 106.237 -4.649 -1.077 140 HG13 ILE 456 HG13 ILE 456 104.744 -4.714 -2.008 141 HG21 ILE 456 HG21 ILE 456 102.745 -4.292 -0.870 142 HG22 ILE 456 HG22 ILE 456 102.654 -4.325 0.891 143 HG23 ILE 456 HG23 ILE 456 102.489 -5.821 -0.030 144 HD11 ILE 456 HD11 ILE 456 104.244 -2.584 -0.440 145 HD12 ILE 456 HD12 ILE 456 104.985 -2.487 -2.037 146 HD13 ILE 456 HD13 ILE 456 105.997 -2.470 -0.593 147 H VAL 457 H VAL 457 103.337 -3.886 3.186 148 HA VAL 457 HA VAL 457 103.434 -6.500 4.539 149 HB VAL 457 HB VAL 457 102.802 -3.792 5.718 150 HG11 VAL 457 HG11 VAL 457 102.934 -6.395 7.215 151 HG12 VAL 457 HG12 VAL 457 101.424 -5.762 6.561 152 HG13 VAL 457 HG13 VAL 457 102.318 -4.838 7.768 153 HG21 VAL 457 HG21 VAL 457 105.159 -4.068 5.452 154 HG22 VAL 457 HG22 VAL 457 105.095 -5.711 6.088 155 HG23 VAL 457 HG23 VAL 457 104.782 -4.342 7.154 156 H LYS 458 H LYS 458 101.781 -7.552 3.517 157 HA LYS 458 HA LYS 458 99.282 -6.293 2.926 158 HB2 LYS 458 HB2 LYS 458 99.972 -8.083 1.507 159 HB3 LYS 458 HB3 LYS 458 100.183 -9.171 2.874 160 HG2 LYS 458 HG2 LYS 458 97.546 -8.443 3.085 161 HG3 LYS 458 HG3 LYS 458 97.794 -8.532 1.339 162 HD2 LYS 458 HD2 LYS 458 98.908 -10.791 1.803 163 HD3 LYS 458 HD3 LYS 458 98.166 -10.684 3.401 164 HE2 LYS 458 HE2 LYS 458 96.145 -10.052 1.560 165 HE3 LYS 458 HE3 LYS 458 96.992 -11.446 0.891 166 HZ1 LYS 458 HZ1 LYS 458 96.670 -11.980 3.575 167 HZ2 LYS 458 HZ2 LYS 458 95.827 -12.686 2.289 168 HZ3 LYS 458 HZ3 LYS 458 95.189 -11.331 3.076 169 H ILE 459 H ILE 459 97.755 -5.837 4.345 170 HA ILE 459 HA ILE 459 97.478 -7.553 6.724 171 HB ILE 459 HB ILE 459 96.531 -4.699 6.488 172 HG12 ILE 459 HG12 ILE 459 99.092 -5.869 7.548 173 HG13 ILE 459 HG13 ILE 459 98.874 -4.500 6.463 174 HG21 ILE 459 HG21 ILE 459 95.742 -4.882 8.612 175 HG22 ILE 459 HG22 ILE 459 96.980 -6.040 9.091 176 HG23 ILE 459 HG23 ILE 459 95.591 -6.577 8.148 177 HD11 ILE 459 HD11 ILE 459 99.595 -3.970 8.816 178 HD12 ILE 459 HD12 ILE 459 97.979 -4.455 9.327 179 HD13 ILE 459 HD13 ILE 459 98.183 -3.097 8.220 180 H ILE 460 H ILE 460 95.696 -8.714 6.859 181 HA ILE 460 HA ILE 460 93.286 -7.764 5.476 182 HB ILE 460 HB ILE 460 94.422 -9.555 4.131 183 HG12 ILE 460 HG12 ILE 460 91.866 -9.024 4.301 184 HG13 ILE 460 HG13 ILE 460 92.405 -10.461 3.435 185 HG21 ILE 460 HG21 ILE 460 93.869 -11.107 6.622 186 HG22 ILE 460 HG22 ILE 460 95.343 -11.036 5.653 187 HG23 ILE 460 HG23 ILE 460 93.932 -11.912 5.054 188 HD11 ILE 460 HD11 ILE 460 90.434 -10.735 4.987 189 HD12 ILE 460 HD12 ILE 460 91.575 -10.534 6.316 190 HD13 ILE 460 HD13 ILE 460 91.759 -11.881 5.192 191 H SER 461 H SER 461 91.442 -7.938 6.612 192 HA SER 461 HA SER 461 91.573 -9.412 9.159 193 HB2 SER 461 HB2 SER 461 90.208 -7.707 10.193 194 HB3 SER 461 HB3 SER 461 91.596 -6.928 9.433 195 HG SER 461 HG SER 461 89.004 -6.492 8.995 196 H THR 462 H THR 462 88.940 -9.068 9.925 197 HA THR 462 HA THR 462 87.486 -10.546 7.825 198 HB THR 462 HB THR 462 86.211 -11.546 9.848 199 HG1 THR 462 HG1 THR 462 87.078 -10.435 11.560 200 HG21 THR 462 HG21 THR 462 89.027 -12.311 9.101 201 HG22 THR 462 HG22 THR 462 87.520 -12.957 8.453 202 HG23 THR 462 HG23 THR 462 87.987 -13.312 10.116 203 H GLU 463 H GLU 463 87.556 -7.760 9.673 204 HA GLU 463 HA GLU 463 85.475 -6.425 8.680 205 HB2 GLU 463 HB2 GLU 463 84.464 -8.544 10.445 206 HB3 GLU 463 HB3 GLU 463 83.827 -6.947 10.814 207 HG2 GLU 463 HG2 GLU 463 83.805 -7.564 7.968 208 HG3 GLU 463 HG3 GLU 463 82.844 -8.680 8.937 209 HA PRO 464 HA PRO 464 86.215 -5.173 13.493 210 HB2 PRO 464 HB2 PRO 464 88.923 -6.450 13.362 211 HB3 PRO 464 HB3 PRO 464 87.880 -6.171 14.763 212 HG2 PRO 464 HG2 PRO 464 88.021 -8.585 13.669 213 HG3 PRO 464 HG3 PRO 464 86.467 -7.939 14.229 214 HD2 PRO 464 HD2 PRO 464 87.494 -8.269 11.457 215 HD3 PRO 464 HD3 PRO 464 85.828 -8.355 12.062 216 H LEU 465 H LEU 465 88.411 -5.345 10.759 217 HA LEU 465 HA LEU 465 90.254 -3.425 11.167 218 HB2 LEU 465 HB2 LEU 465 89.107 -4.622 8.915 219 HB3 LEU 465 HB3 LEU 465 88.971 -2.897 8.627 220 HG LEU 465 HG LEU 465 91.618 -3.805 9.563 221 HD11 LEU 465 HD11 LEU 465 91.845 -4.275 6.877 222 HD12 LEU 465 HD12 LEU 465 90.300 -5.031 7.264 223 HD13 LEU 465 HD13 LEU 465 91.760 -5.515 8.128 224 HD21 LEU 465 HD21 LEU 465 90.606 -1.965 7.401 225 HD22 LEU 465 HD22 LEU 465 92.313 -2.260 7.737 226 HD23 LEU 465 HD23 LEU 465 91.289 -1.511 8.963 227 HA PRO 466 HA PRO 466 87.549 -0.039 12.474 228 HB2 PRO 466 HB2 PRO 466 89.624 1.522 13.336 229 HB3 PRO 466 HB3 PRO 466 88.870 0.258 14.312 230 HG2 PRO 466 HG2 PRO 466 91.397 0.163 12.710 231 HG3 PRO 466 HG3 PRO 466 91.067 -0.495 14.323 232 HD2 PRO 466 HD2 PRO 466 91.092 -2.052 12.127 233 HD3 PRO 466 HD3 PRO 466 89.984 -2.356 13.481 234 H GLY 467 H GLY 467 90.634 0.450 10.745 235 HA2 GLY 467 HA2 GLY 467 89.791 1.549 8.441 236 HA3 GLY 467 HA3 GLY 467 89.652 2.904 9.549 237 H ARG 468 H ARG 468 91.258 3.541 7.669 238 HA ARG 468 HA ARG 468 93.906 2.603 7.738 239 HB2 ARG 468 HB2 ARG 468 94.454 4.785 6.631 240 HB3 ARG 468 HB3 ARG 468 93.168 3.876 5.849 241 HG2 ARG 468 HG2 ARG 468 91.558 5.327 7.190 242 HG3 ARG 468 HG3 ARG 468 92.954 6.353 7.522 243 HD2 ARG 468 HD2 ARG 468 93.220 6.925 5.275 244 HD3 ARG 468 HD3 ARG 468 92.253 5.558 4.719 245 HE ARG 468 HE ARG 468 90.505 7.066 6.163 246 HH11 ARG 468 HH11 ARG 468 92.641 7.692 3.484 247 HH12 ARG 468 HH12 ARG 468 91.637 8.931 2.806 248 HH21 ARG 468 HH21 ARG 468 89.177 8.695 5.279 249 HH22 ARG 468 HH22 ARG 468 89.668 9.501 3.827 250 H LYS 469 H LYS 469 92.295 5.233 9.462 251 HA LYS 469 HA LYS 469 94.568 6.322 10.701 252 HB2 LYS 469 HB2 LYS 469 93.025 7.413 12.217 253 HB3 LYS 469 HB3 LYS 469 92.378 7.457 10.581 254 HG2 LYS 469 HG2 LYS 469 91.089 5.333 11.284 255 HG3 LYS 469 HG3 LYS 469 91.463 5.851 12.929 256 HD2 LYS 469 HD2 LYS 469 90.396 7.937 11.143 257 HD3 LYS 469 HD3 LYS 469 89.274 6.641 11.559 258 HE2 LYS 469 HE2 LYS 469 89.104 7.311 13.699 259 HE3 LYS 469 HE3 LYS 469 90.820 7.697 13.818 260 HZ1 LYS 469 HZ1 LYS 469 90.060 9.653 12.241 261 HZ2 LYS 469 HZ2 LYS 469 89.960 9.776 13.924 262 HZ3 LYS 469 HZ3 LYS 469 88.581 9.394 13.022 263 H GLN 470 H GLN 470 92.318 3.800 11.765 264 HA GLN 470 HA GLN 470 93.638 3.447 14.284 265 HB2 GLN 470 HB2 GLN 470 91.424 2.046 12.839 266 HB3 GLN 470 HB3 GLN 470 92.182 1.268 14.223 267 HG2 GLN 470 HG2 GLN 470 91.456 4.051 14.705 268 HG3 GLN 470 HG3 GLN 470 90.081 3.013 14.330 269 HE21 GLN 470 HE21 GLN 470 91.843 4.230 16.773 270 HE22 GLN 470 HE22 GLN 470 91.577 3.019 17.977 271 H VAL 471 H VAL 471 93.610 1.692 11.195 272 HA VAL 471 HA VAL 471 95.246 -0.454 12.020 273 HB VAL 471 HB VAL 471 94.732 0.762 9.309 274 HG11 VAL 471 HG11 VAL 471 95.806 -1.795 8.942 275 HG12 VAL 471 HG12 VAL 471 96.892 -0.979 10.067 276 HG13 VAL 471 HG13 VAL 471 96.535 -0.252 8.501 277 HG21 VAL 471 HG21 VAL 471 92.825 -0.372 9.924 278 HG22 VAL 471 HG22 VAL 471 93.714 -1.587 10.842 279 HG23 VAL 471 HG23 VAL 471 93.720 -1.634 9.078 280 H ARG 472 H ARG 472 95.989 2.671 10.523 281 HA ARG 472 HA ARG 472 98.779 2.291 10.330 282 HB2 ARG 472 HB2 ARG 472 98.915 4.558 9.765 283 HB3 ARG 472 HB3 ARG 472 97.307 4.097 9.226 284 HG2 ARG 472 HG2 ARG 472 96.325 5.097 11.197 285 HG3 ARG 472 HG3 ARG 472 97.927 5.492 11.821 286 HD2 ARG 472 HD2 ARG 472 98.188 6.729 9.533 287 HD3 ARG 472 HD3 ARG 472 96.425 6.695 9.537 288 HE ARG 472 HE ARG 472 96.416 8.213 11.280 289 HH11 ARG 472 HH11 ARG 472 99.656 7.109 10.648 290 HH12 ARG 472 HH12 ARG 472 100.402 8.326 11.627 291 HH21 ARG 472 HH21 ARG 472 97.385 9.824 12.569 292 HH22 ARG 472 HH22 ARG 472 99.110 9.872 12.721 293 H ASP 473 H ASP 473 96.675 3.569 12.845 294 HA ASP 473 HA ASP 473 98.618 4.550 14.600 295 HB2 ASP 473 HB2 ASP 473 95.813 4.123 14.638 296 HB3 ASP 473 HB3 ASP 473 96.468 3.352 16.079 297 H THR 474 H THR 474 97.165 1.334 14.304 298 HA THR 474 HA THR 474 98.497 0.119 16.455 299 HB THR 474 HB THR 474 98.157 -2.018 14.976 300 HG1 THR 474 HG1 THR 474 97.277 -1.678 13.093 301 HG21 THR 474 HG21 THR 474 95.874 -0.339 16.004 302 HG22 THR 474 HG22 THR 474 96.775 -1.570 16.890 303 HG23 THR 474 HG23 THR 474 95.735 -2.036 15.543 304 H LEU 475 H LEU 475 99.163 -0.790 13.097 305 HA LEU 475 HA LEU 475 101.630 -1.852 13.401 306 HB2 LEU 475 HB2 LEU 475 102.110 -1.242 11.071 307 HB3 LEU 475 HB3 LEU 475 100.486 -1.872 11.275 308 HG LEU 475 HG LEU 475 99.935 0.740 11.480 309 HD11 LEU 475 HD11 LEU 475 102.033 0.842 9.371 310 HD12 LEU 475 HD12 LEU 475 102.506 1.061 11.056 311 HD13 LEU 475 HD13 LEU 475 101.323 2.146 10.324 312 HD21 LEU 475 HD21 LEU 475 99.999 0.377 8.733 313 HD22 LEU 475 HD22 LEU 475 98.674 -0.040 9.819 314 HD23 LEU 475 HD23 LEU 475 99.874 -1.257 9.384 315 H ALA 476 H ALA 476 100.926 1.612 13.065 316 HA ALA 476 HA ALA 476 103.653 2.411 13.031 317 HB1 ALA 476 HB1 ALA 476 101.376 4.154 13.924 318 HB2 ALA 476 HB2 ALA 476 101.666 3.769 12.228 319 HB3 ALA 476 HB3 ALA 476 102.890 4.632 13.157 320 H ALA 477 H ALA 477 101.406 1.641 15.555 321 HA ALA 477 HA ALA 477 102.793 2.968 17.662 322 HB1 ALA 477 HB1 ALA 477 100.417 1.391 17.412 323 HB2 ALA 477 HB2 ALA 477 100.890 2.500 18.700 324 HB3 ALA 477 HB3 ALA 477 101.381 0.807 18.770 325 H ILE 478 H ILE 478 103.085 -0.127 16.106 326 HA ILE 478 HA ILE 478 104.800 -1.229 18.154 327 HB ILE 478 HB ILE 478 103.957 -2.208 15.437 328 HG12 ILE 478 HG12 ILE 478 103.512 -4.046 17.564 329 HG13 ILE 478 HG13 ILE 478 102.975 -2.459 18.108 330 HG21 ILE 478 HG21 ILE 478 105.197 -4.355 16.536 331 HG22 ILE 478 HG22 ILE 478 106.259 -3.046 17.057 332 HG23 ILE 478 HG23 ILE 478 105.928 -3.285 15.341 333 HD11 ILE 478 HD11 ILE 478 101.089 -3.410 17.150 334 HD12 ILE 478 HD12 ILE 478 101.997 -4.080 15.794 335 HD13 ILE 478 HD13 ILE 478 101.709 -2.343 15.891 336 H SER 479 H SER 479 105.158 0.462 15.122 337 HA SER 479 HA SER 479 107.878 1.097 15.670 338 HB2 SER 479 HB2 SER 479 107.318 -0.870 13.439 339 HB3 SER 479 HB3 SER 479 108.834 0.014 13.622 340 HG SER 479 HG SER 479 108.340 -2.258 14.666 341 H GLU 480 H GLU 480 108.835 2.464 13.956 342 HA GLU 480 HA GLU 480 106.862 4.269 12.923 343 HB2 GLU 480 HB2 GLU 480 109.312 4.716 13.800 344 HB3 GLU 480 HB3 GLU 480 109.735 4.428 12.118 345 HG2 GLU 480 HG2 GLU 480 107.522 6.213 12.202 346 HG3 GLU 480 HG3 GLU 480 108.766 6.796 13.306 347 H VAL 481 H VAL 481 105.816 4.012 11.076 348 HA VAL 481 HA VAL 481 107.039 2.381 8.959 349 HB VAL 481 HB VAL 481 104.633 2.456 8.024 350 HG11 VAL 481 HG11 VAL 481 105.980 0.663 9.566 351 HG12 VAL 481 HG12 VAL 481 104.400 0.378 8.835 352 HG13 VAL 481 HG13 VAL 481 104.513 0.912 10.512 353 HG21 VAL 481 HG21 VAL 481 104.160 4.253 9.938 354 HG22 VAL 481 HG22 VAL 481 103.732 2.791 10.827 355 HG23 VAL 481 HG23 VAL 481 102.908 3.177 9.317 356 H LEU 482 H LEU 482 106.605 3.037 6.717 357 HA LEU 482 HA LEU 482 107.148 5.859 6.387 358 HB2 LEU 482 HB2 LEU 482 108.035 3.671 5.074 359 HB3 LEU 482 HB3 LEU 482 106.725 4.149 4.011 360 HG LEU 482 HG LEU 482 109.211 5.685 4.711 361 HD11 LEU 482 HD11 LEU 482 108.446 4.052 2.564 362 HD12 LEU 482 HD12 LEU 482 109.878 5.074 2.689 363 HD13 LEU 482 HD13 LEU 482 108.402 5.710 1.964 364 HD21 LEU 482 HD21 LEU 482 107.977 7.404 3.104 365 HD22 LEU 482 HD22 LEU 482 107.810 7.469 4.859 366 HD23 LEU 482 HD23 LEU 482 106.555 6.708 3.883 367 H TYR 483 H TYR 483 104.958 3.702 4.587 368 HA TYR 483 HA TYR 483 102.783 5.623 4.982 369 HB2 TYR 483 HB2 TYR 483 103.790 6.364 2.905 370 HB3 TYR 483 HB3 TYR 483 103.761 4.724 2.265 371 HD1 TYR 483 HD1 TYR 483 101.940 7.797 2.634 372 HD2 TYR 483 HD2 TYR 483 101.503 3.637 1.850 373 HE1 TYR 483 HE1 TYR 483 99.713 8.217 1.677 374 HE2 TYR 483 HE2 TYR 483 99.276 4.048 0.891 375 HH TYR 483 HH TYR 483 97.902 7.322 0.767 376 H VAL 484 H VAL 484 100.809 4.701 5.138 377 HA VAL 484 HA VAL 484 100.678 1.791 4.702 378 HB VAL 484 HB VAL 484 100.342 2.174 7.004 379 HG11 VAL 484 HG11 VAL 484 99.982 4.366 7.446 380 HG12 VAL 484 HG12 VAL 484 98.310 3.817 7.556 381 HG13 VAL 484 HG13 VAL 484 98.892 4.579 6.075 382 HG21 VAL 484 HG21 VAL 484 98.037 1.491 7.387 383 HG22 VAL 484 HG22 VAL 484 98.714 0.647 5.994 384 HG23 VAL 484 HG23 VAL 484 97.603 1.995 5.753 385 H ASP 485 H ASP 485 99.558 1.224 2.961 386 HA ASP 485 HA ASP 485 97.527 3.039 1.904 387 HB2 ASP 485 HB2 ASP 485 99.028 2.334 0.219 388 HB3 ASP 485 HB3 ASP 485 98.970 0.658 0.755 389 H LEU 486 H LEU 486 95.409 2.656 2.006 390 HA LEU 486 HA LEU 486 94.488 -0.040 2.733 391 HB2 LEU 486 HB2 LEU 486 94.525 1.735 4.631 392 HB3 LEU 486 HB3 LEU 486 93.145 2.423 3.799 393 HG LEU 486 HG LEU 486 93.347 -0.055 5.404 394 HD11 LEU 486 HD11 LEU 486 91.290 2.076 4.901 395 HD12 LEU 486 HD12 LEU 486 92.187 1.742 6.383 396 HD13 LEU 486 HD13 LEU 486 90.943 0.619 5.833 397 HD21 LEU 486 HD21 LEU 486 92.849 -0.930 3.158 398 HD22 LEU 486 HD22 LEU 486 91.462 0.155 3.059 399 HD23 LEU 486 HD23 LEU 486 91.495 -1.127 4.270 400 H LEU 487 H LEU 487 93.118 -0.791 1.224 401 HA LEU 487 HA LEU 487 92.183 0.789 -0.900 402 HB2 LEU 487 HB2 LEU 487 91.529 -1.947 0.112 403 HB3 LEU 487 HB3 LEU 487 90.542 -1.239 -1.153 404 HG LEU 487 HG LEU 487 93.471 -1.173 -1.587 405 HD11 LEU 487 HD11 LEU 487 92.515 -3.519 -0.637 406 HD12 LEU 487 HD12 LEU 487 93.858 -3.376 -1.772 407 HD13 LEU 487 HD13 LEU 487 92.233 -3.717 -2.366 408 HD21 LEU 487 HD21 LEU 487 90.971 -1.400 -3.176 409 HD22 LEU 487 HD22 LEU 487 92.455 -2.068 -3.854 410 HD23 LEU 487 HD23 LEU 487 92.376 -0.361 -3.416 411 H GLU 488 H GLU 488 91.089 2.585 -0.213 412 HA GLU 488 HA GLU 488 89.318 3.078 1.701 413 HB2 GLU 488 HB2 GLU 488 89.758 4.828 0.190 414 HB3 GLU 488 HB3 GLU 488 89.189 3.897 -1.190 415 HG2 GLU 488 HG2 GLU 488 87.186 4.396 0.901 416 HG3 GLU 488 HG3 GLU 488 87.763 5.824 0.044 417 H GLY 489 H GLY 489 87.477 2.291 2.462 418 HA2 GLY 489 HA2 GLY 489 85.421 1.263 2.551 419 HA3 GLY 489 HA3 GLY 489 85.345 1.394 0.802 420 H ASP 490 H ASP 490 88.174 -0.148 1.703 421 HA ASP 490 HA ASP 490 86.954 -2.768 1.153 422 HB2 ASP 490 HB2 ASP 490 88.849 -1.646 -0.319 423 HB3 ASP 490 HB3 ASP 490 89.896 -2.322 0.924 424 H THR 491 H THR 491 88.264 -4.637 2.095 425 HA THR 491 HA THR 491 88.781 -4.035 4.927 426 HB THR 491 HB THR 491 88.477 -6.565 5.192 427 HG1 THR 491 HG1 THR 491 88.505 -7.301 3.100 428 HG21 THR 491 HG21 THR 491 85.858 -5.723 4.300 429 HG22 THR 491 HG22 THR 491 86.671 -4.451 5.212 430 HG23 THR 491 HG23 THR 491 86.441 -6.043 5.934 431 H GLU 492 H GLU 492 90.596 -4.132 2.361 432 HA GLU 492 HA GLU 492 92.749 -5.639 3.686 433 HB2 GLU 492 HB2 GLU 492 93.434 -5.767 1.035 434 HB3 GLU 492 HB3 GLU 492 92.670 -7.058 1.951 435 HG2 GLU 492 HG2 GLU 492 90.481 -6.323 1.200 436 HG3 GLU 492 HG3 GLU 492 91.219 -4.985 0.321 437 H CYS 493 H CYS 493 94.605 -4.575 3.961 438 HA CYS 493 HA CYS 493 95.148 -2.196 2.340 439 HB2 CYS 493 HB2 CYS 493 95.508 -0.802 4.176 440 HB3 CYS 493 HB3 CYS 493 94.090 -1.721 4.667 441 HG CYS 493 HG CYS 493 96.926 -2.426 5.735 442 H HIS 494 H HIS 494 97.332 -1.754 2.016 443 HA HIS 494 HA HIS 494 99.224 -3.731 3.099 444 HB2 HIS 494 HB2 HIS 494 99.094 -2.649 0.277 445 HB3 HIS 494 HB3 HIS 494 100.434 -3.599 0.911 446 HD1 HIS 494 HD1 HIS 494 96.649 -4.078 0.867 447 HD2 HIS 494 HD2 HIS 494 100.166 -6.153 0.099 448 HE1 HIS 494 HE1 HIS 494 95.930 -6.388 0.178 449 HE2 HIS 494 HE2 HIS 494 98.075 -7.625 -0.287 450 H ALA 495 H ALA 495 100.509 -2.661 4.458 451 HA ALA 495 HA ALA 495 101.124 0.139 3.961 452 HB1 ALA 495 HB1 ALA 495 100.827 -1.468 6.298 453 HB2 ALA 495 HB2 ALA 495 100.993 0.283 6.165 454 HB3 ALA 495 HB3 ALA 495 102.429 -0.731 6.299 455 H ARG 496 H ARG 496 103.049 0.926 3.405 456 HA ARG 496 HA ARG 496 105.158 -0.974 2.711 457 HB2 ARG 496 HB2 ARG 496 105.254 1.960 2.097 458 HB3 ARG 496 HB3 ARG 496 105.979 0.621 1.219 459 HG2 ARG 496 HG2 ARG 496 103.562 -0.084 0.710 460 HG3 ARG 496 HG3 ARG 496 103.137 1.555 1.211 461 HD2 ARG 496 HD2 ARG 496 105.385 1.476 -0.638 462 HD3 ARG 496 HD3 ARG 496 103.916 0.778 -1.317 463 HE ARG 496 HE ARG 496 104.380 3.549 -0.633 464 HH11 ARG 496 HH11 ARG 496 102.029 1.086 -1.362 465 HH12 ARG 496 HH12 ARG 496 100.806 2.212 -1.844 466 HH21 ARG 496 HH21 ARG 496 102.776 5.043 -1.266 467 HH22 ARG 496 HH22 ARG 496 101.231 4.463 -1.790 468 H PHE 497 H PHE 497 107.010 -1.110 3.773 469 HA PHE 497 HA PHE 497 107.565 0.858 5.895 470 HB2 PHE 497 HB2 PHE 497 108.286 -2.076 5.729 471 HB3 PHE 497 HB3 PHE 497 108.873 -0.986 6.980 472 HD1 PHE 497 HD1 PHE 497 107.811 -1.199 8.992 473 HD2 PHE 497 HD2 PHE 497 105.576 -1.795 5.422 474 HE1 PHE 497 HE1 PHE 497 105.800 -1.658 10.333 475 HE2 PHE 497 HE2 PHE 497 103.560 -2.255 6.756 476 HZ PHE 497 HZ PHE 497 103.671 -2.186 9.215 477 H LYS 498 H LYS 498 109.769 1.478 6.229 478 HA LYS 498 HA LYS 498 111.236 1.670 3.761 479 HB2 LYS 498 HB2 LYS 498 110.985 3.433 5.678 480 HB3 LYS 498 HB3 LYS 498 112.340 2.570 6.393 481 HG2 LYS 498 HG2 LYS 498 113.806 3.460 4.968 482 HG3 LYS 498 HG3 LYS 498 112.743 3.218 3.580 483 HD2 LYS 498 HD2 LYS 498 112.574 5.456 3.583 484 HD3 LYS 498 HD3 LYS 498 111.453 5.208 4.924 485 HE2 LYS 498 HE2 LYS 498 114.143 5.176 5.903 486 HE3 LYS 498 HE3 LYS 498 113.888 6.627 4.933 487 HZ1 LYS 498 HZ1 LYS 498 112.520 5.783 7.400 488 HZ2 LYS 498 HZ2 LYS 498 111.737 6.821 6.319 489 HZ3 LYS 498 HZ3 LYS 498 113.206 7.283 7.018 490 H THR 499 H THR 499 111.267 -0.433 6.463 491 HA THR 499 HA THR 499 113.688 -1.702 5.405 492 HB THR 499 HB THR 499 114.253 -2.253 7.874 493 HG1 THR 499 HG1 THR 499 112.257 -1.137 8.621 494 HG21 THR 499 HG21 THR 499 115.902 -0.699 7.764 495 HG22 THR 499 HG22 THR 499 114.790 0.612 7.366 496 HG23 THR 499 HG23 THR 499 115.297 -0.524 6.116 497 HA PRO 500 HA PRO 500 111.322 -5.401 5.800 498 HB2 PRO 500 HB2 PRO 500 113.307 -7.230 5.818 499 HB3 PRO 500 HB3 PRO 500 112.889 -6.308 4.370 500 HG2 PRO 500 HG2 PRO 500 115.107 -5.856 6.329 501 HG3 PRO 500 HG3 PRO 500 115.148 -5.780 4.558 502 HD2 PRO 500 HD2 PRO 500 114.975 -3.570 6.133 503 HD3 PRO 500 HD3 PRO 500 114.273 -3.655 4.505 504 H GLU 501 H GLU 501 114.059 -4.983 8.004 505 HA GLU 501 HA GLU 501 113.363 -6.977 9.856 506 HB2 GLU 501 HB2 GLU 501 114.697 -5.389 11.456 507 HB3 GLU 501 HB3 GLU 501 115.522 -6.219 10.143 508 HG2 GLU 501 HG2 GLU 501 116.094 -4.309 9.167 509 HG3 GLU 501 HG3 GLU 501 114.463 -3.656 9.311 510 H ASP 502 H ASP 502 112.454 -3.573 9.616 511 HA ASP 502 HA ASP 502 111.132 -3.376 12.093 512 HB2 ASP 502 HB2 ASP 502 111.835 -1.522 10.407 513 HB3 ASP 502 HB3 ASP 502 110.262 -1.820 9.677 514 H ALA 503 H ALA 503 109.984 -4.278 8.870 515 HA ALA 503 HA ALA 503 107.247 -4.472 9.556 516 HB1 ALA 503 HB1 ALA 503 107.512 -6.210 7.471 517 HB2 ALA 503 HB2 ALA 503 108.911 -5.159 7.250 518 HB3 ALA 503 HB3 ALA 503 107.290 -4.468 7.317 519 H GLN 504 H GLN 504 109.879 -6.832 9.495 520 HA GLN 504 HA GLN 504 108.340 -9.116 10.041 521 HB2 GLN 504 HB2 GLN 504 111.015 -8.573 9.580 522 HB3 GLN 504 HB3 GLN 504 111.002 -9.154 11.239 523 HG2 GLN 504 HG2 GLN 504 109.605 -11.103 10.334 524 HG3 GLN 504 HG3 GLN 504 110.157 -10.574 8.745 525 HE21 GLN 504 HE21 GLN 504 110.854 -13.010 9.315 526 HE22 GLN 504 HE22 GLN 504 112.510 -13.139 9.793 527 H ALA 505 H ALA 505 109.820 -6.720 12.144 528 HA ALA 505 HA ALA 505 109.410 -8.073 14.580 529 HB1 ALA 505 HB1 ALA 505 110.391 -6.298 15.518 530 HB2 ALA 505 HB2 ALA 505 109.287 -5.157 14.750 531 HB3 ALA 505 HB3 ALA 505 110.679 -5.773 13.859 532 H VAL 506 H VAL 506 107.366 -5.792 12.793 533 HA VAL 506 HA VAL 506 105.419 -5.488 14.823 534 HB VAL 506 HB VAL 506 105.510 -3.824 13.129 535 HG11 VAL 506 HG11 VAL 506 104.857 -4.388 10.760 536 HG12 VAL 506 HG12 VAL 506 105.057 -6.085 11.198 537 HG13 VAL 506 HG13 VAL 506 106.432 -4.984 11.282 538 HG21 VAL 506 HG21 VAL 506 102.987 -5.315 12.479 539 HG22 VAL 506 HG22 VAL 506 103.240 -3.575 12.613 540 HG23 VAL 506 HG23 VAL 506 103.250 -4.581 14.062 541 H ILE 507 H ILE 507 105.583 -7.686 12.026 542 HA ILE 507 HA ILE 507 102.989 -8.745 12.339 543 HB ILE 507 HB ILE 507 103.812 -10.682 11.025 544 HG12 ILE 507 HG12 ILE 507 106.366 -9.442 10.353 545 HG13 ILE 507 HG13 ILE 507 106.280 -9.966 12.030 546 HG21 ILE 507 HG21 ILE 507 103.223 -8.202 10.195 547 HG22 ILE 507 HG22 ILE 507 103.627 -9.520 9.095 548 HG23 ILE 507 HG23 ILE 507 104.860 -8.348 9.556 549 HD11 ILE 507 HD11 ILE 507 107.054 -11.547 10.021 550 HD12 ILE 507 HD12 ILE 507 105.327 -11.900 10.034 551 HD13 ILE 507 HD13 ILE 507 106.288 -12.144 11.493 552 H ASN 508 H ASN 508 106.048 -9.551 13.823 553 HA ASN 508 HA ASN 508 105.203 -12.032 14.954 554 HB2 ASN 508 HB2 ASN 508 107.465 -10.144 15.628 555 HB3 ASN 508 HB3 ASN 508 107.201 -11.662 16.481 556 HD21 ASN 508 HD21 ASN 508 109.184 -10.423 14.407 557 HD22 ASN 508 HD22 ASN 508 109.456 -11.744 13.327 558 H ALA 509 H ALA 509 105.297 -8.699 16.030 559 HA ALA 509 HA ALA 509 104.337 -9.260 18.674 560 HB1 ALA 509 HB1 ALA 509 105.569 -7.095 17.453 561 HB2 ALA 509 HB2 ALA 509 104.975 -7.178 19.111 562 HB3 ALA 509 HB3 ALA 509 103.945 -6.520 17.839 563 H TYR 510 H TYR 510 102.891 -8.607 15.603 564 HA TYR 510 HA TYR 510 100.425 -7.579 16.440 565 HB2 TYR 510 HB2 TYR 510 101.590 -8.493 13.986 566 HB3 TYR 510 HB3 TYR 510 99.949 -9.120 14.140 567 HD1 TYR 510 HD1 TYR 510 98.881 -7.803 12.467 568 HD2 TYR 510 HD2 TYR 510 101.162 -5.930 15.529 569 HE1 TYR 510 HE1 TYR 510 97.987 -5.615 11.784 570 HE2 TYR 510 HE2 TYR 510 100.276 -3.733 14.855 571 HH TYR 510 HH TYR 510 98.606 -3.240 11.942 572 H THR 511 H THR 511 101.672 -10.675 16.976 573 HA THR 511 HA THR 511 99.473 -12.337 16.659 574 HB THR 511 HB THR 511 100.387 -13.670 18.557 575 HG1 THR 511 HG1 THR 511 102.126 -12.936 19.705 576 HG21 THR 511 HG21 THR 511 101.363 -14.257 16.533 577 HG22 THR 511 HG22 THR 511 102.760 -13.883 17.542 578 HG23 THR 511 HG23 THR 511 102.183 -12.705 16.363 579 H GLU 512 H GLU 512 100.288 -10.038 19.148 580 HA GLU 512 HA GLU 512 98.413 -10.610 21.090 581 HB2 GLU 512 HB2 GLU 512 100.099 -8.378 20.395 582 HB3 GLU 512 HB3 GLU 512 98.542 -7.805 20.975 583 HG2 GLU 512 HG2 GLU 512 99.327 -9.854 22.724 584 HG3 GLU 512 HG3 GLU 512 100.753 -8.854 22.450 585 H ILE 513 H ILE 513 98.015 -8.546 18.221 586 HA ILE 513 HA ILE 513 95.465 -7.594 18.714 587 HB ILE 513 HB ILE 513 96.696 -8.348 16.060 588 HG12 ILE 513 HG12 ILE 513 96.549 -5.738 17.584 589 HG13 ILE 513 HG13 ILE 513 97.994 -6.696 17.282 590 HG21 ILE 513 HG21 ILE 513 94.533 -6.314 16.321 591 HG22 ILE 513 HG22 ILE 513 94.099 -8.022 16.280 592 HG23 ILE 513 HG23 ILE 513 94.986 -7.307 14.935 593 HD11 ILE 513 HD11 ILE 513 96.415 -5.020 15.382 594 HD12 ILE 513 HD12 ILE 513 97.468 -6.310 14.798 595 HD13 ILE 513 HD13 ILE 513 98.141 -4.981 15.742 596 H ASN 514 H ASN 514 96.403 -10.607 17.067 597 HA ASN 514 HA ASN 514 94.050 -11.609 16.226 598 HB2 ASN 514 HB2 ASN 514 95.938 -12.972 15.898 599 HB3 ASN 514 HB3 ASN 514 96.335 -12.987 17.614 600 HD21 ASN 514 HD21 ASN 514 93.371 -13.678 15.792 601 HD22 ASN 514 HD22 ASN 514 93.130 -15.256 16.454 602 H LYS 515 H LYS 515 95.043 -11.261 19.568 603 HA LYS 515 HA LYS 515 92.994 -12.846 20.715 604 HB2 LYS 515 HB2 LYS 515 94.710 -10.622 21.808 605 HB3 LYS 515 HB3 LYS 515 93.513 -11.455 22.790 606 HG2 LYS 515 HG2 LYS 515 94.909 -13.127 23.173 607 HG3 LYS 515 HG3 LYS 515 95.184 -13.362 21.445 608 HD2 LYS 515 HD2 LYS 515 96.792 -11.419 21.562 609 HD3 LYS 515 HD3 LYS 515 96.642 -11.507 23.318 610 HE2 LYS 515 HE2 LYS 515 98.567 -12.777 22.044 611 HE3 LYS 515 HE3 LYS 515 97.780 -13.485 23.454 612 HZ1 LYS 515 HZ1 LYS 515 96.913 -14.037 20.674 613 HZ2 LYS 515 HZ2 LYS 515 96.458 -14.859 22.080 614 HZ3 LYS 515 HZ3 LYS 515 98.039 -14.996 21.496 615 H LYS 516 H LYS 516 93.295 -9.328 20.247 616 HA LYS 516 HA LYS 516 90.647 -8.804 21.199 617 HB2 LYS 516 HB2 LYS 516 92.805 -7.252 21.007 618 HB3 LYS 516 HB3 LYS 516 92.066 -6.841 19.464 619 HG2 LYS 516 HG2 LYS 516 91.500 -5.330 21.385 620 HG3 LYS 516 HG3 LYS 516 90.122 -6.003 20.512 621 HD2 LYS 516 HD2 LYS 516 91.041 -7.635 22.767 622 HD3 LYS 516 HD3 LYS 516 90.426 -6.044 23.221 623 HE2 LYS 516 HE2 LYS 516 88.307 -6.573 22.681 624 HE3 LYS 516 HE3 LYS 516 88.793 -7.475 21.247 625 HZ1 LYS 516 HZ1 LYS 516 88.963 -8.470 24.041 626 HZ2 LYS 516 HZ2 LYS 516 89.390 -9.338 22.654 627 HZ3 LYS 516 HZ3 LYS 516 87.776 -8.905 22.916 628 H HIS 517 H HIS 517 92.175 -9.014 18.020 629 HA HIS 517 HA HIS 517 89.616 -9.640 16.823 630 HB2 HIS 517 HB2 HIS 517 91.187 -7.370 15.614 631 HB3 HIS 517 HB3 HIS 517 89.539 -7.873 15.256 632 HD1 HIS 517 HD1 HIS 517 87.689 -7.165 16.970 633 HD2 HIS 517 HD2 HIS 517 91.465 -5.611 17.739 634 HE1 HIS 517 HE1 HIS 517 87.330 -5.323 18.644 635 HE2 HIS 517 HE2 HIS 517 89.633 -4.419 19.122 636 H CYS 518 H CYS 518 89.929 -11.266 15.462 637 HA CYS 518 HA CYS 518 92.396 -12.383 14.874 638 HB2 CYS 518 HB2 CYS 518 89.671 -12.645 13.660 639 HB3 CYS 518 HB3 CYS 518 91.042 -13.436 12.886 640 HG CYS 518 HG CYS 518 91.357 -14.610 15.353 641 H TRP 519 H TRP 519 93.877 -10.881 14.113 642 HA TRP 519 HA TRP 519 93.296 -9.726 11.469 643 HB2 TRP 519 HB2 TRP 519 94.091 -8.403 13.709 644 HB3 TRP 519 HB3 TRP 519 95.639 -8.700 12.920 645 HD1 TRP 519 HD1 TRP 519 93.277 -8.429 10.203 646 HE1 TRP 519 HE1 TRP 519 93.229 -6.077 9.213 647 HE3 TRP 519 HE3 TRP 519 95.719 -5.948 13.931 648 HZ2 TRP 519 HZ2 TRP 519 94.117 -3.463 9.925 649 HZ3 TRP 519 HZ3 TRP 519 96.085 -3.528 13.707 650 HH2 TRP 519 HH2 TRP 519 95.300 -2.312 11.744 651 H LYS 520 H LYS 520 94.694 -9.891 9.820 652 HA LYS 520 HA LYS 520 96.760 -11.965 10.084 653 HB2 LYS 520 HB2 LYS 520 95.591 -11.060 7.490 654 HB3 LYS 520 HB3 LYS 520 96.289 -12.622 7.900 655 HG2 LYS 520 HG2 LYS 520 93.675 -11.572 8.970 656 HG3 LYS 520 HG3 LYS 520 93.835 -12.685 7.606 657 HD2 LYS 520 HD2 LYS 520 94.907 -14.329 9.053 658 HD3 LYS 520 HD3 LYS 520 94.804 -13.214 10.415 659 HE2 LYS 520 HE2 LYS 520 92.846 -14.163 10.892 660 HE3 LYS 520 HE3 LYS 520 92.208 -13.346 9.465 661 HZ1 LYS 520 HZ1 LYS 520 93.422 -15.588 8.484 662 HZ2 LYS 520 HZ2 LYS 520 91.759 -15.369 8.702 663 HZ3 LYS 520 HZ3 LYS 520 92.676 -16.129 9.904 664 H LEU 521 H LEU 521 98.828 -11.466 9.692 665 HA LEU 521 HA LEU 521 99.424 -8.998 8.216 666 HB2 LEU 521 HB2 LEU 521 99.895 -9.476 10.994 667 HB3 LEU 521 HB3 LEU 521 101.445 -9.387 10.178 668 HG LEU 521 HG LEU 521 100.636 -7.218 11.115 669 HD11 LEU 521 HD11 LEU 521 100.843 -6.072 8.705 670 HD12 LEU 521 HD12 LEU 521 101.438 -7.686 8.315 671 HD13 LEU 521 HD13 LEU 521 102.220 -6.740 9.582 672 HD21 LEU 521 HD21 LEU 521 98.592 -7.410 8.908 673 HD22 LEU 521 HD22 LEU 521 98.860 -6.030 9.973 674 HD23 LEU 521 HD23 LEU 521 98.250 -7.548 10.633 675 H GLU 522 H GLU 522 100.547 -9.547 6.476 676 HA GLU 522 HA GLU 522 102.722 -11.492 6.747 677 HB2 GLU 522 HB2 GLU 522 100.570 -12.529 5.809 678 HB3 GLU 522 HB3 GLU 522 100.870 -11.560 4.374 679 HG2 GLU 522 HG2 GLU 522 103.282 -12.868 4.948 680 HG3 GLU 522 HG3 GLU 522 102.007 -14.068 5.144 681 H ILE 523 H ILE 523 104.490 -11.112 5.457 682 HA ILE 523 HA ILE 523 104.475 -8.537 4.042 683 HB ILE 523 HB ILE 523 106.842 -10.142 5.014 684 HG12 ILE 523 HG12 ILE 523 106.404 -7.554 6.260 685 HG13 ILE 523 HG13 ILE 523 105.031 -8.630 6.507 686 HG21 ILE 523 HG21 ILE 523 107.594 -7.499 4.656 687 HG22 ILE 523 HG22 ILE 523 106.587 -7.858 3.254 688 HG23 ILE 523 HG23 ILE 523 107.995 -8.859 3.606 689 HD11 ILE 523 HD11 ILE 523 107.448 -8.568 7.915 690 HD12 ILE 523 HD12 ILE 523 107.464 -10.057 6.971 691 HD13 ILE 523 HD13 ILE 523 106.130 -9.727 8.076 692 H LEU 524 H LEU 524 104.421 -8.567 1.897 693 HA LEU 524 HA LEU 524 104.503 -10.884 0.343 694 HB2 LEU 524 HB2 LEU 524 104.930 -8.000 -0.433 695 HB3 LEU 524 HB3 LEU 524 104.771 -9.307 -1.592 696 HG LEU 524 HG LEU 524 102.696 -8.041 0.130 697 HD11 LEU 524 HD11 LEU 524 101.724 -7.573 -1.825 698 HD12 LEU 524 HD12 LEU 524 101.989 -9.199 -2.454 699 HD13 LEU 524 HD13 LEU 524 103.277 -7.997 -2.543 700 HD21 LEU 524 HD21 LEU 524 101.226 -9.950 -0.075 701 HD22 LEU 524 HD22 LEU 524 102.690 -10.420 0.790 702 HD23 LEU 524 HD23 LEU 524 102.484 -10.867 -0.903 703 H SER 525 H SER 525 106.061 -11.765 -1.026 704 HA SER 525 HA SER 525 108.775 -10.712 -0.875 705 HB2 SER 525 HB2 SER 525 108.238 -12.492 0.977 706 HB3 SER 525 HB3 SER 525 108.407 -13.640 -0.351 707 HG SER 525 HG SER 525 110.409 -11.760 -0.214 708 H GLY 526 H GLY 526 110.272 -11.812 -2.354 709 HA2 GLY 526 HA2 GLY 526 110.808 -12.384 -4.511 710 HA3 GLY 526 HA3 GLY 526 109.620 -13.659 -4.285 711 H ASP 527 H ASP 527 108.508 -13.716 -6.123 712 HA ASP 527 HA ASP 527 107.992 -11.515 -7.789 713 HB2 ASP 527 HB2 ASP 527 106.352 -14.045 -7.679 714 HB3 ASP 527 HB3 ASP 527 106.617 -12.992 -9.065 715 H HIS 528 H HIS 528 106.237 -12.836 -5.064 716 HA HIS 528 HA HIS 528 103.745 -11.623 -5.569 717 HB2 HIS 528 HB2 HIS 528 104.747 -13.319 -3.645 718 HB3 HIS 528 HB3 HIS 528 104.455 -11.839 -2.736 719 HD1 HIS 528 HD1 HIS 528 102.718 -14.013 -1.866 720 HD2 HIS 528 HD2 HIS 528 101.731 -11.685 -5.165 721 HE1 HIS 528 HE1 HIS 528 100.233 -14.273 -2.154 722 HE2 HIS 528 HE2 HIS 528 99.658 -12.864 -4.162 723 H GLU 529 H GLU 529 106.538 -10.521 -3.657 724 HA GLU 529 HA GLU 529 105.344 -8.069 -2.865 725 HB2 GLU 529 HB2 GLU 529 107.126 -8.705 -1.513 726 HB3 GLU 529 HB3 GLU 529 108.138 -9.150 -2.880 727 HG2 GLU 529 HG2 GLU 529 108.502 -6.830 -3.420 728 HG3 GLU 529 HG3 GLU 529 107.385 -6.330 -2.150 729 H GLN 530 H GLN 530 107.581 -8.944 -5.465 730 HA GLN 530 HA GLN 530 107.919 -6.345 -6.491 731 HB2 GLN 530 HB2 GLN 530 109.194 -7.317 -8.105 732 HB3 GLN 530 HB3 GLN 530 109.120 -8.681 -7.002 733 HG2 GLN 530 HG2 GLN 530 108.684 -9.585 -9.107 734 HG3 GLN 530 HG3 GLN 530 107.103 -9.456 -8.338 735 HE21 GLN 530 HE21 GLN 530 106.285 -9.582 -10.520 736 HE22 GLN 530 HE22 GLN 530 106.214 -8.152 -11.487 737 H ARG 531 H ARG 531 105.573 -8.886 -7.213 738 HA ARG 531 HA ARG 531 104.344 -7.728 -9.432 739 HB2 ARG 531 HB2 ARG 531 103.898 -10.024 -8.725 740 HB3 ARG 531 HB3 ARG 531 103.123 -9.440 -7.259 741 HG2 ARG 531 HG2 ARG 531 101.679 -8.144 -9.144 742 HG3 ARG 531 HG3 ARG 531 102.090 -9.633 -9.998 743 HD2 ARG 531 HD2 ARG 531 101.078 -10.976 -8.332 744 HD3 ARG 531 HD3 ARG 531 100.948 -9.616 -7.215 745 HE ARG 531 HE ARG 531 99.493 -9.192 -9.642 746 HH11 ARG 531 HH11 ARG 531 99.393 -10.718 -6.517 747 HH12 ARG 531 HH12 ARG 531 97.664 -10.711 -6.422 748 HH21 ARG 531 HH21 ARG 531 97.211 -9.182 -9.532 749 HH22 ARG 531 HH22 ARG 531 96.423 -9.838 -8.137 750 H TYR 532 H TYR 532 103.343 -7.538 -6.011 751 HA TYR 532 HA TYR 532 101.229 -5.790 -6.295 752 HB2 TYR 532 HB2 TYR 532 101.716 -6.860 -4.176 753 HB3 TYR 532 HB3 TYR 532 103.235 -5.981 -4.041 754 HD1 TYR 532 HD1 TYR 532 103.162 -3.487 -3.732 755 HD2 TYR 532 HD2 TYR 532 99.691 -5.919 -3.410 756 HE1 TYR 532 HE1 TYR 532 102.021 -1.685 -2.509 757 HE2 TYR 532 HE2 TYR 532 98.537 -4.124 -2.189 758 HH TYR 532 HH TYR 532 100.102 -1.521 -0.837 759 H TRP 533 H TRP 533 104.683 -5.058 -6.000 760 HA TRP 533 HA TRP 533 104.425 -2.261 -5.915 761 HB2 TRP 533 HB2 TRP 533 106.623 -4.166 -6.530 762 HB3 TRP 533 HB3 TRP 533 106.834 -2.492 -7.045 763 HD1 TRP 533 HD1 TRP 533 107.262 -4.672 -4.098 764 HE1 TRP 533 HE1 TRP 533 107.718 -3.267 -1.991 765 HE3 TRP 533 HE3 TRP 533 106.030 -0.059 -5.918 766 HZ2 TRP 533 HZ2 TRP 533 107.573 -0.551 -1.204 767 HZ3 TRP 533 HZ3 TRP 533 106.218 1.889 -4.428 768 HH2 TRP 533 HH2 TRP 533 106.975 1.646 -2.121 769 H GLN 534 H GLN 534 104.729 -4.514 -8.628 770 HA GLN 534 HA GLN 534 105.037 -2.752 -10.724 771 HB2 GLN 534 HB2 GLN 534 103.450 -5.308 -10.530 772 HB3 GLN 534 HB3 GLN 534 103.607 -4.421 -12.039 773 HG2 GLN 534 HG2 GLN 534 106.132 -4.982 -10.654 774 HG3 GLN 534 HG3 GLN 534 105.262 -6.397 -11.244 775 HE21 GLN 534 HE21 GLN 534 105.475 -3.136 -12.588 776 HE22 GLN 534 HE22 GLN 534 106.180 -3.610 -14.093 777 H LYS 535 H LYS 535 102.084 -3.724 -9.047 778 HA LYS 535 HA LYS 535 100.284 -2.205 -10.591 779 HB2 LYS 535 HB2 LYS 535 99.041 -3.617 -9.325 780 HB3 LYS 535 HB3 LYS 535 100.234 -3.667 -8.037 781 HG2 LYS 535 HG2 LYS 535 98.591 -1.207 -8.367 782 HG3 LYS 535 HG3 LYS 535 97.854 -2.641 -7.649 783 HD2 LYS 535 HD2 LYS 535 100.489 -2.075 -6.560 784 HD3 LYS 535 HD3 LYS 535 99.360 -0.739 -6.327 785 HE2 LYS 535 HE2 LYS 535 98.686 -3.590 -5.640 786 HE3 LYS 535 HE3 LYS 535 99.434 -2.482 -4.491 787 HZ1 LYS 535 HZ1 LYS 535 96.712 -2.543 -5.506 788 HZ2 LYS 535 HZ2 LYS 535 97.393 -1.006 -5.321 789 HZ3 LYS 535 HZ3 LYS 535 97.294 -2.053 -3.995 790 H ILE 536 H ILE 536 102.217 -1.475 -7.731 791 HA ILE 536 HA ILE 536 101.135 1.062 -7.154 792 HB ILE 536 HB ILE 536 103.908 -0.028 -6.659 793 HG12 ILE 536 HG12 ILE 536 101.461 0.240 -4.902 794 HG13 ILE 536 HG13 ILE 536 102.199 -1.257 -5.462 795 HG21 ILE 536 HG21 ILE 536 103.168 2.072 -4.865 796 HG22 ILE 536 HG22 ILE 536 103.044 2.646 -6.528 797 HG23 ILE 536 HG23 ILE 536 104.562 1.966 -5.941 798 HD11 ILE 536 HD11 ILE 536 104.128 0.347 -4.068 799 HD12 ILE 536 HD12 ILE 536 103.569 -1.290 -3.727 800 HD13 ILE 536 HD13 ILE 536 102.692 0.095 -3.075 801 H LEU 537 H LEU 537 104.228 0.309 -8.760 802 HA LEU 537 HA LEU 537 104.933 2.810 -9.609 803 HB2 LEU 537 HB2 LEU 537 105.485 0.067 -10.505 804 HB3 LEU 537 HB3 LEU 537 105.719 1.290 -11.739 805 HG LEU 537 HG LEU 537 107.824 0.948 -10.698 806 HD11 LEU 537 HD11 LEU 537 107.179 3.352 -9.154 807 HD12 LEU 537 HD12 LEU 537 106.654 3.399 -10.836 808 HD13 LEU 537 HD13 LEU 537 108.350 3.111 -10.450 809 HD21 LEU 537 HD21 LEU 537 106.205 0.678 -8.292 810 HD22 LEU 537 HD22 LEU 537 107.650 1.659 -8.049 811 HD23 LEU 537 HD23 LEU 537 107.795 0.015 -8.670 812 H VAL 538 H VAL 538 103.222 0.452 -11.674 813 HA VAL 538 HA VAL 538 102.653 2.126 -13.789 814 HB VAL 538 HB VAL 538 100.906 -0.096 -12.722 815 HG11 VAL 538 HG11 VAL 538 99.662 -0.027 -14.634 816 HG12 VAL 538 HG12 VAL 538 100.965 0.676 -15.592 817 HG13 VAL 538 HG13 VAL 538 100.045 1.687 -14.476 818 HG21 VAL 538 HG21 VAL 538 102.453 -1.508 -13.456 819 HG22 VAL 538 HG22 VAL 538 103.489 -0.147 -13.886 820 HG23 VAL 538 HG23 VAL 538 102.354 -0.797 -15.067 821 H ASP 539 H ASP 539 100.872 1.729 -10.758 822 HA ASP 539 HA ASP 539 98.618 3.258 -11.481 823 HB2 ASP 539 HB2 ASP 539 98.811 1.739 -9.475 824 HB3 ASP 539 HB3 ASP 539 99.771 2.994 -8.699 825 H ARG 540 H ARG 540 101.730 4.127 -10.071 826 HA ARG 540 HA ARG 540 101.127 6.820 -9.499 827 HB2 ARG 540 HB2 ARG 540 103.795 5.571 -10.193 828 HB3 ARG 540 HB3 ARG 540 103.569 7.152 -9.457 829 HG2 ARG 540 HG2 ARG 540 102.207 5.109 -7.947 830 HG3 ARG 540 HG3 ARG 540 103.916 4.720 -8.152 831 HD2 ARG 540 HD2 ARG 540 104.602 6.717 -7.119 832 HD3 ARG 540 HD3 ARG 540 103.004 7.442 -7.271 833 HE ARG 540 HE ARG 540 102.313 6.283 -5.390 834 HH11 ARG 540 HH11 ARG 540 105.505 5.271 -6.347 835 HH12 ARG 540 HH12 ARG 540 105.820 4.426 -4.868 836 HH21 ARG 540 HH21 ARG 540 102.720 5.173 -3.438 837 HH22 ARG 540 HH22 ARG 540 104.237 4.368 -3.216 838 H GLN 541 H GLN 541 102.391 5.210 -12.371 839 HA GLN 541 HA GLN 541 102.935 7.520 -13.888 840 HB2 GLN 541 HB2 GLN 541 102.001 5.059 -15.278 841 HB3 GLN 541 HB3 GLN 541 103.374 6.097 -15.634 842 HG2 GLN 541 HG2 GLN 541 103.162 3.954 -13.545 843 HG3 GLN 541 HG3 GLN 541 104.253 4.029 -14.928 844 HE21 GLN 541 HE21 GLN 541 105.588 3.519 -12.837 845 HE22 GLN 541 HE22 GLN 541 106.356 4.895 -12.128 846 H ALA 542 H ALA 542 100.047 5.506 -13.581 847 HA ALA 542 HA ALA 542 98.500 6.749 -15.561 848 HB1 ALA 542 HB1 ALA 542 98.127 4.656 -13.796 849 HB2 ALA 542 HB2 ALA 542 96.951 5.262 -14.962 850 HB3 ALA 542 HB3 ALA 542 96.923 5.845 -13.298 851 H LYS 543 H LYS 543 99.061 7.530 -12.184 852 HA LYS 543 HA LYS 543 97.054 9.464 -11.871 853 HB2 LYS 543 HB2 LYS 543 97.915 8.973 -9.827 854 HB3 LYS 543 HB3 LYS 543 99.524 8.672 -10.463 855 HG2 LYS 543 HG2 LYS 543 99.931 11.077 -10.576 856 HG3 LYS 543 HG3 LYS 543 98.314 11.378 -9.935 857 HD2 LYS 543 HD2 LYS 543 99.795 11.548 -8.096 858 HD3 LYS 543 HD3 LYS 543 98.988 9.987 -7.934 859 HE2 LYS 543 HE2 LYS 543 101.124 9.297 -7.591 860 HE3 LYS 543 HE3 LYS 543 101.099 9.201 -9.351 861 HZ1 LYS 543 HZ1 LYS 543 101.895 11.658 -9.159 862 HZ2 LYS 543 HZ2 LYS 543 103.003 10.390 -8.989 863 HZ3 LYS 543 HZ3 LYS 543 102.404 11.177 -7.617 864 H LEU 544 H LEU 544 100.254 9.592 -13.277 865 HA LEU 544 HA LEU 544 100.655 12.348 -13.374 866 HB2 LEU 544 HB2 LEU 544 101.858 10.025 -14.477 867 HB3 LEU 544 HB3 LEU 544 101.615 11.160 -15.789 868 HG LEU 544 HG LEU 544 103.836 11.404 -14.812 869 HD11 LEU 544 HD11 LEU 544 103.669 13.534 -15.388 870 HD12 LEU 544 HD12 LEU 544 102.977 13.908 -13.810 871 HD13 LEU 544 HD13 LEU 544 101.922 13.473 -15.155 872 HD21 LEU 544 HD21 LEU 544 103.457 10.661 -12.570 873 HD22 LEU 544 HD22 LEU 544 102.320 11.976 -12.271 874 HD23 LEU 544 HD23 LEU 544 104.033 12.326 -12.504 875 H ASN 545 H ASN 545 98.630 10.266 -15.297 876 HA ASN 545 HA ASN 545 96.935 10.743 -16.743 877 HB2 ASN 545 HB2 ASN 545 97.571 13.652 -16.218 878 HB3 ASN 545 HB3 ASN 545 96.102 13.017 -16.951 879 HD21 ASN 545 HD21 ASN 545 95.644 10.848 -15.284 880 HD22 ASN 545 HD22 ASN 545 95.235 11.431 -13.709 881 H GLN 546 H GLN 546 96.852 10.795 -18.933 882 HA GLN 546 HA GLN 546 97.770 10.677 -21.032 883 HB2 GLN 546 HB2 GLN 546 97.480 13.396 -20.173 884 HB3 GLN 546 HB3 GLN 546 98.867 13.277 -21.246 885 HG2 GLN 546 HG2 GLN 546 97.547 12.411 -23.007 886 HG3 GLN 546 HG3 GLN 546 96.169 12.155 -21.937 887 HE21 GLN 546 HE21 GLN 546 95.097 13.391 -23.678 888 HE22 GLN 546 HE22 GLN 546 95.100 15.115 -23.569 889 HA PRO 547 HA PRO 547 102.134 10.130 -19.406 890 HB2 PRO 547 HB2 PRO 547 102.324 7.539 -20.279 891 HB3 PRO 547 HB3 PRO 547 101.777 7.999 -18.664 892 HG2 PRO 547 HG2 PRO 547 100.169 7.247 -21.071 893 HG3 PRO 547 HG3 PRO 547 99.919 6.804 -19.372 894 HD2 PRO 547 HD2 PRO 547 98.474 8.735 -20.578 895 HD3 PRO 547 HD3 PRO 547 98.918 8.823 -18.861 896 H ARG 548 H ARG 548 103.401 11.188 -20.801 897 HA ARG 548 HA ARG 548 103.417 10.332 -23.618 898 HB2 ARG 548 HB2 ARG 548 103.393 12.933 -22.364 899 HB3 ARG 548 HB3 ARG 548 104.806 12.763 -23.394 900 HG2 ARG 548 HG2 ARG 548 102.263 11.858 -24.565 901 HG3 ARG 548 HG3 ARG 548 102.401 13.591 -24.261 902 HD2 ARG 548 HD2 ARG 548 103.175 12.658 -26.541 903 HD3 ARG 548 HD3 ARG 548 104.196 13.830 -25.711 904 HE ARG 548 HE ARG 548 105.778 12.185 -25.375 905 HH11 ARG 548 HH11 ARG 548 102.836 10.788 -26.603 906 HH12 ARG 548 HH12 ARG 548 103.554 9.248 -26.941 907 HH21 ARG 548 HH21 ARG 548 106.738 10.166 -25.817 908 HH22 ARG 548 HH22 ARG 548 105.776 8.895 -26.493 909 H GLU 549 H GLU 549 104.874 8.606 -23.228 910 HA GLU 549 HA GLU 549 107.651 9.504 -22.872 911 HB2 GLU 549 HB2 GLU 549 106.191 7.741 -21.164 912 HB3 GLU 549 HB3 GLU 549 107.437 6.810 -21.983 913 HG2 GLU 549 HG2 GLU 549 108.732 9.126 -21.189 914 HG3 GLU 549 HG3 GLU 549 107.669 8.732 -19.838 915 H LYS 550 H LYS 550 109.150 7.522 -23.523 916 HA LYS 550 HA LYS 550 108.477 5.585 -25.313 917 HB2 LYS 550 HB2 LYS 550 108.126 8.203 -26.479 918 HB3 LYS 550 HB3 LYS 550 109.347 7.293 -27.359 919 HG2 LYS 550 HG2 LYS 550 106.892 5.809 -26.719 920 HG3 LYS 550 HG3 LYS 550 106.703 7.151 -27.850 921 HD2 LYS 550 HD2 LYS 550 107.157 5.153 -29.102 922 HD3 LYS 550 HD3 LYS 550 108.571 6.205 -29.192 923 HE2 LYS 550 HE2 LYS 550 109.700 4.895 -27.504 924 HE3 LYS 550 HE3 LYS 550 108.263 3.901 -27.271 925 HZ1 LYS 550 HZ1 LYS 550 108.752 2.661 -29.043 926 HZ2 LYS 550 HZ2 LYS 550 110.308 3.312 -28.929 927 HZ3 LYS 550 HZ3 LYS 550 109.185 3.991 -29.995 928 H LYS 551 H LYS 551 110.720 8.289 -24.929 929 HA LYS 551 HA LYS 551 112.959 6.666 -25.816 930 HB2 LYS 551 HB2 LYS 551 113.235 9.400 -24.615 931 HB3 LYS 551 HB3 LYS 551 114.228 8.624 -25.841 932 HG2 LYS 551 HG2 LYS 551 111.981 8.734 -27.225 933 HG3 LYS 551 HG3 LYS 551 111.649 10.066 -26.116 934 HD2 LYS 551 HD2 LYS 551 112.828 11.341 -27.522 935 HD3 LYS 551 HD3 LYS 551 114.258 10.516 -26.899 936 HE2 LYS 551 HE2 LYS 551 114.573 10.076 -29.099 937 HE3 LYS 551 HE3 LYS 551 113.503 8.724 -28.728 938 HZ1 LYS 551 HZ1 LYS 551 111.628 10.190 -29.437 939 HZ2 LYS 551 HZ2 LYS 551 112.690 9.755 -30.679 940 HZ3 LYS 551 HZ3 LYS 551 112.774 11.302 -29.999 941 H ARG 552 H ARG 552 114.784 6.190 -24.530 942 HA ARG 552 HA ARG 552 115.870 5.475 -22.665 943 HB2 ARG 552 HB2 ARG 552 115.708 7.871 -22.039 944 HB3 ARG 552 HB3 ARG 552 114.185 7.534 -21.230 945 HG2 ARG 552 HG2 ARG 552 115.187 6.506 -19.466 946 HG3 ARG 552 HG3 ARG 552 116.548 5.931 -20.432 947 HD2 ARG 552 HD2 ARG 552 117.781 7.685 -19.843 948 HD3 ARG 552 HD3 ARG 552 116.523 8.803 -20.363 949 HE ARG 552 HE ARG 552 115.649 7.898 -17.948 950 HH11 ARG 552 HH11 ARG 552 118.593 9.372 -19.078 951 HH12 ARG 552 HH12 ARG 552 118.925 10.170 -17.576 952 HH21 ARG 552 HH21 ARG 552 116.073 8.945 -15.964 953 HH22 ARG 552 HH22 ARG 552 117.492 9.926 -15.806 954 H GLY 553 H GLY 553 114.983 3.406 -22.706 955 HA2 GLY 553 HA2 GLY 553 113.660 2.546 -20.399 956 HA3 GLY 553 HA3 GLY 553 112.452 2.718 -21.664 957 H THR 554 H THR 554 112.433 0.303 -20.947 958 HA THR 554 HA THR 554 113.255 -1.249 -23.106 959 HB THR 554 HB THR 554 115.539 -0.901 -22.272 960 HG1 THR 554 HG1 THR 554 115.297 -2.890 -23.226 961 HG21 THR 554 HG21 THR 554 116.272 -1.572 -20.142 962 HG22 THR 554 HG22 THR 554 114.782 -2.458 -19.817 963 HG23 THR 554 HG23 THR 554 114.770 -0.695 -19.848 964 H GLU 555 H GLU 555 113.683 -3.730 -21.934 965 HA GLU 555 HA GLU 555 112.505 -5.501 -21.126 966 HB2 GLU 555 HB2 GLU 555 112.106 -3.400 -19.028 967 HB3 GLU 555 HB3 GLU 555 111.273 -4.941 -18.885 968 HG2 GLU 555 HG2 GLU 555 114.239 -4.767 -19.283 969 HG3 GLU 555 HG3 GLU 555 113.496 -4.698 -17.686 970 H LYS 556 H LYS 556 111.057 -5.676 -22.857 971 HA LYS 556 HA LYS 556 108.383 -4.536 -22.380 972 HB2 LYS 556 HB2 LYS 556 109.892 -4.156 -24.583 973 HB3 LYS 556 HB3 LYS 556 109.043 -5.622 -25.056 974 HG2 LYS 556 HG2 LYS 556 107.097 -4.552 -25.339 975 HG3 LYS 556 HG3 LYS 556 107.326 -3.546 -23.906 976 HD2 LYS 556 HD2 LYS 556 109.107 -2.330 -25.326 977 HD3 LYS 556 HD3 LYS 556 108.318 -3.107 -26.700 978 HE2 LYS 556 HE2 LYS 556 106.494 -1.789 -26.560 979 HE3 LYS 556 HE3 LYS 556 106.509 -1.782 -24.797 980 HZ1 LYS 556 HZ1 LYS 556 107.144 0.337 -25.107 981 HZ2 LYS 556 HZ2 LYS 556 107.740 0.064 -26.666 982 HZ3 LYS 556 HZ3 LYS 556 108.681 -0.338 -25.319 983 H LEU 557 H LEU 557 106.975 -6.138 -24.178 984 HA LEU 557 HA LEU 557 105.639 -8.002 -23.908 985 HB2 LEU 557 HB2 LEU 557 108.410 -9.038 -24.453 986 HB3 LEU 557 HB3 LEU 557 107.023 -10.107 -24.378 987 HG LEU 557 HG LEU 557 106.525 -7.872 -26.154 988 HD11 LEU 557 HD11 LEU 557 109.104 -8.292 -26.255 989 HD12 LEU 557 HD12 LEU 557 108.170 -8.090 -27.737 990 HD13 LEU 557 HD13 LEU 557 108.629 -9.705 -27.197 991 HD21 LEU 557 HD21 LEU 557 105.828 -10.568 -25.858 992 HD22 LEU 557 HD22 LEU 557 106.672 -10.453 -27.403 993 HD23 LEU 557 HD23 LEU 557 105.263 -9.439 -27.091 994 H ILE 558 H ILE 558 104.891 -7.966 -21.808 995 HA ILE 558 HA ILE 558 106.292 -9.776 -19.958 996 HB ILE 558 HB ILE 558 105.843 -8.399 -18.081 997 HG12 ILE 558 HG12 ILE 558 104.136 -6.815 -19.990 998 HG13 ILE 558 HG13 ILE 558 103.667 -7.569 -18.470 999 HG21 ILE 558 HG21 ILE 558 107.372 -6.745 -18.442 1000 HG22 ILE 558 HG22 ILE 558 106.659 -6.270 -19.985 1001 HG23 ILE 558 HG23 ILE 558 107.655 -7.722 -19.882 1002 HD11 ILE 558 HD11 ILE 558 105.495 -5.843 -17.560 1003 HD12 ILE 558 HD12 ILE 558 103.787 -5.445 -17.740 1004 HD13 ILE 558 HD13 ILE 558 104.941 -4.965 -18.985 1005 H THR 559 H THR 559 104.807 -10.518 -18.158 1006 HA THR 559 HA THR 559 102.539 -11.767 -19.274 1007 HB THR 559 HB THR 559 103.805 -12.707 -17.367 1008 HG1 THR 559 HG1 THR 559 101.025 -12.328 -17.249 1009 HG21 THR 559 HG21 THR 559 102.524 -11.388 -15.209 1010 HG22 THR 559 HG22 THR 559 103.282 -10.158 -16.221 1011 HG23 THR 559 HG23 THR 559 104.249 -11.481 -15.568 1012 H LYS 560 H LYS 560 100.371 -11.351 -19.113 1013 HA LYS 560 HA LYS 560 98.457 -10.137 -18.913 1014 HB2 LYS 560 HB2 LYS 560 99.819 -9.891 -16.402 1015 HB3 LYS 560 HB3 LYS 560 99.008 -8.374 -16.767 1016 HG2 LYS 560 HG2 LYS 560 97.468 -10.884 -17.132 1017 HG3 LYS 560 HG3 LYS 560 97.801 -10.345 -15.484 1018 HD2 LYS 560 HD2 LYS 560 96.347 -8.644 -15.630 1019 HD3 LYS 560 HD3 LYS 560 96.888 -8.205 -17.251 1020 HE2 LYS 560 HE2 LYS 560 95.580 -10.594 -17.649 1021 HE3 LYS 560 HE3 LYS 560 94.605 -9.806 -16.407 1022 HZ1 LYS 560 HZ1 LYS 560 95.375 -8.049 -18.549 1023 HZ2 LYS 560 HZ2 LYS 560 93.852 -8.312 -17.860 1024 HZ3 LYS 560 HZ3 LYS 560 94.424 -9.349 -19.068 1025 H ALA 561 H ALA 561 98.318 -8.845 -20.655 1026 HA ALA 561 HA ALA 561 98.784 -7.097 -22.092 1027 HB1 ALA 561 HB1 ALA 561 98.336 -5.325 -19.729 1028 HB2 ALA 561 HB2 ALA 561 97.043 -6.378 -20.301 1029 HB3 ALA 561 HB3 ALA 561 97.735 -5.167 -21.380 Start of MODEL 18 1 H1 MET 437 HT1 MET 437 98.520 27.691 4.724 2 H2 MET 437 HT2 MET 437 97.694 26.418 3.923 3 H3 MET 437 HT3 MET 437 97.099 28.025 3.826 4 HA MET 437 HA MET 437 98.726 26.774 2.065 5 HB2 MET 437 HB2 MET 437 97.597 29.444 2.592 6 HB3 MET 437 HB3 MET 437 98.988 29.438 1.517 7 HG2 MET 437 HG2 MET 437 97.889 27.941 0.006 8 HG3 MET 437 HG3 MET 437 96.543 27.731 1.125 9 HE1 MET 437 HE1 MET 437 94.693 29.118 1.455 10 HE2 MET 437 HE2 MET 437 94.349 28.705 -0.224 11 HE3 MET 437 HE3 MET 437 94.144 30.364 0.335 12 H HIS 438 H HIS 438 99.686 29.556 4.091 13 HA HIS 438 HA HIS 438 102.461 28.586 3.938 14 HB2 HIS 438 HB2 HIS 438 102.006 31.517 4.136 15 HB3 HIS 438 HB3 HIS 438 103.294 30.630 3.329 16 HD1 HIS 438 HD1 HIS 438 101.986 29.074 1.206 17 HD2 HIS 438 HD2 HIS 438 100.638 32.864 2.251 18 HE1 HIS 438 HE1 HIS 438 100.716 29.911 -0.796 19 HE2 HIS 438 HE2 HIS 438 99.938 32.221 -0.154 20 H HIS 439 H HIS 439 103.187 28.093 5.889 21 HA HIS 439 HA HIS 439 101.978 29.372 8.233 22 HB2 HIS 439 HB2 HIS 439 103.689 26.892 7.976 23 HB3 HIS 439 HB3 HIS 439 103.096 27.534 9.503 24 HD1 HIS 439 HD1 HIS 439 102.392 24.755 7.842 25 HD2 HIS 439 HD2 HIS 439 99.970 28.046 8.598 26 HE1 HIS 439 HE1 HIS 439 100.030 23.910 7.659 27 HE2 HIS 439 HE2 HIS 439 98.582 25.908 8.171 28 H HIS 440 H HIS 440 105.209 27.980 7.984 29 HA HIS 440 HA HIS 440 106.334 30.616 8.672 30 HB2 HIS 440 HB2 HIS 440 106.579 28.030 10.036 31 HB3 HIS 440 HB3 HIS 440 108.124 28.817 9.730 32 HD1 HIS 440 HD1 HIS 440 107.843 31.610 10.410 33 HD2 HIS 440 HD2 HIS 440 105.691 28.720 12.480 34 HE1 HIS 440 HE1 HIS 440 107.228 32.673 12.603 35 HE2 HIS 440 HE2 HIS 440 106.016 30.871 13.880 36 H HIS 441 H HIS 441 107.798 27.460 7.955 37 HA HIS 441 HA HIS 441 109.716 28.672 6.197 38 HB2 HIS 441 HB2 HIS 441 110.528 26.352 5.880 39 HB3 HIS 441 HB3 HIS 441 110.373 26.782 7.580 40 HD1 HIS 441 HD1 HIS 441 109.872 24.560 8.612 41 HD2 HIS 441 HD2 HIS 441 107.459 25.362 5.324 42 HE1 HIS 441 HE1 HIS 441 108.167 22.713 8.562 43 HE2 HIS 441 HE2 HIS 441 106.756 23.184 6.529 44 H HIS 442 H HIS 442 110.098 27.159 4.080 45 HA HIS 442 HA HIS 442 107.840 27.774 2.399 46 HB2 HIS 442 HB2 HIS 442 110.515 26.501 1.787 47 HB3 HIS 442 HB3 HIS 442 109.305 26.891 0.570 48 HD1 HIS 442 HD1 HIS 442 110.405 29.086 3.461 49 HD2 HIS 442 HD2 HIS 442 110.507 28.986 -0.692 50 HE1 HIS 442 HE1 HIS 442 111.329 31.316 2.758 51 HE2 HIS 442 HE2 HIS 442 111.335 31.253 0.239 52 H HIS 443 H HIS 443 109.766 24.806 2.268 53 HA HIS 443 HA HIS 443 107.971 22.955 3.197 54 HB2 HIS 443 HB2 HIS 443 106.279 23.562 1.678 55 HB3 HIS 443 HB3 HIS 443 107.418 23.759 0.350 56 HD1 HIS 443 HD1 HIS 443 106.411 22.104 -1.261 57 HD2 HIS 443 HD2 HIS 443 107.152 20.460 2.483 58 HE1 HIS 443 HE1 HIS 443 106.025 19.633 -1.524 59 HE2 HIS 443 HE2 HIS 443 106.550 18.650 0.736 60 H SER 444 H SER 444 109.082 21.118 3.357 61 HA SER 444 HA SER 444 111.607 20.823 2.061 62 HB2 SER 444 HB2 SER 444 111.899 18.895 3.387 63 HB3 SER 444 HB3 SER 444 110.907 19.959 4.384 64 HG SER 444 HG SER 444 109.231 18.562 2.943 65 H ASN 445 H ASN 445 112.259 19.140 0.635 66 HA ASN 445 HA ASN 445 110.061 17.932 -0.909 67 HB2 ASN 445 HB2 ASN 445 111.875 19.879 -1.818 68 HB3 ASN 445 HB3 ASN 445 112.412 18.360 -2.530 69 HD21 ASN 445 HD21 ASN 445 109.737 20.593 -2.235 70 HD22 ASN 445 HD22 ASN 445 108.896 20.071 -3.651 71 H ALA 446 H ALA 446 110.994 16.142 -2.403 72 HA ALA 446 HA ALA 446 112.971 14.580 -0.875 73 HB1 ALA 446 HB1 ALA 446 111.100 13.353 -0.408 74 HB2 ALA 446 HB2 ALA 446 111.607 12.582 -1.911 75 HB3 ALA 446 HB3 ALA 446 110.308 13.774 -1.927 76 H THR 447 H THR 447 111.306 13.943 -3.940 77 HA THR 447 HA THR 447 112.094 13.407 -6.010 78 HB THR 447 HB THR 447 114.527 14.944 -6.054 79 HG1 THR 447 HG1 THR 447 112.273 16.146 -4.822 80 HG21 THR 447 HG21 THR 447 111.997 15.913 -7.278 81 HG22 THR 447 HG22 THR 447 112.637 14.359 -7.816 82 HG23 THR 447 HG23 THR 447 113.621 15.817 -7.962 83 H GLY 448 H GLY 448 112.626 11.308 -4.821 84 HA2 GLY 448 HA2 GLY 448 115.195 10.427 -5.703 85 HA3 GLY 448 HA3 GLY 448 115.136 10.568 -3.953 86 HA PRO 449 HA PRO 449 112.117 7.053 -5.443 87 HB2 PRO 449 HB2 PRO 449 112.988 5.763 -7.664 88 HB3 PRO 449 HB3 PRO 449 111.871 7.132 -7.726 89 HG2 PRO 449 HG2 PRO 449 114.830 7.076 -8.181 90 HG3 PRO 449 HG3 PRO 449 113.573 7.937 -9.089 91 HD2 PRO 449 HD2 PRO 449 115.140 9.154 -7.239 92 HD3 PRO 449 HD3 PRO 449 113.468 9.655 -7.560 93 H GLN 450 H GLN 450 112.389 4.721 -5.245 94 HA GLN 450 HA GLN 450 114.824 3.375 -5.203 95 HB2 GLN 450 HB2 GLN 450 115.103 5.097 -3.270 96 HB3 GLN 450 HB3 GLN 450 114.021 4.031 -2.384 97 HG2 GLN 450 HG2 GLN 450 116.182 3.374 -1.776 98 HG3 GLN 450 HG3 GLN 450 115.637 2.162 -2.935 99 HE21 GLN 450 HE21 GLN 450 118.328 3.306 -2.073 100 HE22 GLN 450 HE22 GLN 450 119.125 3.646 -3.568 101 H PHE 451 H PHE 451 114.364 1.277 -5.232 102 HA PHE 451 HA PHE 451 111.663 0.433 -4.655 103 HB2 PHE 451 HB2 PHE 451 113.220 -0.294 -6.631 104 HB3 PHE 451 HB3 PHE 451 113.842 -1.456 -5.462 105 HD1 PHE 451 HD1 PHE 451 112.849 -3.519 -5.357 106 HD2 PHE 451 HD2 PHE 451 110.588 -0.208 -6.780 107 HE1 PHE 451 HE1 PHE 451 110.967 -5.026 -5.851 108 HE2 PHE 451 HE2 PHE 451 108.698 -1.708 -7.277 109 HZ PHE 451 HZ PHE 451 108.887 -4.120 -6.812 110 H VAL 452 H VAL 452 111.131 0.023 -2.618 111 HA VAL 452 HA VAL 452 113.095 -1.198 -0.822 112 HB VAL 452 HB VAL 452 111.913 0.794 -0.004 113 HG11 VAL 452 HG11 VAL 452 109.443 -0.914 -0.287 114 HG12 VAL 452 HG12 VAL 452 109.819 0.554 -1.189 115 HG13 VAL 452 HG13 VAL 452 109.512 0.639 0.546 116 HG21 VAL 452 HG21 VAL 452 110.805 -0.539 2.037 117 HG22 VAL 452 HG22 VAL 452 112.545 -0.357 1.838 118 HG23 VAL 452 HG23 VAL 452 111.748 -1.843 1.320 119 H SER 453 H SER 453 112.322 -2.901 -2.715 120 HA SER 453 HA SER 453 110.159 -4.459 -2.680 121 HB2 SER 453 HB2 SER 453 111.409 -5.997 -3.781 122 HB3 SER 453 HB3 SER 453 112.626 -4.721 -3.732 123 HG SER 453 HG SER 453 112.984 -7.071 -2.847 124 H GLY 454 H GLY 454 109.286 -6.164 -1.607 125 HA2 GLY 454 HA2 GLY 454 108.759 -7.567 0.109 126 HA3 GLY 454 HA3 GLY 454 110.446 -7.515 0.565 127 H VAL 455 H VAL 455 108.357 -4.651 0.577 128 HA VAL 455 HA VAL 455 108.410 -4.796 3.519 129 HB VAL 455 HB VAL 455 108.531 -2.379 3.643 130 HG11 VAL 455 HG11 VAL 455 110.823 -2.122 3.121 131 HG12 VAL 455 HG12 VAL 455 110.738 -3.322 1.832 132 HG13 VAL 455 HG13 VAL 455 110.595 -3.826 3.514 133 HG21 VAL 455 HG21 VAL 455 107.414 -1.725 1.634 134 HG22 VAL 455 HG22 VAL 455 108.640 -2.504 0.634 135 HG23 VAL 455 HG23 VAL 455 109.051 -1.074 1.581 136 H ILE 456 H ILE 456 106.460 -5.072 0.953 137 HA ILE 456 HA ILE 456 104.256 -3.425 1.819 138 HB ILE 456 HB ILE 456 104.420 -5.574 -0.292 139 HG12 ILE 456 HG12 ILE 456 105.577 -3.860 -1.266 140 HG13 ILE 456 HG13 ILE 456 103.947 -3.317 -1.644 141 HG21 ILE 456 HG21 ILE 456 102.223 -3.914 -0.774 142 HG22 ILE 456 HG22 ILE 456 102.139 -4.337 0.936 143 HG23 ILE 456 HG23 ILE 456 102.202 -5.608 -0.286 144 HD11 ILE 456 HD11 ILE 456 104.004 -1.871 0.353 145 HD12 ILE 456 HD12 ILE 456 105.245 -1.471 -0.835 146 HD13 ILE 456 HD13 ILE 456 105.675 -2.364 0.624 147 H VAL 457 H VAL 457 103.733 -4.088 3.870 148 HA VAL 457 HA VAL 457 103.236 -6.854 4.481 149 HB VAL 457 HB VAL 457 102.594 -4.403 6.124 150 HG11 VAL 457 HG11 VAL 457 102.499 -5.922 8.008 151 HG12 VAL 457 HG12 VAL 457 102.880 -7.287 6.958 152 HG13 VAL 457 HG13 VAL 457 101.351 -6.430 6.769 153 HG21 VAL 457 HG21 VAL 457 104.683 -4.789 7.269 154 HG22 VAL 457 HG22 VAL 457 104.992 -4.607 5.542 155 HG23 VAL 457 HG23 VAL 457 105.004 -6.210 6.276 156 H LYS 458 H LYS 458 101.509 -7.812 3.673 157 HA LYS 458 HA LYS 458 99.091 -6.408 3.028 158 HB2 LYS 458 HB2 LYS 458 99.896 -8.335 1.708 159 HB3 LYS 458 HB3 LYS 458 99.646 -9.380 3.099 160 HG2 LYS 458 HG2 LYS 458 97.281 -9.059 3.000 161 HG3 LYS 458 HG3 LYS 458 97.453 -7.813 1.762 162 HD2 LYS 458 HD2 LYS 458 98.348 -9.469 0.209 163 HD3 LYS 458 HD3 LYS 458 98.216 -10.718 1.448 164 HE2 LYS 458 HE2 LYS 458 95.737 -9.238 0.959 165 HE3 LYS 458 HE3 LYS 458 96.317 -10.151 -0.433 166 HZ1 LYS 458 HZ1 LYS 458 95.957 -11.315 2.273 167 HZ2 LYS 458 HZ2 LYS 458 96.304 -12.148 0.842 168 HZ3 LYS 458 HZ3 LYS 458 94.797 -11.406 1.044 169 H ILE 459 H ILE 459 97.464 -5.974 4.366 170 HA ILE 459 HA ILE 459 97.241 -7.563 6.836 171 HB ILE 459 HB ILE 459 96.202 -4.758 6.474 172 HG12 ILE 459 HG12 ILE 459 98.853 -5.783 7.432 173 HG13 ILE 459 HG13 ILE 459 98.501 -4.393 6.410 174 HG21 ILE 459 HG21 ILE 459 95.616 -4.812 8.710 175 HG22 ILE 459 HG22 ILE 459 96.752 -6.108 9.084 176 HG23 ILE 459 HG23 ILE 459 95.264 -6.467 8.209 177 HD11 ILE 459 HD11 ILE 459 98.815 -3.143 8.209 178 HD12 ILE 459 HD12 ILE 459 98.813 -4.550 9.273 179 HD13 ILE 459 HD13 ILE 459 97.290 -3.783 8.821 180 H ILE 460 H ILE 460 95.523 -8.775 7.035 181 HA ILE 460 HA ILE 460 93.030 -7.928 5.747 182 HB ILE 460 HB ILE 460 94.234 -9.745 4.404 183 HG12 ILE 460 HG12 ILE 460 91.737 -9.066 4.409 184 HG13 ILE 460 HG13 ILE 460 92.196 -10.586 3.647 185 HG21 ILE 460 HG21 ILE 460 94.999 -11.368 5.793 186 HG22 ILE 460 HG22 ILE 460 93.436 -12.067 5.373 187 HG23 ILE 460 HG23 ILE 460 93.639 -11.224 6.903 188 HD11 ILE 460 HD11 ILE 460 91.607 -11.035 6.409 189 HD12 ILE 460 HD12 ILE 460 90.829 -11.703 4.974 190 HD13 ILE 460 HD13 ILE 460 90.277 -10.166 5.642 191 H SER 461 H SER 461 91.257 -8.131 6.996 192 HA SER 461 HA SER 461 91.579 -9.582 9.539 193 HB2 SER 461 HB2 SER 461 90.755 -7.829 10.756 194 HB3 SER 461 HB3 SER 461 91.473 -6.913 9.431 195 HG SER 461 HG SER 461 89.354 -7.012 8.428 196 H THR 462 H THR 462 88.974 -9.107 10.455 197 HA THR 462 HA THR 462 87.407 -10.723 8.547 198 HB THR 462 HB THR 462 86.180 -11.576 10.577 199 HG1 THR 462 HG1 THR 462 88.319 -10.228 11.882 200 HG21 THR 462 HG21 THR 462 88.548 -12.430 9.426 201 HG22 THR 462 HG22 THR 462 87.504 -13.371 10.492 202 HG23 THR 462 HG23 THR 462 88.876 -12.484 11.157 203 H GLU 463 H GLU 463 87.590 -7.837 10.326 204 HA GLU 463 HA GLU 463 85.605 -6.447 9.168 205 HB2 GLU 463 HB2 GLU 463 84.444 -8.482 10.859 206 HB3 GLU 463 HB3 GLU 463 83.988 -6.880 11.424 207 HG2 GLU 463 HG2 GLU 463 83.115 -6.323 9.236 208 HG3 GLU 463 HG3 GLU 463 83.634 -7.887 8.610 209 HA PRO 464 HA PRO 464 86.283 -4.954 13.940 210 HB2 PRO 464 HB2 PRO 464 88.940 -6.345 13.893 211 HB3 PRO 464 HB3 PRO 464 87.914 -5.932 15.273 212 HG2 PRO 464 HG2 PRO 464 87.961 -8.416 14.295 213 HG3 PRO 464 HG3 PRO 464 86.459 -7.690 14.894 214 HD2 PRO 464 HD2 PRO 464 87.295 -8.273 12.116 215 HD3 PRO 464 HD3 PRO 464 85.663 -8.118 12.796 216 H LEU 465 H LEU 465 88.463 -5.381 11.226 217 HA LEU 465 HA LEU 465 90.373 -3.502 11.511 218 HB2 LEU 465 HB2 LEU 465 89.310 -4.876 9.377 219 HB3 LEU 465 HB3 LEU 465 89.022 -3.204 8.934 220 HG LEU 465 HG LEU 465 91.750 -3.843 9.888 221 HD11 LEU 465 HD11 LEU 465 90.748 -5.680 8.216 222 HD12 LEU 465 HD12 LEU 465 92.429 -5.151 8.174 223 HD13 LEU 465 HD13 LEU 465 91.262 -4.468 7.043 224 HD21 LEU 465 HD21 LEU 465 91.181 -1.604 9.178 225 HD22 LEU 465 HD22 LEU 465 90.618 -2.210 7.620 226 HD23 LEU 465 HD23 LEU 465 92.327 -2.316 8.043 227 HA PRO 466 HA PRO 466 87.715 0.015 12.638 228 HB2 PRO 466 HB2 PRO 466 89.888 1.607 13.256 229 HB3 PRO 466 HB3 PRO 466 89.082 0.517 14.388 230 HG2 PRO 466 HG2 PRO 466 91.568 0.078 12.780 231 HG3 PRO 466 HG3 PRO 466 91.232 -0.360 14.466 232 HD2 PRO 466 HD2 PRO 466 91.143 -2.183 12.520 233 HD3 PRO 466 HD3 PRO 466 89.973 -2.216 13.856 234 H GLY 467 H GLY 467 90.737 0.330 10.763 235 HA2 GLY 467 HA2 GLY 467 89.863 1.187 8.391 236 HA3 GLY 467 HA3 GLY 467 89.666 2.641 9.358 237 H ARG 468 H ARG 468 91.222 3.245 7.494 238 HA ARG 468 HA ARG 468 93.904 2.414 7.551 239 HB2 ARG 468 HB2 ARG 468 94.298 4.665 6.408 240 HB3 ARG 468 HB3 ARG 468 93.199 3.545 5.615 241 HG2 ARG 468 HG2 ARG 468 91.323 4.797 6.161 242 HG3 ARG 468 HG3 ARG 468 92.154 5.651 7.464 243 HD2 ARG 468 HD2 ARG 468 92.329 7.314 5.967 244 HD3 ARG 468 HD3 ARG 468 93.662 6.358 5.319 245 HE ARG 468 HE ARG 468 91.226 5.530 4.160 246 HH11 ARG 468 HH11 ARG 468 93.502 8.163 4.121 247 HH12 ARG 468 HH12 ARG 468 93.138 8.625 2.491 248 HH21 ARG 468 HH21 ARG 468 90.734 6.131 2.015 249 HH22 ARG 468 HH22 ARG 468 91.564 7.469 1.294 250 H LYS 469 H LYS 469 92.190 4.977 9.241 251 HA LYS 469 HA LYS 469 94.418 6.281 10.352 252 HB2 LYS 469 HB2 LYS 469 91.992 6.226 12.027 253 HB3 LYS 469 HB3 LYS 469 92.922 7.593 11.433 254 HG2 LYS 469 HG2 LYS 469 91.866 7.168 9.176 255 HG3 LYS 469 HG3 LYS 469 90.778 6.050 10.004 256 HD2 LYS 469 HD2 LYS 469 89.929 7.813 11.395 257 HD3 LYS 469 HD3 LYS 469 91.140 8.942 10.785 258 HE2 LYS 469 HE2 LYS 469 90.125 8.594 8.497 259 HE3 LYS 469 HE3 LYS 469 88.805 7.750 9.306 260 HZ1 LYS 469 HZ1 LYS 469 88.459 10.187 8.835 261 HZ2 LYS 469 HZ2 LYS 469 89.606 10.505 10.037 262 HZ3 LYS 469 HZ3 LYS 469 88.174 9.696 10.429 263 H GLN 470 H GLN 470 92.415 3.635 11.598 264 HA GLN 470 HA GLN 470 93.875 3.464 14.060 265 HB2 GLN 470 HB2 GLN 470 91.653 1.957 12.778 266 HB3 GLN 470 HB3 GLN 470 92.558 1.159 14.058 267 HG2 GLN 470 HG2 GLN 470 91.179 3.823 14.301 268 HG3 GLN 470 HG3 GLN 470 90.549 2.285 14.889 269 HE21 GLN 470 HE21 GLN 470 93.060 4.689 15.282 270 HE22 GLN 470 HE22 GLN 470 93.496 4.250 16.894 271 H VAL 471 H VAL 471 93.785 1.543 11.060 272 HA VAL 471 HA VAL 471 95.589 -0.447 11.913 273 HB VAL 471 HB VAL 471 94.988 0.565 9.130 274 HG11 VAL 471 HG11 VAL 471 95.926 -2.002 8.866 275 HG12 VAL 471 HG12 VAL 471 97.005 -1.309 10.077 276 HG13 VAL 471 HG13 VAL 471 96.830 -0.532 8.503 277 HG21 VAL 471 HG21 VAL 471 93.043 -0.452 9.695 278 HG22 VAL 471 HG22 VAL 471 93.801 -1.462 10.927 279 HG23 VAL 471 HG23 VAL 471 93.943 -1.893 9.222 280 H ARG 472 H ARG 472 96.077 2.620 10.209 281 HA ARG 472 HA ARG 472 98.865 2.385 9.858 282 HB2 ARG 472 HB2 ARG 472 98.845 4.702 9.307 283 HB3 ARG 472 HB3 ARG 472 97.332 4.034 8.711 284 HG2 ARG 472 HG2 ARG 472 96.198 4.896 10.727 285 HG3 ARG 472 HG3 ARG 472 97.718 5.639 11.228 286 HD2 ARG 472 HD2 ARG 472 95.930 6.333 8.933 287 HD3 ARG 472 HD3 ARG 472 96.618 7.385 10.171 288 HE ARG 472 HE ARG 472 97.766 6.759 7.662 289 HH11 ARG 472 HH11 ARG 472 98.589 7.307 10.999 290 HH12 ARG 472 HH12 ARG 472 100.200 7.838 10.651 291 HH21 ARG 472 HH21 ARG 472 99.886 7.455 7.188 292 HH22 ARG 472 HH22 ARG 472 100.940 7.921 8.482 293 H ASP 473 H ASP 473 96.888 3.855 12.401 294 HA ASP 473 HA ASP 473 99.010 4.859 13.960 295 HB2 ASP 473 HB2 ASP 473 96.403 5.240 14.096 296 HB3 ASP 473 HB3 ASP 473 96.477 3.900 15.237 297 H THR 474 H THR 474 97.310 1.770 13.942 298 HA THR 474 HA THR 474 98.487 0.651 16.231 299 HB THR 474 HB THR 474 97.993 -1.576 15.022 300 HG1 THR 474 HG1 THR 474 97.384 -1.417 13.010 301 HG21 THR 474 HG21 THR 474 95.420 -0.960 15.110 302 HG22 THR 474 HG22 THR 474 96.046 0.494 15.889 303 HG23 THR 474 HG23 THR 474 96.391 -1.093 16.577 304 H LEU 475 H LEU 475 99.165 -0.697 13.033 305 HA LEU 475 HA LEU 475 101.560 -1.838 13.545 306 HB2 LEU 475 HB2 LEU 475 102.126 -1.536 11.156 307 HB3 LEU 475 HB3 LEU 475 100.491 -2.116 11.414 308 HG LEU 475 HG LEU 475 99.999 0.525 11.271 309 HD11 LEU 475 HD11 LEU 475 101.468 1.047 9.096 310 HD12 LEU 475 HD12 LEU 475 102.630 0.085 10.010 311 HD13 LEU 475 HD13 LEU 475 101.939 1.543 10.721 312 HD21 LEU 475 HD21 LEU 475 99.879 -1.746 9.464 313 HD22 LEU 475 HD22 LEU 475 99.989 -0.205 8.613 314 HD23 LEU 475 HD23 LEU 475 98.689 -0.480 9.772 315 H ALA 476 H ALA 476 101.040 1.575 12.740 316 HA ALA 476 HA ALA 476 103.795 2.249 12.643 317 HB1 ALA 476 HB1 ALA 476 101.992 3.609 11.610 318 HB2 ALA 476 HB2 ALA 476 103.091 4.543 12.625 319 HB3 ALA 476 HB3 ALA 476 101.493 4.103 13.228 320 H ALA 477 H ALA 477 101.517 1.862 15.223 321 HA ALA 477 HA ALA 477 102.955 3.374 17.173 322 HB1 ALA 477 HB1 ALA 477 100.651 1.493 17.234 323 HB2 ALA 477 HB2 ALA 477 100.776 3.148 17.829 324 HB3 ALA 477 HB3 ALA 477 101.503 1.826 18.743 325 H ILE 478 H ILE 478 103.069 0.105 15.990 326 HA ILE 478 HA ILE 478 104.734 -0.854 18.154 327 HB ILE 478 HB ILE 478 103.841 -2.086 15.554 328 HG12 ILE 478 HG12 ILE 478 103.331 -3.522 18.030 329 HG13 ILE 478 HG13 ILE 478 102.670 -1.890 18.076 330 HG21 ILE 478 HG21 ILE 478 104.936 -4.162 16.906 331 HG22 ILE 478 HG22 ILE 478 106.065 -2.868 17.307 332 HG23 ILE 478 HG23 ILE 478 105.750 -3.272 15.620 333 HD11 ILE 478 HD11 ILE 478 101.165 -2.309 16.415 334 HD12 ILE 478 HD12 ILE 478 101.270 -3.903 17.165 335 HD13 ILE 478 HD13 ILE 478 102.159 -3.566 15.679 336 H SER 479 H SER 479 105.137 0.416 14.927 337 HA SER 479 HA SER 479 107.920 0.917 15.381 338 HB2 SER 479 HB2 SER 479 107.261 -1.559 14.197 339 HB3 SER 479 HB3 SER 479 107.856 -0.532 12.893 340 HG SER 479 HG SER 479 109.454 -1.786 14.177 341 H GLU 480 H GLU 480 108.922 2.042 13.501 342 HA GLU 480 HA GLU 480 107.057 3.952 12.440 343 HB2 GLU 480 HB2 GLU 480 109.837 3.867 12.969 344 HB3 GLU 480 HB3 GLU 480 109.653 4.194 11.251 345 HG2 GLU 480 HG2 GLU 480 107.861 5.926 12.193 346 HG3 GLU 480 HG3 GLU 480 108.933 5.849 13.590 347 H VAL 481 H VAL 481 105.858 3.527 10.713 348 HA VAL 481 HA VAL 481 106.963 1.823 8.587 349 HB VAL 481 HB VAL 481 104.486 1.857 7.810 350 HG11 VAL 481 HG11 VAL 481 105.916 0.019 9.004 351 HG12 VAL 481 HG12 VAL 481 104.171 -0.173 8.839 352 HG13 VAL 481 HG13 VAL 481 104.857 0.371 10.369 353 HG21 VAL 481 HG21 VAL 481 103.781 2.173 10.665 354 HG22 VAL 481 HG22 VAL 481 102.858 2.572 9.216 355 HG23 VAL 481 HG23 VAL 481 104.140 3.650 9.769 356 H LEU 482 H LEU 482 106.918 2.466 6.441 357 HA LEU 482 HA LEU 482 107.352 5.192 5.937 358 HB2 LEU 482 HB2 LEU 482 108.278 3.343 4.580 359 HB3 LEU 482 HB3 LEU 482 106.673 3.016 3.958 360 HG LEU 482 HG LEU 482 106.689 5.410 3.072 361 HD11 LEU 482 HD11 LEU 482 108.612 6.646 3.016 362 HD12 LEU 482 HD12 LEU 482 109.657 5.231 3.147 363 HD13 LEU 482 HD13 LEU 482 108.810 5.836 4.570 364 HD21 LEU 482 HD21 LEU 482 107.939 3.002 2.064 365 HD22 LEU 482 HD22 LEU 482 108.667 4.455 1.378 366 HD23 LEU 482 HD23 LEU 482 106.930 4.185 1.230 367 H TYR 483 H TYR 483 104.859 3.314 4.249 368 HA TYR 483 HA TYR 483 102.844 5.298 4.956 369 HB2 TYR 483 HB2 TYR 483 103.757 6.308 2.987 370 HB3 TYR 483 HB3 TYR 483 103.741 4.774 2.122 371 HD1 TYR 483 HD1 TYR 483 101.427 3.701 1.703 372 HD2 TYR 483 HD2 TYR 483 101.968 7.782 2.780 373 HE1 TYR 483 HE1 TYR 483 99.202 4.229 0.799 374 HE2 TYR 483 HE2 TYR 483 99.743 8.320 1.882 375 HH TYR 483 HH TYR 483 98.089 6.465 -0.169 376 H VAL 484 H VAL 484 100.764 4.542 4.908 377 HA VAL 484 HA VAL 484 100.488 1.664 4.436 378 HB VAL 484 HB VAL 484 99.847 2.718 6.661 379 HG11 VAL 484 HG11 VAL 484 97.846 3.923 6.871 380 HG12 VAL 484 HG12 VAL 484 97.330 3.521 5.233 381 HG13 VAL 484 HG13 VAL 484 98.662 4.648 5.486 382 HG21 VAL 484 HG21 VAL 484 98.591 0.902 7.001 383 HG22 VAL 484 HG22 VAL 484 98.837 0.555 5.289 384 HG23 VAL 484 HG23 VAL 484 97.387 1.409 5.816 385 H ASP 485 H ASP 485 99.697 1.084 2.526 386 HA ASP 485 HA ASP 485 97.847 2.887 1.139 387 HB2 ASP 485 HB2 ASP 485 99.898 2.099 -0.048 388 HB3 ASP 485 HB3 ASP 485 99.267 0.458 0.034 389 H LEU 486 H LEU 486 95.990 2.398 2.299 390 HA LEU 486 HA LEU 486 95.029 -0.330 2.428 391 HB2 LEU 486 HB2 LEU 486 94.256 0.651 4.308 392 HB3 LEU 486 HB3 LEU 486 94.299 2.258 3.610 393 HG LEU 486 HG LEU 486 92.156 1.912 2.543 394 HD11 LEU 486 HD11 LEU 486 91.271 -0.507 3.717 395 HD12 LEU 486 HD12 LEU 486 92.792 -0.833 2.887 396 HD13 LEU 486 HD13 LEU 486 91.444 -0.113 2.007 397 HD21 LEU 486 HD21 LEU 486 90.908 1.141 4.804 398 HD22 LEU 486 HD22 LEU 486 91.579 2.752 4.553 399 HD23 LEU 486 HD23 LEU 486 92.501 1.541 5.443 400 H LEU 487 H LEU 487 93.625 -1.278 1.045 401 HA LEU 487 HA LEU 487 93.028 -0.058 -1.428 402 HB2 LEU 487 HB2 LEU 487 92.438 -2.613 -0.094 403 HB3 LEU 487 HB3 LEU 487 91.252 -2.115 -1.287 404 HG LEU 487 HG LEU 487 93.621 -1.721 -2.624 405 HD11 LEU 487 HD11 LEU 487 94.322 -3.285 -0.446 406 HD12 LEU 487 HD12 LEU 487 95.244 -3.072 -1.935 407 HD13 LEU 487 HD13 LEU 487 94.136 -4.435 -1.770 408 HD21 LEU 487 HD21 LEU 487 91.588 -2.727 -3.518 409 HD22 LEU 487 HD22 LEU 487 91.891 -4.192 -2.584 410 HD23 LEU 487 HD23 LEU 487 92.998 -3.724 -3.876 411 H GLU 488 H GLU 488 91.991 1.895 -0.931 412 HA GLU 488 HA GLU 488 89.930 2.545 0.631 413 HB2 GLU 488 HB2 GLU 488 90.758 4.214 -0.814 414 HB3 GLU 488 HB3 GLU 488 90.387 3.272 -2.252 415 HG2 GLU 488 HG2 GLU 488 88.448 4.307 -2.437 416 HG3 GLU 488 HG3 GLU 488 87.964 3.699 -0.855 417 H GLY 489 H GLY 489 88.002 1.723 1.090 418 HA2 GLY 489 HA2 GLY 489 85.847 0.942 0.690 419 HA3 GLY 489 HA3 GLY 489 86.238 0.821 -1.018 420 H ASP 490 H ASP 490 88.547 -0.647 0.980 421 HA ASP 490 HA ASP 490 87.257 -3.272 0.672 422 HB2 ASP 490 HB2 ASP 490 89.368 -2.426 -0.872 423 HB3 ASP 490 HB3 ASP 490 90.179 -3.303 0.423 424 H THR 491 H THR 491 87.830 -4.855 2.194 425 HA THR 491 HA THR 491 88.540 -3.788 4.780 426 HB THR 491 HB THR 491 88.279 -6.337 5.384 427 HG1 THR 491 HG1 THR 491 88.118 -6.792 2.987 428 HG21 THR 491 HG21 THR 491 86.744 -4.641 6.149 429 HG22 THR 491 HG22 THR 491 85.823 -6.014 5.536 430 HG23 THR 491 HG23 THR 491 85.988 -4.556 4.558 431 H GLU 492 H GLU 492 90.518 -4.326 2.410 432 HA GLU 492 HA GLU 492 92.545 -5.636 4.091 433 HB2 GLU 492 HB2 GLU 492 92.956 -5.834 1.188 434 HB3 GLU 492 HB3 GLU 492 93.181 -7.043 2.444 435 HG2 GLU 492 HG2 GLU 492 90.649 -7.229 2.506 436 HG3 GLU 492 HG3 GLU 492 90.657 -6.303 1.007 437 H CYS 493 H CYS 493 94.347 -4.508 4.421 438 HA CYS 493 HA CYS 493 94.946 -2.262 2.616 439 HB2 CYS 493 HB2 CYS 493 95.410 -0.821 4.391 440 HB3 CYS 493 HB3 CYS 493 93.985 -1.684 4.955 441 HG CYS 493 HG CYS 493 96.694 -2.767 5.935 442 H HIS 494 H HIS 494 97.081 -1.926 2.108 443 HA HIS 494 HA HIS 494 99.001 -3.888 3.184 444 HB2 HIS 494 HB2 HIS 494 98.911 -2.800 0.361 445 HB3 HIS 494 HB3 HIS 494 100.066 -3.973 0.987 446 HD1 HIS 494 HD1 HIS 494 96.267 -3.909 1.217 447 HD2 HIS 494 HD2 HIS 494 99.362 -6.318 -0.156 448 HE1 HIS 494 HE1 HIS 494 95.166 -6.022 0.410 449 HE2 HIS 494 HE2 HIS 494 97.066 -7.496 -0.341 450 H ALA 495 H ALA 495 100.271 -2.753 4.528 451 HA ALA 495 HA ALA 495 100.986 -0.013 3.861 452 HB1 ALA 495 HB1 ALA 495 102.156 -1.149 6.289 453 HB2 ALA 495 HB2 ALA 495 100.393 -1.187 6.243 454 HB3 ALA 495 HB3 ALA 495 101.247 0.344 6.054 455 H ARG 496 H ARG 496 102.930 0.674 3.238 456 HA ARG 496 HA ARG 496 104.953 -1.335 2.624 457 HB2 ARG 496 HB2 ARG 496 105.417 1.500 1.912 458 HB3 ARG 496 HB3 ARG 496 105.669 0.044 0.959 459 HG2 ARG 496 HG2 ARG 496 103.223 -0.094 0.608 460 HG3 ARG 496 HG3 ARG 496 103.052 1.441 1.462 461 HD2 ARG 496 HD2 ARG 496 105.005 1.375 -0.754 462 HD3 ARG 496 HD3 ARG 496 103.304 1.254 -1.203 463 HE ARG 496 HE ARG 496 103.459 3.358 0.562 464 HH11 ARG 496 HH11 ARG 496 104.867 2.540 -2.517 465 HH12 ARG 496 HH12 ARG 496 105.015 4.188 -3.032 466 HH21 ARG 496 HH21 ARG 496 103.648 5.528 -0.106 467 HH22 ARG 496 HH22 ARG 496 104.321 5.887 -1.661 468 H PHE 497 H PHE 497 106.842 -1.504 3.681 469 HA PHE 497 HA PHE 497 107.362 0.454 5.822 470 HB2 PHE 497 HB2 PHE 497 108.192 -2.440 5.547 471 HB3 PHE 497 HB3 PHE 497 108.754 -1.375 6.832 472 HD1 PHE 497 HD1 PHE 497 107.768 -1.885 8.832 473 HD2 PHE 497 HD2 PHE 497 105.418 -2.051 5.286 474 HE1 PHE 497 HE1 PHE 497 105.787 -2.457 10.174 475 HE2 PHE 497 HE2 PHE 497 103.434 -2.623 6.623 476 HZ PHE 497 HZ PHE 497 103.617 -2.828 9.070 477 H LYS 498 H LYS 498 109.346 1.453 5.989 478 HA LYS 498 HA LYS 498 110.828 1.853 3.657 479 HB2 LYS 498 HB2 LYS 498 110.817 2.898 6.273 480 HB3 LYS 498 HB3 LYS 498 112.461 2.343 5.978 481 HG2 LYS 498 HG2 LYS 498 112.431 3.652 3.848 482 HG3 LYS 498 HG3 LYS 498 110.881 4.323 4.355 483 HD2 LYS 498 HD2 LYS 498 112.004 5.123 6.443 484 HD3 LYS 498 HD3 LYS 498 113.541 4.608 5.745 485 HE2 LYS 498 HE2 LYS 498 111.676 6.758 4.778 486 HE3 LYS 498 HE3 LYS 498 113.358 6.918 5.283 487 HZ1 LYS 498 HZ1 LYS 498 113.672 5.236 3.285 488 HZ2 LYS 498 HZ2 LYS 498 113.645 6.912 3.049 489 HZ3 LYS 498 HZ3 LYS 498 112.260 5.993 2.742 490 H THR 499 H THR 499 110.905 -0.718 5.878 491 HA THR 499 HA THR 499 113.122 -1.931 4.437 492 HB THR 499 HB THR 499 113.799 -2.706 6.962 493 HG1 THR 499 HG1 THR 499 113.433 -1.152 8.362 494 HG21 THR 499 HG21 THR 499 115.047 -0.240 5.824 495 HG22 THR 499 HG22 THR 499 115.146 -1.764 4.941 496 HG23 THR 499 HG23 THR 499 115.812 -1.644 6.569 497 HA PRO 500 HA PRO 500 110.641 -5.534 4.958 498 HB2 PRO 500 HB2 PRO 500 112.502 -7.467 4.636 499 HB3 PRO 500 HB3 PRO 500 111.947 -6.450 3.302 500 HG2 PRO 500 HG2 PRO 500 114.432 -6.218 4.951 501 HG3 PRO 500 HG3 PRO 500 114.232 -6.045 3.198 502 HD2 PRO 500 HD2 PRO 500 114.408 -3.921 4.885 503 HD3 PRO 500 HD3 PRO 500 113.482 -3.880 3.370 504 H GLU 501 H GLU 501 113.636 -5.379 6.824 505 HA GLU 501 HA GLU 501 113.055 -7.447 8.640 506 HB2 GLU 501 HB2 GLU 501 114.695 -5.030 9.351 507 HB3 GLU 501 HB3 GLU 501 114.899 -6.690 9.893 508 HG2 GLU 501 HG2 GLU 501 115.546 -7.312 7.585 509 HG3 GLU 501 HG3 GLU 501 115.458 -5.608 7.141 510 H ASP 502 H ASP 502 112.259 -4.024 8.638 511 HA ASP 502 HA ASP 502 111.387 -3.805 11.298 512 HB2 ASP 502 HB2 ASP 502 111.698 -2.066 9.220 513 HB3 ASP 502 HB3 ASP 502 109.943 -2.165 9.324 514 H ALA 503 H ALA 503 109.711 -4.816 8.366 515 HA ALA 503 HA ALA 503 107.104 -4.820 9.453 516 HB1 ALA 503 HB1 ALA 503 107.249 -4.830 7.110 517 HB2 ALA 503 HB2 ALA 503 106.618 -6.420 7.541 518 HB3 ALA 503 HB3 ALA 503 108.315 -6.234 7.097 519 H GLN 504 H GLN 504 109.591 -7.328 9.242 520 HA GLN 504 HA GLN 504 108.105 -9.516 10.081 521 HB2 GLN 504 HB2 GLN 504 110.306 -9.879 9.263 522 HB3 GLN 504 HB3 GLN 504 111.010 -8.823 10.480 523 HG2 GLN 504 HG2 GLN 504 110.635 -10.392 12.200 524 HG3 GLN 504 HG3 GLN 504 109.581 -11.368 11.178 525 HE21 GLN 504 HE21 GLN 504 111.406 -12.781 12.331 526 HE22 GLN 504 HE22 GLN 504 112.724 -13.175 11.286 527 H ALA 505 H ALA 505 109.709 -7.031 12.019 528 HA ALA 505 HA ALA 505 109.302 -8.259 14.522 529 HB1 ALA 505 HB1 ALA 505 110.175 -6.368 15.464 530 HB2 ALA 505 HB2 ALA 505 109.377 -5.292 14.317 531 HB3 ALA 505 HB3 ALA 505 110.793 -6.219 13.819 532 H VAL 506 H VAL 506 107.323 -5.961 12.686 533 HA VAL 506 HA VAL 506 105.418 -5.528 14.745 534 HB VAL 506 HB VAL 506 104.924 -5.249 11.783 535 HG11 VAL 506 HG11 VAL 506 103.329 -3.543 12.456 536 HG12 VAL 506 HG12 VAL 506 103.740 -3.804 14.151 537 HG13 VAL 506 HG13 VAL 506 102.949 -5.083 13.228 538 HG21 VAL 506 HG21 VAL 506 105.570 -2.750 12.879 539 HG22 VAL 506 HG22 VAL 506 106.508 -3.690 11.718 540 HG23 VAL 506 HG23 VAL 506 106.813 -3.865 13.447 541 H ILE 507 H ILE 507 105.477 -7.740 11.972 542 HA ILE 507 HA ILE 507 102.876 -8.764 12.331 543 HB ILE 507 HB ILE 507 103.719 -10.766 11.054 544 HG12 ILE 507 HG12 ILE 507 105.996 -10.089 9.870 545 HG13 ILE 507 HG13 ILE 507 106.270 -9.259 11.395 546 HG21 ILE 507 HG21 ILE 507 104.488 -8.338 9.525 547 HG22 ILE 507 HG22 ILE 507 102.850 -8.436 10.173 548 HG23 ILE 507 HG23 ILE 507 103.438 -9.679 9.068 549 HD11 ILE 507 HD11 ILE 507 106.412 -11.205 12.586 550 HD12 ILE 507 HD12 ILE 507 107.079 -11.712 11.035 551 HD13 ILE 507 HD13 ILE 507 105.409 -12.102 11.446 552 H ASN 508 H ASN 508 105.930 -9.567 13.800 553 HA ASN 508 HA ASN 508 105.086 -12.047 14.947 554 HB2 ASN 508 HB2 ASN 508 107.391 -10.182 15.462 555 HB3 ASN 508 HB3 ASN 508 107.088 -11.552 16.525 556 HD21 ASN 508 HD21 ASN 508 109.187 -10.789 14.432 557 HD22 ASN 508 HD22 ASN 508 109.348 -12.225 13.485 558 H ALA 509 H ALA 509 105.199 -8.708 16.012 559 HA ALA 509 HA ALA 509 104.229 -9.248 18.656 560 HB1 ALA 509 HB1 ALA 509 105.627 -7.337 18.368 561 HB2 ALA 509 HB2 ALA 509 104.016 -6.771 18.808 562 HB3 ALA 509 HB3 ALA 509 104.556 -6.674 17.132 563 H TYR 510 H TYR 510 102.800 -8.575 15.579 564 HA TYR 510 HA TYR 510 100.346 -7.526 16.416 565 HB2 TYR 510 HB2 TYR 510 101.495 -8.459 13.955 566 HB3 TYR 510 HB3 TYR 510 99.832 -9.021 14.105 567 HD1 TYR 510 HD1 TYR 510 98.748 -7.657 12.507 568 HD2 TYR 510 HD2 TYR 510 101.236 -5.881 15.465 569 HE1 TYR 510 HE1 TYR 510 97.939 -5.434 11.839 570 HE2 TYR 510 HE2 TYR 510 100.430 -3.649 14.803 571 HH TYR 510 HH TYR 510 98.254 -3.218 12.053 572 H THR 511 H THR 511 101.552 -10.658 16.879 573 HA THR 511 HA THR 511 99.278 -12.243 16.595 574 HB THR 511 HB THR 511 100.239 -13.692 18.365 575 HG1 THR 511 HG1 THR 511 101.473 -12.757 19.801 576 HG21 THR 511 HG21 THR 511 102.415 -12.717 16.525 577 HG22 THR 511 HG22 THR 511 101.062 -13.712 15.984 578 HG23 THR 511 HG23 THR 511 102.196 -14.339 17.181 579 H GLU 512 H GLU 512 100.263 -10.000 19.067 580 HA GLU 512 HA GLU 512 98.436 -10.618 21.083 581 HB2 GLU 512 HB2 GLU 512 100.407 -8.722 20.700 582 HB3 GLU 512 HB3 GLU 512 98.943 -7.754 20.791 583 HG2 GLU 512 HG2 GLU 512 99.843 -7.911 22.978 584 HG3 GLU 512 HG3 GLU 512 98.394 -8.914 22.926 585 H ILE 513 H ILE 513 98.114 -8.410 18.325 586 HA ILE 513 HA ILE 513 95.812 -7.104 18.780 587 HB ILE 513 HB ILE 513 96.411 -8.556 16.197 588 HG12 ILE 513 HG12 ILE 513 98.296 -7.257 16.437 589 HG13 ILE 513 HG13 ILE 513 97.222 -6.087 15.678 590 HG21 ILE 513 HG21 ILE 513 94.082 -7.619 16.511 591 HG22 ILE 513 HG22 ILE 513 94.974 -7.032 15.107 592 HG23 ILE 513 HG23 ILE 513 94.831 -6.022 16.546 593 HD11 ILE 513 HD11 ILE 513 96.631 -5.424 18.108 594 HD12 ILE 513 HD12 ILE 513 98.154 -4.879 17.404 595 HD13 ILE 513 HD13 ILE 513 98.136 -6.252 18.513 596 H ASN 514 H ASN 514 96.036 -10.498 17.771 597 HA ASN 514 HA ASN 514 93.388 -11.112 17.418 598 HB2 ASN 514 HB2 ASN 514 95.034 -12.756 16.912 599 HB3 ASN 514 HB3 ASN 514 95.637 -12.759 18.567 600 HD21 ASN 514 HD21 ASN 514 92.323 -12.872 17.350 601 HD22 ASN 514 HD22 ASN 514 91.923 -14.391 18.072 602 H LYS 515 H LYS 515 95.105 -10.634 20.442 603 HA LYS 515 HA LYS 515 93.445 -11.843 22.264 604 HB2 LYS 515 HB2 LYS 515 94.908 -9.211 22.451 605 HB3 LYS 515 HB3 LYS 515 94.076 -9.937 23.819 606 HG2 LYS 515 HG2 LYS 515 96.343 -11.181 22.276 607 HG3 LYS 515 HG3 LYS 515 96.461 -10.424 23.865 608 HD2 LYS 515 HD2 LYS 515 94.386 -12.301 24.061 609 HD3 LYS 515 HD3 LYS 515 95.683 -13.105 23.175 610 HE2 LYS 515 HE2 LYS 515 95.996 -11.681 25.815 611 HE3 LYS 515 HE3 LYS 515 95.863 -13.426 25.610 612 HZ1 LYS 515 HZ1 LYS 515 97.892 -13.368 24.272 613 HZ2 LYS 515 HZ2 LYS 515 98.162 -12.771 25.833 614 HZ3 LYS 515 HZ3 LYS 515 98.027 -11.700 24.531 615 H LYS 516 H LYS 516 92.806 -9.133 20.262 616 HA LYS 516 HA LYS 516 90.203 -8.748 21.590 617 HB2 LYS 516 HB2 LYS 516 92.112 -6.831 21.344 618 HB3 LYS 516 HB3 LYS 516 91.219 -6.581 19.851 619 HG2 LYS 516 HG2 LYS 516 90.355 -6.194 22.669 620 HG3 LYS 516 HG3 LYS 516 90.117 -5.160 21.259 621 HD2 LYS 516 HD2 LYS 516 88.003 -5.950 21.404 622 HD3 LYS 516 HD3 LYS 516 88.686 -7.299 20.498 623 HE2 LYS 516 HE2 LYS 516 88.361 -8.716 22.189 624 HE3 LYS 516 HE3 LYS 516 89.084 -7.602 23.351 625 HZ1 LYS 516 HZ1 LYS 516 86.331 -7.220 22.344 626 HZ2 LYS 516 HZ2 LYS 516 87.044 -6.569 23.733 627 HZ3 LYS 516 HZ3 LYS 516 86.657 -8.215 23.674 628 H HIS 517 H HIS 517 91.958 -8.710 18.522 629 HA HIS 517 HA HIS 517 89.653 -9.860 17.188 630 HB2 HIS 517 HB2 HIS 517 90.889 -7.495 15.839 631 HB3 HIS 517 HB3 HIS 517 89.276 -8.177 15.645 632 HD1 HIS 517 HD1 HIS 517 87.475 -7.472 17.388 633 HD2 HIS 517 HD2 HIS 517 91.149 -5.585 17.849 634 HE1 HIS 517 HE1 HIS 517 87.058 -5.564 18.974 635 HE2 HIS 517 HE2 HIS 517 89.309 -4.479 19.291 636 H CYS 518 H CYS 518 90.302 -11.393 15.823 637 HA CYS 518 HA CYS 518 93.023 -12.031 15.491 638 HB2 CYS 518 HB2 CYS 518 92.265 -13.779 13.993 639 HB3 CYS 518 HB3 CYS 518 91.175 -13.681 15.372 640 HG CYS 518 HG CYS 518 90.160 -13.734 12.725 641 H TRP 519 H TRP 519 94.468 -11.022 14.272 642 HA TRP 519 HA TRP 519 93.559 -9.814 11.743 643 HB2 TRP 519 HB2 TRP 519 94.609 -8.439 13.848 644 HB3 TRP 519 HB3 TRP 519 96.052 -8.761 12.889 645 HD1 TRP 519 HD1 TRP 519 93.485 -8.571 10.398 646 HE1 TRP 519 HE1 TRP 519 93.279 -6.243 9.384 647 HE3 TRP 519 HE3 TRP 519 96.113 -5.936 13.905 648 HZ2 TRP 519 HZ2 TRP 519 94.120 -3.594 9.978 649 HZ3 TRP 519 HZ3 TRP 519 96.366 -3.507 13.605 650 HH2 TRP 519 HH2 TRP 519 95.390 -2.364 11.681 651 H LYS 520 H LYS 520 94.787 -10.040 9.945 652 HA LYS 520 HA LYS 520 96.846 -12.135 10.073 653 HB2 LYS 520 HB2 LYS 520 95.484 -11.273 7.562 654 HB3 LYS 520 HB3 LYS 520 96.177 -12.840 7.960 655 HG2 LYS 520 HG2 LYS 520 93.676 -11.703 9.192 656 HG3 LYS 520 HG3 LYS 520 93.709 -12.849 7.849 657 HD2 LYS 520 HD2 LYS 520 94.252 -14.598 9.180 658 HD3 LYS 520 HD3 LYS 520 95.264 -13.613 10.238 659 HE2 LYS 520 HE2 LYS 520 93.577 -13.947 11.697 660 HE3 LYS 520 HE3 LYS 520 92.851 -12.594 10.831 661 HZ1 LYS 520 HZ1 LYS 520 92.214 -15.457 10.667 662 HZ2 LYS 520 HZ2 LYS 520 91.930 -14.473 9.320 663 HZ3 LYS 520 HZ3 LYS 520 91.171 -14.131 10.791 664 H LEU 521 H LEU 521 98.858 -11.758 9.315 665 HA LEU 521 HA LEU 521 99.350 -9.293 7.810 666 HB2 LEU 521 HB2 LEU 521 101.152 -10.147 10.064 667 HB3 LEU 521 HB3 LEU 521 101.171 -8.632 9.180 668 HG LEU 521 HG LEU 521 100.279 -8.217 11.362 669 HD11 LEU 521 HD11 LEU 521 98.923 -7.635 9.001 670 HD12 LEU 521 HD12 LEU 521 98.754 -6.821 10.557 671 HD13 LEU 521 HD13 LEU 521 97.673 -8.149 10.135 672 HD21 LEU 521 HD21 LEU 521 97.838 -9.696 11.303 673 HD22 LEU 521 HD22 LEU 521 99.134 -9.738 12.498 674 HD23 LEU 521 HD23 LEU 521 99.194 -10.804 11.095 675 H GLU 522 H GLU 522 100.226 -9.909 5.960 676 HA GLU 522 HA GLU 522 102.282 -12.014 6.017 677 HB2 GLU 522 HB2 GLU 522 100.454 -13.079 4.988 678 HB3 GLU 522 HB3 GLU 522 100.002 -11.634 4.095 679 HG2 GLU 522 HG2 GLU 522 101.680 -11.925 2.523 680 HG3 GLU 522 HG3 GLU 522 102.620 -12.981 3.577 681 H ILE 523 H ILE 523 104.185 -11.362 5.288 682 HA ILE 523 HA ILE 523 104.405 -8.784 3.964 683 HB ILE 523 HB ILE 523 106.514 -10.680 4.997 684 HG12 ILE 523 HG12 ILE 523 106.815 -8.459 6.457 685 HG13 ILE 523 HG13 ILE 523 105.104 -8.293 6.082 686 HG21 ILE 523 HG21 ILE 523 108.066 -8.754 4.626 687 HG22 ILE 523 HG22 ILE 523 106.785 -7.979 3.695 688 HG23 ILE 523 HG23 ILE 523 107.467 -9.512 3.151 689 HD11 ILE 523 HD11 ILE 523 104.763 -10.588 6.987 690 HD12 ILE 523 HD12 ILE 523 105.300 -9.399 8.174 691 HD13 ILE 523 HD13 ILE 523 106.446 -10.566 7.513 692 H LEU 524 H LEU 524 104.382 -8.633 1.824 693 HA LEU 524 HA LEU 524 104.503 -10.843 0.089 694 HB2 LEU 524 HB2 LEU 524 104.813 -7.888 -0.424 695 HB3 LEU 524 HB3 LEU 524 104.760 -9.086 -1.703 696 HG LEU 524 HG LEU 524 102.573 -8.009 -0.028 697 HD11 LEU 524 HD11 LEU 524 101.891 -7.437 -2.055 698 HD12 LEU 524 HD12 LEU 524 101.713 -9.143 -2.465 699 HD13 LEU 524 HD13 LEU 524 103.237 -8.314 -2.781 700 HD21 LEU 524 HD21 LEU 524 102.699 -10.393 0.665 701 HD22 LEU 524 HD22 LEU 524 102.489 -10.854 -1.023 702 HD23 LEU 524 HD23 LEU 524 101.209 -9.981 -0.183 703 H SER 525 H SER 525 106.114 -11.702 -1.134 704 HA SER 525 HA SER 525 108.775 -10.509 -1.024 705 HB2 SER 525 HB2 SER 525 108.059 -12.604 0.676 706 HB3 SER 525 HB3 SER 525 108.951 -13.381 -0.632 707 HG SER 525 HG SER 525 110.683 -12.021 -0.222 708 H GLY 526 H GLY 526 110.299 -11.536 -2.531 709 HA2 GLY 526 HA2 GLY 526 110.816 -12.123 -4.691 710 HA3 GLY 526 HA3 GLY 526 109.664 -13.427 -4.445 711 H ASP 527 H ASP 527 109.135 -13.227 -6.704 712 HA ASP 527 HA ASP 527 108.330 -11.078 -8.127 713 HB2 ASP 527 HB2 ASP 527 107.541 -13.918 -8.097 714 HB3 ASP 527 HB3 ASP 527 106.374 -12.840 -8.856 715 H HIS 528 H HIS 528 106.610 -12.550 -5.461 716 HA HIS 528 HA HIS 528 104.109 -11.310 -5.870 717 HB2 HIS 528 HB2 HIS 528 105.110 -13.148 -4.085 718 HB3 HIS 528 HB3 HIS 528 104.839 -11.738 -3.064 719 HD1 HIS 528 HD1 HIS 528 103.006 -13.551 -2.066 720 HD2 HIS 528 HD2 HIS 528 102.184 -11.783 -5.736 721 HE1 HIS 528 HE1 HIS 528 100.536 -13.862 -2.425 722 HE2 HIS 528 HE2 HIS 528 100.078 -12.857 -4.690 723 H GLU 529 H GLU 529 106.926 -10.356 -3.914 724 HA GLU 529 HA GLU 529 105.753 -7.989 -2.892 725 HB2 GLU 529 HB2 GLU 529 107.813 -7.561 -1.924 726 HB3 GLU 529 HB3 GLU 529 107.880 -9.304 -2.134 727 HG2 GLU 529 HG2 GLU 529 109.131 -8.941 -4.249 728 HG3 GLU 529 HG3 GLU 529 109.167 -7.219 -3.877 729 H GLN 530 H GLN 530 107.912 -8.616 -5.628 730 HA GLN 530 HA GLN 530 108.131 -5.928 -6.471 731 HB2 GLN 530 HB2 GLN 530 109.303 -6.732 -8.286 732 HB3 GLN 530 HB3 GLN 530 109.503 -8.056 -7.149 733 HG2 GLN 530 HG2 GLN 530 108.795 -9.377 -8.784 734 HG3 GLN 530 HG3 GLN 530 107.188 -8.722 -8.473 735 HE21 GLN 530 HE21 GLN 530 106.183 -8.053 -10.219 736 HE22 GLN 530 HE22 GLN 530 106.920 -7.392 -11.636 737 H ARG 531 H ARG 531 105.777 -8.428 -7.032 738 HA ARG 531 HA ARG 531 104.463 -7.331 -9.256 739 HB2 ARG 531 HB2 ARG 531 103.986 -9.580 -8.721 740 HB3 ARG 531 HB3 ARG 531 103.581 -9.185 -7.056 741 HG2 ARG 531 HG2 ARG 531 101.836 -7.750 -8.796 742 HG3 ARG 531 HG3 ARG 531 101.849 -9.454 -9.260 743 HD2 ARG 531 HD2 ARG 531 101.470 -10.019 -6.850 744 HD3 ARG 531 HD3 ARG 531 101.244 -8.297 -6.544 745 HE ARG 531 HE ARG 531 99.140 -8.478 -7.405 746 HH11 ARG 531 HH11 ARG 531 101.036 -11.181 -8.515 747 HH12 ARG 531 HH12 ARG 531 99.700 -11.967 -9.288 748 HH21 ARG 531 HH21 ARG 531 97.373 -9.503 -8.421 749 HH22 ARG 531 HH22 ARG 531 97.617 -11.011 -9.238 750 H TYR 532 H TYR 532 103.637 -7.090 -5.784 751 HA TYR 532 HA TYR 532 101.461 -5.349 -6.123 752 HB2 TYR 532 HB2 TYR 532 101.807 -6.559 -4.044 753 HB3 TYR 532 HB3 TYR 532 103.317 -5.701 -3.759 754 HD1 TYR 532 HD1 TYR 532 103.125 -3.102 -3.573 755 HD2 TYR 532 HD2 TYR 532 99.849 -5.770 -3.088 756 HE1 TYR 532 HE1 TYR 532 101.905 -1.367 -2.328 757 HE2 TYR 532 HE2 TYR 532 98.618 -4.043 -1.843 758 HH TYR 532 HH TYR 532 98.570 -1.862 -1.279 759 H TRP 533 H TRP 533 104.894 -4.694 -5.523 760 HA TRP 533 HA TRP 533 104.681 -1.901 -5.298 761 HB2 TRP 533 HB2 TRP 533 106.895 -3.814 -5.867 762 HB3 TRP 533 HB3 TRP 533 107.172 -2.111 -6.218 763 HD1 TRP 533 HD1 TRP 533 107.263 -4.555 -3.428 764 HE1 TRP 533 HE1 TRP 533 107.635 -3.344 -1.187 765 HE3 TRP 533 HE3 TRP 533 106.440 0.254 -4.956 766 HZ2 TRP 533 HZ2 TRP 533 107.581 -0.702 -0.198 767 HZ3 TRP 533 HZ3 TRP 533 106.620 2.066 -3.301 768 HH2 TRP 533 HH2 TRP 533 107.180 1.597 -0.970 769 H GLN 534 H GLN 534 105.120 -4.022 -8.079 770 HA GLN 534 HA GLN 534 105.635 -2.099 -10.030 771 HB2 GLN 534 HB2 GLN 534 104.244 -4.772 -10.172 772 HB3 GLN 534 HB3 GLN 534 104.555 -3.795 -11.599 773 HG2 GLN 534 HG2 GLN 534 106.933 -4.111 -9.992 774 HG3 GLN 534 HG3 GLN 534 106.245 -5.666 -10.456 775 HE21 GLN 534 HE21 GLN 534 108.272 -3.219 -11.381 776 HE22 GLN 534 HE22 GLN 534 108.350 -3.545 -13.076 777 H LYS 535 H LYS 535 102.575 -3.317 -8.750 778 HA LYS 535 HA LYS 535 100.880 -1.906 -10.503 779 HB2 LYS 535 HB2 LYS 535 99.169 -2.767 -9.271 780 HB3 LYS 535 HB3 LYS 535 100.448 -3.802 -8.655 781 HG2 LYS 535 HG2 LYS 535 100.703 -1.916 -6.862 782 HG3 LYS 535 HG3 LYS 535 99.051 -1.525 -7.339 783 HD2 LYS 535 HD2 LYS 535 98.266 -3.673 -6.722 784 HD3 LYS 535 HD3 LYS 535 99.906 -4.304 -6.564 785 HE2 LYS 535 HE2 LYS 535 98.771 -3.824 -4.397 786 HE3 LYS 535 HE3 LYS 535 100.305 -2.984 -4.617 787 HZ1 LYS 535 HZ1 LYS 535 97.956 -1.536 -5.502 788 HZ2 LYS 535 HZ2 LYS 535 99.304 -0.989 -4.640 789 HZ3 LYS 535 HZ3 LYS 535 98.053 -1.792 -3.832 790 H ILE 536 H ILE 536 102.384 -1.080 -7.431 791 HA ILE 536 HA ILE 536 101.036 1.296 -6.868 792 HB ILE 536 HB ILE 536 103.943 0.680 -6.319 793 HG12 ILE 536 HG12 ILE 536 101.483 0.195 -4.625 794 HG13 ILE 536 HG13 ILE 536 102.432 -1.048 -5.435 795 HG21 ILE 536 HG21 ILE 536 104.042 2.483 -4.947 796 HG22 ILE 536 HG22 ILE 536 102.328 2.404 -4.535 797 HG23 ILE 536 HG23 ILE 536 102.833 3.089 -6.081 798 HD11 ILE 536 HD11 ILE 536 102.857 0.231 -2.889 799 HD12 ILE 536 HD12 ILE 536 104.283 0.351 -3.922 800 HD13 ILE 536 HD13 ILE 536 103.588 -1.228 -3.558 801 H LEU 537 H LEU 537 104.331 1.120 -8.220 802 HA LEU 537 HA LEU 537 104.618 3.720 -8.999 803 HB2 LEU 537 HB2 LEU 537 105.931 1.265 -9.520 804 HB3 LEU 537 HB3 LEU 537 105.728 2.076 -11.061 805 HG LEU 537 HG LEU 537 107.055 3.890 -10.432 806 HD11 LEU 537 HD11 LEU 537 106.323 3.094 -7.663 807 HD12 LEU 537 HD12 LEU 537 106.323 4.687 -8.422 808 HD13 LEU 537 HD13 LEU 537 107.844 3.948 -7.920 809 HD21 LEU 537 HD21 LEU 537 108.209 1.443 -9.103 810 HD22 LEU 537 HD22 LEU 537 109.117 2.906 -9.486 811 HD23 LEU 537 HD23 LEU 537 108.419 1.936 -10.784 812 H VAL 538 H VAL 538 103.134 1.107 -10.895 813 HA VAL 538 HA VAL 538 102.636 2.549 -13.230 814 HB VAL 538 HB VAL 538 101.062 0.280 -12.009 815 HG11 VAL 538 HG11 VAL 538 100.720 0.337 -14.799 816 HG12 VAL 538 HG12 VAL 538 100.406 1.974 -14.221 817 HG13 VAL 538 HG13 VAL 538 99.503 0.615 -13.552 818 HG21 VAL 538 HG21 VAL 538 102.570 -0.256 -14.426 819 HG22 VAL 538 HG22 VAL 538 102.583 -1.099 -12.877 820 HG23 VAL 538 HG23 VAL 538 103.600 0.321 -13.118 821 H ASP 539 H ASP 539 100.758 2.297 -10.250 822 HA ASP 539 HA ASP 539 98.452 3.634 -11.167 823 HB2 ASP 539 HB2 ASP 539 98.493 2.296 -9.101 824 HB3 ASP 539 HB3 ASP 539 99.573 3.473 -8.359 825 H ARG 540 H ARG 540 101.459 4.787 -9.725 826 HA ARG 540 HA ARG 540 100.681 7.461 -9.330 827 HB2 ARG 540 HB2 ARG 540 103.177 5.936 -9.325 828 HB3 ARG 540 HB3 ARG 540 103.383 7.595 -9.867 829 HG2 ARG 540 HG2 ARG 540 103.761 7.465 -7.496 830 HG3 ARG 540 HG3 ARG 540 102.284 8.379 -7.807 831 HD2 ARG 540 HD2 ARG 540 100.934 6.764 -6.926 832 HD3 ARG 540 HD3 ARG 540 102.026 5.454 -7.374 833 HE ARG 540 HE ARG 540 103.119 7.132 -5.336 834 HH11 ARG 540 HH11 ARG 540 100.931 4.491 -5.932 835 HH12 ARG 540 HH12 ARG 540 101.081 3.834 -4.335 836 HH21 ARG 540 HH21 ARG 540 103.323 6.278 -3.229 837 HH22 ARG 540 HH22 ARG 540 102.441 4.850 -2.800 838 H GLN 541 H GLN 541 102.136 5.804 -12.091 839 HA GLN 541 HA GLN 541 102.574 8.077 -13.694 840 HB2 GLN 541 HB2 GLN 541 102.006 5.234 -14.551 841 HB3 GLN 541 HB3 GLN 541 102.687 6.493 -15.574 842 HG2 GLN 541 HG2 GLN 541 104.720 6.471 -14.471 843 HG3 GLN 541 HG3 GLN 541 104.041 5.725 -13.024 844 HE21 GLN 541 HE21 GLN 541 105.343 3.978 -12.886 845 HE22 GLN 541 HE22 GLN 541 105.425 2.730 -14.077 846 H ALA 542 H ALA 542 99.804 5.896 -13.403 847 HA ALA 542 HA ALA 542 98.275 6.974 -15.499 848 HB1 ALA 542 HB1 ALA 542 96.580 6.030 -13.390 849 HB2 ALA 542 HB2 ALA 542 97.957 4.947 -13.587 850 HB3 ALA 542 HB3 ALA 542 96.914 5.307 -14.963 851 H LYS 543 H LYS 543 98.584 7.873 -12.109 852 HA LYS 543 HA LYS 543 96.410 9.648 -11.974 853 HB2 LYS 543 HB2 LYS 543 97.148 10.127 -9.874 854 HB3 LYS 543 HB3 LYS 543 98.113 8.684 -10.149 855 HG2 LYS 543 HG2 LYS 543 99.859 10.404 -11.079 856 HG3 LYS 543 HG3 LYS 543 98.943 11.542 -10.090 857 HD2 LYS 543 HD2 LYS 543 99.616 10.593 -8.134 858 HD3 LYS 543 HD3 LYS 543 99.719 8.975 -8.829 859 HE2 LYS 543 HE2 LYS 543 101.874 10.406 -8.173 860 HE3 LYS 543 HE3 LYS 543 101.864 9.256 -9.510 861 HZ1 LYS 543 HZ1 LYS 543 101.102 12.053 -10.001 862 HZ2 LYS 543 HZ2 LYS 543 101.781 10.927 -11.064 863 HZ3 LYS 543 HZ3 LYS 543 102.741 11.651 -9.874 864 H LEU 544 H LEU 544 99.692 10.052 -13.143 865 HA LEU 544 HA LEU 544 99.902 12.809 -13.211 866 HB2 LEU 544 HB2 LEU 544 101.458 10.760 -14.045 867 HB3 LEU 544 HB3 LEU 544 100.922 11.392 -15.591 868 HG LEU 544 HG LEU 544 101.861 13.471 -13.760 869 HD11 LEU 544 HD11 LEU 544 103.806 11.384 -14.734 870 HD12 LEU 544 HD12 LEU 544 103.369 11.691 -13.053 871 HD13 LEU 544 HD13 LEU 544 104.229 12.921 -13.979 872 HD21 LEU 544 HD21 LEU 544 102.145 14.471 -15.718 873 HD22 LEU 544 HD22 LEU 544 101.589 13.004 -16.525 874 HD23 LEU 544 HD23 LEU 544 103.308 13.241 -16.212 875 H ASN 545 H ASN 545 98.191 10.661 -15.410 876 HA ASN 545 HA ASN 545 96.376 12.590 -16.266 877 HB2 ASN 545 HB2 ASN 545 98.890 12.889 -17.529 878 HB3 ASN 545 HB3 ASN 545 97.801 12.202 -18.730 879 HD21 ASN 545 HD21 ASN 545 98.026 14.781 -16.322 880 HD22 ASN 545 HD22 ASN 545 97.089 15.931 -17.208 881 H GLN 546 H GLN 546 95.087 10.740 -15.867 882 HA GLN 546 HA GLN 546 95.405 8.338 -17.388 883 HB2 GLN 546 HB2 GLN 546 93.504 7.541 -16.265 884 HB3 GLN 546 HB3 GLN 546 94.271 8.611 -15.099 885 HG2 GLN 546 HG2 GLN 546 92.648 10.383 -16.179 886 HG3 GLN 546 HG3 GLN 546 91.728 8.937 -16.592 887 HE21 GLN 546 HE21 GLN 546 92.752 7.552 -14.184 888 HE22 GLN 546 HE22 GLN 546 91.838 8.193 -12.866 889 HA PRO 547 HA PRO 547 93.826 10.079 -21.222 890 HB2 PRO 547 HB2 PRO 547 93.483 7.141 -21.658 891 HB3 PRO 547 HB3 PRO 547 94.160 8.366 -22.738 892 HG2 PRO 547 HG2 PRO 547 95.756 6.709 -21.396 893 HG3 PRO 547 HG3 PRO 547 96.196 8.410 -21.629 894 HD2 PRO 547 HD2 PRO 547 95.219 7.026 -19.187 895 HD3 PRO 547 HD3 PRO 547 96.314 8.413 -19.338 896 H ARG 548 H ARG 548 91.842 10.869 -21.338 897 HA ARG 548 HA ARG 548 89.602 9.373 -20.211 898 HB2 ARG 548 HB2 ARG 548 88.626 11.794 -21.207 899 HB3 ARG 548 HB3 ARG 548 88.987 11.409 -19.531 900 HG2 ARG 548 HG2 ARG 548 91.247 12.274 -19.805 901 HG3 ARG 548 HG3 ARG 548 90.911 12.628 -21.502 902 HD2 ARG 548 HD2 ARG 548 89.437 13.815 -19.153 903 HD3 ARG 548 HD3 ARG 548 90.726 14.617 -20.051 904 HE ARG 548 HE ARG 548 87.988 14.349 -20.836 905 HH11 ARG 548 HH11 ARG 548 91.249 14.649 -22.020 906 HH12 ARG 548 HH12 ARG 548 90.773 15.352 -23.530 907 HH21 ARG 548 HH21 ARG 548 87.350 15.278 -22.820 908 HH22 ARG 548 HH22 ARG 548 88.558 15.709 -23.985 909 H GLU 549 H GLU 549 87.802 8.756 -21.362 910 HA GLU 549 HA GLU 549 86.905 9.402 -23.818 911 HB2 GLU 549 HB2 GLU 549 87.951 7.594 -25.290 912 HB3 GLU 549 HB3 GLU 549 88.937 9.009 -24.941 913 HG2 GLU 549 HG2 GLU 549 90.473 7.384 -24.572 914 HG3 GLU 549 HG3 GLU 549 89.782 7.494 -22.953 915 H LYS 550 H LYS 550 85.464 7.805 -24.785 916 HA LYS 550 HA LYS 550 85.088 5.215 -23.856 917 HB2 LYS 550 HB2 LYS 550 82.943 5.763 -22.473 918 HB3 LYS 550 HB3 LYS 550 84.521 5.832 -21.700 919 HG2 LYS 550 HG2 LYS 550 83.888 7.847 -20.996 920 HG3 LYS 550 HG3 LYS 550 84.227 8.381 -22.643 921 HD2 LYS 550 HD2 LYS 550 82.080 8.855 -22.978 922 HD3 LYS 550 HD3 LYS 550 81.609 7.217 -22.518 923 HE2 LYS 550 HE2 LYS 550 81.968 8.077 -20.093 924 HE3 LYS 550 HE3 LYS 550 81.824 9.674 -20.825 925 HZ1 LYS 550 HZ1 LYS 550 79.635 9.412 -21.164 926 HZ2 LYS 550 HZ2 LYS 550 79.751 8.236 -19.954 927 HZ3 LYS 550 HZ3 LYS 550 79.769 7.778 -21.583 928 H LYS 551 H LYS 551 83.951 4.295 -25.414 929 HA LYS 551 HA LYS 551 81.904 5.898 -26.798 930 HB2 LYS 551 HB2 LYS 551 83.671 3.703 -27.895 931 HB3 LYS 551 HB3 LYS 551 82.361 4.467 -28.785 932 HG2 LYS 551 HG2 LYS 551 84.574 6.113 -27.632 933 HG3 LYS 551 HG3 LYS 551 84.781 5.269 -29.166 934 HD2 LYS 551 HD2 LYS 551 82.570 6.395 -29.847 935 HD3 LYS 551 HD3 LYS 551 82.852 7.458 -28.467 936 HE2 LYS 551 HE2 LYS 551 83.738 8.536 -30.399 937 HE3 LYS 551 HE3 LYS 551 85.099 7.978 -29.428 938 HZ1 LYS 551 HZ1 LYS 551 84.546 7.400 -32.099 939 HZ2 LYS 551 HZ2 LYS 551 84.384 5.954 -31.237 940 HZ3 LYS 551 HZ3 LYS 551 85.829 6.829 -31.155 941 H ARG 552 H ARG 552 80.651 3.938 -28.236 942 HA ARG 552 HA ARG 552 79.475 2.285 -26.104 943 HB2 ARG 552 HB2 ARG 552 77.989 2.701 -28.635 944 HB3 ARG 552 HB3 ARG 552 77.398 2.623 -26.981 945 HG2 ARG 552 HG2 ARG 552 77.019 4.822 -27.500 946 HG3 ARG 552 HG3 ARG 552 78.605 4.918 -26.734 947 HD2 ARG 552 HD2 ARG 552 79.243 4.444 -29.356 948 HD3 ARG 552 HD3 ARG 552 77.810 5.462 -29.495 949 HE ARG 552 HE ARG 552 80.411 6.267 -28.640 950 HH11 ARG 552 HH11 ARG 552 77.009 6.897 -28.259 951 HH12 ARG 552 HH12 ARG 552 77.233 8.553 -27.805 952 HH21 ARG 552 HH21 ARG 552 80.720 8.444 -28.044 953 HH22 ARG 552 HH22 ARG 552 79.346 9.433 -27.683 954 H GLY 553 H GLY 553 80.971 0.571 -26.368 955 HA2 GLY 553 HA2 GLY 553 81.382 -0.707 -28.890 956 HA3 GLY 553 HA3 GLY 553 81.830 -1.347 -27.316 957 H THR 554 H THR 554 80.446 -2.736 -26.243 958 HA THR 554 HA THR 554 78.523 -4.090 -27.915 959 HB THR 554 HB THR 554 78.218 -5.586 -25.933 960 HG1 THR 554 HG1 THR 554 78.958 -4.949 -24.064 961 HG21 THR 554 HG21 THR 554 79.776 -6.553 -27.268 962 HG22 THR 554 HG22 THR 554 80.829 -6.178 -25.903 963 HG23 THR 554 HG23 THR 554 80.793 -5.112 -27.308 964 H GLU 555 H GLU 555 78.504 -1.788 -25.321 965 HA GLU 555 HA GLU 555 76.823 -0.448 -24.545 966 HB2 GLU 555 HB2 GLU 555 75.879 -0.835 -26.922 967 HB3 GLU 555 HB3 GLU 555 74.809 -1.997 -26.150 968 HG2 GLU 555 HG2 GLU 555 74.887 0.588 -24.802 969 HG3 GLU 555 HG3 GLU 555 74.311 0.670 -26.466 970 H LYS 556 H LYS 556 75.835 -0.582 -22.622 971 HA LYS 556 HA LYS 556 75.632 -3.077 -21.297 972 HB2 LYS 556 HB2 LYS 556 74.730 -1.808 -19.428 973 HB3 LYS 556 HB3 LYS 556 76.106 -0.962 -20.124 974 HG2 LYS 556 HG2 LYS 556 73.578 -0.149 -21.305 975 HG3 LYS 556 HG3 LYS 556 73.643 0.121 -19.562 976 HD2 LYS 556 HD2 LYS 556 76.117 0.978 -20.437 977 HD3 LYS 556 HD3 LYS 556 75.025 1.503 -21.721 978 HE2 LYS 556 HE2 LYS 556 73.614 2.206 -19.512 979 HE3 LYS 556 HE3 LYS 556 75.267 2.426 -18.940 980 HZ1 LYS 556 HZ1 LYS 556 74.299 4.433 -19.962 981 HZ2 LYS 556 HZ2 LYS 556 74.189 3.612 -21.438 982 HZ3 LYS 556 HZ3 LYS 556 75.705 3.910 -20.747 983 H LEU 557 H LEU 557 74.220 -3.885 -23.207 984 HA LEU 557 HA LEU 557 71.434 -3.176 -23.073 985 HB2 LEU 557 HB2 LEU 557 72.860 -4.057 -25.095 986 HB3 LEU 557 HB3 LEU 557 72.440 -5.631 -24.452 987 HG LEU 557 HG LEU 557 70.987 -4.514 -26.328 988 HD11 LEU 557 HD11 LEU 557 69.080 -5.535 -24.448 989 HD12 LEU 557 HD12 LEU 557 70.563 -6.489 -24.391 990 HD13 LEU 557 HD13 LEU 557 69.710 -6.275 -25.920 991 HD21 LEU 557 HD21 LEU 557 69.155 -3.204 -25.544 992 HD22 LEU 557 HD22 LEU 557 70.640 -2.436 -24.982 993 HD23 LEU 557 HD23 LEU 557 69.664 -3.392 -23.866 994 H ILE 558 H ILE 558 71.602 -3.713 -20.638 995 HA ILE 558 HA ILE 558 71.247 -5.137 -18.861 996 HB ILE 558 HB ILE 558 69.193 -6.747 -19.668 997 HG12 ILE 558 HG12 ILE 558 69.111 -4.257 -21.387 998 HG13 ILE 558 HG13 ILE 558 69.349 -5.899 -21.978 999 HG21 ILE 558 HG21 ILE 558 68.024 -5.463 -18.254 1000 HG22 ILE 558 HG22 ILE 558 68.360 -3.989 -19.162 1001 HG23 ILE 558 HG23 ILE 558 69.548 -4.608 -18.015 1002 HD11 ILE 558 HD11 ILE 558 66.886 -4.615 -20.895 1003 HD12 ILE 558 HD12 ILE 558 67.080 -6.367 -20.824 1004 HD13 ILE 558 HD13 ILE 558 67.115 -5.538 -22.380 1005 H THR 559 H THR 559 73.426 -6.115 -20.023 1006 HA THR 559 HA THR 559 73.077 -8.884 -20.793 1007 HB THR 559 HB THR 559 75.732 -8.707 -20.502 1008 HG1 THR 559 HG1 THR 559 75.164 -6.074 -21.328 1009 HG21 THR 559 HG21 THR 559 73.940 -7.837 -22.729 1010 HG22 THR 559 HG22 THR 559 74.970 -9.264 -22.610 1011 HG23 THR 559 HG23 THR 559 75.688 -7.679 -22.899 1012 H LYS 560 H LYS 560 72.757 -10.412 -19.319 1013 HA LYS 560 HA LYS 560 74.253 -10.261 -16.788 1014 HB2 LYS 560 HB2 LYS 560 71.577 -9.851 -16.911 1015 HB3 LYS 560 HB3 LYS 560 71.620 -11.596 -16.702 1016 HG2 LYS 560 HG2 LYS 560 72.924 -11.346 -14.671 1017 HG3 LYS 560 HG3 LYS 560 72.960 -9.596 -14.894 1018 HD2 LYS 560 HD2 LYS 560 70.254 -10.556 -15.012 1019 HD3 LYS 560 HD3 LYS 560 71.033 -11.115 -13.529 1020 HE2 LYS 560 HE2 LYS 560 70.738 -8.281 -14.505 1021 HE3 LYS 560 HE3 LYS 560 70.021 -9.005 -13.065 1022 HZ1 LYS 560 HZ1 LYS 560 72.430 -9.393 -12.356 1023 HZ2 LYS 560 HZ2 LYS 560 71.827 -7.817 -12.261 1024 HZ3 LYS 560 HZ3 LYS 560 72.836 -8.258 -13.545 1025 H ALA 561 H ALA 561 75.793 -11.754 -17.345 1026 HA ALA 561 HA ALA 561 76.654 -13.879 -17.316 1027 HB1 ALA 561 HB1 ALA 561 74.496 -14.457 -16.058 1028 HB2 ALA 561 HB2 ALA 561 75.345 -15.764 -16.885 1029 HB3 ALA 561 HB3 ALA 561 73.907 -15.046 -17.613 Start of MODEL 19 1 H1 MET 437 HT1 MET 437 144.402 8.791 9.705 2 H2 MET 437 HT2 MET 437 145.106 10.205 9.033 3 H3 MET 437 HT3 MET 437 143.913 9.338 8.156 4 HA MET 437 HA MET 437 142.817 9.933 10.600 5 HB2 MET 437 HB2 MET 437 144.574 12.050 9.452 6 HB3 MET 437 HB3 MET 437 143.026 12.546 10.120 7 HG2 MET 437 HG2 MET 437 144.865 12.724 11.734 8 HG3 MET 437 HG3 MET 437 143.595 11.622 12.263 9 HE1 MET 437 HE1 MET 437 144.784 10.785 13.972 10 HE2 MET 437 HE2 MET 437 146.542 10.914 13.912 11 HE3 MET 437 HE3 MET 437 145.771 9.329 13.850 12 H HIS 438 H HIS 438 140.704 10.223 10.192 13 HA HIS 438 HA HIS 438 138.748 10.535 9.072 14 HB2 HIS 438 HB2 HIS 438 140.115 12.162 6.967 15 HB3 HIS 438 HB3 HIS 438 138.543 12.405 7.722 16 HD1 HIS 438 HD1 HIS 438 141.488 14.141 7.527 17 HD2 HIS 438 HD2 HIS 438 139.279 12.816 10.787 18 HE1 HIS 438 HE1 HIS 438 142.186 15.602 9.450 19 HE2 HIS 438 HE2 HIS 438 140.895 14.731 11.431 20 H HIS 439 H HIS 439 140.083 8.208 8.517 21 HA HIS 439 HA HIS 439 140.414 7.741 5.731 22 HB2 HIS 439 HB2 HIS 439 141.361 6.404 7.740 23 HB3 HIS 439 HB3 HIS 439 139.807 5.575 7.726 24 HD1 HIS 439 HD1 HIS 439 139.214 4.356 5.376 25 HD2 HIS 439 HD2 HIS 439 143.187 5.411 5.985 26 HE1 HIS 439 HE1 HIS 439 140.532 3.004 3.713 27 HE2 HIS 439 HE2 HIS 439 142.935 3.659 4.100 28 H HIS 440 H HIS 440 137.904 6.621 8.007 29 HA HIS 440 HA HIS 440 135.687 6.185 7.718 30 HB2 HIS 440 HB2 HIS 440 136.013 8.424 6.297 31 HB3 HIS 440 HB3 HIS 440 135.621 7.332 4.972 32 HD1 HIS 440 HD1 HIS 440 133.743 5.931 7.535 33 HD2 HIS 440 HD2 HIS 440 133.375 9.464 5.381 34 HE1 HIS 440 HE1 HIS 440 131.332 6.610 7.764 35 HE2 HIS 440 HE2 HIS 440 131.154 8.796 6.525 36 H HIS 441 H HIS 441 136.007 3.965 7.613 37 HA HIS 441 HA HIS 441 136.677 2.631 5.174 38 HB2 HIS 441 HB2 HIS 441 135.353 1.282 7.509 39 HB3 HIS 441 HB3 HIS 441 136.558 0.640 6.399 40 HD1 HIS 441 HD1 HIS 441 136.183 2.540 9.563 41 HD2 HIS 441 HD2 HIS 441 139.231 1.409 6.974 42 HE1 HIS 441 HE1 HIS 441 138.323 2.948 10.822 43 HE2 HIS 441 HE2 HIS 441 140.155 2.289 9.223 44 H HIS 442 H HIS 442 135.000 3.691 3.853 45 HA HIS 442 HA HIS 442 132.466 2.201 4.015 46 HB2 HIS 442 HB2 HIS 442 132.639 4.876 4.501 47 HB3 HIS 442 HB3 HIS 442 132.334 4.870 2.766 48 HD1 HIS 442 HD1 HIS 442 130.727 4.187 6.045 49 HD2 HIS 442 HD2 HIS 442 129.801 3.853 2.008 50 HE1 HIS 442 HE1 HIS 442 128.243 3.806 5.954 51 HE2 HIS 442 HE2 HIS 442 127.694 3.687 3.498 52 H HIS 443 H HIS 443 133.638 0.759 2.531 53 HA HIS 443 HA HIS 443 134.267 1.726 -0.109 54 HB2 HIS 443 HB2 HIS 443 135.253 -0.326 1.265 55 HB3 HIS 443 HB3 HIS 443 133.950 -1.187 0.452 56 HD1 HIS 443 HD1 HIS 443 134.805 -2.317 -1.561 57 HD2 HIS 443 HD2 HIS 443 136.692 1.331 -0.934 58 HE1 HIS 443 HE1 HIS 443 136.421 -2.058 -3.473 59 HE2 HIS 443 HE2 HIS 443 137.510 0.184 -3.103 60 H SER 444 H SER 444 131.807 2.543 0.143 61 HA SER 444 HA SER 444 129.572 1.129 -0.187 62 HB2 SER 444 HB2 SER 444 130.149 3.706 -0.625 63 HB3 SER 444 HB3 SER 444 129.965 3.187 -2.300 64 HG SER 444 HG SER 444 128.028 3.929 -0.970 65 H ASN 445 H ASN 445 128.364 0.244 -1.949 66 HA ASN 445 HA ASN 445 130.097 -0.930 -4.018 67 HB2 ASN 445 HB2 ASN 445 127.464 -2.168 -3.612 68 HB3 ASN 445 HB3 ASN 445 129.053 -2.916 -3.750 69 HD21 ASN 445 HD21 ASN 445 126.546 -2.035 -1.674 70 HD22 ASN 445 HD22 ASN 445 127.319 -2.413 -0.176 71 H ALA 446 H ALA 446 128.659 -1.665 -5.981 72 HA ALA 446 HA ALA 446 127.869 0.646 -7.332 73 HB1 ALA 446 HB1 ALA 446 126.563 -1.609 -8.494 74 HB2 ALA 446 HB2 ALA 446 128.176 -2.088 -7.963 75 HB3 ALA 446 HB3 ALA 446 127.978 -0.728 -9.069 76 H THR 447 H THR 447 125.481 0.000 -8.612 77 HA THR 447 HA THR 447 123.316 -0.583 -6.947 78 HB THR 447 HB THR 447 124.070 1.517 -5.789 79 HG1 THR 447 HG1 THR 447 121.935 1.077 -5.478 80 HG21 THR 447 HG21 THR 447 123.942 3.613 -6.796 81 HG22 THR 447 HG22 THR 447 122.962 3.018 -8.134 82 HG23 THR 447 HG23 THR 447 124.674 2.609 -8.047 83 H GLY 448 H GLY 448 121.519 -0.832 -8.173 84 HA2 GLY 448 HA2 GLY 448 121.042 0.756 -10.521 85 HA3 GLY 448 HA3 GLY 448 121.566 -0.876 -10.901 86 HA PRO 449 HA PRO 449 117.117 -1.521 -11.072 87 HB2 PRO 449 HB2 PRO 449 118.127 -4.318 -11.292 88 HB3 PRO 449 HB3 PRO 449 116.936 -3.468 -12.283 89 HG2 PRO 449 HG2 PRO 449 119.395 -3.884 -13.203 90 HG3 PRO 449 HG3 PRO 449 118.560 -2.351 -13.513 91 HD2 PRO 449 HD2 PRO 449 120.739 -2.963 -11.564 92 HD3 PRO 449 HD3 PRO 449 120.467 -1.497 -12.530 93 H GLN 450 H GLN 450 116.869 -0.972 -8.836 94 HA GLN 450 HA GLN 450 116.218 -3.265 -7.207 95 HB2 GLN 450 HB2 GLN 450 118.735 -2.116 -6.874 96 HB3 GLN 450 HB3 GLN 450 117.766 -1.412 -5.588 97 HG2 GLN 450 HG2 GLN 450 117.264 -4.225 -5.749 98 HG3 GLN 450 HG3 GLN 450 118.998 -3.926 -5.642 99 HE21 GLN 450 HE21 GLN 450 115.900 -3.262 -4.118 100 HE22 GLN 450 HE22 GLN 450 116.526 -3.007 -2.529 101 H PHE 451 H PHE 451 114.447 -1.592 -8.280 102 HA PHE 451 HA PHE 451 113.766 0.779 -7.130 103 HB2 PHE 451 HB2 PHE 451 111.483 0.347 -7.750 104 HB3 PHE 451 HB3 PHE 451 112.526 -0.370 -8.971 105 HD1 PHE 451 HD1 PHE 451 110.113 -1.010 -6.323 106 HD2 PHE 451 HD2 PHE 451 112.752 -2.790 -9.148 107 HE1 PHE 451 HE1 PHE 451 108.976 -3.170 -6.019 108 HE2 PHE 451 HE2 PHE 451 111.620 -4.953 -8.849 109 HZ PHE 451 HZ PHE 451 109.729 -5.146 -7.283 110 H VAL 452 H VAL 452 113.914 1.235 -5.032 111 HA VAL 452 HA VAL 452 113.785 -0.315 -2.830 112 HB VAL 452 HB VAL 452 112.745 1.687 -1.629 113 HG11 VAL 452 HG11 VAL 452 115.170 2.258 -3.324 114 HG12 VAL 452 HG12 VAL 452 115.182 1.260 -1.871 115 HG13 VAL 452 HG13 VAL 452 114.768 2.971 -1.762 116 HG21 VAL 452 HG21 VAL 452 113.107 3.010 -4.312 117 HG22 VAL 452 HG22 VAL 452 112.476 3.731 -2.830 118 HG23 VAL 452 HG23 VAL 452 111.545 2.495 -3.677 119 H SER 453 H SER 453 112.332 -2.015 -2.831 120 HA SER 453 HA SER 453 109.561 -1.674 -3.407 121 HB2 SER 453 HB2 SER 453 109.391 -3.950 -3.207 122 HB3 SER 453 HB3 SER 453 111.132 -3.815 -3.457 123 HG SER 453 HG SER 453 111.452 -4.504 -1.498 124 H GLY 454 H GLY 454 110.892 -0.191 -0.998 125 HA2 GLY 454 HA2 GLY 454 110.446 0.139 1.272 126 HA3 GLY 454 HA3 GLY 454 108.905 0.520 0.533 127 H VAL 455 H VAL 455 110.198 -2.753 0.723 128 HA VAL 455 HA VAL 455 109.169 -4.645 1.523 129 HB VAL 455 HB VAL 455 108.746 -3.401 4.165 130 HG11 VAL 455 HG11 VAL 455 109.357 -5.943 3.064 131 HG12 VAL 455 HG12 VAL 455 109.026 -5.524 4.745 132 HG13 VAL 455 HG13 VAL 455 110.680 -5.480 4.134 133 HG21 VAL 455 HG21 VAL 455 111.329 -3.190 2.684 134 HG22 VAL 455 HG22 VAL 455 111.349 -3.487 4.423 135 HG23 VAL 455 HG23 VAL 455 110.566 -2.042 3.783 136 H ILE 456 H ILE 456 107.186 -5.016 0.663 137 HA ILE 456 HA ILE 456 104.882 -3.449 1.421 138 HB ILE 456 HB ILE 456 105.078 -5.938 -0.282 139 HG12 ILE 456 HG12 ILE 456 106.253 -4.033 -1.263 140 HG13 ILE 456 HG13 ILE 456 104.777 -4.368 -2.167 141 HG21 ILE 456 HG21 ILE 456 102.773 -4.037 0.133 142 HG22 ILE 456 HG22 ILE 456 102.860 -5.713 0.676 143 HG23 ILE 456 HG23 ILE 456 102.822 -5.346 -1.048 144 HD11 ILE 456 HD11 ILE 456 104.073 -2.301 -1.849 145 HD12 ILE 456 HD12 ILE 456 105.606 -1.935 -1.056 146 HD13 ILE 456 HD13 ILE 456 104.225 -2.473 -0.100 147 H VAL 457 H VAL 457 103.519 -3.876 3.046 148 HA VAL 457 HA VAL 457 103.635 -6.542 4.295 149 HB VAL 457 HB VAL 457 103.015 -3.875 5.571 150 HG11 VAL 457 HG11 VAL 457 102.114 -4.892 7.349 151 HG12 VAL 457 HG12 VAL 457 103.308 -6.189 7.326 152 HG13 VAL 457 HG13 VAL 457 101.893 -6.274 6.278 153 HG21 VAL 457 HG21 VAL 457 104.998 -4.663 7.024 154 HG22 VAL 457 HG22 VAL 457 105.334 -4.021 5.416 155 HG23 VAL 457 HG23 VAL 457 105.339 -5.763 5.688 156 H LYS 458 H LYS 458 101.924 -7.669 3.547 157 HA LYS 458 HA LYS 458 99.439 -6.373 2.876 158 HB2 LYS 458 HB2 LYS 458 100.036 -8.170 1.459 159 HB3 LYS 458 HB3 LYS 458 100.361 -9.238 2.820 160 HG2 LYS 458 HG2 LYS 458 97.885 -9.027 3.367 161 HG3 LYS 458 HG3 LYS 458 97.710 -8.319 1.761 162 HD2 LYS 458 HD2 LYS 458 99.272 -10.696 1.553 163 HD3 LYS 458 HD3 LYS 458 97.809 -11.055 2.473 164 HE2 LYS 458 HE2 LYS 458 96.473 -10.790 0.689 165 HE3 LYS 458 HE3 LYS 458 97.368 -9.389 0.103 166 HZ1 LYS 458 HZ1 LYS 458 97.945 -10.831 -1.508 167 HZ2 LYS 458 HZ2 LYS 458 97.690 -12.202 -0.552 168 HZ3 LYS 458 HZ3 LYS 458 99.122 -11.315 -0.392 169 H ILE 459 H ILE 459 97.879 -5.930 4.251 170 HA ILE 459 HA ILE 459 97.619 -7.563 6.690 171 HB ILE 459 HB ILE 459 96.690 -4.712 6.319 172 HG12 ILE 459 HG12 ILE 459 99.152 -5.905 7.563 173 HG13 ILE 459 HG13 ILE 459 99.023 -4.534 6.467 174 HG21 ILE 459 HG21 ILE 459 96.924 -6.034 8.974 175 HG22 ILE 459 HG22 ILE 459 95.553 -6.467 7.951 176 HG23 ILE 459 HG23 ILE 459 95.804 -4.786 8.426 177 HD11 ILE 459 HD11 ILE 459 99.612 -3.828 8.715 178 HD12 ILE 459 HD12 ILE 459 98.144 -4.576 9.345 179 HD13 ILE 459 HD13 ILE 459 98.032 -3.200 8.247 180 H ILE 460 H ILE 460 95.839 -8.733 6.876 181 HA ILE 460 HA ILE 460 93.433 -7.886 5.417 182 HB ILE 460 HB ILE 460 94.663 -9.734 4.210 183 HG12 ILE 460 HG12 ILE 460 92.072 -9.186 4.288 184 HG13 ILE 460 HG13 ILE 460 92.686 -10.580 3.407 185 HG21 ILE 460 HG21 ILE 460 93.988 -11.152 6.749 186 HG22 ILE 460 HG22 ILE 460 95.494 -11.149 5.830 187 HG23 ILE 460 HG23 ILE 460 94.094 -12.041 5.231 188 HD11 ILE 460 HD11 ILE 460 91.484 -10.590 6.162 189 HD12 ILE 460 HD12 ILE 460 92.159 -11.998 5.342 190 HD13 ILE 460 HD13 ILE 460 90.738 -11.188 4.681 191 H SER 461 H SER 461 91.565 -8.039 6.533 192 HA SER 461 HA SER 461 91.659 -9.438 9.124 193 HB2 SER 461 HB2 SER 461 90.480 -7.693 10.194 194 HB3 SER 461 HB3 SER 461 91.709 -6.878 9.229 195 HG SER 461 HG SER 461 89.009 -6.726 9.066 196 H THR 462 H THR 462 89.058 -9.048 9.885 197 HA THR 462 HA THR 462 87.536 -10.442 7.776 198 HB THR 462 HB THR 462 86.301 -11.463 9.853 199 HG1 THR 462 HG1 THR 462 87.919 -11.886 11.527 200 HG21 THR 462 HG21 THR 462 87.979 -12.468 8.047 201 HG22 THR 462 HG22 THR 462 87.388 -13.415 9.412 202 HG23 THR 462 HG23 THR 462 88.985 -12.670 9.483 203 H GLU 463 H GLU 463 87.659 -7.807 9.907 204 HA GLU 463 HA GLU 463 85.498 -6.458 8.940 205 HB2 GLU 463 HB2 GLU 463 84.635 -8.624 10.613 206 HB3 GLU 463 HB3 GLU 463 84.202 -7.098 11.370 207 HG2 GLU 463 HG2 GLU 463 83.486 -7.958 8.576 208 HG3 GLU 463 HG3 GLU 463 82.404 -7.925 9.966 209 HA PRO 464 HA PRO 464 86.537 -5.063 13.681 210 HB2 PRO 464 HB2 PRO 464 89.239 -6.319 13.324 211 HB3 PRO 464 HB3 PRO 464 88.346 -5.984 14.814 212 HG2 PRO 464 HG2 PRO 464 88.397 -8.442 13.757 213 HG3 PRO 464 HG3 PRO 464 86.946 -7.803 14.547 214 HD2 PRO 464 HD2 PRO 464 87.459 -8.302 11.685 215 HD3 PRO 464 HD3 PRO 464 85.916 -8.181 12.550 216 H LEU 465 H LEU 465 88.506 -5.301 10.778 217 HA LEU 465 HA LEU 465 90.318 -3.316 10.976 218 HB2 LEU 465 HB2 LEU 465 89.105 -4.675 8.868 219 HB3 LEU 465 HB3 LEU 465 88.847 -2.980 8.496 220 HG LEU 465 HG LEU 465 91.593 -3.649 9.318 221 HD11 LEU 465 HD11 LEU 465 91.702 -4.333 6.668 222 HD12 LEU 465 HD12 LEU 465 90.253 -5.169 7.225 223 HD13 LEU 465 HD13 LEU 465 91.798 -5.455 8.026 224 HD21 LEU 465 HD21 LEU 465 90.716 -2.269 6.811 225 HD22 LEU 465 HD22 LEU 465 92.167 -2.011 7.780 226 HD23 LEU 465 HD23 LEU 465 90.601 -1.459 8.373 227 HA PRO 466 HA PRO 466 87.569 0.045 12.246 228 HB2 PRO 466 HB2 PRO 466 89.580 1.626 13.161 229 HB3 PRO 466 HB3 PRO 466 88.899 0.293 14.100 230 HG2 PRO 466 HG2 PRO 466 91.394 0.359 12.438 231 HG3 PRO 466 HG3 PRO 466 91.147 -0.328 14.056 232 HD2 PRO 466 HD2 PRO 466 91.175 -1.858 11.837 233 HD3 PRO 466 HD3 PRO 466 90.138 -2.236 13.228 234 H GLY 467 H GLY 467 90.654 0.534 10.526 235 HA2 GLY 467 HA2 GLY 467 89.841 1.650 8.228 236 HA3 GLY 467 HA3 GLY 467 89.669 2.998 9.342 237 H ARG 468 H ARG 468 91.301 3.642 7.475 238 HA ARG 468 HA ARG 468 93.955 2.731 7.605 239 HB2 ARG 468 HB2 ARG 468 94.520 4.816 6.420 240 HB3 ARG 468 HB3 ARG 468 93.131 4.006 5.707 241 HG2 ARG 468 HG2 ARG 468 91.816 5.628 7.333 242 HG3 ARG 468 HG3 ARG 468 93.289 6.584 7.161 243 HD2 ARG 468 HD2 ARG 468 93.046 6.566 4.747 244 HD3 ARG 468 HD3 ARG 468 91.624 5.532 4.876 245 HE ARG 468 HE ARG 468 90.847 7.622 6.316 246 HH11 ARG 468 HH11 ARG 468 92.452 7.482 3.230 247 HH12 ARG 468 HH12 ARG 468 91.758 8.961 2.655 248 HH21 ARG 468 HH21 ARG 468 89.925 9.572 5.570 249 HH22 ARG 468 HH22 ARG 468 90.322 10.150 3.986 250 H LYS 469 H LYS 469 92.306 5.394 9.270 251 HA LYS 469 HA LYS 469 94.584 6.459 10.532 252 HB2 LYS 469 HB2 LYS 469 93.093 7.717 11.870 253 HB3 LYS 469 HB3 LYS 469 92.291 7.528 10.317 254 HG2 LYS 469 HG2 LYS 469 90.946 5.698 11.246 255 HG3 LYS 469 HG3 LYS 469 91.732 5.932 12.809 256 HD2 LYS 469 HD2 LYS 469 90.869 8.463 12.172 257 HD3 LYS 469 HD3 LYS 469 89.573 7.440 11.548 258 HE2 LYS 469 HE2 LYS 469 89.202 8.145 13.886 259 HE3 LYS 469 HE3 LYS 469 89.296 6.394 13.701 260 HZ1 LYS 469 HZ1 LYS 469 91.308 6.299 14.762 261 HZ2 LYS 469 HZ2 LYS 469 90.593 7.588 15.593 262 HZ3 LYS 469 HZ3 LYS 469 91.730 7.892 14.379 263 H GLN 470 H GLN 470 92.209 4.062 11.620 264 HA GLN 470 HA GLN 470 93.492 3.664 14.148 265 HB2 GLN 470 HB2 GLN 470 91.259 2.310 12.675 266 HB3 GLN 470 HB3 GLN 470 91.956 1.553 14.101 267 HG2 GLN 470 HG2 GLN 470 91.080 4.396 14.249 268 HG3 GLN 470 HG3 GLN 470 89.870 3.113 14.291 269 HE21 GLN 470 HE21 GLN 470 92.174 4.866 16.051 270 HE22 GLN 470 HE22 GLN 470 92.075 3.980 17.531 271 H VAL 471 H VAL 471 93.392 1.896 11.079 272 HA VAL 471 HA VAL 471 94.943 -0.300 11.913 273 HB VAL 471 HB VAL 471 94.642 0.883 9.149 274 HG11 VAL 471 HG11 VAL 471 96.303 -1.268 10.148 275 HG12 VAL 471 HG12 VAL 471 96.285 -0.501 8.561 276 HG13 VAL 471 HG13 VAL 471 95.175 -1.825 8.913 277 HG21 VAL 471 HG21 VAL 471 93.333 -1.648 9.693 278 HG22 VAL 471 HG22 VAL 471 92.682 -0.170 8.988 279 HG23 VAL 471 HG23 VAL 471 92.753 -0.354 10.741 280 H ARG 472 H ARG 472 95.805 2.798 10.446 281 HA ARG 472 HA ARG 472 98.559 2.292 10.156 282 HB2 ARG 472 HB2 ARG 472 98.811 4.601 9.735 283 HB3 ARG 472 HB3 ARG 472 97.207 4.201 9.137 284 HG2 ARG 472 HG2 ARG 472 96.147 5.275 10.918 285 HG3 ARG 472 HG3 ARG 472 97.618 5.307 11.892 286 HD2 ARG 472 HD2 ARG 472 97.119 6.869 9.363 287 HD3 ARG 472 HD3 ARG 472 97.116 7.516 11.003 288 HE ARG 472 HE ARG 472 99.563 6.502 10.885 289 HH11 ARG 472 HH11 ARG 472 97.814 8.392 8.539 290 HH12 ARG 472 HH12 ARG 472 99.237 9.137 7.890 291 HH21 ARG 472 HH21 ARG 472 101.441 7.481 10.039 292 HH22 ARG 472 HH22 ARG 472 101.296 8.620 8.743 293 H ASP 473 H ASP 473 96.630 3.607 12.803 294 HA ASP 473 HA ASP 473 98.804 4.306 14.477 295 HB2 ASP 473 HB2 ASP 473 96.304 4.985 14.640 296 HB3 ASP 473 HB3 ASP 473 96.112 3.475 15.527 297 H THR 474 H THR 474 96.980 1.351 13.989 298 HA THR 474 HA THR 474 97.951 -0.074 16.234 299 HB THR 474 HB THR 474 97.422 -2.076 14.519 300 HG1 THR 474 HG1 THR 474 95.726 0.002 13.586 301 HG21 THR 474 HG21 THR 474 95.061 -0.552 15.516 302 HG22 THR 474 HG22 THR 474 96.221 -1.203 16.675 303 HG23 THR 474 HG23 THR 474 95.384 -2.285 15.562 304 H LEU 475 H LEU 475 98.832 -0.342 12.788 305 HA LEU 475 HA LEU 475 101.072 -1.996 13.211 306 HB2 LEU 475 HB2 LEU 475 101.749 -1.235 10.914 307 HB3 LEU 475 HB3 LEU 475 100.141 -1.923 11.029 308 HG LEU 475 HG LEU 475 99.552 0.696 11.347 309 HD11 LEU 475 HD11 LEU 475 101.813 0.668 9.360 310 HD12 LEU 475 HD12 LEU 475 101.961 1.275 11.009 311 HD13 LEU 475 HD13 LEU 475 100.850 2.050 9.881 312 HD21 LEU 475 HD21 LEU 475 99.406 -1.282 9.259 313 HD22 LEU 475 HD22 LEU 475 99.595 0.334 8.579 314 HD23 LEU 475 HD23 LEU 475 98.262 -0.008 9.682 315 H ALA 476 H ALA 476 100.669 1.497 13.006 316 HA ALA 476 HA ALA 476 103.434 2.125 13.120 317 HB1 ALA 476 HB1 ALA 476 101.040 3.808 13.858 318 HB2 ALA 476 HB2 ALA 476 101.834 3.746 12.284 319 HB3 ALA 476 HB3 ALA 476 102.690 4.404 13.678 320 H ALA 477 H ALA 477 101.061 1.239 15.474 321 HA ALA 477 HA ALA 477 102.425 2.308 17.746 322 HB1 ALA 477 HB1 ALA 477 100.348 0.123 17.621 323 HB2 ALA 477 HB2 ALA 477 100.023 1.845 17.819 324 HB3 ALA 477 HB3 ALA 477 100.886 0.960 19.076 325 H ILE 478 H ILE 478 102.557 -0.649 15.903 326 HA ILE 478 HA ILE 478 104.149 -2.059 17.868 327 HB ILE 478 HB ILE 478 104.012 -2.872 14.989 328 HG12 ILE 478 HG12 ILE 478 101.715 -2.339 15.494 329 HG13 ILE 478 HG13 ILE 478 101.898 -4.089 15.518 330 HG21 ILE 478 HG21 ILE 478 103.861 -5.140 16.149 331 HG22 ILE 478 HG22 ILE 478 104.278 -4.273 17.629 332 HG23 ILE 478 HG23 ILE 478 105.392 -4.272 16.261 333 HD11 ILE 478 HD11 ILE 478 101.999 -2.427 18.012 334 HD12 ILE 478 HD12 ILE 478 101.774 -4.171 17.861 335 HD13 ILE 478 HD13 ILE 478 100.497 -3.068 17.348 336 H SER 479 H SER 479 104.669 -0.127 15.008 337 HA SER 479 HA SER 479 107.372 0.414 15.668 338 HB2 SER 479 HB2 SER 479 108.532 -1.106 14.488 339 HB3 SER 479 HB3 SER 479 107.019 -1.984 14.263 340 HG SER 479 HG SER 479 108.433 -0.401 12.492 341 H GLU 480 H GLU 480 108.407 1.845 14.062 342 HA GLU 480 HA GLU 480 106.489 3.687 13.000 343 HB2 GLU 480 HB2 GLU 480 108.944 4.045 13.971 344 HB3 GLU 480 HB3 GLU 480 109.370 3.896 12.271 345 HG2 GLU 480 HG2 GLU 480 108.344 5.845 11.694 346 HG3 GLU 480 HG3 GLU 480 107.164 5.741 13.001 347 H VAL 481 H VAL 481 105.511 3.490 11.111 348 HA VAL 481 HA VAL 481 106.836 1.961 8.974 349 HB VAL 481 HB VAL 481 104.636 1.650 7.981 350 HG11 VAL 481 HG11 VAL 481 104.318 -0.145 9.251 351 HG12 VAL 481 HG12 VAL 481 103.832 0.839 10.631 352 HG13 VAL 481 HG13 VAL 481 105.539 0.500 10.348 353 HG21 VAL 481 HG21 VAL 481 103.437 3.021 10.373 354 HG22 VAL 481 HG22 VAL 481 102.633 2.498 8.893 355 HG23 VAL 481 HG23 VAL 481 103.753 3.860 8.855 356 H LEU 482 H LEU 482 106.465 2.705 6.749 357 HA LEU 482 HA LEU 482 106.950 5.540 6.556 358 HB2 LEU 482 HB2 LEU 482 107.592 3.257 5.027 359 HB3 LEU 482 HB3 LEU 482 106.601 4.275 4.000 360 HG LEU 482 HG LEU 482 108.989 5.374 5.460 361 HD11 LEU 482 HD11 LEU 482 109.703 5.020 2.796 362 HD12 LEU 482 HD12 LEU 482 108.972 3.488 3.276 363 HD13 LEU 482 HD13 LEU 482 110.331 4.142 4.190 364 HD21 LEU 482 HD21 LEU 482 108.819 7.182 4.009 365 HD22 LEU 482 HD22 LEU 482 107.138 6.804 4.381 366 HD23 LEU 482 HD23 LEU 482 107.839 6.285 2.848 367 H TYR 483 H TYR 483 104.725 3.423 4.725 368 HA TYR 483 HA TYR 483 102.581 5.365 5.148 369 HB2 TYR 483 HB2 TYR 483 103.384 6.259 3.133 370 HB3 TYR 483 HB3 TYR 483 103.755 4.670 2.471 371 HD1 TYR 483 HD1 TYR 483 101.266 7.263 2.792 372 HD2 TYR 483 HD2 TYR 483 101.868 3.185 1.736 373 HE1 TYR 483 HE1 TYR 483 99.100 7.250 1.626 374 HE2 TYR 483 HE2 TYR 483 99.704 3.162 0.567 375 HH TYR 483 HH TYR 483 97.820 6.090 0.123 376 H VAL 484 H VAL 484 100.535 4.503 5.087 377 HA VAL 484 HA VAL 484 100.408 1.579 4.782 378 HB VAL 484 HB VAL 484 99.753 2.128 6.978 379 HG11 VAL 484 HG11 VAL 484 97.667 3.821 7.078 380 HG12 VAL 484 HG12 VAL 484 98.532 4.483 5.690 381 HG13 VAL 484 HG13 VAL 484 99.347 4.332 7.247 382 HG21 VAL 484 HG21 VAL 484 98.186 0.658 5.545 383 HG22 VAL 484 HG22 VAL 484 97.076 2.024 5.639 384 HG23 VAL 484 HG23 VAL 484 97.617 1.224 7.113 385 H ASP 485 H ASP 485 99.386 0.793 3.067 386 HA ASP 485 HA ASP 485 97.664 2.568 1.505 387 HB2 ASP 485 HB2 ASP 485 99.656 0.868 0.722 388 HB3 ASP 485 HB3 ASP 485 98.224 -0.118 0.443 389 H LEU 486 H LEU 486 95.530 2.299 1.318 390 HA LEU 486 HA LEU 486 94.336 -0.213 2.281 391 HB2 LEU 486 HB2 LEU 486 94.193 2.089 3.702 392 HB3 LEU 486 HB3 LEU 486 92.777 2.264 2.682 393 HG LEU 486 HG LEU 486 93.325 -0.062 4.529 394 HD11 LEU 486 HD11 LEU 486 92.578 1.319 6.107 395 HD12 LEU 486 HD12 LEU 486 91.004 1.192 5.321 396 HD13 LEU 486 HD13 LEU 486 92.080 2.533 4.927 397 HD21 LEU 486 HD21 LEU 486 90.756 -0.317 3.972 398 HD22 LEU 486 HD22 LEU 486 91.999 -1.038 2.948 399 HD23 LEU 486 HD23 LEU 486 91.245 0.485 2.478 400 H LEU 487 H LEU 487 92.979 -1.129 0.840 401 HA LEU 487 HA LEU 487 92.390 0.319 -1.593 402 HB2 LEU 487 HB2 LEU 487 92.403 -2.471 -0.711 403 HB3 LEU 487 HB3 LEU 487 91.076 -2.082 -1.790 404 HG LEU 487 HG LEU 487 93.543 -1.001 -2.819 405 HD11 LEU 487 HD11 LEU 487 94.902 -2.614 -1.985 406 HD12 LEU 487 HD12 LEU 487 94.288 -3.484 -3.390 407 HD13 LEU 487 HD13 LEU 487 93.592 -3.779 -1.796 408 HD21 LEU 487 HD21 LEU 487 91.999 -1.264 -4.453 409 HD22 LEU 487 HD22 LEU 487 91.275 -2.681 -3.695 410 HD23 LEU 487 HD23 LEU 487 92.776 -2.840 -4.606 411 H GLU 488 H GLU 488 90.692 1.598 -1.743 412 HA GLU 488 HA GLU 488 88.686 2.592 -1.259 413 HB2 GLU 488 HB2 GLU 488 88.072 -0.269 -1.903 414 HB3 GLU 488 HB3 GLU 488 86.769 0.842 -1.497 415 HG2 GLU 488 HG2 GLU 488 88.082 2.310 -3.320 416 HG3 GLU 488 HG3 GLU 488 88.453 0.688 -3.903 417 H GLY 489 H GLY 489 90.169 1.610 1.089 418 HA2 GLY 489 HA2 GLY 489 89.826 1.613 3.363 419 HA3 GLY 489 HA3 GLY 489 88.165 2.088 3.043 420 H ASP 490 H ASP 490 88.840 -0.690 1.349 421 HA ASP 490 HA ASP 490 87.028 -2.298 2.686 422 HB2 ASP 490 HB2 ASP 490 88.406 -2.535 0.384 423 HB3 ASP 490 HB3 ASP 490 89.306 -3.677 1.379 424 H THR 491 H THR 491 88.325 -4.745 3.140 425 HA THR 491 HA THR 491 89.532 -4.184 5.741 426 HB THR 491 HB THR 491 89.233 -6.663 6.107 427 HG1 THR 491 HG1 THR 491 87.404 -7.345 4.494 428 HG21 THR 491 HG21 THR 491 87.301 -4.573 6.095 429 HG22 THR 491 HG22 THR 491 87.390 -5.986 7.146 430 HG23 THR 491 HG23 THR 491 86.504 -6.074 5.623 431 H GLU 492 H GLU 492 90.784 -4.242 2.866 432 HA GLU 492 HA GLU 492 93.124 -5.841 3.667 433 HB2 GLU 492 HB2 GLU 492 93.472 -6.069 1.109 434 HB3 GLU 492 HB3 GLU 492 92.292 -7.102 1.906 435 HG2 GLU 492 HG2 GLU 492 91.350 -4.522 0.790 436 HG3 GLU 492 HG3 GLU 492 91.756 -5.816 -0.337 437 H CYS 493 H CYS 493 94.853 -4.629 3.983 438 HA CYS 493 HA CYS 493 95.358 -2.342 2.224 439 HB2 CYS 493 HB2 CYS 493 96.346 -1.470 4.645 440 HB3 CYS 493 HB3 CYS 493 94.841 -0.939 3.909 441 HG CYS 493 HG CYS 493 94.974 -2.221 6.513 442 H HIS 494 H HIS 494 97.559 -1.852 1.927 443 HA HIS 494 HA HIS 494 99.435 -3.822 3.048 444 HB2 HIS 494 HB2 HIS 494 99.305 -2.749 0.230 445 HB3 HIS 494 HB3 HIS 494 100.691 -3.625 0.871 446 HD1 HIS 494 HD1 HIS 494 96.956 -4.368 1.038 447 HD2 HIS 494 HD2 HIS 494 100.535 -6.121 -0.136 448 HE1 HIS 494 HE1 HIS 494 96.353 -6.692 0.292 449 HE2 HIS 494 HE2 HIS 494 98.521 -7.701 -0.499 450 H ALA 495 H ALA 495 100.582 -2.697 4.509 451 HA ALA 495 HA ALA 495 101.275 0.074 4.027 452 HB1 ALA 495 HB1 ALA 495 100.768 -0.118 6.238 453 HB2 ALA 495 HB2 ALA 495 102.507 -0.392 6.322 454 HB3 ALA 495 HB3 ALA 495 101.397 -1.762 6.357 455 H ARG 496 H ARG 496 103.206 0.843 3.445 456 HA ARG 496 HA ARG 496 105.303 -1.072 2.748 457 HB2 ARG 496 HB2 ARG 496 105.425 1.859 2.127 458 HB3 ARG 496 HB3 ARG 496 106.108 0.506 1.237 459 HG2 ARG 496 HG2 ARG 496 103.445 -0.025 1.068 460 HG3 ARG 496 HG3 ARG 496 103.464 1.740 1.052 461 HD2 ARG 496 HD2 ARG 496 105.550 0.887 -0.637 462 HD3 ARG 496 HD3 ARG 496 104.142 -0.097 -1.036 463 HE ARG 496 HE ARG 496 104.527 2.613 -1.702 464 HH11 ARG 496 HH11 ARG 496 102.067 0.434 -0.551 465 HH12 ARG 496 HH12 ARG 496 100.761 1.336 -1.243 466 HH21 ARG 496 HH21 ARG 496 102.814 3.812 -2.616 467 HH22 ARG 496 HH22 ARG 496 101.185 3.256 -2.417 468 H PHE 497 H PHE 497 107.169 -1.216 3.798 469 HA PHE 497 HA PHE 497 107.708 0.689 5.978 470 HB2 PHE 497 HB2 PHE 497 108.517 -2.204 5.630 471 HB3 PHE 497 HB3 PHE 497 109.123 -1.166 6.917 472 HD1 PHE 497 HD1 PHE 497 108.203 -1.744 8.930 473 HD2 PHE 497 HD2 PHE 497 105.735 -1.761 5.462 474 HE1 PHE 497 HE1 PHE 497 106.263 -2.336 10.319 475 HE2 PHE 497 HE2 PHE 497 103.789 -2.350 6.847 476 HZ PHE 497 HZ PHE 497 104.050 -2.638 9.279 477 H LYS 498 H LYS 498 109.902 1.344 6.349 478 HA LYS 498 HA LYS 498 111.371 1.711 3.891 479 HB2 LYS 498 HB2 LYS 498 111.039 3.383 5.879 480 HB3 LYS 498 HB3 LYS 498 112.410 2.533 6.578 481 HG2 LYS 498 HG2 LYS 498 113.879 3.458 5.152 482 HG3 LYS 498 HG3 LYS 498 112.759 3.394 3.789 483 HD2 LYS 498 HD2 LYS 498 111.982 5.474 4.170 484 HD3 LYS 498 HD3 LYS 498 112.010 5.270 5.922 485 HE2 LYS 498 HE2 LYS 498 114.066 6.164 6.119 486 HE3 LYS 498 HE3 LYS 498 114.655 5.381 4.652 487 HZ1 LYS 498 HZ1 LYS 498 114.662 7.662 4.196 488 HZ2 LYS 498 HZ2 LYS 498 113.141 7.913 4.893 489 HZ3 LYS 498 HZ3 LYS 498 113.271 7.087 3.422 490 H THR 499 H THR 499 111.436 -0.467 6.538 491 HA THR 499 HA THR 499 113.893 -1.667 5.477 492 HB THR 499 HB THR 499 114.440 -2.251 7.946 493 HG1 THR 499 HG1 THR 499 112.455 -0.325 8.222 494 HG21 THR 499 HG21 THR 499 116.106 -0.781 7.720 495 HG22 THR 499 HG22 THR 499 114.999 0.591 7.714 496 HG23 THR 499 HG23 THR 499 115.323 -0.285 6.220 497 HA PRO 500 HA PRO 500 111.605 -5.420 5.812 498 HB2 PRO 500 HB2 PRO 500 113.611 -7.221 5.916 499 HB3 PRO 500 HB3 PRO 500 113.233 -6.311 4.448 500 HG2 PRO 500 HG2 PRO 500 115.390 -5.850 6.468 501 HG3 PRO 500 HG3 PRO 500 115.464 -5.729 4.701 502 HD2 PRO 500 HD2 PRO 500 115.214 -3.570 6.362 503 HD3 PRO 500 HD3 PRO 500 114.619 -3.600 4.689 504 H GLU 501 H GLU 501 114.235 -4.975 8.144 505 HA GLU 501 HA GLU 501 113.500 -6.998 9.943 506 HB2 GLU 501 HB2 GLU 501 114.770 -5.595 11.630 507 HB3 GLU 501 HB3 GLU 501 115.659 -6.060 10.185 508 HG2 GLU 501 HG2 GLU 501 114.597 -3.663 9.442 509 HG3 GLU 501 HG3 GLU 501 114.901 -3.415 11.161 510 H ASP 502 H ASP 502 112.492 -3.619 9.704 511 HA ASP 502 HA ASP 502 111.070 -3.488 12.121 512 HB2 ASP 502 HB2 ASP 502 111.555 -1.779 9.930 513 HB3 ASP 502 HB3 ASP 502 109.805 -1.877 10.099 514 H ALA 503 H ALA 503 110.101 -4.530 8.889 515 HA ALA 503 HA ALA 503 107.343 -4.803 9.459 516 HB1 ALA 503 HB1 ALA 503 108.629 -6.549 7.421 517 HB2 ALA 503 HB2 ALA 503 108.644 -4.803 7.172 518 HB3 ALA 503 HB3 ALA 503 107.111 -5.656 7.348 519 H GLN 504 H GLN 504 110.067 -7.053 9.610 520 HA GLN 504 HA GLN 504 108.603 -9.379 10.194 521 HB2 GLN 504 HB2 GLN 504 111.367 -8.577 10.113 522 HB3 GLN 504 HB3 GLN 504 111.075 -9.550 11.549 523 HG2 GLN 504 HG2 GLN 504 111.287 -11.344 10.275 524 HG3 GLN 504 HG3 GLN 504 109.767 -10.899 9.499 525 HE21 GLN 504 HE21 GLN 504 113.164 -11.153 9.175 526 HE22 GLN 504 HE22 GLN 504 113.276 -10.631 7.532 527 H ALA 505 H ALA 505 110.014 -6.909 12.295 528 HA ALA 505 HA ALA 505 109.436 -8.176 14.741 529 HB1 ALA 505 HB1 ALA 505 109.417 -5.494 15.339 530 HB2 ALA 505 HB2 ALA 505 110.415 -5.577 13.886 531 HB3 ALA 505 HB3 ALA 505 110.836 -6.541 15.302 532 H VAL 506 H VAL 506 107.560 -5.868 12.798 533 HA VAL 506 HA VAL 506 105.526 -5.489 14.736 534 HB VAL 506 HB VAL 506 105.788 -3.860 12.989 535 HG11 VAL 506 HG11 VAL 506 106.616 -5.271 11.211 536 HG12 VAL 506 HG12 VAL 506 105.207 -4.371 10.648 537 HG13 VAL 506 HG13 VAL 506 105.052 -6.075 11.081 538 HG21 VAL 506 HG21 VAL 506 103.557 -3.429 12.598 539 HG22 VAL 506 HG22 VAL 506 103.467 -4.561 13.948 540 HG23 VAL 506 HG23 VAL 506 103.171 -5.124 12.303 541 H ILE 507 H ILE 507 105.789 -7.674 11.953 542 HA ILE 507 HA ILE 507 103.186 -8.739 12.156 543 HB ILE 507 HB ILE 507 104.125 -10.719 10.908 544 HG12 ILE 507 HG12 ILE 507 106.438 -10.008 9.838 545 HG13 ILE 507 HG13 ILE 507 106.629 -9.157 11.362 546 HG21 ILE 507 HG21 ILE 507 104.932 -8.892 9.007 547 HG22 ILE 507 HG22 ILE 507 103.874 -7.955 10.061 548 HG23 ILE 507 HG23 ILE 507 103.279 -9.431 9.300 549 HD11 ILE 507 HD11 ILE 507 106.817 -11.075 12.566 550 HD12 ILE 507 HD12 ILE 507 107.475 -11.624 11.025 551 HD13 ILE 507 HD13 ILE 507 105.807 -12.001 11.457 552 H ASN 508 H ASN 508 106.187 -9.545 13.734 553 HA ASN 508 HA ASN 508 105.304 -12.031 14.832 554 HB2 ASN 508 HB2 ASN 508 107.596 -10.176 15.413 555 HB3 ASN 508 HB3 ASN 508 107.255 -11.533 16.483 556 HD21 ASN 508 HD21 ASN 508 109.104 -10.598 13.993 557 HD22 ASN 508 HD22 ASN 508 109.408 -12.125 13.243 558 H ALA 509 H ALA 509 105.388 -8.702 15.941 559 HA ALA 509 HA ALA 509 104.350 -9.280 18.552 560 HB1 ALA 509 HB1 ALA 509 104.873 -7.162 19.036 561 HB2 ALA 509 HB2 ALA 509 104.034 -6.533 17.616 562 HB3 ALA 509 HB3 ALA 509 105.678 -7.154 17.466 563 H TYR 510 H TYR 510 102.992 -8.563 15.447 564 HA TYR 510 HA TYR 510 100.486 -7.585 16.285 565 HB2 TYR 510 HB2 TYR 510 101.753 -8.228 13.812 566 HB3 TYR 510 HB3 TYR 510 100.146 -8.952 13.835 567 HD1 TYR 510 HD1 TYR 510 99.136 -7.524 12.192 568 HD2 TYR 510 HD2 TYR 510 101.061 -5.861 15.600 569 HE1 TYR 510 HE1 TYR 510 98.152 -5.332 11.666 570 HE2 TYR 510 HE2 TYR 510 100.079 -3.661 15.085 571 HH TYR 510 HH TYR 510 97.600 -3.245 12.775 572 H THR 511 H THR 511 101.766 -10.774 16.337 573 HA THR 511 HA THR 511 99.565 -12.376 15.918 574 HB THR 511 HB THR 511 101.717 -13.366 16.423 575 HG1 THR 511 HG1 THR 511 99.908 -14.647 17.020 576 HG21 THR 511 HG21 THR 511 101.489 -12.703 19.321 577 HG22 THR 511 HG22 THR 511 102.148 -11.495 18.218 578 HG23 THR 511 HG23 THR 511 102.920 -13.074 18.359 579 H GLU 512 H GLU 512 100.409 -10.421 18.695 580 HA GLU 512 HA GLU 512 98.396 -11.333 20.446 581 HB2 GLU 512 HB2 GLU 512 100.014 -8.801 20.310 582 HB3 GLU 512 HB3 GLU 512 98.789 -9.043 21.548 583 HG2 GLU 512 HG2 GLU 512 101.001 -11.016 21.097 584 HG3 GLU 512 HG3 GLU 512 101.195 -9.609 22.142 585 H ILE 513 H ILE 513 98.348 -9.101 17.797 586 HA ILE 513 HA ILE 513 96.300 -7.401 18.253 587 HB ILE 513 HB ILE 513 96.646 -9.038 15.738 588 HG12 ILE 513 HG12 ILE 513 98.546 -7.499 16.756 589 HG13 ILE 513 HG13 ILE 513 98.222 -7.523 15.026 590 HG21 ILE 513 HG21 ILE 513 95.496 -7.159 14.625 591 HG22 ILE 513 HG22 ILE 513 95.167 -6.452 16.206 592 HG23 ILE 513 HG23 ILE 513 94.464 -8.010 15.774 593 HD11 ILE 513 HD11 ILE 513 97.377 -5.419 15.018 594 HD12 ILE 513 HD12 ILE 513 98.475 -5.274 16.391 595 HD13 ILE 513 HD13 ILE 513 96.754 -5.542 16.663 596 H ASN 514 H ASN 514 95.986 -10.859 17.567 597 HA ASN 514 HA ASN 514 93.225 -10.999 17.254 598 HB2 ASN 514 HB2 ASN 514 94.612 -12.901 16.737 599 HB3 ASN 514 HB3 ASN 514 95.160 -13.014 18.407 600 HD21 ASN 514 HD21 ASN 514 91.912 -12.505 17.108 601 HD22 ASN 514 HD22 ASN 514 91.219 -13.923 17.812 602 H LYS 515 H LYS 515 95.149 -10.636 20.129 603 HA LYS 515 HA LYS 515 93.383 -11.505 22.088 604 HB2 LYS 515 HB2 LYS 515 94.674 -10.320 23.630 605 HB3 LYS 515 HB3 LYS 515 95.801 -10.630 22.317 606 HG2 LYS 515 HG2 LYS 515 95.297 -8.340 21.453 607 HG3 LYS 515 HG3 LYS 515 94.368 -8.058 22.927 608 HD2 LYS 515 HD2 LYS 515 97.318 -8.594 22.666 609 HD3 LYS 515 HD3 LYS 515 96.527 -7.156 23.312 610 HE2 LYS 515 HE2 LYS 515 96.973 -8.130 25.296 611 HE3 LYS 515 HE3 LYS 515 95.498 -9.031 24.947 612 HZ1 LYS 515 HZ1 LYS 515 97.679 -10.315 23.718 613 HZ2 LYS 515 HZ2 LYS 515 96.664 -10.898 24.940 614 HZ3 LYS 515 HZ3 LYS 515 98.063 -10.037 25.342 615 H LYS 516 H LYS 516 93.307 -8.668 20.104 616 HA LYS 516 HA LYS 516 90.979 -7.661 21.601 617 HB2 LYS 516 HB2 LYS 516 93.233 -6.286 20.944 618 HB3 LYS 516 HB3 LYS 516 92.213 -5.924 19.558 619 HG2 LYS 516 HG2 LYS 516 91.867 -5.173 22.415 620 HG3 LYS 516 HG3 LYS 516 91.691 -4.192 20.958 621 HD2 LYS 516 HD2 LYS 516 89.490 -4.436 21.398 622 HD3 LYS 516 HD3 LYS 516 89.715 -5.975 20.562 623 HE2 LYS 516 HE2 LYS 516 89.185 -7.104 22.399 624 HE3 LYS 516 HE3 LYS 516 90.430 -6.262 23.320 625 HZ1 LYS 516 HZ1 LYS 516 88.303 -5.891 24.328 626 HZ2 LYS 516 HZ2 LYS 516 87.641 -5.345 22.871 627 HZ3 LYS 516 HZ3 LYS 516 88.835 -4.434 23.651 628 H HIS 517 H HIS 517 92.279 -8.156 18.344 629 HA HIS 517 HA HIS 517 89.683 -8.962 17.376 630 HB2 HIS 517 HB2 HIS 517 90.895 -6.825 15.711 631 HB3 HIS 517 HB3 HIS 517 89.200 -7.229 15.968 632 HD1 HIS 517 HD1 HIS 517 88.002 -6.105 17.957 633 HD2 HIS 517 HD2 HIS 517 91.976 -4.974 17.516 634 HE1 HIS 517 HE1 HIS 517 88.294 -4.088 19.431 635 HE2 HIS 517 HE2 HIS 517 90.701 -3.406 19.131 636 H CYS 518 H CYS 518 89.931 -10.528 15.895 637 HA CYS 518 HA CYS 518 92.396 -11.621 15.253 638 HB2 CYS 518 HB2 CYS 518 90.226 -12.806 15.058 639 HB3 CYS 518 HB3 CYS 518 89.855 -11.847 13.630 640 HG CYS 518 HG CYS 518 91.852 -14.186 13.751 641 H TRP 519 H TRP 519 93.991 -10.904 14.015 642 HA TRP 519 HA TRP 519 93.348 -9.528 11.513 643 HB2 TRP 519 HB2 TRP 519 94.075 -8.053 13.671 644 HB3 TRP 519 HB3 TRP 519 95.647 -8.372 12.939 645 HD1 TRP 519 HD1 TRP 519 93.453 -8.345 10.115 646 HE1 TRP 519 HE1 TRP 519 93.336 -6.062 8.986 647 HE3 TRP 519 HE3 TRP 519 95.509 -5.503 13.834 648 HZ2 TRP 519 HZ2 TRP 519 94.025 -3.370 9.586 649 HZ3 TRP 519 HZ3 TRP 519 95.744 -3.085 13.472 650 HH2 TRP 519 HH2 TRP 519 95.020 -2.046 11.389 651 H LYS 520 H LYS 520 94.765 -9.805 9.887 652 HA LYS 520 HA LYS 520 96.865 -11.808 10.344 653 HB2 LYS 520 HB2 LYS 520 95.765 -11.144 7.651 654 HB3 LYS 520 HB3 LYS 520 96.424 -12.668 8.235 655 HG2 LYS 520 HG2 LYS 520 93.814 -11.517 9.190 656 HG3 LYS 520 HG3 LYS 520 93.946 -12.636 7.831 657 HD2 LYS 520 HD2 LYS 520 94.440 -14.415 9.165 658 HD3 LYS 520 HD3 LYS 520 95.263 -13.423 10.369 659 HE2 LYS 520 HE2 LYS 520 93.378 -13.983 11.537 660 HE3 LYS 520 HE3 LYS 520 92.830 -12.492 10.770 661 HZ1 LYS 520 HZ1 LYS 520 91.892 -13.920 8.973 662 HZ2 LYS 520 HZ2 LYS 520 91.148 -14.116 10.479 663 HZ3 LYS 520 HZ3 LYS 520 92.247 -15.274 9.922 664 H LEU 521 H LEU 521 98.936 -11.324 9.919 665 HA LEU 521 HA LEU 521 99.508 -8.912 8.338 666 HB2 LEU 521 HB2 LEU 521 99.938 -9.177 11.082 667 HB3 LEU 521 HB3 LEU 521 101.516 -9.444 10.367 668 HG LEU 521 HG LEU 521 99.786 -6.989 10.141 669 HD11 LEU 521 HD11 LEU 521 101.649 -7.679 12.006 670 HD12 LEU 521 HD12 LEU 521 101.210 -6.025 11.575 671 HD13 LEU 521 HD13 LEU 521 102.620 -6.783 10.838 672 HD21 LEU 521 HD21 LEU 521 100.985 -7.823 7.978 673 HD22 LEU 521 HD22 LEU 521 102.434 -7.227 8.787 674 HD23 LEU 521 HD23 LEU 521 101.096 -6.129 8.455 675 H GLU 522 H GLU 522 100.561 -9.515 6.565 676 HA GLU 522 HA GLU 522 102.669 -11.551 6.805 677 HB2 GLU 522 HB2 GLU 522 100.530 -12.472 5.817 678 HB3 GLU 522 HB3 GLU 522 100.780 -11.384 4.458 679 HG2 GLU 522 HG2 GLU 522 102.138 -12.836 3.501 680 HG3 GLU 522 HG3 GLU 522 103.179 -12.849 4.925 681 H ILE 523 H ILE 523 104.500 -11.195 5.621 682 HA ILE 523 HA ILE 523 104.700 -8.575 4.327 683 HB ILE 523 HB ILE 523 106.847 -10.492 5.243 684 HG12 ILE 523 HG12 ILE 523 106.617 -7.743 6.321 685 HG13 ILE 523 HG13 ILE 523 105.338 -8.861 6.784 686 HG21 ILE 523 HG21 ILE 523 107.356 -9.085 3.174 687 HG22 ILE 523 HG22 ILE 523 108.484 -8.977 4.525 688 HG23 ILE 523 HG23 ILE 523 107.304 -7.694 4.257 689 HD11 ILE 523 HD11 ILE 523 107.433 -8.627 8.273 690 HD12 ILE 523 HD12 ILE 523 108.197 -9.661 7.067 691 HD13 ILE 523 HD13 ILE 523 106.779 -10.232 7.946 692 H LEU 524 H LEU 524 104.620 -8.434 2.183 693 HA LEU 524 HA LEU 524 104.527 -10.691 0.493 694 HB2 LEU 524 HB2 LEU 524 104.499 -7.759 0.154 695 HB3 LEU 524 HB3 LEU 524 105.054 -8.676 -1.234 696 HG LEU 524 HG LEU 524 102.525 -8.059 -0.980 697 HD11 LEU 524 HD11 LEU 524 101.928 -10.117 -2.204 698 HD12 LEU 524 HD12 LEU 524 103.498 -10.798 -1.778 699 HD13 LEU 524 HD13 LEU 524 103.407 -9.367 -2.806 700 HD21 LEU 524 HD21 LEU 524 102.513 -10.680 0.482 701 HD22 LEU 524 HD22 LEU 524 101.186 -9.545 0.240 702 HD23 LEU 524 HD23 LEU 524 102.505 -9.138 1.337 703 H SER 525 H SER 525 106.001 -11.557 -0.928 704 HA SER 525 HA SER 525 108.702 -10.484 -1.024 705 HB2 SER 525 HB2 SER 525 108.178 -12.355 0.885 706 HB3 SER 525 HB3 SER 525 108.658 -13.382 -0.466 707 HG SER 525 HG SER 525 110.597 -12.895 0.198 708 H GLY 526 H GLY 526 110.088 -11.661 -2.572 709 HA2 GLY 526 HA2 GLY 526 110.444 -12.363 -4.726 710 HA3 GLY 526 HA3 GLY 526 109.236 -13.583 -4.361 711 H ASP 527 H ASP 527 108.830 -13.338 -6.700 712 HA ASP 527 HA ASP 527 107.983 -11.212 -8.105 713 HB2 ASP 527 HB2 ASP 527 106.306 -13.708 -8.155 714 HB3 ASP 527 HB3 ASP 527 106.758 -12.657 -9.494 715 H HIS 528 H HIS 528 106.271 -12.688 -5.442 716 HA HIS 528 HA HIS 528 103.749 -11.506 -5.890 717 HB2 HIS 528 HB2 HIS 528 104.706 -13.321 -4.114 718 HB3 HIS 528 HB3 HIS 528 104.572 -11.903 -3.078 719 HD1 HIS 528 HD1 HIS 528 102.573 -12.678 -1.735 720 HD2 HIS 528 HD2 HIS 528 101.901 -12.740 -5.835 721 HE1 HIS 528 HE1 HIS 528 100.110 -13.108 -2.005 722 HE2 HIS 528 HE2 HIS 528 99.723 -13.133 -4.495 723 H GLU 529 H GLU 529 106.529 -10.463 -3.935 724 HA GLU 529 HA GLU 529 105.321 -8.070 -3.001 725 HB2 GLU 529 HB2 GLU 529 107.120 -8.692 -1.695 726 HB3 GLU 529 HB3 GLU 529 108.097 -9.167 -3.076 727 HG2 GLU 529 HG2 GLU 529 108.957 -7.108 -3.349 728 HG3 GLU 529 HG3 GLU 529 107.456 -6.301 -2.895 729 H GLN 530 H GLN 530 107.537 -8.773 -5.671 730 HA GLN 530 HA GLN 530 107.803 -6.119 -6.585 731 HB2 GLN 530 HB2 GLN 530 108.994 -6.987 -8.350 732 HB3 GLN 530 HB3 GLN 530 109.111 -8.321 -7.213 733 HG2 GLN 530 HG2 GLN 530 108.586 -9.362 -9.209 734 HG3 GLN 530 HG3 GLN 530 107.027 -9.240 -8.399 735 HE21 GLN 530 HE21 GLN 530 106.067 -9.471 -10.481 736 HE22 GLN 530 HE22 GLN 530 105.954 -8.116 -11.546 737 H ARG 531 H ARG 531 105.497 -8.667 -7.316 738 HA ARG 531 HA ARG 531 104.187 -7.526 -9.490 739 HB2 ARG 531 HB2 ARG 531 103.707 -9.784 -8.914 740 HB3 ARG 531 HB3 ARG 531 103.221 -9.339 -7.285 741 HG2 ARG 531 HG2 ARG 531 101.461 -7.902 -8.766 742 HG3 ARG 531 HG3 ARG 531 101.691 -9.327 -9.781 743 HD2 ARG 531 HD2 ARG 531 101.453 -10.279 -7.156 744 HD3 ARG 531 HD3 ARG 531 100.205 -9.047 -7.337 745 HE ARG 531 HE ARG 531 100.349 -11.603 -8.685 746 HH11 ARG 531 HH11 ARG 531 98.939 -8.423 -8.603 747 HH12 ARG 531 HH12 ARG 531 97.554 -8.867 -9.543 748 HH21 ARG 531 HH21 ARG 531 98.529 -12.206 -9.927 749 HH22 ARG 531 HH22 ARG 531 97.321 -11.022 -10.297 750 H TYR 532 H TYR 532 103.286 -7.331 -6.039 751 HA TYR 532 HA TYR 532 101.149 -5.579 -6.302 752 HB2 TYR 532 HB2 TYR 532 101.675 -6.713 -4.194 753 HB3 TYR 532 HB3 TYR 532 103.151 -5.765 -4.036 754 HD1 TYR 532 HD1 TYR 532 102.946 -3.261 -3.744 755 HD2 TYR 532 HD2 TYR 532 99.621 -5.888 -3.402 756 HE1 TYR 532 HE1 TYR 532 101.701 -1.521 -2.541 757 HE2 TYR 532 HE2 TYR 532 98.365 -4.153 -2.195 758 HH TYR 532 HH TYR 532 99.810 -0.977 -1.519 759 H TRP 533 H TRP 533 104.606 -4.918 -6.000 760 HA TRP 533 HA TRP 533 104.426 -2.126 -5.825 761 HB2 TRP 533 HB2 TRP 533 106.557 -4.075 -6.517 762 HB3 TRP 533 HB3 TRP 533 106.813 -2.400 -7.009 763 HD1 TRP 533 HD1 TRP 533 107.361 -4.613 -4.149 764 HE1 TRP 533 HE1 TRP 533 107.829 -3.263 -2.010 765 HE3 TRP 533 HE3 TRP 533 105.887 0.002 -5.768 766 HZ2 TRP 533 HZ2 TRP 533 107.596 -0.581 -1.124 767 HZ3 TRP 533 HZ3 TRP 533 106.041 1.905 -4.218 768 HH2 TRP 533 HH2 TRP 533 106.879 1.616 -1.944 769 H GLN 534 H GLN 534 104.443 -4.308 -8.590 770 HA GLN 534 HA GLN 534 104.794 -2.421 -10.622 771 HB2 GLN 534 HB2 GLN 534 103.261 -5.018 -10.540 772 HB3 GLN 534 HB3 GLN 534 103.362 -4.043 -11.999 773 HG2 GLN 534 HG2 GLN 534 105.801 -4.987 -10.531 774 HG3 GLN 534 HG3 GLN 534 105.004 -5.958 -11.769 775 HE21 GLN 534 HE21 GLN 534 104.929 -5.150 -13.914 776 HE22 GLN 534 HE22 GLN 534 106.104 -4.012 -14.471 777 H LYS 535 H LYS 535 101.964 -3.403 -8.788 778 HA LYS 535 HA LYS 535 100.030 -1.948 -10.234 779 HB2 LYS 535 HB2 LYS 535 99.687 -2.160 -7.289 780 HB3 LYS 535 HB3 LYS 535 98.537 -2.477 -8.574 781 HG2 LYS 535 HG2 LYS 535 99.544 -4.631 -8.995 782 HG3 LYS 535 HG3 LYS 535 100.797 -4.310 -7.796 783 HD2 LYS 535 HD2 LYS 535 97.884 -4.838 -7.375 784 HD3 LYS 535 HD3 LYS 535 99.279 -5.618 -6.627 785 HE2 LYS 535 HE2 LYS 535 98.571 -4.291 -4.898 786 HE3 LYS 535 HE3 LYS 535 99.720 -3.209 -5.685 787 HZ1 LYS 535 HZ1 LYS 535 98.096 -1.824 -6.344 788 HZ2 LYS 535 HZ2 LYS 535 97.223 -2.521 -5.075 789 HZ3 LYS 535 HZ3 LYS 535 96.990 -3.066 -6.659 790 H ILE 536 H ILE 536 102.117 -1.132 -7.511 791 HA ILE 536 HA ILE 536 101.050 1.431 -6.998 792 HB ILE 536 HB ILE 536 103.822 0.352 -6.473 793 HG12 ILE 536 HG12 ILE 536 101.386 0.650 -4.701 794 HG13 ILE 536 HG13 ILE 536 102.055 -0.864 -5.302 795 HG21 ILE 536 HG21 ILE 536 104.453 2.328 -5.671 796 HG22 ILE 536 HG22 ILE 536 102.962 2.501 -4.745 797 HG23 ILE 536 HG23 ILE 536 103.015 3.009 -6.432 798 HD11 ILE 536 HD11 ILE 536 103.893 0.855 -3.766 799 HD12 ILE 536 HD12 ILE 536 103.703 -0.899 -3.766 800 HD13 ILE 536 HD13 ILE 536 102.567 0.111 -2.870 801 H LEU 537 H LEU 537 104.208 0.707 -8.501 802 HA LEU 537 HA LEU 537 104.859 3.160 -9.466 803 HB2 LEU 537 HB2 LEU 537 105.415 0.397 -10.323 804 HB3 LEU 537 HB3 LEU 537 105.660 1.617 -11.559 805 HG LEU 537 HG LEU 537 107.077 2.830 -9.750 806 HD11 LEU 537 HD11 LEU 537 107.082 0.007 -8.694 807 HD12 LEU 537 HD12 LEU 537 106.427 1.425 -7.875 808 HD13 LEU 537 HD13 LEU 537 108.162 1.300 -8.174 809 HD21 LEU 537 HD21 LEU 537 108.652 0.522 -10.454 810 HD22 LEU 537 HD22 LEU 537 108.765 2.181 -11.042 811 HD23 LEU 537 HD23 LEU 537 107.658 1.045 -11.813 812 H VAL 538 H VAL 538 103.198 0.728 -11.481 813 HA VAL 538 HA VAL 538 102.564 2.384 -13.606 814 HB VAL 538 HB VAL 538 100.931 0.065 -12.561 815 HG11 VAL 538 HG11 VAL 538 100.650 0.143 -15.294 816 HG12 VAL 538 HG12 VAL 538 100.590 1.846 -14.838 817 HG13 VAL 538 HG13 VAL 538 99.462 0.698 -14.116 818 HG21 VAL 538 HG21 VAL 538 103.476 -0.133 -13.272 819 HG22 VAL 538 HG22 VAL 538 102.765 -0.170 -14.885 820 HG23 VAL 538 HG23 VAL 538 102.295 -1.374 -13.686 821 H ASP 539 H ASP 539 100.814 1.864 -10.583 822 HA ASP 539 HA ASP 539 98.479 3.282 -11.277 823 HB2 ASP 539 HB2 ASP 539 98.510 1.797 -9.358 824 HB3 ASP 539 HB3 ASP 539 99.734 2.788 -8.568 825 H ARG 540 H ARG 540 101.556 4.297 -9.888 826 HA ARG 540 HA ARG 540 100.825 6.932 -9.221 827 HB2 ARG 540 HB2 ARG 540 102.942 5.673 -8.552 828 HB3 ARG 540 HB3 ARG 540 103.568 6.080 -10.144 829 HG2 ARG 540 HG2 ARG 540 104.252 8.031 -9.368 830 HG3 ARG 540 HG3 ARG 540 102.584 8.466 -8.988 831 HD2 ARG 540 HD2 ARG 540 103.548 6.650 -7.009 832 HD3 ARG 540 HD3 ARG 540 104.715 7.958 -7.201 833 HE ARG 540 HE ARG 540 102.252 8.134 -5.883 834 HH11 ARG 540 HH11 ARG 540 104.164 9.902 -8.195 835 HH12 ARG 540 HH12 ARG 540 103.518 11.444 -7.746 836 HH21 ARG 540 HH21 ARG 540 101.394 10.163 -5.283 837 HH22 ARG 540 HH22 ARG 540 101.944 11.593 -6.092 838 H GLN 541 H GLN 541 102.088 5.497 -12.190 839 HA GLN 541 HA GLN 541 102.464 7.890 -13.626 840 HB2 GLN 541 HB2 GLN 541 101.723 5.214 -14.809 841 HB3 GLN 541 HB3 GLN 541 102.610 6.517 -15.587 842 HG2 GLN 541 HG2 GLN 541 104.526 6.131 -14.275 843 HG3 GLN 541 HG3 GLN 541 103.643 5.092 -13.158 844 HE21 GLN 541 HE21 GLN 541 104.646 3.192 -13.366 845 HE22 GLN 541 HE22 GLN 541 104.844 2.330 -14.850 846 H ALA 542 H ALA 542 99.686 5.711 -13.370 847 HA ALA 542 HA ALA 542 98.073 6.981 -15.288 848 HB1 ALA 542 HB1 ALA 542 96.269 5.908 -13.527 849 HB2 ALA 542 HB2 ALA 542 97.712 4.933 -13.250 850 HB3 ALA 542 HB3 ALA 542 97.029 5.057 -14.871 851 H LYS 543 H LYS 543 98.514 7.583 -11.841 852 HA LYS 543 HA LYS 543 96.341 9.273 -11.410 853 HB2 LYS 543 HB2 LYS 543 98.866 8.677 -10.070 854 HB3 LYS 543 HB3 LYS 543 98.335 10.336 -9.820 855 HG2 LYS 543 HG2 LYS 543 96.905 9.648 -8.283 856 HG3 LYS 543 HG3 LYS 543 96.085 8.647 -9.484 857 HD2 LYS 543 HD2 LYS 543 96.748 7.218 -7.692 858 HD3 LYS 543 HD3 LYS 543 97.812 6.882 -9.059 859 HE2 LYS 543 HE2 LYS 543 99.280 6.993 -7.263 860 HE3 LYS 543 HE3 LYS 543 99.390 8.603 -7.972 861 HZ1 LYS 543 HZ1 LYS 543 99.017 8.204 -5.393 862 HZ2 LYS 543 HZ2 LYS 543 97.397 8.220 -5.878 863 HZ3 LYS 543 HZ3 LYS 543 98.388 9.553 -6.199 864 H LEU 544 H LEU 544 99.493 9.946 -12.817 865 HA LEU 544 HA LEU 544 99.430 12.731 -12.781 866 HB2 LEU 544 HB2 LEU 544 101.473 12.081 -13.488 867 HB3 LEU 544 HB3 LEU 544 100.856 10.647 -14.284 868 HG LEU 544 HG LEU 544 100.044 12.221 -16.134 869 HD11 LEU 544 HD11 LEU 544 100.181 14.336 -15.092 870 HD12 LEU 544 HD12 LEU 544 101.468 14.299 -16.296 871 HD13 LEU 544 HD13 LEU 544 101.849 14.064 -14.590 872 HD21 LEU 544 HD21 LEU 544 101.951 11.806 -17.313 873 HD22 LEU 544 HD22 LEU 544 102.216 10.725 -15.944 874 HD23 LEU 544 HD23 LEU 544 103.009 12.299 -15.990 875 H ASN 545 H ASN 545 97.626 10.483 -14.678 876 HA ASN 545 HA ASN 545 96.487 12.729 -16.208 877 HB2 ASN 545 HB2 ASN 545 96.884 9.885 -17.163 878 HB3 ASN 545 HB3 ASN 545 96.093 11.168 -18.074 879 HD21 ASN 545 HD21 ASN 545 97.568 13.268 -17.993 880 HD22 ASN 545 HD22 ASN 545 99.190 12.988 -18.518 881 H GLN 546 H GLN 546 95.133 12.627 -14.127 882 HA GLN 546 HA GLN 546 93.414 10.725 -13.322 883 HB2 GLN 546 HB2 GLN 546 93.539 13.132 -12.533 884 HB3 GLN 546 HB3 GLN 546 92.465 13.538 -13.865 885 HG2 GLN 546 HG2 GLN 546 90.801 11.952 -12.937 886 HG3 GLN 546 HG3 GLN 546 91.867 11.707 -11.555 887 HE21 GLN 546 HE21 GLN 546 92.388 13.592 -10.258 888 HE22 GLN 546 HE22 GLN 546 91.214 14.849 -10.093 889 HA PRO 547 HA PRO 547 91.113 9.781 -17.035 890 HB2 PRO 547 HB2 PRO 547 89.874 7.600 -16.124 891 HB3 PRO 547 HB3 PRO 547 91.615 7.597 -16.434 892 HG2 PRO 547 HG2 PRO 547 90.153 7.867 -13.835 893 HG3 PRO 547 HG3 PRO 547 91.603 6.917 -14.211 894 HD2 PRO 547 HD2 PRO 547 91.636 9.395 -13.006 895 HD3 PRO 547 HD3 PRO 547 92.992 8.711 -13.925 896 H ARG 548 H ARG 548 88.663 8.853 -17.220 897 HA ARG 548 HA ARG 548 87.010 11.042 -16.448 898 HB2 ARG 548 HB2 ARG 548 85.176 9.645 -17.454 899 HB3 ARG 548 HB3 ARG 548 86.534 9.964 -18.525 900 HG2 ARG 548 HG2 ARG 548 86.713 7.482 -16.955 901 HG3 ARG 548 HG3 ARG 548 85.431 7.535 -18.166 902 HD2 ARG 548 HD2 ARG 548 86.885 7.335 -19.847 903 HD3 ARG 548 HD3 ARG 548 87.937 8.584 -19.181 904 HE ARG 548 HE ARG 548 89.265 6.943 -18.306 905 HH11 ARG 548 HH11 ARG 548 86.178 5.573 -19.151 906 HH12 ARG 548 HH12 ARG 548 86.672 3.941 -18.844 907 HH21 ARG 548 HH21 ARG 548 89.927 4.797 -17.899 908 HH22 ARG 548 HH22 ARG 548 88.803 3.500 -18.131 909 H GLU 549 H GLU 549 87.762 10.511 -14.086 910 HA GLU 549 HA GLU 549 87.182 9.914 -11.970 911 HB2 GLU 549 HB2 GLU 549 84.403 9.342 -12.955 912 HB3 GLU 549 HB3 GLU 549 84.909 10.017 -11.412 913 HG2 GLU 549 HG2 GLU 549 85.711 11.686 -13.636 914 HG3 GLU 549 HG3 GLU 549 83.970 11.413 -13.603 915 H LYS 550 H LYS 550 86.434 8.118 -10.583 916 HA LYS 550 HA LYS 550 87.309 5.621 -11.628 917 HB2 LYS 550 HB2 LYS 550 86.771 6.750 -9.060 918 HB3 LYS 550 HB3 LYS 550 85.917 5.219 -9.187 919 HG2 LYS 550 HG2 LYS 550 88.285 4.448 -10.140 920 HG3 LYS 550 HG3 LYS 550 88.816 5.775 -9.104 921 HD2 LYS 550 HD2 LYS 550 87.942 4.770 -7.176 922 HD3 LYS 550 HD3 LYS 550 86.934 3.661 -8.106 923 HE2 LYS 550 HE2 LYS 550 88.546 2.136 -8.093 924 HE3 LYS 550 HE3 LYS 550 89.665 3.277 -8.840 925 HZ1 LYS 550 HZ1 LYS 550 90.757 3.419 -6.937 926 HZ2 LYS 550 HZ2 LYS 550 89.716 2.283 -6.238 927 HZ3 LYS 550 HZ3 LYS 550 89.363 3.934 -6.126 928 H LYS 551 H LYS 551 84.220 6.356 -10.036 929 HA LYS 551 HA LYS 551 82.739 5.072 -12.165 930 HB2 LYS 551 HB2 LYS 551 82.225 3.974 -9.435 931 HB3 LYS 551 HB3 LYS 551 81.922 3.247 -11.007 932 HG2 LYS 551 HG2 LYS 551 84.228 2.724 -11.295 933 HG3 LYS 551 HG3 LYS 551 84.676 3.666 -9.872 934 HD2 LYS 551 HD2 LYS 551 82.683 1.649 -9.260 935 HD3 LYS 551 HD3 LYS 551 84.145 0.945 -9.954 936 HE2 LYS 551 HE2 LYS 551 84.475 3.005 -7.844 937 HE3 LYS 551 HE3 LYS 551 83.887 1.419 -7.349 938 HZ1 LYS 551 HZ1 LYS 551 86.243 1.568 -9.092 939 HZ2 LYS 551 HZ2 LYS 551 85.841 0.413 -7.925 940 HZ3 LYS 551 HZ3 LYS 551 86.429 1.925 -7.447 941 H ARG 552 H ARG 552 82.967 7.698 -10.739 942 HA ARG 552 HA ARG 552 80.299 8.480 -10.835 943 HB2 ARG 552 HB2 ARG 552 81.024 7.231 -8.345 944 HB3 ARG 552 HB3 ARG 552 80.613 8.920 -8.074 945 HG2 ARG 552 HG2 ARG 552 78.439 8.570 -8.437 946 HG3 ARG 552 HG3 ARG 552 78.743 7.533 -9.832 947 HD2 ARG 552 HD2 ARG 552 79.540 6.296 -7.327 948 HD3 ARG 552 HD3 ARG 552 77.830 6.722 -7.353 949 HE ARG 552 HE ARG 552 78.162 5.489 -9.723 950 HH11 ARG 552 HH11 ARG 552 79.025 4.616 -6.467 951 HH12 ARG 552 HH12 ARG 552 78.888 2.911 -6.748 952 HH21 ARG 552 HH21 ARG 552 77.980 3.246 -10.108 953 HH22 ARG 552 HH22 ARG 552 78.295 2.133 -8.819 954 H GLY 553 H GLY 553 82.727 9.289 -8.375 955 HA2 GLY 553 HA2 GLY 553 84.310 11.110 -8.726 956 HA3 GLY 553 HA3 GLY 553 83.086 11.896 -9.714 957 H THR 554 H THR 554 80.913 11.290 -7.867 958 HA THR 554 HA THR 554 81.649 12.801 -5.471 959 HB THR 554 HB THR 554 79.793 14.346 -5.695 960 HG1 THR 554 HG1 THR 554 78.452 12.907 -7.006 961 HG21 THR 554 HG21 THR 554 82.098 14.589 -7.005 962 HG22 THR 554 HG22 THR 554 80.814 15.793 -7.130 963 HG23 THR 554 HG23 THR 554 81.009 14.577 -8.393 964 H GLU 555 H GLU 555 81.210 11.198 -4.040 965 HA GLU 555 HA GLU 555 78.783 9.623 -4.275 966 HB2 GLU 555 HB2 GLU 555 81.294 9.095 -3.273 967 HB3 GLU 555 HB3 GLU 555 80.340 9.320 -1.814 968 HG2 GLU 555 HG2 GLU 555 78.802 7.691 -3.496 969 HG3 GLU 555 HG3 GLU 555 80.451 7.075 -3.585 970 H LYS 556 H LYS 556 77.660 9.207 -2.033 971 HA LYS 556 HA LYS 556 76.943 11.854 -0.968 972 HB2 LYS 556 HB2 LYS 556 75.386 9.516 -1.763 973 HB3 LYS 556 HB3 LYS 556 74.963 10.096 -0.157 974 HG2 LYS 556 HG2 LYS 556 73.563 11.085 -1.904 975 HG3 LYS 556 HG3 LYS 556 74.504 12.302 -1.037 976 HD2 LYS 556 HD2 LYS 556 76.132 12.344 -2.860 977 HD3 LYS 556 HD3 LYS 556 75.204 11.115 -3.723 978 HE2 LYS 556 HE2 LYS 556 73.962 12.707 -4.643 979 HE3 LYS 556 HE3 LYS 556 73.423 13.205 -3.039 980 HZ1 LYS 556 HZ1 LYS 556 74.386 15.075 -4.124 981 HZ2 LYS 556 HZ2 LYS 556 75.788 14.214 -4.520 982 HZ3 LYS 556 HZ3 LYS 556 75.457 14.592 -2.906 983 H LEU 557 H LEU 557 77.374 12.306 1.088 984 HA LEU 557 HA LEU 557 78.489 10.226 2.786 985 HB2 LEU 557 HB2 LEU 557 78.279 13.218 3.054 986 HB3 LEU 557 HB3 LEU 557 78.888 12.197 4.341 987 HG LEU 557 HG LEU 557 80.130 12.833 1.694 988 HD11 LEU 557 HD11 LEU 557 80.922 12.950 4.578 989 HD12 LEU 557 HD12 LEU 557 80.935 14.228 3.364 990 HD13 LEU 557 HD13 LEU 557 82.139 12.942 3.302 991 HD21 LEU 557 HD21 LEU 557 80.326 10.522 1.564 992 HD22 LEU 557 HD22 LEU 557 80.485 10.336 3.312 993 HD23 LEU 557 HD23 LEU 557 81.820 11.002 2.371 994 H ILE 558 H ILE 558 75.541 10.535 2.106 995 HA ILE 558 HA ILE 558 73.531 10.244 3.141 996 HB ILE 558 HB ILE 558 75.210 9.523 5.546 997 HG12 ILE 558 HG12 ILE 558 74.151 7.831 3.274 998 HG13 ILE 558 HG13 ILE 558 75.841 8.134 3.669 999 HG21 ILE 558 HG21 ILE 558 72.651 10.032 5.706 1000 HG22 ILE 558 HG22 ILE 558 73.338 8.633 6.531 1001 HG23 ILE 558 HG23 ILE 558 72.495 8.426 4.995 1002 HD11 ILE 558 HD11 ILE 558 74.069 6.844 5.687 1003 HD12 ILE 558 HD12 ILE 558 75.813 6.704 5.465 1004 HD13 ILE 558 HD13 ILE 558 74.715 5.896 4.348 1005 H THR 559 H THR 559 72.168 11.796 3.758 1006 HA THR 559 HA THR 559 72.389 13.257 6.152 1007 HB THR 559 HB THR 559 74.224 14.396 4.939 1008 HG1 THR 559 HG1 THR 559 73.082 15.653 6.434 1009 HG21 THR 559 HG21 THR 559 74.043 15.009 2.811 1010 HG22 THR 559 HG22 THR 559 72.620 15.986 3.172 1011 HG23 THR 559 HG23 THR 559 72.439 14.278 2.774 1012 H LYS 560 H LYS 560 70.240 12.098 5.671 1013 HA LYS 560 HA LYS 560 68.351 12.875 3.868 1014 HB2 LYS 560 HB2 LYS 560 68.364 11.527 6.367 1015 HB3 LYS 560 HB3 LYS 560 67.055 12.701 6.411 1016 HG2 LYS 560 HG2 LYS 560 66.972 11.399 3.894 1017 HG3 LYS 560 HG3 LYS 560 67.119 10.167 5.149 1018 HD2 LYS 560 HD2 LYS 560 65.015 10.483 5.815 1019 HD3 LYS 560 HD3 LYS 560 65.236 12.232 5.900 1020 HE2 LYS 560 HE2 LYS 560 63.603 12.042 4.284 1021 HE3 LYS 560 HE3 LYS 560 65.070 12.106 3.307 1022 HZ1 LYS 560 HZ1 LYS 560 63.430 10.338 2.688 1023 HZ2 LYS 560 HZ2 LYS 560 63.801 9.562 4.144 1024 HZ3 LYS 560 HZ3 LYS 560 65.003 9.785 2.974 1025 H ALA 561 H ALA 561 66.846 14.502 3.658 1026 HA ALA 561 HA ALA 561 67.549 17.009 4.928 1027 HB1 ALA 561 HB1 ALA 561 66.967 16.687 2.447 1028 HB2 ALA 561 HB2 ALA 561 66.291 18.081 3.287 1029 HB3 ALA 561 HB3 ALA 561 65.289 16.660 2.990 Start of MODEL 20 1 H1 MET 437 HT1 MET 437 123.974 16.820 18.633 2 H2 MET 437 HT2 MET 437 123.358 15.970 19.991 3 H3 MET 437 HT3 MET 437 123.428 17.684 20.009 4 HA MET 437 HA MET 437 121.213 16.709 19.625 5 HB2 MET 437 HB2 MET 437 122.472 18.960 18.654 6 HB3 MET 437 HB3 MET 437 121.765 18.265 17.202 7 HG2 MET 437 HG2 MET 437 120.288 18.957 19.731 8 HG3 MET 437 HG3 MET 437 120.276 19.884 18.234 9 HE1 MET 437 HE1 MET 437 117.673 18.034 20.048 10 HE2 MET 437 HE2 MET 437 116.691 18.307 18.609 11 HE3 MET 437 HE3 MET 437 117.746 19.586 19.211 12 H HIS 438 H HIS 438 123.230 14.754 18.510 13 HA HIS 438 HA HIS 438 121.569 13.838 16.267 14 HB2 HIS 438 HB2 HIS 438 123.991 12.872 15.528 15 HB3 HIS 438 HB3 HIS 438 123.319 14.384 14.929 16 HD1 HIS 438 HD1 HIS 438 124.724 16.401 15.269 17 HD2 HIS 438 HD2 HIS 438 125.784 13.311 17.836 18 HE1 HIS 438 HE1 HIS 438 126.773 17.209 16.483 19 HE2 HIS 438 HE2 HIS 438 127.346 15.357 18.092 20 H HIS 439 H HIS 439 120.542 12.352 17.609 21 HA HIS 439 HA HIS 439 122.157 10.408 19.053 22 HB2 HIS 439 HB2 HIS 439 119.564 11.502 19.385 23 HB3 HIS 439 HB3 HIS 439 119.362 9.777 19.098 24 HD1 HIS 439 HD1 HIS 439 118.932 8.863 21.375 25 HD2 HIS 439 HD2 HIS 439 122.169 11.470 21.315 26 HE1 HIS 439 HE1 HIS 439 119.933 8.746 23.679 27 HE2 HIS 439 HE2 HIS 439 121.845 10.386 23.641 28 H HIS 440 H HIS 440 121.697 10.643 15.977 29 HA HIS 440 HA HIS 440 121.619 7.779 15.563 30 HB2 HIS 440 HB2 HIS 440 119.930 8.254 13.601 31 HB3 HIS 440 HB3 HIS 440 119.347 7.949 15.234 32 HD1 HIS 440 HD1 HIS 440 117.634 9.555 15.971 33 HD2 HIS 440 HD2 HIS 440 120.224 11.245 13.198 34 HE1 HIS 440 HE1 HIS 440 116.774 11.885 15.584 35 HE2 HIS 440 HE2 HIS 440 118.302 12.857 13.832 36 H HIS 441 H HIS 441 122.497 7.119 13.574 37 HA HIS 441 HA HIS 441 124.183 9.156 12.322 38 HB2 HIS 441 HB2 HIS 441 125.329 7.122 11.319 39 HB3 HIS 441 HB3 HIS 441 125.439 7.281 13.070 40 HD1 HIS 441 HD1 HIS 441 123.509 5.348 10.447 41 HD2 HIS 441 HD2 HIS 441 124.489 5.139 14.479 42 HE1 HIS 441 HE1 HIS 441 122.706 3.094 11.216 43 HE2 HIS 441 HE2 HIS 441 123.322 2.981 13.656 44 H HIS 442 H HIS 442 124.700 8.357 9.889 45 HA HIS 442 HA HIS 442 122.175 7.803 8.510 46 HB2 HIS 442 HB2 HIS 442 123.197 10.372 8.700 47 HB3 HIS 442 HB3 HIS 442 123.772 9.821 7.130 48 HD1 HIS 442 HD1 HIS 442 122.039 9.519 5.275 49 HD2 HIS 442 HD2 HIS 442 120.387 10.612 8.928 50 HE1 HIS 442 HE1 HIS 442 119.654 10.134 4.775 51 HE2 HIS 442 HE2 HIS 442 118.701 10.881 6.985 52 H HIS 443 H HIS 443 122.444 6.250 7.056 53 HA HIS 443 HA HIS 443 125.158 5.587 6.185 54 HB2 HIS 443 HB2 HIS 443 122.569 4.063 6.264 55 HB3 HIS 443 HB3 HIS 443 123.912 3.506 5.270 56 HD1 HIS 443 HD1 HIS 443 122.548 2.497 8.193 57 HD2 HIS 443 HD2 HIS 443 126.377 3.858 7.323 58 HE1 HIS 443 HE1 HIS 443 124.017 1.589 10.022 59 HE2 HIS 443 HE2 HIS 443 126.336 2.394 9.454 60 H SER 444 H SER 444 125.850 6.245 4.277 61 HA SER 444 HA SER 444 123.915 6.529 2.079 62 HB2 SER 444 HB2 SER 444 126.259 8.394 2.351 63 HB3 SER 444 HB3 SER 444 124.778 8.606 1.417 64 HG SER 444 HG SER 444 125.274 9.486 3.838 65 H ASN 445 H ASN 445 124.569 5.800 0.110 66 HA ASN 445 HA ASN 445 125.962 4.973 -1.528 67 HB2 ASN 445 HB2 ASN 445 128.240 4.951 0.448 68 HB3 ASN 445 HB3 ASN 445 128.324 4.977 -1.310 69 HD21 ASN 445 HD21 ASN 445 129.822 6.766 -0.140 70 HD22 ASN 445 HD22 ASN 445 129.139 8.351 -0.216 71 H ALA 446 H ALA 446 124.293 3.387 -0.118 72 HA ALA 446 HA ALA 446 125.829 1.022 0.674 73 HB1 ALA 446 HB1 ALA 446 122.908 1.672 1.029 74 HB2 ALA 446 HB2 ALA 446 124.159 1.696 2.272 75 HB3 ALA 446 HB3 ALA 446 123.675 0.168 1.539 76 H THR 447 H THR 447 122.876 1.705 -1.219 77 HA THR 447 HA THR 447 121.974 0.680 -3.043 78 HB THR 447 HB THR 447 123.420 0.147 -4.863 79 HG1 THR 447 HG1 THR 447 124.923 -1.139 -3.499 80 HG21 THR 447 HG21 THR 447 125.298 2.106 -3.977 81 HG22 THR 447 HG22 THR 447 123.694 2.536 -3.385 82 HG23 THR 447 HG23 THR 447 123.959 2.288 -5.110 83 H GLY 448 H GLY 448 122.929 -1.611 -4.482 84 HA2 GLY 448 HA2 GLY 448 123.539 -3.923 -3.923 85 HA3 GLY 448 HA3 GLY 448 122.668 -3.704 -2.413 86 HA PRO 449 HA PRO 449 119.033 -5.295 -4.318 87 HB2 PRO 449 HB2 PRO 449 117.044 -3.955 -3.101 88 HB3 PRO 449 HB3 PRO 449 118.078 -5.089 -2.222 89 HG2 PRO 449 HG2 PRO 449 118.231 -2.098 -2.348 90 HG3 PRO 449 HG3 PRO 449 118.372 -3.165 -0.939 91 HD2 PRO 449 HD2 PRO 449 120.526 -2.104 -2.225 92 HD3 PRO 449 HD3 PRO 449 120.572 -3.665 -1.382 93 H GLN 450 H GLN 450 116.755 -4.447 -5.212 94 HA GLN 450 HA GLN 450 117.431 -2.450 -7.234 95 HB2 GLN 450 HB2 GLN 450 114.912 -4.060 -7.283 96 HB3 GLN 450 HB3 GLN 450 115.877 -3.459 -8.625 97 HG2 GLN 450 HG2 GLN 450 116.540 -5.762 -6.811 98 HG3 GLN 450 HG3 GLN 450 116.067 -5.846 -8.506 99 HE21 GLN 450 HE21 GLN 450 117.853 -6.727 -9.374 100 HE22 GLN 450 HE22 GLN 450 119.422 -6.005 -9.332 101 H PHE 451 H PHE 451 114.463 -2.150 -7.714 102 HA PHE 451 HA PHE 451 114.048 0.290 -6.485 103 HB2 PHE 451 HB2 PHE 451 111.734 0.109 -7.164 104 HB3 PHE 451 HB3 PHE 451 112.751 -0.583 -8.425 105 HD1 PHE 451 HD1 PHE 451 110.245 -1.265 -5.865 106 HD2 PHE 451 HD2 PHE 451 112.773 -2.981 -8.827 107 HE1 PHE 451 HE1 PHE 451 108.938 -3.348 -5.768 108 HE2 PHE 451 HE2 PHE 451 111.471 -5.067 -8.736 109 HZ PHE 451 HZ PHE 451 109.551 -5.251 -7.205 110 H VAL 452 H VAL 452 114.080 0.648 -4.350 111 HA VAL 452 HA VAL 452 113.723 -1.082 -2.286 112 HB VAL 452 HB VAL 452 112.928 0.866 -0.912 113 HG11 VAL 452 HG11 VAL 452 115.418 0.435 -2.184 114 HG12 VAL 452 HG12 VAL 452 115.098 1.231 -0.643 115 HG13 VAL 452 HG13 VAL 452 115.141 2.176 -2.132 116 HG21 VAL 452 HG21 VAL 452 113.182 3.103 -2.198 117 HG22 VAL 452 HG22 VAL 452 111.667 2.208 -2.323 118 HG23 VAL 452 HG23 VAL 452 112.851 2.124 -3.627 119 H SER 453 H SER 453 112.137 -2.575 -2.273 120 HA SER 453 HA SER 453 109.471 -2.054 -3.117 121 HB2 SER 453 HB2 SER 453 109.168 -4.296 -2.944 122 HB3 SER 453 HB3 SER 453 110.929 -4.302 -2.852 123 HG SER 453 HG SER 453 110.542 -5.317 -1.041 124 H GLY 454 H GLY 454 110.624 -0.527 -0.654 125 HA2 GLY 454 HA2 GLY 454 109.958 -0.014 1.513 126 HA3 GLY 454 HA3 GLY 454 108.449 0.231 0.651 127 H VAL 455 H VAL 455 109.912 -2.923 1.067 128 HA VAL 455 HA VAL 455 108.876 -4.846 1.817 129 HB VAL 455 HB VAL 455 108.421 -3.756 4.486 130 HG11 VAL 455 HG11 VAL 455 110.657 -5.589 3.990 131 HG12 VAL 455 HG12 VAL 455 109.090 -6.155 3.412 132 HG13 VAL 455 HG13 VAL 455 109.301 -5.724 5.109 133 HG21 VAL 455 HG21 VAL 455 111.039 -3.497 4.702 134 HG22 VAL 455 HG22 VAL 455 110.019 -2.132 4.245 135 HG23 VAL 455 HG23 VAL 455 110.900 -3.029 3.007 136 H ILE 456 H ILE 456 106.892 -4.805 0.685 137 HA ILE 456 HA ILE 456 104.610 -3.385 1.536 138 HB ILE 456 HB ILE 456 104.647 -5.972 -0.014 139 HG12 ILE 456 HG12 ILE 456 106.086 -4.442 -1.163 140 HG13 ILE 456 HG13 ILE 456 104.544 -4.447 -2.016 141 HG21 ILE 456 HG21 ILE 456 102.482 -5.512 -0.677 142 HG22 ILE 456 HG22 ILE 456 102.623 -3.795 -0.299 143 HG23 ILE 456 HG23 ILE 456 102.478 -4.976 1.004 144 HD11 ILE 456 HD11 ILE 456 104.853 -2.219 -1.933 145 HD12 ILE 456 HD12 ILE 456 105.864 -2.301 -0.490 146 HD13 ILE 456 HD13 ILE 456 104.110 -2.409 -0.345 147 H VAL 457 H VAL 457 103.262 -3.729 3.176 148 HA VAL 457 HA VAL 457 103.361 -6.343 4.528 149 HB VAL 457 HB VAL 457 102.998 -3.570 5.626 150 HG11 VAL 457 HG11 VAL 457 102.035 -6.145 6.831 151 HG12 VAL 457 HG12 VAL 457 101.164 -4.624 6.635 152 HG13 VAL 457 HG13 VAL 457 102.462 -4.751 7.823 153 HG21 VAL 457 HG21 VAL 457 105.230 -4.224 5.729 154 HG22 VAL 457 HG22 VAL 457 104.822 -5.890 6.141 155 HG23 VAL 457 HG23 VAL 457 104.614 -4.611 7.337 156 H LYS 458 H LYS 458 101.670 -7.462 3.689 157 HA LYS 458 HA LYS 458 99.174 -6.167 3.076 158 HB2 LYS 458 HB2 LYS 458 100.055 -8.051 1.726 159 HB3 LYS 458 HB3 LYS 458 99.845 -9.113 3.113 160 HG2 LYS 458 HG2 LYS 458 97.479 -8.863 3.045 161 HG3 LYS 458 HG3 LYS 458 97.594 -7.586 1.832 162 HD2 LYS 458 HD2 LYS 458 98.399 -9.137 0.187 163 HD3 LYS 458 HD3 LYS 458 98.529 -10.419 1.392 164 HE2 LYS 458 HE2 LYS 458 96.243 -10.728 1.503 165 HE3 LYS 458 HE3 LYS 458 95.891 -9.104 0.914 166 HZ1 LYS 458 HZ1 LYS 458 95.432 -10.921 -0.701 167 HZ2 LYS 458 HZ2 LYS 458 97.093 -11.232 -0.768 168 HZ3 LYS 458 HZ3 LYS 458 96.492 -9.737 -1.281 169 H ILE 459 H ILE 459 97.662 -5.739 4.512 170 HA ILE 459 HA ILE 459 97.473 -7.425 6.920 171 HB ILE 459 HB ILE 459 96.459 -4.595 6.685 172 HG12 ILE 459 HG12 ILE 459 99.097 -5.654 7.700 173 HG13 ILE 459 HG13 ILE 459 98.821 -4.395 6.501 174 HG21 ILE 459 HG21 ILE 459 95.768 -4.775 8.829 175 HG22 ILE 459 HG22 ILE 459 97.107 -5.825 9.288 176 HG23 ILE 459 HG23 ILE 459 95.713 -6.493 8.439 177 HD11 ILE 459 HD11 ILE 459 99.563 -3.756 8.894 178 HD12 ILE 459 HD12 ILE 459 97.867 -4.016 9.301 179 HD13 ILE 459 HD13 ILE 459 98.309 -2.811 8.091 180 H ILE 460 H ILE 460 95.708 -8.618 7.111 181 HA ILE 460 HA ILE 460 93.241 -7.696 5.802 182 HB ILE 460 HB ILE 460 94.365 -9.517 4.454 183 HG12 ILE 460 HG12 ILE 460 91.820 -8.927 4.642 184 HG13 ILE 460 HG13 ILE 460 92.322 -10.380 3.783 185 HG21 ILE 460 HG21 ILE 460 93.779 -11.853 5.433 186 HG22 ILE 460 HG22 ILE 460 93.843 -11.013 6.982 187 HG23 ILE 460 HG23 ILE 460 95.259 -11.035 5.932 188 HD11 ILE 460 HD11 ILE 460 90.376 -10.384 5.577 189 HD12 ILE 460 HD12 ILE 460 91.735 -10.645 6.670 190 HD13 ILE 460 HD13 ILE 460 91.444 -11.769 5.342 191 H SER 461 H SER 461 91.423 -7.898 6.992 192 HA SER 461 HA SER 461 91.748 -9.114 9.651 193 HB2 SER 461 HB2 SER 461 90.071 -7.569 10.456 194 HB3 SER 461 HB3 SER 461 91.303 -6.660 9.580 195 HG SER 461 HG SER 461 88.674 -6.797 9.109 196 H THR 462 H THR 462 89.588 -9.771 10.638 197 HA THR 462 HA THR 462 88.115 -11.385 8.655 198 HB THR 462 HB THR 462 87.479 -12.709 10.835 199 HG1 THR 462 HG1 THR 462 89.906 -11.403 11.561 200 HG21 THR 462 HG21 THR 462 89.645 -14.041 10.557 201 HG22 THR 462 HG22 THR 462 90.073 -12.851 9.328 202 HG23 THR 462 HG23 THR 462 88.628 -13.841 9.131 203 H GLU 463 H GLU 463 87.718 -8.583 9.838 204 HA GLU 463 HA GLU 463 85.103 -8.170 9.586 205 HB2 GLU 463 HB2 GLU 463 84.256 -9.694 11.095 206 HB3 GLU 463 HB3 GLU 463 85.617 -9.527 12.194 207 HG2 GLU 463 HG2 GLU 463 84.739 -7.665 13.217 208 HG3 GLU 463 HG3 GLU 463 83.745 -7.238 11.824 209 HA PRO 464 HA PRO 464 86.957 -5.050 12.927 210 HB2 PRO 464 HB2 PRO 464 89.800 -5.850 12.622 211 HB3 PRO 464 HB3 PRO 464 88.916 -5.373 14.075 212 HG2 PRO 464 HG2 PRO 464 89.570 -7.919 13.661 213 HG3 PRO 464 HG3 PRO 464 88.002 -7.487 14.370 214 HD2 PRO 464 HD2 PRO 464 88.651 -8.319 11.568 215 HD3 PRO 464 HD3 PRO 464 87.267 -8.769 12.585 216 H LEU 465 H LEU 465 89.724 -4.018 12.282 217 HA LEU 465 HA LEU 465 90.794 -2.719 10.749 218 HB2 LEU 465 HB2 LEU 465 89.357 -4.571 9.117 219 HB3 LEU 465 HB3 LEU 465 89.243 -2.978 8.390 220 HG LEU 465 HG LEU 465 91.921 -3.958 9.276 221 HD11 LEU 465 HD11 LEU 465 91.774 -4.641 6.604 222 HD12 LEU 465 HD12 LEU 465 90.266 -5.255 7.281 223 HD13 LEU 465 HD13 LEU 465 91.810 -5.756 7.971 224 HD21 LEU 465 HD21 LEU 465 92.627 -2.181 8.152 225 HD22 LEU 465 HD22 LEU 465 90.940 -1.702 7.973 226 HD23 LEU 465 HD23 LEU 465 91.725 -2.655 6.713 227 HA PRO 466 HA PRO 466 87.336 0.246 11.747 228 HB2 PRO 466 HB2 PRO 466 89.139 2.036 12.834 229 HB3 PRO 466 HB3 PRO 466 88.262 0.807 13.752 230 HG2 PRO 466 HG2 PRO 466 91.053 0.727 12.664 231 HG3 PRO 466 HG3 PRO 466 90.447 0.174 14.238 232 HD2 PRO 466 HD2 PRO 466 90.954 -1.556 12.272 233 HD3 PRO 466 HD3 PRO 466 89.550 -1.774 13.342 234 H GLY 467 H GLY 467 90.530 0.708 10.304 235 HA2 GLY 467 HA2 GLY 467 89.856 1.793 7.932 236 HA3 GLY 467 HA3 GLY 467 89.741 3.178 9.009 237 H ARG 468 H ARG 468 91.492 3.541 7.095 238 HA ARG 468 HA ARG 468 94.066 2.480 7.444 239 HB2 ARG 468 HB2 ARG 468 94.800 4.095 5.914 240 HB3 ARG 468 HB3 ARG 468 93.128 3.799 5.462 241 HG2 ARG 468 HG2 ARG 468 92.833 5.858 7.196 242 HG3 ARG 468 HG3 ARG 468 94.405 6.229 6.489 243 HD2 ARG 468 HD2 ARG 468 92.967 5.548 4.286 244 HD3 ARG 468 HD3 ARG 468 91.724 6.287 5.295 245 HE ARG 468 HE ARG 468 94.187 7.792 4.998 246 HH11 ARG 468 HH11 ARG 468 90.918 7.261 3.921 247 HH12 ARG 468 HH12 ARG 468 90.766 8.826 3.194 248 HH21 ARG 468 HH21 ARG 468 93.996 9.857 4.049 249 HH22 ARG 468 HH22 ARG 468 92.516 10.301 3.267 250 H LYS 469 H LYS 469 92.480 5.281 8.888 251 HA LYS 469 HA LYS 469 94.745 6.444 10.070 252 HB2 LYS 469 HB2 LYS 469 93.135 7.581 11.556 253 HB3 LYS 469 HB3 LYS 469 92.648 7.648 9.868 254 HG2 LYS 469 HG2 LYS 469 91.108 5.749 10.291 255 HG3 LYS 469 HG3 LYS 469 91.531 5.842 12.002 256 HD2 LYS 469 HD2 LYS 469 89.568 7.086 11.868 257 HD3 LYS 469 HD3 LYS 469 90.831 8.318 11.810 258 HE2 LYS 469 HE2 LYS 469 90.426 7.561 9.156 259 HE3 LYS 469 HE3 LYS 469 88.811 7.655 9.856 260 HZ1 LYS 469 HZ1 LYS 469 88.998 9.825 9.433 261 HZ2 LYS 469 HZ2 LYS 469 90.680 9.764 9.262 262 HZ3 LYS 469 HZ3 LYS 469 89.991 9.887 10.802 263 H GLN 470 H GLN 470 92.421 4.080 11.342 264 HA GLN 470 HA GLN 470 93.767 3.882 13.868 265 HB2 GLN 470 HB2 GLN 470 91.433 2.551 12.578 266 HB3 GLN 470 HB3 GLN 470 92.203 1.739 13.936 267 HG2 GLN 470 HG2 GLN 470 90.860 4.418 13.888 268 HG3 GLN 470 HG3 GLN 470 90.447 2.998 14.847 269 HE21 GLN 470 HE21 GLN 470 91.311 5.899 15.390 270 HE22 GLN 470 HE22 GLN 470 92.512 5.731 16.621 271 H VAL 471 H VAL 471 93.562 1.874 10.951 272 HA VAL 471 HA VAL 471 95.086 -0.276 11.919 273 HB VAL 471 HB VAL 471 94.946 0.670 9.054 274 HG11 VAL 471 HG11 VAL 471 96.582 -1.212 10.025 275 HG12 VAL 471 HG12 VAL 471 95.856 -1.301 8.420 276 HG13 VAL 471 HG13 VAL 471 95.138 -2.190 9.764 277 HG21 VAL 471 HG21 VAL 471 92.881 -0.194 8.831 278 HG22 VAL 471 HG22 VAL 471 92.788 0.069 10.573 279 HG23 VAL 471 HG23 VAL 471 93.206 -1.522 9.942 280 H ARG 472 H ARG 472 96.021 2.690 10.221 281 HA ARG 472 HA ARG 472 98.769 2.093 10.000 282 HB2 ARG 472 HB2 ARG 472 99.061 4.283 9.286 283 HB3 ARG 472 HB3 ARG 472 97.380 3.980 8.876 284 HG2 ARG 472 HG2 ARG 472 96.611 5.236 10.735 285 HG3 ARG 472 HG3 ARG 472 98.234 5.334 11.420 286 HD2 ARG 472 HD2 ARG 472 98.941 6.636 9.435 287 HD3 ARG 472 HD3 ARG 472 97.275 6.608 8.859 288 HE ARG 472 HE ARG 472 97.088 7.655 11.361 289 HH11 ARG 472 HH11 ARG 472 98.930 8.452 8.517 290 HH12 ARG 472 HH12 ARG 472 98.996 10.145 8.875 291 HH21 ARG 472 HH21 ARG 472 97.163 9.885 11.839 292 HH22 ARG 472 HH22 ARG 472 97.993 10.959 10.763 293 H ASP 473 H ASP 473 96.880 3.785 12.477 294 HA ASP 473 HA ASP 473 99.058 4.535 14.104 295 HB2 ASP 473 HB2 ASP 473 96.124 4.124 14.645 296 HB3 ASP 473 HB3 ASP 473 97.239 4.575 15.931 297 H THR 474 H THR 474 97.146 1.592 13.908 298 HA THR 474 HA THR 474 98.079 0.393 16.298 299 HB THR 474 HB THR 474 97.447 -1.774 14.891 300 HG1 THR 474 HG1 THR 474 95.806 0.133 13.600 301 HG21 THR 474 HG21 THR 474 95.868 0.212 16.368 302 HG22 THR 474 HG22 THR 474 95.977 -1.536 16.578 303 HG23 THR 474 HG23 THR 474 94.928 -0.862 15.331 304 H LEU 475 H LEU 475 98.945 -0.294 12.902 305 HA LEU 475 HA LEU 475 101.123 -1.973 13.552 306 HB2 LEU 475 HB2 LEU 475 101.804 -1.589 11.172 307 HB3 LEU 475 HB3 LEU 475 100.166 -2.175 11.387 308 HG LEU 475 HG LEU 475 99.623 0.433 11.291 309 HD11 LEU 475 HD11 LEU 475 101.297 1.716 10.614 310 HD12 LEU 475 HD12 LEU 475 101.447 0.752 9.144 311 HD13 LEU 475 HD13 LEU 475 102.369 0.315 10.583 312 HD21 LEU 475 HD21 LEU 475 99.910 -0.279 8.585 313 HD22 LEU 475 HD22 LEU 475 98.467 -0.400 9.592 314 HD23 LEU 475 HD23 LEU 475 99.571 -1.770 9.465 315 H ALA 476 H ALA 476 100.850 1.468 12.832 316 HA ALA 476 HA ALA 476 103.640 1.993 12.863 317 HB1 ALA 476 HB1 ALA 476 103.081 4.291 12.794 318 HB2 ALA 476 HB2 ALA 476 101.480 3.998 13.472 319 HB3 ALA 476 HB3 ALA 476 101.856 3.461 11.835 320 H ALA 477 H ALA 477 101.224 1.613 15.317 321 HA ALA 477 HA ALA 477 102.641 2.984 17.388 322 HB1 ALA 477 HB1 ALA 477 101.060 1.658 18.894 323 HB2 ALA 477 HB2 ALA 477 100.333 1.062 17.402 324 HB3 ALA 477 HB3 ALA 477 100.330 2.790 17.755 325 H ILE 478 H ILE 478 102.605 -0.257 16.094 326 HA ILE 478 HA ILE 478 104.178 -1.350 18.267 327 HB ILE 478 HB ILE 478 103.210 -2.473 15.648 328 HG12 ILE 478 HG12 ILE 478 102.770 -3.963 18.120 329 HG13 ILE 478 HG13 ILE 478 102.110 -2.332 18.186 330 HG21 ILE 478 HG21 ILE 478 104.339 -4.594 17.030 331 HG22 ILE 478 HG22 ILE 478 105.543 -3.311 17.147 332 HG23 ILE 478 HG23 ILE 478 104.968 -3.839 15.566 333 HD11 ILE 478 HD11 ILE 478 100.635 -2.729 16.447 334 HD12 ILE 478 HD12 ILE 478 100.620 -4.245 17.347 335 HD13 ILE 478 HD13 ILE 478 101.551 -4.114 15.855 336 H SER 479 H SER 479 104.695 -0.027 15.079 337 HA SER 479 HA SER 479 107.469 0.394 15.570 338 HB2 SER 479 HB2 SER 479 108.051 -0.977 13.386 339 HB3 SER 479 HB3 SER 479 107.998 -1.772 14.960 340 HG SER 479 HG SER 479 105.755 -2.279 14.418 341 H GLU 480 H GLU 480 107.959 2.236 14.583 342 HA GLU 480 HA GLU 480 106.278 3.748 13.058 343 HB2 GLU 480 HB2 GLU 480 108.559 4.342 14.121 344 HB3 GLU 480 HB3 GLU 480 109.242 3.850 12.577 345 HG2 GLU 480 HG2 GLU 480 108.353 5.630 11.455 346 HG3 GLU 480 HG3 GLU 480 107.005 5.805 12.577 347 H VAL 481 H VAL 481 105.495 3.672 11.074 348 HA VAL 481 HA VAL 481 106.863 1.996 9.067 349 HB VAL 481 HB VAL 481 104.479 2.028 7.996 350 HG11 VAL 481 HG11 VAL 481 105.887 0.245 9.623 351 HG12 VAL 481 HG12 VAL 481 104.550 -0.126 8.534 352 HG13 VAL 481 HG13 VAL 481 104.231 0.232 10.232 353 HG21 VAL 481 HG21 VAL 481 103.839 3.623 10.028 354 HG22 VAL 481 HG22 VAL 481 103.499 2.072 10.794 355 HG23 VAL 481 HG23 VAL 481 102.678 2.515 9.298 356 H LEU 482 H LEU 482 106.460 2.661 6.798 357 HA LEU 482 HA LEU 482 107.059 5.450 6.505 358 HB2 LEU 482 HB2 LEU 482 108.232 4.042 5.044 359 HB3 LEU 482 HB3 LEU 482 106.794 3.137 4.615 360 HG LEU 482 HG LEU 482 106.085 4.710 3.082 361 HD11 LEU 482 HD11 LEU 482 105.880 6.741 4.047 362 HD12 LEU 482 HD12 LEU 482 107.381 7.051 3.174 363 HD13 LEU 482 HD13 LEU 482 107.427 6.623 4.884 364 HD21 LEU 482 HD21 LEU 482 108.948 5.444 2.810 365 HD22 LEU 482 HD22 LEU 482 107.801 4.884 1.593 366 HD23 LEU 482 HD23 LEU 482 108.518 3.736 2.723 367 H TYR 483 H TYR 483 104.659 3.499 4.749 368 HA TYR 483 HA TYR 483 102.605 5.500 5.310 369 HB2 TYR 483 HB2 TYR 483 103.652 6.356 3.286 370 HB3 TYR 483 HB3 TYR 483 103.475 4.790 2.501 371 HD1 TYR 483 HD1 TYR 483 102.011 7.978 2.999 372 HD2 TYR 483 HD2 TYR 483 101.039 3.903 2.247 373 HE1 TYR 483 HE1 TYR 483 99.816 8.667 2.129 374 HE2 TYR 483 HE2 TYR 483 98.842 4.582 1.375 375 HH TYR 483 HH TYR 483 97.553 7.659 1.829 376 H VAL 484 H VAL 484 100.531 4.727 5.234 377 HA VAL 484 HA VAL 484 100.272 1.828 4.839 378 HB VAL 484 HB VAL 484 99.600 2.565 7.041 379 HG11 VAL 484 HG11 VAL 484 97.280 4.047 6.683 380 HG12 VAL 484 HG12 VAL 484 98.434 4.752 5.552 381 HG13 VAL 484 HG13 VAL 484 98.835 4.644 7.264 382 HG21 VAL 484 HG21 VAL 484 97.569 1.451 7.169 383 HG22 VAL 484 HG22 VAL 484 98.249 0.838 5.662 384 HG23 VAL 484 HG23 VAL 484 97.006 2.089 5.624 385 H ASP 485 H ASP 485 99.426 1.198 2.957 386 HA ASP 485 HA ASP 485 97.635 3.024 1.523 387 HB2 ASP 485 HB2 ASP 485 99.535 2.294 0.224 388 HB3 ASP 485 HB3 ASP 485 99.179 0.605 0.575 389 H LEU 486 H LEU 486 95.764 2.594 2.736 390 HA LEU 486 HA LEU 486 94.729 -0.133 2.754 391 HB2 LEU 486 HB2 LEU 486 94.497 1.174 4.794 392 HB3 LEU 486 HB3 LEU 486 93.627 2.422 3.922 393 HG LEU 486 HG LEU 486 92.382 -0.201 3.655 394 HD11 LEU 486 HD11 LEU 486 93.312 -0.472 5.907 395 HD12 LEU 486 HD12 LEU 486 91.553 -0.362 5.923 396 HD13 LEU 486 HD13 LEU 486 92.528 1.027 6.402 397 HD21 LEU 486 HD21 LEU 486 91.513 2.560 4.467 398 HD22 LEU 486 HD22 LEU 486 90.416 1.179 4.461 399 HD23 LEU 486 HD23 LEU 486 91.180 1.705 2.961 400 H LEU 487 H LEU 487 93.207 -0.881 1.392 401 HA LEU 487 HA LEU 487 92.439 0.686 -0.858 402 HB2 LEU 487 HB2 LEU 487 91.938 -2.069 0.111 403 HB3 LEU 487 HB3 LEU 487 90.761 -1.410 -1.010 404 HG LEU 487 HG LEU 487 92.349 -1.198 -2.737 405 HD11 LEU 487 HD11 LEU 487 94.806 -2.056 -1.849 406 HD12 LEU 487 HD12 LEU 487 94.235 -1.037 -0.528 407 HD13 LEU 487 HD13 LEU 487 94.343 -0.383 -2.162 408 HD21 LEU 487 HD21 LEU 487 91.946 -3.672 -1.437 409 HD22 LEU 487 HD22 LEU 487 93.625 -3.632 -1.977 410 HD23 LEU 487 HD23 LEU 487 92.320 -3.379 -3.136 411 H GLU 488 H GLU 488 91.333 2.484 -0.119 412 HA GLU 488 HA GLU 488 89.432 2.856 1.714 413 HB2 GLU 488 HB2 GLU 488 90.161 4.154 -0.682 414 HB3 GLU 488 HB3 GLU 488 88.407 4.020 -0.706 415 HG2 GLU 488 HG2 GLU 488 88.141 5.356 1.139 416 HG3 GLU 488 HG3 GLU 488 89.755 5.006 1.759 417 H GLY 489 H GLY 489 87.598 1.908 2.289 418 HA2 GLY 489 HA2 GLY 489 85.497 0.959 2.090 419 HA3 GLY 489 HA3 GLY 489 85.623 1.130 0.347 420 H ASP 490 H ASP 490 88.302 -0.434 1.711 421 HA ASP 490 HA ASP 490 87.149 -3.059 1.035 422 HB2 ASP 490 HB2 ASP 490 89.020 -1.939 -0.469 423 HB3 ASP 490 HB3 ASP 490 90.084 -2.585 0.777 424 H THR 491 H THR 491 88.163 -4.894 2.099 425 HA THR 491 HA THR 491 88.724 -4.268 4.894 426 HB THR 491 HB THR 491 88.124 -6.470 5.429 427 HG1 THR 491 HG1 THR 491 89.002 -7.935 4.156 428 HG21 THR 491 HG21 THR 491 86.484 -5.178 3.348 429 HG22 THR 491 HG22 THR 491 86.048 -5.705 4.974 430 HG23 THR 491 HG23 THR 491 86.129 -6.876 3.658 431 H GLU 492 H GLU 492 90.656 -4.268 2.410 432 HA GLU 492 HA GLU 492 92.812 -5.681 3.830 433 HB2 GLU 492 HB2 GLU 492 93.201 -5.568 0.947 434 HB3 GLU 492 HB3 GLU 492 93.360 -6.927 2.049 435 HG2 GLU 492 HG2 GLU 492 91.099 -7.497 1.854 436 HG3 GLU 492 HG3 GLU 492 90.680 -5.938 1.144 437 H CYS 493 H CYS 493 94.550 -4.495 4.245 438 HA CYS 493 HA CYS 493 95.036 -2.075 2.642 439 HB2 CYS 493 HB2 CYS 493 96.079 -1.351 5.019 440 HB3 CYS 493 HB3 CYS 493 94.428 -0.980 4.538 441 HG CYS 493 HG CYS 493 94.251 -3.544 5.935 442 H HIS 494 H HIS 494 97.197 -1.609 2.202 443 HA HIS 494 HA HIS 494 99.154 -3.602 3.140 444 HB2 HIS 494 HB2 HIS 494 99.014 -2.375 0.377 445 HB3 HIS 494 HB3 HIS 494 100.250 -3.494 0.943 446 HD1 HIS 494 HD1 HIS 494 96.437 -3.564 0.849 447 HD2 HIS 494 HD2 HIS 494 99.723 -5.970 0.017 448 HE1 HIS 494 HE1 HIS 494 95.485 -5.739 0.018 449 HE2 HIS 494 HE2 HIS 494 97.490 -7.178 -0.486 450 H ALA 495 H ALA 495 100.271 -2.450 4.617 451 HA ALA 495 HA ALA 495 101.000 0.305 4.064 452 HB1 ALA 495 HB1 ALA 495 101.956 0.245 6.368 453 HB2 ALA 495 HB2 ALA 495 101.394 -1.421 6.500 454 HB3 ALA 495 HB3 ALA 495 100.232 -0.113 6.283 455 H ARG 496 H ARG 496 102.888 0.957 3.328 456 HA ARG 496 HA ARG 496 104.967 -0.983 2.752 457 HB2 ARG 496 HB2 ARG 496 104.287 1.766 1.898 458 HB3 ARG 496 HB3 ARG 496 106.003 1.388 1.950 459 HG2 ARG 496 HG2 ARG 496 105.877 0.238 0.063 460 HG3 ARG 496 HG3 ARG 496 104.535 -0.733 0.674 461 HD2 ARG 496 HD2 ARG 496 103.852 0.447 -1.323 462 HD3 ARG 496 HD3 ARG 496 102.984 1.082 0.073 463 HE ARG 496 HE ARG 496 105.295 2.622 -0.364 464 HH11 ARG 496 HH11 ARG 496 102.176 1.976 -1.762 465 HH12 ARG 496 HH12 ARG 496 102.047 3.528 -2.520 466 HH21 ARG 496 HH21 ARG 496 105.141 4.672 -1.357 467 HH22 ARG 496 HH22 ARG 496 103.735 5.062 -2.291 468 H PHE 497 H PHE 497 106.771 -1.260 3.887 469 HA PHE 497 HA PHE 497 107.285 0.539 6.150 470 HB2 PHE 497 HB2 PHE 497 108.095 -2.318 5.617 471 HB3 PHE 497 HB3 PHE 497 108.781 -1.368 6.929 472 HD1 PHE 497 HD1 PHE 497 105.316 -1.730 5.608 473 HD2 PHE 497 HD2 PHE 497 107.942 -2.111 8.934 474 HE1 PHE 497 HE1 PHE 497 103.412 -2.343 7.034 475 HE2 PHE 497 HE2 PHE 497 106.040 -2.725 10.369 476 HZ PHE 497 HZ PHE 497 103.770 -2.842 9.421 477 H LYS 498 H LYS 498 109.333 1.417 6.494 478 HA LYS 498 HA LYS 498 110.835 1.896 4.095 479 HB2 LYS 498 HB2 LYS 498 110.394 3.283 6.464 480 HB3 LYS 498 HB3 LYS 498 112.094 2.842 6.536 481 HG2 LYS 498 HG2 LYS 498 112.450 3.874 4.346 482 HG3 LYS 498 HG3 LYS 498 110.746 4.332 4.294 483 HD2 LYS 498 HD2 LYS 498 111.082 5.652 6.362 484 HD3 LYS 498 HD3 LYS 498 112.802 5.259 6.298 485 HE2 LYS 498 HE2 LYS 498 111.311 6.654 4.082 486 HE3 LYS 498 HE3 LYS 498 112.196 7.499 5.353 487 HZ1 LYS 498 HZ1 LYS 498 113.983 7.298 4.079 488 HZ2 LYS 498 HZ2 LYS 498 113.186 6.279 2.989 489 HZ3 LYS 498 HZ3 LYS 498 113.947 5.627 4.351 490 H THR 499 H THR 499 111.021 -0.377 6.642 491 HA THR 499 HA THR 499 113.611 -1.279 5.609 492 HB THR 499 HB THR 499 113.905 -1.952 8.216 493 HG1 THR 499 HG1 THR 499 113.032 0.725 8.403 494 HG21 THR 499 HG21 THR 499 114.817 0.469 6.695 495 HG22 THR 499 HG22 THR 499 115.709 -1.007 7.064 496 HG23 THR 499 HG23 THR 499 115.360 0.155 8.344 497 HA PRO 500 HA PRO 500 111.725 -5.263 5.705 498 HB2 PRO 500 HB2 PRO 500 113.897 -6.855 5.821 499 HB3 PRO 500 HB3 PRO 500 113.508 -5.901 4.383 500 HG2 PRO 500 HG2 PRO 500 115.463 -5.307 6.574 501 HG3 PRO 500 HG3 PRO 500 115.672 -5.151 4.820 502 HD2 PRO 500 HD2 PRO 500 115.094 -3.040 6.430 503 HD3 PRO 500 HD3 PRO 500 114.554 -3.138 4.742 504 H GLU 501 H GLU 501 114.242 -4.694 8.149 505 HA GLU 501 HA GLU 501 113.602 -6.828 9.849 506 HB2 GLU 501 HB2 GLU 501 114.577 -4.244 10.988 507 HB3 GLU 501 HB3 GLU 501 115.071 -5.889 11.365 508 HG2 GLU 501 HG2 GLU 501 116.047 -5.895 8.976 509 HG3 GLU 501 HG3 GLU 501 115.909 -4.142 9.093 510 H ASP 502 H ASP 502 112.316 -3.565 9.614 511 HA ASP 502 HA ASP 502 110.836 -3.541 11.997 512 HB2 ASP 502 HB2 ASP 502 110.220 -2.112 9.402 513 HB3 ASP 502 HB3 ASP 502 109.581 -1.698 10.990 514 H ALA 503 H ALA 503 110.040 -4.736 8.770 515 HA ALA 503 HA ALA 503 107.291 -5.178 9.265 516 HB1 ALA 503 HB1 ALA 503 107.259 -5.688 7.104 517 HB2 ALA 503 HB2 ALA 503 108.350 -7.052 7.354 518 HB3 ALA 503 HB3 ALA 503 109.004 -5.439 7.073 519 H GLN 504 H GLN 504 110.134 -7.278 9.527 520 HA GLN 504 HA GLN 504 108.754 -9.641 10.166 521 HB2 GLN 504 HB2 GLN 504 111.217 -9.326 9.501 522 HB3 GLN 504 HB3 GLN 504 111.502 -8.980 11.202 523 HG2 GLN 504 HG2 GLN 504 110.304 -11.229 11.619 524 HG3 GLN 504 HG3 GLN 504 110.643 -11.535 9.916 525 HE21 GLN 504 HE21 GLN 504 112.697 -11.990 9.276 526 HE22 GLN 504 HE22 GLN 504 114.013 -12.220 10.373 527 H ALA 505 H ALA 505 110.110 -7.095 12.223 528 HA ALA 505 HA ALA 505 109.572 -8.354 14.685 529 HB1 ALA 505 HB1 ALA 505 111.153 -6.597 14.681 530 HB2 ALA 505 HB2 ALA 505 109.783 -6.034 15.639 531 HB3 ALA 505 HB3 ALA 505 109.997 -5.461 13.984 532 H VAL 506 H VAL 506 107.640 -6.105 12.735 533 HA VAL 506 HA VAL 506 105.612 -5.725 14.675 534 HB VAL 506 HB VAL 506 105.941 -4.167 12.819 535 HG11 VAL 506 HG11 VAL 506 104.971 -6.463 11.132 536 HG12 VAL 506 HG12 VAL 506 106.517 -5.621 11.024 537 HG13 VAL 506 HG13 VAL 506 105.027 -4.792 10.574 538 HG21 VAL 506 HG21 VAL 506 103.813 -3.525 12.991 539 HG22 VAL 506 HG22 VAL 506 103.541 -5.015 13.893 540 HG23 VAL 506 HG23 VAL 506 103.230 -4.966 12.158 541 H ILE 507 H ILE 507 105.867 -7.975 11.928 542 HA ILE 507 HA ILE 507 103.261 -9.026 12.163 543 HB ILE 507 HB ILE 507 104.118 -10.969 10.891 544 HG12 ILE 507 HG12 ILE 507 106.716 -9.798 10.310 545 HG13 ILE 507 HG13 ILE 507 106.551 -10.252 12.002 546 HG21 ILE 507 HG21 ILE 507 105.305 -8.807 9.346 547 HG22 ILE 507 HG22 ILE 507 103.751 -8.373 10.058 548 HG23 ILE 507 HG23 ILE 507 103.877 -9.786 9.010 549 HD11 ILE 507 HD11 ILE 507 105.801 -12.510 11.212 550 HD12 ILE 507 HD12 ILE 507 107.485 -12.100 10.887 551 HD13 ILE 507 HD13 ILE 507 106.290 -12.014 9.593 552 H ASN 508 H ASN 508 106.253 -9.793 13.780 553 HA ASN 508 HA ASN 508 105.376 -12.272 14.904 554 HB2 ASN 508 HB2 ASN 508 107.626 -10.380 15.587 555 HB3 ASN 508 HB3 ASN 508 107.307 -11.829 16.536 556 HD21 ASN 508 HD21 ASN 508 109.403 -10.784 14.479 557 HD22 ASN 508 HD22 ASN 508 109.683 -12.176 13.495 558 H ALA 509 H ALA 509 105.411 -8.926 15.927 559 HA ALA 509 HA ALA 509 104.355 -9.429 18.546 560 HB1 ALA 509 HB1 ALA 509 104.886 -7.302 18.958 561 HB2 ALA 509 HB2 ALA 509 103.999 -6.718 17.548 562 HB3 ALA 509 HB3 ALA 509 105.651 -7.313 17.368 563 H TYR 510 H TYR 510 103.018 -8.820 15.412 564 HA TYR 510 HA TYR 510 100.521 -7.804 16.171 565 HB2 TYR 510 HB2 TYR 510 101.785 -8.590 13.757 566 HB3 TYR 510 HB3 TYR 510 100.197 -9.353 13.819 567 HD1 TYR 510 HD1 TYR 510 99.115 -8.063 12.126 568 HD2 TYR 510 HD2 TYR 510 101.068 -6.139 15.378 569 HE1 TYR 510 HE1 TYR 510 98.071 -5.932 11.476 570 HE2 TYR 510 HE2 TYR 510 100.028 -3.995 14.733 571 HH TYR 510 HH TYR 510 97.614 -3.498 13.228 572 H THR 511 H THR 511 101.734 -11.046 16.300 573 HA THR 511 HA THR 511 99.452 -12.566 16.050 574 HB THR 511 HB THR 511 100.454 -14.190 17.553 575 HG1 THR 511 HG1 THR 511 102.292 -12.120 18.243 576 HG21 THR 511 HG21 THR 511 102.593 -14.502 16.474 577 HG22 THR 511 HG22 THR 511 102.623 -12.811 15.974 578 HG23 THR 511 HG23 THR 511 101.424 -13.911 15.293 579 H GLU 512 H GLU 512 100.528 -10.585 18.730 580 HA GLU 512 HA GLU 512 98.576 -11.399 20.604 581 HB2 GLU 512 HB2 GLU 512 99.462 -9.811 21.996 582 HB3 GLU 512 HB3 GLU 512 100.791 -9.983 20.861 583 HG2 GLU 512 HG2 GLU 512 100.690 -7.749 20.800 584 HG3 GLU 512 HG3 GLU 512 99.386 -8.034 19.648 585 H ILE 513 H ILE 513 98.507 -9.180 17.953 586 HA ILE 513 HA ILE 513 96.524 -7.411 18.538 587 HB ILE 513 HB ILE 513 96.887 -8.899 15.936 588 HG12 ILE 513 HG12 ILE 513 98.834 -7.574 16.915 589 HG13 ILE 513 HG13 ILE 513 98.335 -7.143 15.282 590 HG21 ILE 513 HG21 ILE 513 95.685 -7.109 14.873 591 HG22 ILE 513 HG22 ILE 513 95.492 -6.270 16.410 592 HG23 ILE 513 HG23 ILE 513 94.672 -7.807 16.137 593 HD11 ILE 513 HD11 ILE 513 98.790 -5.354 17.214 594 HD12 ILE 513 HD12 ILE 513 97.067 -5.632 17.470 595 HD13 ILE 513 HD13 ILE 513 97.648 -5.089 15.896 596 H ASN 514 H ASN 514 96.107 -10.812 17.647 597 HA ASN 514 HA ASN 514 93.342 -10.818 17.299 598 HB2 ASN 514 HB2 ASN 514 94.627 -12.725 16.622 599 HB3 ASN 514 HB3 ASN 514 95.207 -12.987 18.264 600 HD21 ASN 514 HD21 ASN 514 91.940 -12.225 17.176 601 HD22 ASN 514 HD22 ASN 514 91.216 -13.685 17.748 602 H LYS 515 H LYS 515 95.198 -10.535 20.186 603 HA LYS 515 HA LYS 515 93.656 -11.626 22.153 604 HB2 LYS 515 HB2 LYS 515 95.321 -9.154 22.022 605 HB3 LYS 515 HB3 LYS 515 94.312 -9.402 23.440 606 HG2 LYS 515 HG2 LYS 515 95.406 -11.736 23.534 607 HG3 LYS 515 HG3 LYS 515 96.618 -11.032 22.463 608 HD2 LYS 515 HD2 LYS 515 97.516 -9.778 24.101 609 HD3 LYS 515 HD3 LYS 515 95.944 -9.385 24.797 610 HE2 LYS 515 HE2 LYS 515 96.564 -12.179 25.154 611 HE3 LYS 515 HE3 LYS 515 97.850 -11.162 25.804 612 HZ1 LYS 515 HZ1 LYS 515 96.009 -11.718 27.383 613 HZ2 LYS 515 HZ2 LYS 515 94.986 -10.751 26.446 614 HZ3 LYS 515 HZ3 LYS 515 96.327 -10.064 27.216 615 H LYS 516 H LYS 516 92.848 -8.975 20.099 616 HA LYS 516 HA LYS 516 90.276 -8.718 21.500 617 HB2 LYS 516 HB2 LYS 516 91.866 -6.753 21.874 618 HB3 LYS 516 HB3 LYS 516 91.641 -6.385 20.168 619 HG2 LYS 516 HG2 LYS 516 89.857 -5.202 20.734 620 HG3 LYS 516 HG3 LYS 516 89.067 -6.713 21.191 621 HD2 LYS 516 HD2 LYS 516 89.049 -4.984 22.980 622 HD3 LYS 516 HD3 LYS 516 89.827 -6.495 23.455 623 HE2 LYS 516 HE2 LYS 516 91.947 -5.570 23.410 624 HE3 LYS 516 HE3 LYS 516 91.463 -4.266 22.325 625 HZ1 LYS 516 HZ1 LYS 516 90.533 -3.067 24.039 626 HZ2 LYS 516 HZ2 LYS 516 91.870 -3.762 24.808 627 HZ3 LYS 516 HZ3 LYS 516 90.327 -4.416 25.038 628 H HIS 517 H HIS 517 91.986 -7.914 18.483 629 HA HIS 517 HA HIS 517 89.594 -8.789 17.009 630 HB2 HIS 517 HB2 HIS 517 91.316 -6.687 15.798 631 HB3 HIS 517 HB3 HIS 517 89.580 -6.938 15.654 632 HD1 HIS 517 HD1 HIS 517 88.072 -5.710 17.304 633 HD2 HIS 517 HD2 HIS 517 92.123 -5.188 18.070 634 HE1 HIS 517 HE1 HIS 517 88.204 -3.863 19.008 635 HE2 HIS 517 HE2 HIS 517 90.662 -3.588 19.481 636 H CYS 518 H CYS 518 90.131 -10.631 16.031 637 HA CYS 518 HA CYS 518 92.674 -11.597 15.536 638 HB2 CYS 518 HB2 CYS 518 90.340 -12.756 15.365 639 HB3 CYS 518 HB3 CYS 518 90.413 -12.263 13.676 640 HG CYS 518 HG CYS 518 92.597 -14.113 14.894 641 H TRP 519 H TRP 519 94.225 -10.656 14.367 642 HA TRP 519 HA TRP 519 93.464 -9.514 11.766 643 HB2 TRP 519 HB2 TRP 519 94.433 -8.089 13.903 644 HB3 TRP 519 HB3 TRP 519 95.877 -8.354 12.923 645 HD1 TRP 519 HD1 TRP 519 93.548 -8.343 10.336 646 HE1 TRP 519 HE1 TRP 519 93.089 -6.036 9.356 647 HE3 TRP 519 HE3 TRP 519 95.425 -5.464 14.123 648 HZ2 TRP 519 HZ2 TRP 519 93.472 -3.308 10.083 649 HZ3 TRP 519 HZ3 TRP 519 95.341 -3.023 13.900 650 HH2 TRP 519 HH2 TRP 519 94.382 -1.971 11.920 651 H LYS 520 H LYS 520 94.813 -9.755 10.060 652 HA LYS 520 HA LYS 520 96.848 -11.861 10.337 653 HB2 LYS 520 HB2 LYS 520 95.586 -11.032 7.760 654 HB3 LYS 520 HB3 LYS 520 96.281 -12.589 8.193 655 HG2 LYS 520 HG2 LYS 520 93.708 -11.451 9.269 656 HG3 LYS 520 HG3 LYS 520 93.845 -12.689 8.018 657 HD2 LYS 520 HD2 LYS 520 94.131 -14.305 9.532 658 HD3 LYS 520 HD3 LYS 520 95.365 -13.378 10.387 659 HE2 LYS 520 HE2 LYS 520 93.511 -13.821 11.870 660 HE3 LYS 520 HE3 LYS 520 93.584 -12.096 11.510 661 HZ1 LYS 520 HZ1 LYS 520 91.326 -12.815 11.383 662 HZ2 LYS 520 HZ2 LYS 520 91.718 -14.080 10.331 663 HZ3 LYS 520 HZ3 LYS 520 91.850 -12.477 9.810 664 H LEU 521 H LEU 521 98.900 -11.520 9.670 665 HA LEU 521 HA LEU 521 99.501 -9.060 8.178 666 HB2 LEU 521 HB2 LEU 521 100.231 -9.661 10.886 667 HB3 LEU 521 HB3 LEU 521 101.682 -9.600 9.903 668 HG LEU 521 HG LEU 521 100.936 -7.442 11.050 669 HD11 LEU 521 HD11 LEU 521 102.486 -6.740 9.627 670 HD12 LEU 521 HD12 LEU 521 101.176 -6.379 8.503 671 HD13 LEU 521 HD13 LEU 521 102.008 -7.930 8.415 672 HD21 LEU 521 HD21 LEU 521 98.535 -7.731 10.384 673 HD22 LEU 521 HD22 LEU 521 99.016 -7.341 8.733 674 HD23 LEU 521 HD23 LEU 521 99.224 -6.150 10.016 675 H GLU 522 H GLU 522 100.675 -9.462 6.409 676 HA GLU 522 HA GLU 522 102.539 -11.724 6.414 677 HB2 GLU 522 HB2 GLU 522 100.072 -11.923 5.215 678 HB3 GLU 522 HB3 GLU 522 101.101 -11.425 3.879 679 HG2 GLU 522 HG2 GLU 522 101.555 -13.587 3.647 680 HG3 GLU 522 HG3 GLU 522 102.591 -13.390 5.059 681 H ILE 523 H ILE 523 104.425 -11.310 5.429 682 HA ILE 523 HA ILE 523 104.762 -8.690 4.182 683 HB ILE 523 HB ILE 523 106.815 -10.719 5.079 684 HG12 ILE 523 HG12 ILE 523 106.883 -8.138 6.379 685 HG13 ILE 523 HG13 ILE 523 105.293 -8.876 6.546 686 HG21 ILE 523 HG21 ILE 523 107.344 -7.888 4.224 687 HG22 ILE 523 HG22 ILE 523 107.446 -9.252 3.111 688 HG23 ILE 523 HG23 ILE 523 108.508 -9.180 4.516 689 HD11 ILE 523 HD11 ILE 523 107.662 -10.567 7.093 690 HD12 ILE 523 HD12 ILE 523 106.065 -10.572 7.841 691 HD13 ILE 523 HD13 ILE 523 107.237 -9.325 8.270 692 H LEU 524 H LEU 524 104.661 -8.527 2.034 693 HA LEU 524 HA LEU 524 104.541 -10.738 0.300 694 HB2 LEU 524 HB2 LEU 524 104.815 -7.793 -0.073 695 HB3 LEU 524 HB3 LEU 524 105.049 -8.846 -1.451 696 HG LEU 524 HG LEU 524 102.723 -7.854 -1.117 697 HD11 LEU 524 HD11 LEU 524 103.530 -10.559 -1.836 698 HD12 LEU 524 HD12 LEU 524 102.466 -9.429 -2.675 699 HD13 LEU 524 HD13 LEU 524 101.833 -10.434 -1.371 700 HD21 LEU 524 HD21 LEU 524 102.488 -10.050 0.930 701 HD22 LEU 524 HD22 LEU 524 101.263 -8.872 0.458 702 HD23 LEU 524 HD23 LEU 524 102.695 -8.348 1.344 703 H SER 525 H SER 525 106.012 -11.677 -1.060 704 HA SER 525 HA SER 525 108.742 -10.678 -1.135 705 HB2 SER 525 HB2 SER 525 108.342 -12.358 0.836 706 HB3 SER 525 HB3 SER 525 108.367 -13.573 -0.441 707 HG SER 525 HG SER 525 110.431 -12.491 0.744 708 H GLY 526 H GLY 526 110.103 -11.898 -2.676 709 HA2 GLY 526 HA2 GLY 526 110.452 -12.621 -4.823 710 HA3 GLY 526 HA3 GLY 526 109.192 -13.791 -4.470 711 H ASP 527 H ASP 527 108.524 -13.692 -6.645 712 HA ASP 527 HA ASP 527 107.875 -11.501 -8.146 713 HB2 ASP 527 HB2 ASP 527 107.197 -14.313 -8.151 714 HB3 ASP 527 HB3 ASP 527 105.832 -13.340 -8.692 715 H HIS 528 H HIS 528 106.091 -12.836 -5.439 716 HA HIS 528 HA HIS 528 103.634 -11.539 -5.934 717 HB2 HIS 528 HB2 HIS 528 104.619 -13.281 -4.000 718 HB3 HIS 528 HB3 HIS 528 104.241 -11.816 -3.100 719 HD1 HIS 528 HD1 HIS 528 102.463 -13.836 -2.197 720 HD2 HIS 528 HD2 HIS 528 101.701 -11.921 -5.806 721 HE1 HIS 528 HE1 HIS 528 100.017 -14.206 -2.651 722 HE2 HIS 528 HE2 HIS 528 99.598 -13.110 -4.881 723 H GLU 529 H GLU 529 106.454 -10.574 -3.987 724 HA GLU 529 HA GLU 529 105.341 -8.102 -3.143 725 HB2 GLU 529 HB2 GLU 529 107.107 -8.782 -1.803 726 HB3 GLU 529 HB3 GLU 529 108.085 -9.294 -3.170 727 HG2 GLU 529 HG2 GLU 529 108.334 -6.863 -3.763 728 HG3 GLU 529 HG3 GLU 529 107.585 -6.491 -2.211 729 H GLN 530 H GLN 530 107.518 -9.018 -5.766 730 HA GLN 530 HA GLN 530 107.961 -6.430 -6.787 731 HB2 GLN 530 HB2 GLN 530 109.287 -8.505 -7.323 732 HB3 GLN 530 HB3 GLN 530 107.967 -9.000 -8.375 733 HG2 GLN 530 HG2 GLN 530 108.709 -6.330 -9.027 734 HG3 GLN 530 HG3 GLN 530 110.159 -7.331 -8.973 735 HE21 GLN 530 HE21 GLN 530 106.856 -7.315 -10.250 736 HE22 GLN 530 HE22 GLN 530 107.238 -8.119 -11.731 737 H ARG 531 H ARG 531 105.498 -8.853 -7.474 738 HA ARG 531 HA ARG 531 104.323 -7.611 -9.699 739 HB2 ARG 531 HB2 ARG 531 103.935 -9.968 -8.922 740 HB3 ARG 531 HB3 ARG 531 102.917 -9.320 -7.643 741 HG2 ARG 531 HG2 ARG 531 102.375 -8.702 -10.523 742 HG3 ARG 531 HG3 ARG 531 101.795 -10.191 -9.773 743 HD2 ARG 531 HD2 ARG 531 101.120 -8.177 -7.975 744 HD3 ARG 531 HD3 ARG 531 100.774 -7.493 -9.562 745 HE ARG 531 HE ARG 531 98.983 -8.896 -9.707 746 HH11 ARG 531 HH11 ARG 531 101.214 -10.195 -7.368 747 HH12 ARG 531 HH12 ARG 531 100.168 -11.491 -6.896 748 HH21 ARG 531 HH21 ARG 531 97.596 -10.598 -9.092 749 HH22 ARG 531 HH22 ARG 531 98.109 -11.721 -7.877 750 H TYR 532 H TYR 532 103.352 -7.515 -6.268 751 HA TYR 532 HA TYR 532 101.204 -5.777 -6.521 752 HB2 TYR 532 HB2 TYR 532 101.681 -6.965 -4.448 753 HB3 TYR 532 HB3 TYR 532 103.168 -6.046 -4.237 754 HD1 TYR 532 HD1 TYR 532 103.036 -3.606 -3.757 755 HD2 TYR 532 HD2 TYR 532 99.586 -6.088 -3.749 756 HE1 TYR 532 HE1 TYR 532 101.817 -1.896 -2.476 757 HE2 TYR 532 HE2 TYR 532 98.354 -4.383 -2.475 758 HH TYR 532 HH TYR 532 98.385 -2.200 -1.805 759 H TRP 533 H TRP 533 104.644 -5.064 -6.092 760 HA TRP 533 HA TRP 533 104.386 -2.273 -5.894 761 HB2 TRP 533 HB2 TRP 533 106.602 -4.158 -6.500 762 HB3 TRP 533 HB3 TRP 533 106.835 -2.469 -6.949 763 HD1 TRP 533 HD1 TRP 533 107.357 -4.720 -4.130 764 HE1 TRP 533 HE1 TRP 533 107.694 -3.415 -1.939 765 HE3 TRP 533 HE3 TRP 533 105.743 -0.119 -5.667 766 HZ2 TRP 533 HZ2 TRP 533 107.325 -0.781 -0.986 767 HZ3 TRP 533 HZ3 TRP 533 105.766 1.739 -4.055 768 HH2 TRP 533 HH2 TRP 533 106.540 1.413 -1.762 769 H GLN 534 H GLN 534 104.802 -4.410 -8.685 770 HA GLN 534 HA GLN 534 105.187 -2.548 -10.686 771 HB2 GLN 534 HB2 GLN 534 103.697 -5.165 -10.656 772 HB3 GLN 534 HB3 GLN 534 103.816 -4.201 -12.123 773 HG2 GLN 534 HG2 GLN 534 106.416 -4.313 -11.252 774 HG3 GLN 534 HG3 GLN 534 105.789 -5.907 -10.838 775 HE21 GLN 534 HE21 GLN 534 106.834 -3.826 -13.328 776 HE22 GLN 534 HE22 GLN 534 106.594 -4.910 -14.652 777 H LYS 535 H LYS 535 102.173 -3.636 -9.194 778 HA LYS 535 HA LYS 535 100.424 -2.079 -10.762 779 HB2 LYS 535 HB2 LYS 535 99.158 -3.585 -9.631 780 HB3 LYS 535 HB3 LYS 535 100.270 -3.648 -8.273 781 HG2 LYS 535 HG2 LYS 535 98.488 -1.279 -8.676 782 HG3 LYS 535 HG3 LYS 535 97.889 -2.748 -7.900 783 HD2 LYS 535 HD2 LYS 535 100.417 -2.083 -6.767 784 HD3 LYS 535 HD3 LYS 535 99.399 -0.640 -6.754 785 HE2 LYS 535 HE2 LYS 535 98.002 -3.074 -5.941 786 HE3 LYS 535 HE3 LYS 535 99.353 -2.651 -4.890 787 HZ1 LYS 535 HZ1 LYS 535 96.798 -1.464 -5.048 788 HZ2 LYS 535 HZ2 LYS 535 97.974 -0.301 -5.401 789 HZ3 LYS 535 HZ3 LYS 535 98.043 -1.157 -3.944 790 H ILE 536 H ILE 536 102.214 -1.450 -7.791 791 HA ILE 536 HA ILE 536 101.047 1.029 -7.135 792 HB ILE 536 HB ILE 536 103.886 0.135 -6.608 793 HG12 ILE 536 HG12 ILE 536 101.304 -0.345 -5.138 794 HG13 ILE 536 HG13 ILE 536 102.528 -1.516 -5.620 795 HG21 ILE 536 HG21 ILE 536 104.122 1.866 -5.135 796 HG22 ILE 536 HG22 ILE 536 102.388 1.995 -4.837 797 HG23 ILE 536 HG23 ILE 536 103.074 2.622 -6.336 798 HD11 ILE 536 HD11 ILE 536 103.788 0.323 -3.901 799 HD12 ILE 536 HD12 ILE 536 103.411 -1.373 -3.601 800 HD13 ILE 536 HD13 ILE 536 102.253 -0.118 -3.156 801 H LEU 537 H LEU 537 104.307 0.534 -8.485 802 HA LEU 537 HA LEU 537 104.957 3.043 -9.232 803 HB2 LEU 537 HB2 LEU 537 105.447 0.430 -10.626 804 HB3 LEU 537 HB3 LEU 537 106.061 1.929 -11.296 805 HG LEU 537 HG LEU 537 106.706 0.973 -8.509 806 HD11 LEU 537 HD11 LEU 537 107.948 0.357 -11.139 807 HD12 LEU 537 HD12 LEU 537 107.778 -0.652 -9.703 808 HD13 LEU 537 HD13 LEU 537 109.004 0.614 -9.749 809 HD21 LEU 537 HD21 LEU 537 108.196 2.725 -8.380 810 HD22 LEU 537 HD22 LEU 537 106.876 3.457 -9.292 811 HD23 LEU 537 HD23 LEU 537 108.320 2.890 -10.131 812 H VAL 538 H VAL 538 103.273 0.783 -11.423 813 HA VAL 538 HA VAL 538 102.746 2.520 -13.491 814 HB VAL 538 HB VAL 538 101.081 0.231 -12.449 815 HG11 VAL 538 HG11 VAL 538 100.495 0.739 -15.166 816 HG12 VAL 538 HG12 VAL 538 100.304 2.260 -14.293 817 HG13 VAL 538 HG13 VAL 538 99.409 0.830 -13.779 818 HG21 VAL 538 HG21 VAL 538 103.245 0.554 -14.467 819 HG22 VAL 538 HG22 VAL 538 101.991 -0.651 -14.760 820 HG23 VAL 538 HG23 VAL 538 102.974 -0.738 -13.299 821 H ASP 539 H ASP 539 100.978 2.101 -10.461 822 HA ASP 539 HA ASP 539 98.770 3.728 -11.115 823 HB2 ASP 539 HB2 ASP 539 98.818 2.175 -9.180 824 HB3 ASP 539 HB3 ASP 539 99.977 3.235 -8.383 825 H ARG 540 H ARG 540 101.934 4.432 -9.734 826 HA ARG 540 HA ARG 540 101.459 7.130 -9.078 827 HB2 ARG 540 HB2 ARG 540 103.989 5.636 -9.764 828 HB3 ARG 540 HB3 ARG 540 103.985 7.327 -9.282 829 HG2 ARG 540 HG2 ARG 540 102.611 5.366 -7.525 830 HG3 ARG 540 HG3 ARG 540 104.375 5.386 -7.543 831 HD2 ARG 540 HD2 ARG 540 103.554 8.071 -7.398 832 HD3 ARG 540 HD3 ARG 540 102.546 7.184 -6.255 833 HE ARG 540 HE ARG 540 105.235 6.411 -5.938 834 HH11 ARG 540 HH11 ARG 540 103.111 9.111 -5.369 835 HH12 ARG 540 HH12 ARG 540 104.021 9.711 -4.023 836 HH21 ARG 540 HH21 ARG 540 106.441 7.191 -4.165 837 HH22 ARG 540 HH22 ARG 540 105.914 8.620 -3.339 838 H GLN 541 H GLN 541 102.602 5.550 -12.019 839 HA GLN 541 HA GLN 541 103.208 7.879 -13.479 840 HB2 GLN 541 HB2 GLN 541 102.608 5.038 -14.190 841 HB3 GLN 541 HB3 GLN 541 102.631 6.243 -15.471 842 HG2 GLN 541 HG2 GLN 541 104.779 5.121 -15.261 843 HG3 GLN 541 HG3 GLN 541 104.913 6.842 -14.896 844 HE21 GLN 541 HE21 GLN 541 105.477 7.491 -12.866 845 HE22 GLN 541 HE22 GLN 541 105.987 6.404 -11.624 846 H ALA 542 H ALA 542 100.245 5.977 -13.163 847 HA ALA 542 HA ALA 542 98.716 7.382 -15.060 848 HB1 ALA 542 HB1 ALA 542 96.749 6.446 -13.856 849 HB2 ALA 542 HB2 ALA 542 97.850 5.828 -12.625 850 HB3 ALA 542 HB3 ALA 542 97.962 5.239 -14.283 851 H LYS 543 H LYS 543 99.516 8.012 -11.724 852 HA LYS 543 HA LYS 543 97.548 9.950 -11.173 853 HB2 LYS 543 HB2 LYS 543 100.142 9.140 -9.985 854 HB3 LYS 543 HB3 LYS 543 99.575 10.757 -9.591 855 HG2 LYS 543 HG2 LYS 543 97.433 9.763 -8.829 856 HG3 LYS 543 HG3 LYS 543 98.127 8.164 -9.101 857 HD2 LYS 543 HD2 LYS 543 99.970 9.670 -7.552 858 HD3 LYS 543 HD3 LYS 543 98.373 9.844 -6.820 859 HE2 LYS 543 HE2 LYS 543 98.132 7.507 -6.563 860 HE3 LYS 543 HE3 LYS 543 99.504 7.174 -7.618 861 HZ1 LYS 543 HZ1 LYS 543 99.564 8.315 -4.883 862 HZ2 LYS 543 HZ2 LYS 543 100.908 8.312 -5.909 863 HZ3 LYS 543 HZ3 LYS 543 100.227 6.849 -5.406 864 H LEU 544 H LEU 544 100.108 10.034 -13.348 865 HA LEU 544 HA LEU 544 101.310 12.427 -13.321 866 HB2 LEU 544 HB2 LEU 544 100.641 10.549 -15.312 867 HB3 LEU 544 HB3 LEU 544 100.185 12.116 -15.947 868 HG LEU 544 HG LEU 544 102.552 12.871 -15.294 869 HD11 LEU 544 HD11 LEU 544 103.935 10.529 -15.654 870 HD12 LEU 544 HD12 LEU 544 102.627 10.050 -14.572 871 HD13 LEU 544 HD13 LEU 544 103.709 11.368 -14.119 872 HD21 LEU 544 HD21 LEU 544 102.237 10.817 -17.479 873 HD22 LEU 544 HD22 LEU 544 103.459 12.087 -17.393 874 HD23 LEU 544 HD23 LEU 544 101.760 12.511 -17.600 875 H ASN 545 H ASN 545 97.912 11.884 -13.979 876 HA ASN 545 HA ASN 545 97.517 14.785 -14.270 877 HB2 ASN 545 HB2 ASN 545 95.684 12.506 -15.048 878 HB3 ASN 545 HB3 ASN 545 95.343 14.217 -15.285 879 HD21 ASN 545 HD21 ASN 545 97.569 15.255 -16.268 880 HD22 ASN 545 HD22 ASN 545 98.018 14.502 -17.757 881 H GLN 546 H GLN 546 97.920 14.523 -11.804 882 HA GLN 546 HA GLN 546 96.392 13.435 -9.921 883 HB2 GLN 546 HB2 GLN 546 97.683 16.065 -10.169 884 HB3 GLN 546 HB3 GLN 546 96.415 15.992 -8.953 885 HG2 GLN 546 HG2 GLN 546 97.560 13.984 -8.004 886 HG3 GLN 546 HG3 GLN 546 98.889 14.294 -9.120 887 HE21 GLN 546 HE21 GLN 546 98.871 17.098 -9.004 888 HE22 GLN 546 HE22 GLN 546 99.411 17.578 -7.435 889 HA PRO 547 HA PRO 547 92.271 14.452 -11.639 890 HB2 PRO 547 HB2 PRO 547 91.673 12.644 -9.341 891 HB3 PRO 547 HB3 PRO 547 91.012 12.636 -10.980 892 HG2 PRO 547 HG2 PRO 547 92.837 10.843 -10.263 893 HG3 PRO 547 HG3 PRO 547 92.887 11.590 -11.872 894 HD2 PRO 547 HD2 PRO 547 94.588 12.127 -9.478 895 HD3 PRO 547 HD3 PRO 547 95.023 12.139 -11.200 896 H ARG 548 H ARG 548 92.103 16.584 -10.985 897 HA ARG 548 HA ARG 548 91.884 17.290 -8.201 898 HB2 ARG 548 HB2 ARG 548 92.445 18.651 -10.606 899 HB3 ARG 548 HB3 ARG 548 90.963 19.359 -9.981 900 HG2 ARG 548 HG2 ARG 548 93.166 18.966 -8.050 901 HG3 ARG 548 HG3 ARG 548 93.386 20.211 -9.282 902 HD2 ARG 548 HD2 ARG 548 90.751 20.449 -8.274 903 HD3 ARG 548 HD3 ARG 548 91.839 20.317 -6.894 904 HE ARG 548 HE ARG 548 93.101 22.156 -8.317 905 HH11 ARG 548 HH11 ARG 548 89.705 21.834 -7.607 906 HH12 ARG 548 HH12 ARG 548 89.399 23.537 -7.669 907 HH21 ARG 548 HH21 ARG 548 92.706 24.401 -8.404 908 HH22 ARG 548 HH22 ARG 548 91.103 24.996 -8.122 909 H GLU 549 H GLU 549 90.094 16.778 -7.118 910 HA GLU 549 HA GLU 549 87.625 16.114 -8.163 911 HB2 GLU 549 HB2 GLU 549 87.966 17.457 -5.487 912 HB3 GLU 549 HB3 GLU 549 86.765 16.260 -5.954 913 HG2 GLU 549 HG2 GLU 549 89.203 15.008 -6.397 914 HG3 GLU 549 HG3 GLU 549 89.422 15.896 -4.889 915 H LYS 550 H LYS 550 86.752 17.446 -9.671 916 HA LYS 550 HA LYS 550 85.418 19.806 -8.744 917 HB2 LYS 550 HB2 LYS 550 87.841 20.492 -9.345 918 HB3 LYS 550 HB3 LYS 550 87.335 20.258 -11.013 919 HG2 LYS 550 HG2 LYS 550 86.688 22.383 -10.958 920 HG3 LYS 550 HG3 LYS 550 85.332 21.829 -9.973 921 HD2 LYS 550 HD2 LYS 550 87.970 22.525 -8.728 922 HD3 LYS 550 HD3 LYS 550 86.779 23.775 -9.095 923 HE2 LYS 550 HE2 LYS 550 85.218 22.889 -7.600 924 HE3 LYS 550 HE3 LYS 550 86.032 21.327 -7.535 925 HZ1 LYS 550 HZ1 LYS 550 87.851 22.358 -6.337 926 HZ2 LYS 550 HZ2 LYS 550 86.394 22.609 -5.518 927 HZ3 LYS 550 HZ3 LYS 550 87.088 23.865 -6.413 928 H LYS 551 H LYS 551 84.257 17.590 -9.634 929 HA LYS 551 HA LYS 551 82.554 16.977 -11.036 930 HB2 LYS 551 HB2 LYS 551 83.246 19.288 -12.838 931 HB3 LYS 551 HB3 LYS 551 81.702 18.464 -12.668 932 HG2 LYS 551 HG2 LYS 551 81.370 19.422 -10.489 933 HG3 LYS 551 HG3 LYS 551 82.985 20.133 -10.517 934 HD2 LYS 551 HD2 LYS 551 82.237 21.380 -12.601 935 HD3 LYS 551 HD3 LYS 551 80.599 20.862 -12.197 936 HE2 LYS 551 HE2 LYS 551 82.354 22.303 -10.229 937 HE3 LYS 551 HE3 LYS 551 81.335 23.166 -11.381 938 HZ1 LYS 551 HZ1 LYS 551 79.440 21.823 -10.456 939 HZ2 LYS 551 HZ2 LYS 551 80.098 22.972 -9.404 940 HZ3 LYS 551 HZ3 LYS 551 80.480 21.336 -9.214 941 H ARG 552 H ARG 552 83.539 15.093 -11.677 942 HA ARG 552 HA ARG 552 85.034 15.224 -14.210 943 HB2 ARG 552 HB2 ARG 552 85.790 14.072 -11.709 944 HB3 ARG 552 HB3 ARG 552 85.586 12.775 -12.879 945 HG2 ARG 552 HG2 ARG 552 87.193 15.206 -13.552 946 HG3 ARG 552 HG3 ARG 552 87.898 13.874 -12.635 947 HD2 ARG 552 HD2 ARG 552 86.431 13.284 -15.161 948 HD3 ARG 552 HD3 ARG 552 88.060 13.948 -15.256 949 HE ARG 552 HE ARG 552 88.484 11.935 -13.605 950 HH11 ARG 552 HH11 ARG 552 86.555 12.022 -16.508 951 HH12 ARG 552 HH12 ARG 552 86.821 10.354 -16.886 952 HH21 ARG 552 HH21 ARG 552 88.845 9.743 -14.102 953 HH22 ARG 552 HH22 ARG 552 88.124 9.059 -15.521 954 H GLY 553 H GLY 553 82.781 13.349 -12.242 955 HA2 GLY 553 HA2 GLY 553 82.241 11.280 -14.024 956 HA3 GLY 553 HA3 GLY 553 81.105 11.897 -12.834 957 H THR 554 H THR 554 79.261 12.660 -13.617 958 HA THR 554 HA THR 554 77.667 13.228 -15.162 959 HB THR 554 HB THR 554 79.051 15.219 -16.647 960 HG1 THR 554 HG1 THR 554 80.701 15.129 -15.061 961 HG21 THR 554 HG21 THR 554 76.737 14.942 -15.110 962 HG22 THR 554 HG22 THR 554 77.232 16.354 -16.045 963 HG23 THR 554 HG23 THR 554 77.654 16.236 -14.337 964 H GLU 555 H GLU 555 78.754 10.984 -16.057 965 HA GLU 555 HA GLU 555 78.295 10.994 -18.803 966 HB2 GLU 555 HB2 GLU 555 80.688 10.432 -19.530 967 HB3 GLU 555 HB3 GLU 555 80.302 12.124 -19.243 968 HG2 GLU 555 HG2 GLU 555 81.947 12.267 -17.779 969 HG3 GLU 555 HG3 GLU 555 81.211 10.997 -16.803 970 H LYS 556 H LYS 556 77.584 9.009 -19.172 971 HA LYS 556 HA LYS 556 78.636 6.811 -17.531 972 HB2 LYS 556 HB2 LYS 556 75.991 7.570 -18.367 973 HB3 LYS 556 HB3 LYS 556 76.353 5.952 -18.953 974 HG2 LYS 556 HG2 LYS 556 77.234 5.809 -16.384 975 HG3 LYS 556 HG3 LYS 556 75.860 6.906 -16.234 976 HD2 LYS 556 HD2 LYS 556 75.189 4.568 -15.926 977 HD3 LYS 556 HD3 LYS 556 74.424 5.283 -17.347 978 HE2 LYS 556 HE2 LYS 556 76.800 4.212 -18.304 979 HE3 LYS 556 HE3 LYS 556 76.218 3.015 -17.147 980 HZ1 LYS 556 HZ1 LYS 556 73.975 3.561 -18.469 981 HZ2 LYS 556 HZ2 LYS 556 75.038 2.322 -18.913 982 HZ3 LYS 556 HZ3 LYS 556 75.103 3.816 -19.704 983 H LEU 557 H LEU 557 80.288 5.876 -18.575 984 HA LEU 557 HA LEU 557 80.044 5.364 -21.456 985 HB2 LEU 557 HB2 LEU 557 82.444 4.962 -21.428 986 HB3 LEU 557 HB3 LEU 557 82.069 6.531 -20.739 987 HG LEU 557 HG LEU 557 82.178 4.538 -18.660 988 HD11 LEU 557 HD11 LEU 557 84.290 4.449 -20.718 989 HD12 LEU 557 HD12 LEU 557 83.757 3.213 -19.579 990 HD13 LEU 557 HD13 LEU 557 84.832 4.502 -19.040 991 HD21 LEU 557 HD21 LEU 557 82.537 6.598 -17.817 992 HD22 LEU 557 HD22 LEU 557 83.276 7.196 -19.302 993 HD23 LEU 557 HD23 LEU 557 84.222 6.221 -18.177 994 H ILE 558 H ILE 558 80.160 3.306 -22.300 995 HA ILE 558 HA ILE 558 79.103 1.185 -20.900 996 HB ILE 558 HB ILE 558 80.018 -0.291 -22.675 997 HG12 ILE 558 HG12 ILE 558 81.327 2.247 -23.676 998 HG13 ILE 558 HG13 ILE 558 82.179 0.885 -22.958 999 HG21 ILE 558 HG21 ILE 558 78.915 2.249 -23.849 1000 HG22 ILE 558 HG22 ILE 558 77.938 1.112 -22.919 1001 HG23 ILE 558 HG23 ILE 558 78.694 0.597 -24.427 1002 HD11 ILE 558 HD11 ILE 558 81.768 1.266 -25.620 1003 HD12 ILE 558 HD12 ILE 558 80.465 0.153 -25.203 1004 HD13 ILE 558 HD13 ILE 558 82.139 -0.281 -24.858 1005 H THR 559 H THR 559 80.024 -0.807 -20.135 1006 HA THR 559 HA THR 559 81.497 -2.076 -18.946 1007 HB THR 559 HB THR 559 83.976 -0.686 -19.490 1008 HG1 THR 559 HG1 THR 559 83.737 -1.360 -21.859 1009 HG21 THR 559 HG21 THR 559 84.215 -2.977 -20.811 1010 HG22 THR 559 HG22 THR 559 82.797 -3.384 -19.848 1011 HG23 THR 559 HG23 THR 559 84.293 -2.900 -19.052 1012 H LYS 560 H LYS 560 81.533 -1.896 -16.811 1013 HA LYS 560 HA LYS 560 81.367 0.391 -15.324 1014 HB2 LYS 560 HB2 LYS 560 81.111 -2.039 -14.573 1015 HB3 LYS 560 HB3 LYS 560 82.852 -2.036 -14.335 1016 HG2 LYS 560 HG2 LYS 560 82.676 -0.971 -12.393 1017 HG3 LYS 560 HG3 LYS 560 81.586 0.242 -13.072 1018 HD2 LYS 560 HD2 LYS 560 80.075 -0.700 -11.691 1019 HD3 LYS 560 HD3 LYS 560 79.946 -1.911 -12.968 1020 HE2 LYS 560 HE2 LYS 560 81.241 -2.080 -10.304 1021 HE3 LYS 560 HE3 LYS 560 80.307 -3.287 -11.187 1022 HZ1 LYS 560 HZ1 LYS 560 82.427 -3.109 -12.755 1023 HZ2 LYS 560 HZ2 LYS 560 82.345 -4.183 -11.451 1024 HZ3 LYS 560 HZ3 LYS 560 83.158 -2.709 -11.283 1025 H ALA 561 H ALA 561 82.774 1.979 -16.129 1026 HA ALA 561 HA ALA 561 85.636 1.546 -15.626 1027 HB1 ALA 561 HB1 ALA 561 85.879 3.690 -16.988 1028 HB2 ALA 561 HB2 ALA 561 84.185 3.466 -17.420 1029 HB3 ALA 561 HB3 ALA 561 85.373 2.236 -17.851
Contact the webmaster for help, if required. Monday, July 8, 2024 7:09:50 AM GMT (wattos1)