NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
487255 | 2kwv | 16885 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H LEU 491 H LEU 491 15.875 6.998 10.822 2 HA LEU 491 HA LEU 491 18.354 5.990 10.604 3 HB2 LEU 491 HB2 LEU 491 16.769 3.800 9.910 4 HB3 LEU 491 HB3 LEU 491 17.274 4.321 11.505 5 HG LEU 491 HG LEU 491 15.172 5.687 11.705 6 HD11 LEU 491 HD11 LEU 491 14.705 5.941 9.253 7 HD12 LEU 491 HD12 LEU 491 14.447 4.187 9.147 8 HD13 LEU 491 HD13 LEU 491 13.341 5.197 10.114 9 HD21 LEU 491 HD21 LEU 491 14.870 2.730 11.106 10 HD22 LEU 491 HD22 LEU 491 15.409 3.445 12.643 11 HD23 LEU 491 HD23 LEU 491 13.746 3.725 12.070 12 HA PRO 492 HA PRO 492 19.217 5.515 6.242 13 HB2 PRO 492 HB2 PRO 492 21.542 4.117 6.471 14 HB3 PRO 492 HB3 PRO 492 21.405 5.841 6.944 15 HG2 PRO 492 HG2 PRO 492 21.400 3.403 8.707 16 HG3 PRO 492 HG3 PRO 492 22.200 4.980 8.988 17 HD2 PRO 492 HD2 PRO 492 19.729 4.208 10.051 18 HD3 PRO 492 HD3 PRO 492 20.220 5.897 9.869 19 H LEU 493 H LEU 493 20.207 3.206 5.074 20 HA LEU 493 HA LEU 493 18.015 1.398 5.216 21 HB2 LEU 493 HB2 LEU 493 19.331 0.056 3.612 22 HB3 LEU 493 HB3 LEU 493 19.117 1.742 3.156 23 HG LEU 493 HG LEU 493 21.329 0.763 2.596 24 HD11 LEU 493 HD11 LEU 493 21.679 3.068 4.535 25 HD12 LEU 493 HD12 LEU 493 22.623 2.680 3.095 26 HD13 LEU 493 HD13 LEU 493 20.950 3.241 2.911 27 HD21 LEU 493 HD21 LEU 493 21.883 0.884 5.583 28 HD22 LEU 493 HD22 LEU 493 21.719 -0.605 4.614 29 HD23 LEU 493 HD23 LEU 493 23.056 0.520 4.303 30 H GLN 494 H GLN 494 19.219 1.714 7.705 31 HA GLN 494 HA GLN 494 20.884 -0.405 8.545 32 HB2 GLN 494 HB2 GLN 494 20.308 0.417 10.744 33 HB3 GLN 494 HB3 GLN 494 20.545 1.767 9.616 34 HG2 GLN 494 HG2 GLN 494 18.661 2.561 10.531 35 HG3 GLN 494 HG3 GLN 494 17.883 1.516 9.325 36 HE21 GLN 494 HE21 GLN 494 19.480 0.973 12.483 37 HE22 GLN 494 HE22 GLN 494 18.159 0.042 13.196 38 H ALA 495 H ALA 495 17.375 -0.206 8.157 39 HA ALA 495 HA ALA 495 17.310 -3.121 8.651 40 HB1 ALA 495 HB1 ALA 495 16.776 -2.049 10.811 41 HB2 ALA 495 HB2 ALA 495 15.433 -1.177 10.024 42 HB3 ALA 495 HB3 ALA 495 15.385 -2.952 10.160 43 H LEU 496 H LEU 496 16.565 -0.636 6.598 44 HA LEU 496 HA LEU 496 13.853 -1.326 5.872 45 HB2 LEU 496 HB2 LEU 496 16.049 0.381 4.639 46 HB3 LEU 496 HB3 LEU 496 14.497 0.118 3.855 47 HG LEU 496 HG LEU 496 13.389 0.951 6.027 48 HD11 LEU 496 HD11 LEU 496 16.227 1.973 6.435 49 HD12 LEU 496 HD12 LEU 496 14.802 2.543 7.334 50 HD13 LEU 496 HD13 LEU 496 15.366 0.877 7.536 51 HD21 LEU 496 HD21 LEU 496 13.755 3.316 5.352 52 HD22 LEU 496 HD22 LEU 496 15.122 2.794 4.332 53 HD23 LEU 496 HD23 LEU 496 13.468 2.253 3.959 54 HA PRO 497 HA PRO 497 14.283 -4.626 3.007 55 HB2 PRO 497 HB2 PRO 497 13.113 -2.760 0.948 56 HB3 PRO 497 HB3 PRO 497 12.612 -4.435 1.324 57 HG2 PRO 497 HG2 PRO 497 11.150 -2.382 2.261 58 HG3 PRO 497 HG3 PRO 497 11.565 -3.738 3.365 59 HD2 PRO 497 HD2 PRO 497 12.895 -1.032 3.132 60 HD3 PRO 497 HD3 PRO 497 12.422 -1.926 4.607 61 H GLU 498 H GLU 498 15.530 -5.379 1.195 62 HA GLU 498 HA GLU 498 17.804 -3.667 0.560 63 HB2 GLU 498 HB2 GLU 498 17.960 -6.119 1.130 64 HB3 GLU 498 HB3 GLU 498 17.208 -6.478 -0.441 65 HG2 GLU 498 HG2 GLU 498 19.069 -5.389 -1.613 66 HG3 GLU 498 HG3 GLU 498 19.703 -4.770 -0.086 67 H GLY 499 H GLY 499 16.025 -2.251 -0.317 68 HA2 GLY 499 HA2 GLY 499 16.401 -1.813 -3.054 69 HA3 GLY 499 HA3 GLY 499 14.957 -2.840 -2.910 70 H VAL 500 H VAL 500 15.780 -0.491 -0.375 71 HA VAL 500 HA VAL 500 13.732 1.414 -1.374 72 HB VAL 500 HB VAL 500 13.671 -0.056 1.290 73 HG11 VAL 500 HG11 VAL 500 13.092 2.282 1.730 74 HG12 VAL 500 HG12 VAL 500 11.977 2.296 0.336 75 HG13 VAL 500 HG13 VAL 500 11.624 1.296 1.757 76 HG21 VAL 500 HG21 VAL 500 12.629 -1.270 -0.601 77 HG22 VAL 500 HG22 VAL 500 11.399 -0.693 0.544 78 HG23 VAL 500 HG23 VAL 500 11.660 0.171 -0.989 79 H ASP 501 H ASP 501 13.783 3.454 -0.195 80 HA ASP 501 HA ASP 501 16.330 4.007 1.273 81 HB2 ASP 501 HB2 ASP 501 16.274 4.632 -1.290 82 HB3 ASP 501 HB3 ASP 501 15.181 5.917 -0.773 83 H GLN 502 H GLN 502 16.195 5.522 2.792 84 HA GLN 502 HA GLN 502 13.695 5.901 4.084 85 HB2 GLN 502 HB2 GLN 502 15.126 7.661 5.370 86 HB3 GLN 502 HB3 GLN 502 15.479 5.945 5.535 87 HG2 GLN 502 HG2 GLN 502 16.926 7.695 3.511 88 HG3 GLN 502 HG3 GLN 502 17.445 7.534 5.195 89 HE21 GLN 502 HE21 GLN 502 16.234 4.536 4.679 90 HE22 GLN 502 HE22 GLN 502 17.686 3.740 4.098 91 H GLU 503 H GLU 503 15.421 7.835 1.638 92 HA GLU 503 HA GLU 503 13.828 10.183 2.117 93 HB2 GLU 503 HB2 GLU 503 14.844 11.085 0.155 94 HB3 GLU 503 HB3 GLU 503 16.085 10.108 0.956 95 HG2 GLU 503 HG2 GLU 503 15.460 8.207 -0.616 96 HG3 GLU 503 HG3 GLU 503 14.370 9.314 -1.444 97 H VAL 504 H VAL 504 12.876 7.184 1.025 98 HA VAL 504 HA VAL 504 10.459 8.404 -0.155 99 HB VAL 504 HB VAL 504 12.031 7.713 -1.921 100 HG11 VAL 504 HG11 VAL 504 11.381 4.885 -0.989 101 HG12 VAL 504 HG12 VAL 504 12.212 5.312 -2.502 102 HG13 VAL 504 HG13 VAL 504 12.977 5.676 -0.947 103 HG21 VAL 504 HG21 VAL 504 9.590 7.914 -2.287 104 HG22 VAL 504 HG22 VAL 504 10.335 6.688 -3.337 105 HG23 VAL 504 HG23 VAL 504 9.392 6.184 -1.927 106 H PHE 505 H PHE 505 11.463 7.059 2.438 107 HA PHE 505 HA PHE 505 9.099 5.260 2.738 108 HB2 PHE 505 HB2 PHE 505 10.691 3.677 3.040 109 HB3 PHE 505 HB3 PHE 505 11.960 4.852 3.329 110 HD1 PHE 505 HD1 PHE 505 12.327 5.850 5.547 111 HD2 PHE 505 HD2 PHE 505 9.495 2.681 4.936 112 HE1 PHE 505 HE1 PHE 505 12.402 5.313 7.974 113 HE2 PHE 505 HE2 PHE 505 9.567 2.151 7.370 114 HZ PHE 505 HZ PHE 505 11.045 3.452 8.874 115 H LYS 506 H LYS 506 10.951 8.012 3.856 116 HA LYS 506 HA LYS 506 9.586 8.297 6.388 117 HB2 LYS 506 HB2 LYS 506 11.164 10.189 4.608 118 HB3 LYS 506 HB3 LYS 506 10.449 10.686 6.158 119 HG2 LYS 506 HG2 LYS 506 11.660 8.894 7.329 120 HG3 LYS 506 HG3 LYS 506 12.433 8.388 5.821 121 HD2 LYS 506 HD2 LYS 506 12.705 11.145 7.083 122 HD3 LYS 506 HD3 LYS 506 13.899 9.836 7.207 123 HE2 LYS 506 HE2 LYS 506 14.187 9.824 4.774 124 HE3 LYS 506 HE3 LYS 506 12.999 11.136 4.609 125 HZ1 LYS 506 HZ1 LYS 506 14.426 12.536 5.907 126 HZ2 LYS 506 HZ2 LYS 506 15.514 11.333 6.132 127 HZ3 LYS 506 HZ3 LYS 506 15.278 11.949 4.628 128 H GLN 507 H GLN 507 8.287 8.195 3.397 129 HA GLN 507 HA GLN 507 6.470 10.485 3.609 130 HB2 GLN 507 HB2 GLN 507 6.049 8.229 1.675 131 HB3 GLN 507 HB3 GLN 507 5.832 9.969 1.442 132 HG2 GLN 507 HG2 GLN 507 8.416 8.371 1.470 133 HG3 GLN 507 HG3 GLN 507 7.696 9.189 0.092 134 HE21 GLN 507 HE21 GLN 507 10.406 9.468 1.286 135 HE22 GLN 507 HE22 GLN 507 10.574 11.144 1.705 136 H LEU 508 H LEU 508 6.662 7.766 5.342 137 HA LEU 508 HA LEU 508 3.803 6.926 5.073 138 HB2 LEU 508 HB2 LEU 508 6.173 5.366 6.154 139 HB3 LEU 508 HB3 LEU 508 4.564 4.739 5.775 140 HG LEU 508 HG LEU 508 6.544 5.860 3.737 141 HD11 LEU 508 HD11 LEU 508 5.740 2.976 4.248 142 HD12 LEU 508 HD12 LEU 508 6.951 3.576 3.101 143 HD13 LEU 508 HD13 LEU 508 7.242 3.719 4.847 144 HD21 LEU 508 HD21 LEU 508 5.006 4.821 2.084 145 HD22 LEU 508 HD22 LEU 508 3.883 4.413 3.403 146 HD23 LEU 508 HD23 LEU 508 4.207 6.114 3.005 147 HA PRO 509 HA PRO 509 3.200 8.202 9.286 148 HB2 PRO 509 HB2 PRO 509 1.342 6.307 10.108 149 HB3 PRO 509 HB3 PRO 509 0.975 7.765 9.155 150 HG2 PRO 509 HG2 PRO 509 1.412 4.925 8.218 151 HG3 PRO 509 HG3 PRO 509 0.171 6.091 7.655 152 HD2 PRO 509 HD2 PRO 509 2.470 5.585 6.254 153 HD3 PRO 509 HD3 PRO 509 1.741 7.218 6.295 154 H ALA 510 H ALA 510 3.398 7.425 11.507 155 HA ALA 510 HA ALA 510 5.694 5.835 11.893 156 HB1 ALA 510 HB1 ALA 510 3.456 6.667 13.783 157 HB2 ALA 510 HB2 ALA 510 5.060 6.069 14.292 158 HB3 ALA 510 HB3 ALA 510 4.907 7.611 13.406 159 H ASP 511 H ASP 511 2.337 4.918 11.498 160 HA ASP 511 HA ASP 511 2.704 2.294 12.780 161 HB2 ASP 511 HB2 ASP 511 0.395 3.491 11.182 162 HB3 ASP 511 HB3 ASP 511 0.346 1.956 12.066 163 H ILE 512 H ILE 512 3.602 3.653 9.853 164 HA ILE 512 HA ILE 512 3.707 0.918 8.664 165 HB ILE 512 HB ILE 512 3.597 3.624 7.304 166 HG12 ILE 512 HG12 ILE 512 1.729 1.225 7.484 167 HG13 ILE 512 HG13 ILE 512 1.439 2.875 8.062 168 HG21 ILE 512 HG21 ILE 512 3.701 2.367 5.176 169 HG22 ILE 512 HG22 ILE 512 5.166 2.116 6.114 170 HG23 ILE 512 HG23 ILE 512 3.911 0.846 6.079 171 HD11 ILE 512 HD11 ILE 512 1.657 1.993 5.149 172 HD12 ILE 512 HD12 ILE 512 0.214 2.552 6.012 173 HD13 ILE 512 HD13 ILE 512 1.548 3.683 5.689 174 H GLN 513 H GLN 513 5.522 3.624 9.953 175 HA GLN 513 HA GLN 513 8.055 3.084 8.807 176 HB2 GLN 513 HB2 GLN 513 7.332 3.745 11.701 177 HB3 GLN 513 HB3 GLN 513 8.975 3.777 11.050 178 HG2 GLN 513 HG2 GLN 513 6.692 5.502 10.004 179 HG3 GLN 513 HG3 GLN 513 7.899 6.027 11.187 180 HE21 GLN 513 HE21 GLN 513 7.149 5.735 7.875 181 HE22 GLN 513 HE22 GLN 513 8.739 6.062 7.216 182 H GLU 514 H GLU 514 6.183 1.402 11.323 183 HA GLU 514 HA GLU 514 8.277 -0.504 11.933 184 HB2 GLU 514 HB2 GLU 514 6.595 -1.473 13.405 185 HB3 GLU 514 HB3 GLU 514 6.576 0.297 13.565 186 HG2 GLU 514 HG2 GLU 514 4.627 0.430 12.064 187 HG3 GLU 514 HG3 GLU 514 4.633 -1.334 11.890 188 H GLU 515 H GLU 515 6.183 -0.245 9.254 189 HA GLU 515 HA GLU 515 5.796 -3.183 9.032 190 HB2 GLU 515 HB2 GLU 515 4.795 -0.840 7.362 191 HB3 GLU 515 HB3 GLU 515 4.401 -2.536 7.071 192 HG2 GLU 515 HG2 GLU 515 3.766 -1.088 9.679 193 HG3 GLU 515 HG3 GLU 515 2.650 -1.192 8.317 194 H ILE 516 H ILE 516 7.816 -0.594 7.820 195 HA ILE 516 HA ILE 516 8.759 -2.319 5.567 196 HB ILE 516 HB ILE 516 8.935 0.641 6.188 197 HG12 ILE 516 HG12 ILE 516 7.924 0.994 4.069 198 HG13 ILE 516 HG13 ILE 516 8.112 -0.695 3.582 199 HG21 ILE 516 HG21 ILE 516 11.176 -0.033 5.431 200 HG22 ILE 516 HG22 ILE 516 10.461 -0.914 4.057 201 HG23 ILE 516 HG23 ILE 516 10.352 0.855 4.138 202 HD11 ILE 516 HD11 ILE 516 5.768 -0.041 4.199 203 HD12 ILE 516 HD12 ILE 516 6.400 -1.397 5.144 204 HD13 ILE 516 HD13 ILE 516 6.333 0.232 5.865 205 H LEU 517 H LEU 517 9.762 -0.624 8.566 206 HA LEU 517 HA LEU 517 12.502 -1.471 8.466 207 HB2 LEU 517 HB2 LEU 517 10.615 -0.767 10.749 208 HB3 LEU 517 HB3 LEU 517 12.326 -1.137 10.993 209 HG LEU 517 HG LEU 517 11.301 1.096 9.189 210 HD11 LEU 517 HD11 LEU 517 12.498 1.224 11.993 211 HD12 LEU 517 HD12 LEU 517 12.021 2.611 10.988 212 HD13 LEU 517 HD13 LEU 517 10.786 1.489 11.599 213 HD21 LEU 517 HD21 LEU 517 14.090 0.499 10.262 214 HD22 LEU 517 HD22 LEU 517 13.553 0.256 8.580 215 HD23 LEU 517 HD23 LEU 517 13.627 1.891 9.264 216 H SER 518 H SER 518 9.633 -3.272 8.707 217 HA SER 518 HA SER 518 10.521 -5.399 10.438 218 HB2 SER 518 HB2 SER 518 8.145 -4.953 9.816 219 HB3 SER 518 HB3 SER 518 8.517 -5.424 8.146 220 HG SER 518 HG SER 518 7.659 -7.152 9.400 221 H GLY 519 H GLY 519 10.587 -4.890 6.862 222 HA2 GLY 519 HA2 GLY 519 12.628 -5.613 5.709 223 HA3 GLY 519 HA3 GLY 519 12.562 -7.125 6.638 224 H LYS 520 H LYS 520 11.925 -5.871 3.630 225 HA LYS 520 HA LYS 520 9.836 -7.878 3.051 226 HB2 LYS 520 HB2 LYS 520 9.793 -4.974 2.157 227 HB3 LYS 520 HB3 LYS 520 8.595 -6.238 1.800 228 HG2 LYS 520 HG2 LYS 520 8.198 -6.417 4.311 229 HG3 LYS 520 HG3 LYS 520 9.145 -4.919 4.478 230 HD2 LYS 520 HD2 LYS 520 6.614 -5.337 2.840 231 HD3 LYS 520 HD3 LYS 520 6.758 -4.386 4.333 232 HE2 LYS 520 HE2 LYS 520 8.242 -2.795 3.200 233 HE3 LYS 520 HE3 LYS 520 8.238 -3.791 1.736 234 HZ1 LYS 520 HZ1 LYS 520 5.892 -3.407 1.531 235 HZ2 LYS 520 HZ2 LYS 520 5.882 -2.453 2.875 236 HZ3 LYS 520 HZ3 LYS 520 6.722 -1.996 1.527 237 H SER 521 H SER 521 9.445 -7.532 0.563 238 HA SER 521 HA SER 521 11.863 -7.195 -1.058 239 HB2 SER 521 HB2 SER 521 12.056 -9.504 -0.102 240 HB3 SER 521 HB3 SER 521 10.491 -9.907 -0.838 241 HG SER 521 HG SER 521 12.307 -10.483 -2.140 242 H ARG 522 H ARG 522 10.989 -8.313 -3.383 243 HA ARG 522 HA ARG 522 9.677 -7.983 -5.153 244 HB2 ARG 522 HB2 ARG 522 8.024 -9.047 -3.259 245 HB3 ARG 522 HB3 ARG 522 7.169 -7.538 -3.592 246 HG2 ARG 522 HG2 ARG 522 6.330 -9.226 -5.101 247 HG3 ARG 522 HG3 ARG 522 7.324 -8.083 -6.043 248 HD2 ARG 522 HD2 ARG 522 7.704 -10.510 -6.618 249 HD3 ARG 522 HD3 ARG 522 9.158 -9.625 -6.150 250 HE ARG 522 HE ARG 522 9.383 -10.947 -4.276 251 HH11 ARG 522 HH11 ARG 522 6.149 -11.460 -5.629 252 HH12 ARG 522 HH12 ARG 522 5.825 -12.833 -4.588 253 HH21 ARG 522 HH21 ARG 522 8.925 -12.752 -2.974 254 HH22 ARG 522 HH22 ARG 522 7.371 -13.546 -3.103 255 H GLU 523 H GLU 523 10.752 -5.649 -3.495 256 HA GLU 523 HA GLU 523 9.527 -3.559 -5.178 257 HB2 GLU 523 HB2 GLU 523 9.343 -2.031 -3.222 258 HB3 GLU 523 HB3 GLU 523 8.232 -3.403 -3.154 259 HG2 GLU 523 HG2 GLU 523 9.875 -4.573 -1.612 260 HG3 GLU 523 HG3 GLU 523 10.828 -3.086 -1.600 261 H ASN 524 H ASN 524 10.946 -1.815 -5.584 262 HA ASN 524 HA ASN 524 13.748 -2.081 -4.710 263 HB2 ASN 524 HB2 ASN 524 12.780 -2.470 -7.592 264 HB3 ASN 524 HB3 ASN 524 14.470 -2.258 -7.131 265 HD21 ASN 524 HD21 ASN 524 11.753 -4.468 -7.262 266 HD22 ASN 524 HD22 ASN 524 12.632 -5.893 -6.739 267 H LEU 525 H LEU 525 11.654 -0.096 -4.476 268 HA LEU 525 HA LEU 525 11.240 2.092 -4.730 269 HB2 LEU 525 HB2 LEU 525 12.942 3.491 -4.083 270 HB3 LEU 525 HB3 LEU 525 13.171 1.931 -3.314 271 HG LEU 525 HG LEU 525 14.951 1.451 -5.113 272 HD11 LEU 525 HD11 LEU 525 15.984 3.574 -6.025 273 HD12 LEU 525 HD12 LEU 525 14.375 3.224 -6.706 274 HD13 LEU 525 HD13 LEU 525 14.545 4.455 -5.439 275 HD21 LEU 525 HD21 LEU 525 15.443 2.002 -2.779 276 HD22 LEU 525 HD22 LEU 525 16.610 2.809 -3.852 277 HD23 LEU 525 HD23 LEU 525 15.270 3.739 -3.128 278 H LYS 526 H LYS 526 11.922 0.498 -7.315 279 HA LYS 526 HA LYS 526 11.964 2.843 -9.160 280 HB2 LYS 526 HB2 LYS 526 13.210 0.085 -9.257 281 HB3 LYS 526 HB3 LYS 526 13.044 1.077 -10.726 282 HG2 LYS 526 HG2 LYS 526 14.413 2.841 -9.729 283 HG3 LYS 526 HG3 LYS 526 14.568 1.907 -8.221 284 HD2 LYS 526 HD2 LYS 526 15.397 0.841 -10.936 285 HD3 LYS 526 HD3 LYS 526 16.514 1.734 -9.881 286 HE2 LYS 526 HE2 LYS 526 15.045 -0.813 -9.064 287 HE3 LYS 526 HE3 LYS 526 16.701 -0.767 -9.703 288 HZ1 LYS 526 HZ1 LYS 526 16.722 -0.789 -7.333 289 HZ2 LYS 526 HZ2 LYS 526 17.284 0.667 -7.847 290 HZ3 LYS 526 HZ3 LYS 526 15.755 0.532 -7.241 291 H1 MET 1 H1 MET 1 -14.289 11.174 -13.199 292 H2 MET 1 H2 MET 1 -13.068 12.114 -13.773 293 H3 MET 1 H3 MET 1 -14.436 12.813 -13.176 294 HA MET 1 HA MET 1 -12.624 13.011 -11.617 295 HB2 MET 1 HB2 MET 1 -14.842 12.926 -10.652 296 HB3 MET 1 HB3 MET 1 -14.911 11.159 -10.829 297 HG2 MET 1 HG2 MET 1 -13.122 10.876 -9.214 298 HG3 MET 1 HG3 MET 1 -12.867 12.625 -9.133 299 HE1 MET 1 HE1 MET 1 -13.103 10.855 -6.580 300 HE2 MET 1 HE2 MET 1 -12.935 12.623 -6.514 301 HE3 MET 1 HE3 MET 1 -14.202 11.816 -5.564 302 H GLN 2 H GLN 2 -10.797 12.258 -10.849 303 HA GLN 2 HA GLN 2 -10.402 9.413 -10.400 304 HB2 GLN 2 HB2 GLN 2 -8.591 9.125 -11.980 305 HB3 GLN 2 HB3 GLN 2 -9.975 9.791 -12.875 306 HG2 GLN 2 HG2 GLN 2 -8.836 12.103 -12.215 307 HG3 GLN 2 HG3 GLN 2 -7.408 11.127 -11.975 308 HE21 GLN 2 HE21 GLN 2 -6.296 12.177 -13.708 309 HE22 GLN 2 HE22 GLN 2 -6.723 11.896 -15.386 310 H ILE 3 H ILE 3 -8.026 9.102 -9.656 311 HA ILE 3 HA ILE 3 -6.932 11.534 -8.350 312 HB ILE 3 HB ILE 3 -6.746 10.547 -6.218 313 HG12 ILE 3 HG12 ILE 3 -7.408 7.942 -7.591 314 HG13 ILE 3 HG13 ILE 3 -6.100 8.365 -6.500 315 HG21 ILE 3 HG21 ILE 3 -9.540 9.924 -7.226 316 HG22 ILE 3 HG22 ILE 3 -9.055 10.290 -5.550 317 HG23 ILE 3 HG23 ILE 3 -8.919 11.536 -6.793 318 HD11 ILE 3 HD11 ILE 3 -7.666 6.904 -5.361 319 HD12 ILE 3 HD12 ILE 3 -7.742 8.519 -4.618 320 HD13 ILE 3 HD13 ILE 3 -9.023 7.979 -5.735 321 H PHE 4 H PHE 4 -4.768 10.662 -7.120 322 HA PHE 4 HA PHE 4 -3.297 8.983 -9.098 323 HB2 PHE 4 HB2 PHE 4 -2.339 11.624 -7.930 324 HB3 PHE 4 HB3 PHE 4 -1.454 10.619 -9.010 325 HD1 PHE 4 HD1 PHE 4 -2.403 10.017 -11.295 326 HD2 PHE 4 HD2 PHE 4 -3.833 13.305 -8.911 327 HE1 PHE 4 HE1 PHE 4 -3.213 11.110 -13.323 328 HE2 PHE 4 HE2 PHE 4 -4.648 14.425 -10.968 329 HZ PHE 4 HZ PHE 4 -4.357 13.335 -13.181 330 H VAL 5 H VAL 5 -2.982 7.243 -7.874 331 HA VAL 5 HA VAL 5 -2.253 7.536 -5.015 332 HB VAL 5 HB VAL 5 -3.004 5.100 -6.680 333 HG11 VAL 5 HG11 VAL 5 -1.616 4.544 -4.737 334 HG12 VAL 5 HG12 VAL 5 -2.675 5.510 -3.678 335 HG13 VAL 5 HG13 VAL 5 -3.291 4.032 -4.459 336 HG21 VAL 5 HG21 VAL 5 -4.633 6.770 -4.712 337 HG22 VAL 5 HG22 VAL 5 -4.905 6.670 -6.464 338 HG23 VAL 5 HG23 VAL 5 -5.156 5.243 -5.444 339 H LYS 6 H LYS 6 -0.079 7.943 -4.798 340 HA LYS 6 HA LYS 6 1.816 6.748 -6.677 341 HB2 LYS 6 HB2 LYS 6 1.934 9.120 -5.845 342 HB3 LYS 6 HB3 LYS 6 2.363 8.490 -4.242 343 HG2 LYS 6 HG2 LYS 6 4.379 7.439 -5.150 344 HG3 LYS 6 HG3 LYS 6 3.870 7.816 -6.806 345 HD2 LYS 6 HD2 LYS 6 5.548 9.410 -6.203 346 HD3 LYS 6 HD3 LYS 6 3.996 10.259 -6.251 347 HE2 LYS 6 HE2 LYS 6 3.823 10.036 -3.772 348 HE3 LYS 6 HE3 LYS 6 5.392 9.202 -3.754 349 HZ1 LYS 6 HZ1 LYS 6 5.618 11.530 -3.239 350 HZ2 LYS 6 HZ2 LYS 6 6.379 11.197 -4.653 351 HZ3 LYS 6 HZ3 LYS 6 4.924 11.965 -4.661 352 H THR 7 H THR 7 3.234 5.112 -6.276 353 HA THR 7 HA THR 7 2.613 3.362 -4.023 354 HB THR 7 HB THR 7 4.155 1.827 -5.213 355 HG1 THR 7 HG1 THR 7 5.152 2.560 -7.065 356 HG21 THR 7 HG21 THR 7 2.835 1.581 -7.249 357 HG22 THR 7 HG22 THR 7 1.767 2.026 -5.901 358 HG23 THR 7 HG23 THR 7 2.232 3.251 -7.105 359 H LEU 8 H LEU 8 4.538 2.132 -3.083 360 HA LEU 8 HA LEU 8 6.237 3.837 -1.563 361 HB2 LEU 8 HB2 LEU 8 5.370 1.616 -0.871 362 HB3 LEU 8 HB3 LEU 8 6.339 0.836 -2.117 363 HG LEU 8 HG LEU 8 8.401 1.458 -1.001 364 HD11 LEU 8 HD11 LEU 8 6.620 2.917 0.995 365 HD12 LEU 8 HD12 LEU 8 8.363 2.614 1.208 366 HD13 LEU 8 HD13 LEU 8 7.803 3.666 -0.105 367 HD21 LEU 8 HD21 LEU 8 7.179 -0.559 -0.225 368 HD22 LEU 8 HD22 LEU 8 8.192 0.177 1.032 369 HD23 LEU 8 HD23 LEU 8 6.430 0.426 1.061 370 H THR 9 H THR 9 6.406 3.290 -4.795 371 HA THR 9 HA THR 9 9.388 3.348 -4.843 372 HB THR 9 HB THR 9 9.303 2.258 -7.015 373 HG1 THR 9 HG1 THR 9 7.274 2.934 -7.717 374 HG21 THR 9 HG21 THR 9 7.617 0.738 -4.984 375 HG22 THR 9 HG22 THR 9 8.594 0.041 -6.291 376 HG23 THR 9 HG23 THR 9 9.391 0.875 -4.932 377 H GLY 10 H GLY 10 6.919 5.402 -4.935 378 HA2 GLY 10 HA2 GLY 10 6.888 7.583 -5.555 379 HA3 GLY 10 HA3 GLY 10 8.513 7.402 -6.244 380 H LYS 11 H LYS 11 5.763 5.403 -7.263 381 HA LYS 11 HA LYS 11 5.514 6.992 -9.787 382 HB2 LYS 11 HB2 LYS 11 6.820 4.898 -9.982 383 HB3 LYS 11 HB3 LYS 11 5.451 3.964 -9.375 384 HG2 LYS 11 HG2 LYS 11 4.993 5.776 -11.742 385 HG3 LYS 11 HG3 LYS 11 5.899 4.271 -11.983 386 HD2 LYS 11 HD2 LYS 11 4.022 2.947 -11.076 387 HD3 LYS 11 HD3 LYS 11 3.112 4.420 -10.736 388 HE2 LYS 11 HE2 LYS 11 2.310 3.448 -12.801 389 HE3 LYS 11 HE3 LYS 11 3.119 4.980 -13.159 390 HZ1 LYS 11 HZ1 LYS 11 4.314 2.303 -13.466 391 HZ2 LYS 11 HZ2 LYS 11 3.760 3.250 -14.689 392 HZ3 LYS 11 HZ3 LYS 11 5.062 3.727 -13.815 393 H THR 12 H THR 12 3.417 7.098 -10.682 394 HA THR 12 HA THR 12 1.343 6.458 -8.634 395 HB THR 12 HB THR 12 1.501 8.998 -10.310 396 HG1 THR 12 HG1 THR 12 3.133 8.970 -8.792 397 HG21 THR 12 HG21 THR 12 -0.410 7.813 -8.341 398 HG22 THR 12 HG22 THR 12 -0.061 9.549 -8.239 399 HG23 THR 12 HG23 THR 12 -0.708 8.850 -9.761 400 H ILE 13 H ILE 13 -0.779 6.213 -9.338 401 HA ILE 13 HA ILE 13 -1.090 5.413 -12.194 402 HB ILE 13 HB ILE 13 -2.051 3.897 -9.733 403 HG12 ILE 13 HG12 ILE 13 0.212 3.246 -11.684 404 HG13 ILE 13 HG13 ILE 13 0.398 3.738 -9.991 405 HG21 ILE 13 HG21 ILE 13 -2.751 2.170 -11.345 406 HG22 ILE 13 HG22 ILE 13 -3.531 3.712 -11.719 407 HG23 ILE 13 HG23 ILE 13 -2.142 3.160 -12.690 408 HD11 ILE 13 HD11 ILE 13 -0.867 1.719 -9.278 409 HD12 ILE 13 HD12 ILE 13 -0.914 1.178 -10.976 410 HD13 ILE 13 HD13 ILE 13 0.643 1.347 -10.144 411 H THR 14 H THR 14 -2.929 6.183 -13.105 412 HA THR 14 HA THR 14 -4.567 7.995 -11.512 413 HB THR 14 HB THR 14 -4.922 7.207 -14.428 414 HG1 THR 14 HG1 THR 14 -3.502 8.912 -14.858 415 HG21 THR 14 HG21 THR 14 -5.777 9.517 -14.576 416 HG22 THR 14 HG22 THR 14 -6.696 8.570 -13.384 417 HG23 THR 14 HG23 THR 14 -5.468 9.742 -12.833 418 H LEU 15 H LEU 15 -6.706 7.612 -10.879 419 HA LEU 15 HA LEU 15 -7.916 4.991 -11.607 420 HB2 LEU 15 HB2 LEU 15 -7.356 5.970 -8.780 421 HB3 LEU 15 HB3 LEU 15 -8.255 4.508 -9.206 422 HG LEU 15 HG LEU 15 -5.344 5.012 -9.938 423 HD11 LEU 15 HD11 LEU 15 -6.520 3.329 -7.683 424 HD12 LEU 15 HD12 LEU 15 -4.786 3.533 -8.076 425 HD13 LEU 15 HD13 LEU 15 -5.736 4.911 -7.480 426 HD21 LEU 15 HD21 LEU 15 -6.482 3.323 -11.367 427 HD22 LEU 15 HD22 LEU 15 -5.258 2.597 -10.297 428 HD23 LEU 15 HD23 LEU 15 -6.982 2.445 -9.910 429 H GLU 16 H GLU 16 -10.067 5.087 -11.713 430 HA GLU 16 HA GLU 16 -11.406 7.670 -11.113 431 HB2 GLU 16 HB2 GLU 16 -11.720 6.798 -13.345 432 HB3 GLU 16 HB3 GLU 16 -12.103 5.183 -12.725 433 HG2 GLU 16 HG2 GLU 16 -14.146 6.001 -11.698 434 HG3 GLU 16 HG3 GLU 16 -13.789 7.667 -12.207 435 H VAL 17 H VAL 17 -12.629 7.942 -9.416 436 HA VAL 17 HA VAL 17 -14.001 5.678 -8.112 437 HB VAL 17 HB VAL 17 -13.192 6.372 -5.890 438 HG11 VAL 17 HG11 VAL 17 -10.895 5.689 -7.768 439 HG12 VAL 17 HG12 VAL 17 -10.934 5.444 -6.014 440 HG13 VAL 17 HG13 VAL 17 -12.039 4.524 -7.057 441 HG21 VAL 17 HG21 VAL 17 -11.232 8.137 -7.419 442 HG22 VAL 17 HG22 VAL 17 -12.595 8.721 -6.427 443 HG23 VAL 17 HG23 VAL 17 -11.250 7.855 -5.667 444 H GLU 18 H GLU 18 -15.380 6.624 -6.242 445 HA GLU 18 HA GLU 18 -16.346 9.382 -6.817 446 HB2 GLU 18 HB2 GLU 18 -17.998 6.864 -6.352 447 HB3 GLU 18 HB3 GLU 18 -18.661 8.492 -6.486 448 HG2 GLU 18 HG2 GLU 18 -17.112 7.058 -8.687 449 HG3 GLU 18 HG3 GLU 18 -18.869 7.112 -8.542 450 HA PRO 19 HA PRO 19 -16.259 9.812 -2.420 451 HB2 PRO 19 HB2 PRO 19 -19.067 10.839 -2.424 452 HB3 PRO 19 HB3 PRO 19 -17.579 11.619 -1.816 453 HG2 PRO 19 HG2 PRO 19 -18.728 12.419 -4.163 454 HG3 PRO 19 HG3 PRO 19 -16.943 12.350 -3.948 455 HD2 PRO 19 HD2 PRO 19 -18.745 10.360 -5.324 456 HD3 PRO 19 HD3 PRO 19 -17.143 10.984 -5.831 457 H SER 20 H SER 20 -18.195 7.489 -3.899 458 HA SER 20 HA SER 20 -19.221 6.464 -1.309 459 HB2 SER 20 HB2 SER 20 -20.967 5.401 -2.766 460 HB3 SER 20 HB3 SER 20 -21.059 7.186 -2.712 461 HG SER 20 HG SER 20 -19.954 5.554 -4.754 462 H ASP 21 H ASP 21 -17.085 6.059 -3.935 463 HA ASP 21 HA ASP 21 -16.903 3.125 -3.753 464 HB2 ASP 21 HB2 ASP 21 -15.218 5.218 -5.118 465 HB3 ASP 21 HB3 ASP 21 -14.994 3.475 -5.299 466 H THR 22 H THR 22 -16.678 3.379 -1.436 467 HA THR 22 HA THR 22 -14.466 4.692 -0.169 468 HB THR 22 HB THR 22 -16.462 4.166 1.044 469 HG1 THR 22 HG1 THR 22 -15.419 3.332 2.845 470 HG21 THR 22 HG21 THR 22 -17.167 2.091 0.049 471 HG22 THR 22 HG22 THR 22 -15.715 1.255 0.686 472 HG23 THR 22 HG23 THR 22 -16.968 1.898 1.798 473 H ILE 23 H ILE 23 -13.025 3.156 1.363 474 HA ILE 23 HA ILE 23 -10.920 2.575 -0.335 475 HB ILE 23 HB ILE 23 -11.285 1.384 2.426 476 HG12 ILE 23 HG12 ILE 23 -11.911 3.704 2.622 477 HG13 ILE 23 HG13 ILE 23 -10.286 3.500 3.270 478 HG21 ILE 23 HG21 ILE 23 -9.287 0.640 1.216 479 HG22 ILE 23 HG22 ILE 23 -8.844 2.321 0.856 480 HG23 ILE 23 HG23 ILE 23 -8.827 1.732 2.538 481 HD11 ILE 23 HD11 ILE 23 -10.966 4.594 0.501 482 HD12 ILE 23 HD12 ILE 23 -10.498 5.553 1.918 483 HD13 ILE 23 HD13 ILE 23 -9.327 4.435 1.189 484 H GLU 24 H GLU 24 -13.370 0.192 0.866 485 HA GLU 24 HA GLU 24 -11.813 -2.046 -0.060 486 HB2 GLU 24 HB2 GLU 24 -13.778 -3.364 0.318 487 HB3 GLU 24 HB3 GLU 24 -13.656 -2.183 1.635 488 HG2 GLU 24 HG2 GLU 24 -15.322 -0.752 0.483 489 HG3 GLU 24 HG3 GLU 24 -15.456 -1.950 -0.814 490 H ASN 25 H ASN 25 -13.838 0.279 -1.694 491 HA ASN 25 HA ASN 25 -14.240 -1.350 -4.072 492 HB2 ASN 25 HB2 ASN 25 -14.580 1.621 -3.578 493 HB3 ASN 25 HB3 ASN 25 -15.047 0.803 -5.047 494 HD21 ASN 25 HD21 ASN 25 -15.805 1.398 -1.789 495 HD22 ASN 25 HD22 ASN 25 -17.330 0.488 -1.698 496 H VAL 26 H VAL 26 -12.112 1.228 -2.870 497 HA VAL 26 HA VAL 26 -10.739 1.942 -5.277 498 HB VAL 26 HB VAL 26 -9.940 2.048 -2.334 499 HG11 VAL 26 HG11 VAL 26 -8.705 3.343 -4.789 500 HG12 VAL 26 HG12 VAL 26 -8.340 3.812 -3.109 501 HG13 VAL 26 HG13 VAL 26 -7.959 2.172 -3.670 502 HG21 VAL 26 HG21 VAL 26 -11.980 3.309 -2.825 503 HG22 VAL 26 HG22 VAL 26 -10.628 4.400 -2.480 504 HG23 VAL 26 HG23 VAL 26 -11.159 4.149 -4.166 505 H LYS 27 H LYS 27 -10.086 -0.453 -2.692 506 HA LYS 27 HA LYS 27 -7.568 -1.286 -3.616 507 HB2 LYS 27 HB2 LYS 27 -9.824 -2.707 -2.164 508 HB3 LYS 27 HB3 LYS 27 -8.240 -3.444 -2.481 509 HG2 LYS 27 HG2 LYS 27 -7.082 -1.738 -1.227 510 HG3 LYS 27 HG3 LYS 27 -8.575 -0.805 -1.004 511 HD2 LYS 27 HD2 LYS 27 -9.567 -2.672 0.278 512 HD3 LYS 27 HD3 LYS 27 -8.077 -3.623 0.049 513 HE2 LYS 27 HE2 LYS 27 -6.780 -1.872 1.205 514 HE3 LYS 27 HE3 LYS 27 -8.254 -0.925 1.449 515 HZ1 LYS 27 HZ1 LYS 27 -9.146 -2.704 2.752 516 HZ2 LYS 27 HZ2 LYS 27 -7.800 -3.628 2.528 517 HZ3 LYS 27 HZ3 LYS 27 -7.718 -2.226 3.388 518 H ALA 28 H ALA 28 -10.771 -1.860 -5.023 519 HA ALA 28 HA ALA 28 -9.778 -4.046 -6.704 520 HB1 ALA 28 HB1 ALA 28 -12.159 -3.915 -5.993 521 HB2 ALA 28 HB2 ALA 28 -12.331 -2.405 -6.924 522 HB3 ALA 28 HB3 ALA 28 -11.968 -3.925 -7.761 523 H LYS 29 H LYS 29 -10.042 -0.512 -6.860 524 HA LYS 29 HA LYS 29 -9.710 -0.272 -9.718 525 HB2 LYS 29 HB2 LYS 29 -9.287 1.583 -7.349 526 HB3 LYS 29 HB3 LYS 29 -8.777 2.048 -8.965 527 HG2 LYS 29 HG2 LYS 29 -10.927 2.962 -8.520 528 HG3 LYS 29 HG3 LYS 29 -11.076 1.748 -9.811 529 HD2 LYS 29 HD2 LYS 29 -12.067 0.150 -8.306 530 HD3 LYS 29 HD3 LYS 29 -11.586 1.120 -6.898 531 HE2 LYS 29 HE2 LYS 29 -13.981 1.320 -7.344 532 HE3 LYS 29 HE3 LYS 29 -13.160 2.878 -7.501 533 HZ1 LYS 29 HZ1 LYS 29 -13.910 1.144 -9.758 534 HZ2 LYS 29 HZ2 LYS 29 -14.708 2.503 -9.288 535 HZ3 LYS 29 HZ3 LYS 29 -13.177 2.618 -9.867 536 H ILE 30 H ILE 30 -7.489 -0.652 -6.963 537 HA ILE 30 HA ILE 30 -5.123 -0.131 -8.631 538 HB ILE 30 HB ILE 30 -5.544 -0.982 -5.735 539 HG12 ILE 30 HG12 ILE 30 -4.639 1.657 -6.957 540 HG13 ILE 30 HG13 ILE 30 -6.298 1.317 -6.436 541 HG21 ILE 30 HG21 ILE 30 -2.967 -0.178 -7.163 542 HG22 ILE 30 HG22 ILE 30 -3.135 -0.480 -5.419 543 HG23 ILE 30 HG23 ILE 30 -3.354 -1.806 -6.567 544 HD11 ILE 30 HD11 ILE 30 -3.853 1.347 -4.621 545 HD12 ILE 30 HD12 ILE 30 -5.115 2.591 -4.731 546 HD13 ILE 30 HD13 ILE 30 -5.521 0.972 -4.120 547 H GLN 31 H GLN 31 -6.991 -2.864 -7.331 548 HA GLN 31 HA GLN 31 -5.092 -4.915 -7.996 549 HB2 GLN 31 HB2 GLN 31 -6.962 -5.379 -6.495 550 HB3 GLN 31 HB3 GLN 31 -8.129 -4.868 -7.732 551 HG2 GLN 31 HG2 GLN 31 -7.514 -6.703 -9.185 552 HG3 GLN 31 HG3 GLN 31 -6.188 -7.171 -8.131 553 HE21 GLN 31 HE21 GLN 31 -6.708 -9.073 -7.139 554 HE22 GLN 31 HE22 GLN 31 -8.248 -9.419 -6.374 555 H ASP 32 H ASP 32 -7.691 -3.228 -9.791 556 HA ASP 32 HA ASP 32 -7.708 -5.036 -11.996 557 HB2 ASP 32 HB2 ASP 32 -9.521 -3.450 -11.401 558 HB3 ASP 32 HB3 ASP 32 -8.443 -2.100 -11.659 559 H LYS 33 H LYS 33 -5.824 -2.245 -11.136 560 HA LYS 33 HA LYS 33 -4.756 -1.750 -13.796 561 HB2 LYS 33 HB2 LYS 33 -4.412 -0.656 -11.002 562 HB3 LYS 33 HB3 LYS 33 -3.356 -0.103 -12.316 563 HG2 LYS 33 HG2 LYS 33 -6.395 -0.080 -12.534 564 HG3 LYS 33 HG3 LYS 33 -5.471 1.282 -11.869 565 HD2 LYS 33 HD2 LYS 33 -4.155 1.438 -13.951 566 HD3 LYS 33 HD3 LYS 33 -5.120 0.135 -14.671 567 HE2 LYS 33 HE2 LYS 33 -6.244 2.762 -13.602 568 HE3 LYS 33 HE3 LYS 33 -5.871 2.455 -15.303 569 HZ1 LYS 33 HZ1 LYS 33 -7.463 0.645 -15.252 570 HZ2 LYS 33 HZ2 LYS 33 -7.810 0.946 -13.677 571 HZ3 LYS 33 HZ3 LYS 33 -8.188 2.060 -14.828 572 H GLU 34 H GLU 34 -3.713 -3.664 -11.015 573 HA GLU 34 HA GLU 34 -1.244 -4.258 -12.572 574 HB2 GLU 34 HB2 GLU 34 -1.328 -3.610 -9.600 575 HB3 GLU 34 HB3 GLU 34 0.079 -4.248 -10.472 576 HG2 GLU 34 HG2 GLU 34 0.013 -2.237 -11.963 577 HG3 GLU 34 HG3 GLU 34 -1.290 -1.578 -10.957 578 H GLY 35 H GLY 35 -3.599 -5.325 -10.106 579 HA2 GLY 35 HA2 GLY 35 -4.398 -7.613 -10.338 580 HA3 GLY 35 HA3 GLY 35 -2.735 -8.135 -10.651 581 H ILE 36 H ILE 36 -2.938 -5.660 -8.318 582 HA ILE 36 HA ILE 36 -1.874 -7.441 -6.277 583 HB ILE 36 HB ILE 36 -2.457 -4.457 -6.352 584 HG12 ILE 36 HG12 ILE 36 0.153 -6.018 -6.606 585 HG13 ILE 36 HG13 ILE 36 -0.744 -5.339 -7.968 586 HG21 ILE 36 HG21 ILE 36 -0.820 -6.084 -4.362 587 HG22 ILE 36 HG22 ILE 36 -1.061 -4.316 -4.348 588 HG23 ILE 36 HG23 ILE 36 -2.431 -5.400 -4.042 589 HD11 ILE 36 HD11 ILE 36 -0.509 -3.061 -6.941 590 HD12 ILE 36 HD12 ILE 36 0.531 -3.774 -5.683 591 HD13 ILE 36 HD13 ILE 36 1.043 -3.808 -7.383 592 HA PRO 37 HA PRO 37 -5.961 -8.125 -4.657 593 HB2 PRO 37 HB2 PRO 37 -5.325 -9.610 -2.447 594 HB3 PRO 37 HB3 PRO 37 -5.134 -10.232 -4.119 595 HG2 PRO 37 HG2 PRO 37 -3.030 -9.000 -2.333 596 HG3 PRO 37 HG3 PRO 37 -2.917 -10.524 -3.275 597 HD2 PRO 37 HD2 PRO 37 -1.901 -8.164 -4.208 598 HD3 PRO 37 HD3 PRO 37 -2.655 -9.350 -5.313 599 HA PRO 38 HA PRO 38 -6.696 -5.053 -1.548 600 HB2 PRO 38 HB2 PRO 38 -8.786 -6.194 -0.137 601 HB3 PRO 38 HB3 PRO 38 -8.949 -5.447 -1.758 602 HG2 PRO 38 HG2 PRO 38 -8.633 -8.381 -1.067 603 HG3 PRO 38 HG3 PRO 38 -9.772 -7.633 -2.238 604 HD2 PRO 38 HD2 PRO 38 -7.454 -8.781 -3.033 605 HD3 PRO 38 HD3 PRO 38 -8.065 -7.291 -3.818 606 H ASP 39 H ASP 39 -5.800 -8.316 -0.806 607 HA ASP 39 HA ASP 39 -5.650 -7.933 2.064 608 HB2 ASP 39 HB2 ASP 39 -6.203 -10.102 1.034 609 HB3 ASP 39 HB3 ASP 39 -4.626 -10.122 0.226 610 H GLN 40 H GLN 40 -3.622 -7.045 -0.583 611 HA GLN 40 HA GLN 40 -1.230 -7.045 1.214 612 HB2 GLN 40 HB2 GLN 40 -1.483 -7.537 -1.769 613 HB3 GLN 40 HB3 GLN 40 0.061 -7.205 -0.965 614 HG2 GLN 40 HG2 GLN 40 -0.151 -9.159 0.443 615 HG3 GLN 40 HG3 GLN 40 -1.813 -9.449 -0.105 616 HE21 GLN 40 HE21 GLN 40 1.185 -8.678 -1.989 617 HE22 GLN 40 HE22 GLN 40 1.104 -10.122 -2.975 618 H GLN 41 H GLN 41 -3.412 -4.990 -0.576 619 HA GLN 41 HA GLN 41 -1.521 -2.851 -0.976 620 HB2 GLN 41 HB2 GLN 41 -4.554 -2.943 -0.759 621 HB3 GLN 41 HB3 GLN 41 -3.630 -1.487 -1.188 622 HG2 GLN 41 HG2 GLN 41 -2.690 -2.592 -3.154 623 HG3 GLN 41 HG3 GLN 41 -3.470 -4.118 -2.695 624 HE21 GLN 41 HE21 GLN 41 -4.877 -4.386 -4.444 625 HE22 GLN 41 HE22 GLN 41 -6.208 -3.296 -4.720 626 H ARG 42 H ARG 42 -1.828 -0.716 0.069 627 HA ARG 42 HA ARG 42 -2.793 -0.567 2.810 628 HB2 ARG 42 HB2 ARG 42 -0.608 -1.690 3.117 629 HB3 ARG 42 HB3 ARG 42 0.182 -0.444 2.155 630 HG2 ARG 42 HG2 ARG 42 0.564 -0.036 4.532 631 HG3 ARG 42 HG3 ARG 42 -0.422 1.262 3.837 632 HD2 ARG 42 HD2 ARG 42 -1.304 0.630 6.004 633 HD3 ARG 42 HD3 ARG 42 -2.466 0.185 4.747 634 HE ARG 42 HE ARG 42 -1.713 -2.149 4.959 635 HH11 ARG 42 HH11 ARG 42 -0.834 0.045 7.604 636 HH12 ARG 42 HH12 ARG 42 -0.568 -1.259 8.736 637 HH21 ARG 42 HH21 ARG 42 -1.409 -3.802 6.481 638 HH22 ARG 42 HH22 ARG 42 -0.905 -3.414 8.111 639 H LEU 43 H LEU 43 -4.074 1.150 2.016 640 HA LEU 43 HA LEU 43 -2.823 3.195 0.318 641 HB2 LEU 43 HB2 LEU 43 -4.996 1.971 -0.179 642 HB3 LEU 43 HB3 LEU 43 -5.706 2.792 1.218 643 HG LEU 43 HG LEU 43 -5.139 4.989 0.124 644 HD11 LEU 43 HD11 LEU 43 -4.694 4.950 -2.320 645 HD12 LEU 43 HD12 LEU 43 -3.367 4.180 -1.430 646 HD13 LEU 43 HD13 LEU 43 -4.568 3.181 -2.277 647 HD21 LEU 43 HD21 LEU 43 -7.003 4.817 -1.516 648 HD22 LEU 43 HD22 LEU 43 -6.916 3.042 -1.416 649 HD23 LEU 43 HD23 LEU 43 -7.392 3.987 0.008 650 H ILE 44 H ILE 44 -2.648 5.345 0.810 651 HA ILE 44 HA ILE 44 -3.402 6.303 3.528 652 HB ILE 44 HB ILE 44 -0.684 6.378 2.161 653 HG12 ILE 44 HG12 ILE 44 0.035 5.694 4.525 654 HG13 ILE 44 HG13 ILE 44 -1.662 5.358 4.855 655 HG21 ILE 44 HG21 ILE 44 -1.480 7.964 4.632 656 HG22 ILE 44 HG22 ILE 44 0.135 7.857 3.928 657 HG23 ILE 44 HG23 ILE 44 -1.139 8.671 3.028 658 HD11 ILE 44 HD11 ILE 44 -1.671 3.489 3.455 659 HD12 ILE 44 HD12 ILE 44 -0.378 4.147 2.401 660 HD13 ILE 44 HD13 ILE 44 0.001 3.471 3.998 661 H PHE 45 H PHE 45 -3.650 8.588 3.645 662 HA PHE 45 HA PHE 45 -3.443 10.242 1.217 663 HB2 PHE 45 HB2 PHE 45 -5.702 9.214 1.117 664 HB3 PHE 45 HB3 PHE 45 -6.034 9.776 2.747 665 HD1 PHE 45 HD1 PHE 45 -4.691 11.368 -0.405 666 HD2 PHE 45 HD2 PHE 45 -7.455 11.597 2.880 667 HE1 PHE 45 HE1 PHE 45 -5.603 13.461 -1.331 668 HE2 PHE 45 HE2 PHE 45 -8.349 13.723 1.980 669 HZ PHE 45 HZ PHE 45 -7.425 14.670 -0.121 670 H ALA 46 H ALA 46 -3.219 12.416 1.735 671 HA ALA 46 HA ALA 46 -2.309 14.052 2.977 672 HB1 ALA 46 HB1 ALA 46 -4.565 13.320 4.878 673 HB2 ALA 46 HB2 ALA 46 -3.712 14.882 4.809 674 HB3 ALA 46 HB3 ALA 46 -4.712 14.353 3.435 675 H GLY 47 H GLY 47 -1.550 11.090 3.685 676 HA2 GLY 47 HA2 GLY 47 0.413 10.488 4.794 677 HA3 GLY 47 HA3 GLY 47 0.255 11.860 5.893 678 H LYS 48 H LYS 48 -2.724 10.068 5.498 679 HA LYS 48 HA LYS 48 -1.973 8.272 7.737 680 HB2 LYS 48 HB2 LYS 48 -4.144 8.604 8.813 681 HB3 LYS 48 HB3 LYS 48 -3.111 10.031 8.827 682 HG2 LYS 48 HG2 LYS 48 -5.296 10.757 8.439 683 HG3 LYS 48 HG3 LYS 48 -4.395 10.957 6.919 684 HD2 LYS 48 HD2 LYS 48 -5.527 8.998 5.967 685 HD3 LYS 48 HD3 LYS 48 -6.402 8.708 7.489 686 HE2 LYS 48 HE2 LYS 48 -6.572 11.209 5.762 687 HE3 LYS 48 HE3 LYS 48 -7.767 9.904 5.813 688 HZ1 LYS 48 HZ1 LYS 48 -7.020 11.620 8.089 689 HZ2 LYS 48 HZ2 LYS 48 -8.401 11.737 7.207 690 HZ3 LYS 48 HZ3 LYS 48 -8.131 10.405 8.126 691 H GLN 49 H GLN 49 -3.537 6.543 8.030 692 HA GLN 49 HA GLN 49 -3.913 5.342 5.331 693 HB2 GLN 49 HB2 GLN 49 -2.361 4.180 6.743 694 HB3 GLN 49 HB3 GLN 49 -3.463 4.230 8.115 695 HG2 GLN 49 HG2 GLN 49 -5.064 2.777 6.827 696 HG3 GLN 49 HG3 GLN 49 -3.875 2.671 5.521 697 HE21 GLN 49 HE21 GLN 49 -4.811 0.375 6.694 698 HE22 GLN 49 HE22 GLN 49 -3.569 -0.350 7.696 699 H LEU 50 H LEU 50 -5.861 4.984 4.545 700 HA LEU 50 HA LEU 50 -8.200 5.784 6.060 701 HB2 LEU 50 HB2 LEU 50 -8.096 4.401 3.357 702 HB3 LEU 50 HB3 LEU 50 -9.409 5.354 4.049 703 HG LEU 50 HG LEU 50 -8.569 6.843 2.562 704 HD11 LEU 50 HD11 LEU 50 -7.489 8.622 3.668 705 HD12 LEU 50 HD12 LEU 50 -8.357 7.773 4.960 706 HD13 LEU 50 HD13 LEU 50 -6.609 7.531 4.767 707 HD21 LEU 50 HD21 LEU 50 -6.689 5.420 1.815 708 HD22 LEU 50 HD22 LEU 50 -6.265 7.142 1.916 709 HD23 LEU 50 HD23 LEU 50 -5.706 6.014 3.174 710 H GLU 51 H GLU 51 -10.242 4.219 5.816 711 HA GLU 51 HA GLU 51 -9.409 1.423 6.421 712 HB2 GLU 51 HB2 GLU 51 -11.072 3.289 8.122 713 HB3 GLU 51 HB3 GLU 51 -11.297 1.531 8.205 714 HG2 GLU 51 HG2 GLU 51 -8.933 1.217 8.748 715 HG3 GLU 51 HG3 GLU 51 -8.644 2.955 8.606 716 H ASP 52 H ASP 52 -11.005 -0.143 6.152 717 HA ASP 52 HA ASP 52 -12.598 0.274 3.791 718 HB2 ASP 52 HB2 ASP 52 -12.407 -2.077 5.712 719 HB3 ASP 52 HB3 ASP 52 -13.138 -2.110 4.103 720 H GLY 53 H GLY 53 -13.226 1.210 6.884 721 HA2 GLY 53 HA2 GLY 53 -16.123 0.527 6.758 722 HA3 GLY 53 HA3 GLY 53 -15.212 0.856 8.245 723 H ARG 54 H ARG 54 -14.257 2.894 5.665 724 HA ARG 54 HA ARG 54 -15.897 5.155 6.706 725 HB2 ARG 54 HB2 ARG 54 -13.264 5.299 5.209 726 HB3 ARG 54 HB3 ARG 54 -14.035 6.554 6.171 727 HG2 ARG 54 HG2 ARG 54 -12.928 3.957 7.322 728 HG3 ARG 54 HG3 ARG 54 -12.054 5.490 7.274 729 HD2 ARG 54 HD2 ARG 54 -13.793 6.560 8.618 730 HD3 ARG 54 HD3 ARG 54 -14.708 5.038 8.694 731 HE ARG 54 HE ARG 54 -12.303 4.257 9.663 732 HH11 ARG 54 HH11 ARG 54 -14.312 7.059 10.457 733 HH12 ARG 54 HH12 ARG 54 -13.730 7.145 12.105 734 HH21 ARG 54 HH21 ARG 54 -11.551 4.408 11.757 735 HH22 ARG 54 HH22 ARG 54 -12.165 5.628 12.857 736 H THR 55 H THR 55 -15.071 6.870 4.566 737 HA THR 55 HA THR 55 -15.754 5.651 1.994 738 HB THR 55 HB THR 55 -17.327 7.694 1.612 739 HG1 THR 55 HG1 THR 55 -18.233 8.530 3.404 740 HG21 THR 55 HG21 THR 55 -18.055 5.257 1.811 741 HG22 THR 55 HG22 THR 55 -18.287 5.546 3.547 742 HG23 THR 55 HG23 THR 55 -19.269 6.441 2.363 743 H LEU 56 H LEU 56 -15.116 7.142 0.215 744 HA LEU 56 HA LEU 56 -12.710 8.572 0.829 745 HB2 LEU 56 HB2 LEU 56 -14.588 8.665 -1.571 746 HB3 LEU 56 HB3 LEU 56 -13.024 9.473 -1.511 747 HG LEU 56 HG LEU 56 -13.542 6.471 -1.359 748 HD11 LEU 56 HD11 LEU 56 -13.684 7.503 -3.614 749 HD12 LEU 56 HD12 LEU 56 -12.071 8.208 -3.386 750 HD13 LEU 56 HD13 LEU 56 -12.266 6.441 -3.465 751 HD21 LEU 56 HD21 LEU 56 -10.891 7.966 -1.259 752 HD22 LEU 56 HD22 LEU 56 -11.608 7.041 0.095 753 HD23 LEU 56 HD23 LEU 56 -11.084 6.206 -1.372 754 H SER 57 H SER 57 -16.101 9.388 0.843 755 HA SER 57 HA SER 57 -15.836 12.245 0.895 756 HB2 SER 57 HB2 SER 57 -18.224 12.084 1.490 757 HB3 SER 57 HB3 SER 57 -17.827 10.971 0.161 758 HG SER 57 HG SER 57 -19.102 9.999 1.791 759 H ASP 58 H ASP 58 -15.608 9.687 3.317 760 HA ASP 58 HA ASP 58 -16.061 11.359 5.622 761 HB2 ASP 58 HB2 ASP 58 -16.180 8.787 5.446 762 HB3 ASP 58 HB3 ASP 58 -14.418 8.808 5.518 763 H TYR 59 H TYR 59 -13.454 10.988 3.430 764 HA TYR 59 HA TYR 59 -11.618 12.394 5.298 765 HB2 TYR 59 HB2 TYR 59 -10.973 10.175 3.325 766 HB3 TYR 59 HB3 TYR 59 -9.758 11.180 4.118 767 HD1 TYR 59 HD1 TYR 59 -10.793 11.409 6.887 768 HD2 TYR 59 HD2 TYR 59 -10.660 8.039 4.218 769 HE1 TYR 59 HE1 TYR 59 -10.675 9.879 8.833 770 HE2 TYR 59 HE2 TYR 59 -10.466 6.507 6.170 771 HH TYR 59 HH TYR 59 -10.392 6.332 8.456 772 H ASN 60 H ASN 60 -13.590 13.284 3.267 773 HA ASN 60 HA ASN 60 -13.826 14.793 1.669 774 HB2 ASN 60 HB2 ASN 60 -12.769 16.819 2.145 775 HB3 ASN 60 HB3 ASN 60 -12.876 15.945 3.679 776 HD21 ASN 60 HD21 ASN 60 -11.067 15.487 4.846 777 HD22 ASN 60 HD22 ASN 60 -9.445 15.911 4.332 778 H ILE 61 H ILE 61 -11.906 12.501 0.831 779 HA ILE 61 HA ILE 61 -10.007 13.619 -0.976 780 HB ILE 61 HB ILE 61 -11.492 10.969 -0.937 781 HG12 ILE 61 HG12 ILE 61 -8.606 11.640 -0.275 782 HG13 ILE 61 HG13 ILE 61 -9.887 11.556 0.950 783 HG21 ILE 61 HG21 ILE 61 -9.124 11.824 -2.663 784 HG22 ILE 61 HG22 ILE 61 -9.767 10.172 -2.553 785 HG23 ILE 61 HG23 ILE 61 -10.763 11.453 -3.251 786 HD11 ILE 61 HD11 ILE 61 -10.304 9.213 0.421 787 HD12 ILE 61 HD12 ILE 61 -9.027 9.243 -0.826 788 HD13 ILE 61 HD13 ILE 61 -8.613 9.478 0.882 789 H GLN 62 H GLN 62 -10.116 14.389 -2.984 790 HA GLN 62 HA GLN 62 -12.684 14.311 -4.510 791 HB2 GLN 62 HB2 GLN 62 -10.725 16.627 -4.408 792 HB3 GLN 62 HB3 GLN 62 -12.347 16.618 -5.108 793 HG2 GLN 62 HG2 GLN 62 -11.685 16.339 -2.148 794 HG3 GLN 62 HG3 GLN 62 -12.151 17.831 -2.924 795 HE21 GLN 62 HE21 GLN 62 -13.496 16.334 -0.736 796 HE22 GLN 62 HE22 GLN 62 -15.127 16.027 -1.302 797 H LYS 63 H LYS 63 -12.021 15.322 -6.827 798 HA LYS 63 HA LYS 63 -10.288 13.458 -8.075 799 HB2 LYS 63 HB2 LYS 63 -10.643 14.813 -10.018 800 HB3 LYS 63 HB3 LYS 63 -12.161 14.725 -9.112 801 HG2 LYS 63 HG2 LYS 63 -11.522 16.960 -8.039 802 HG3 LYS 63 HG3 LYS 63 -10.233 17.078 -9.260 803 HD2 LYS 63 HD2 LYS 63 -13.197 16.687 -9.825 804 HD3 LYS 63 HD3 LYS 63 -12.359 18.248 -9.918 805 HE2 LYS 63 HE2 LYS 63 -11.588 15.810 -11.569 806 HE3 LYS 63 HE3 LYS 63 -12.709 17.057 -12.127 807 HZ1 LYS 63 HZ1 LYS 63 -10.502 17.501 -12.900 808 HZ2 LYS 63 HZ2 LYS 63 -10.954 18.679 -11.849 809 HZ3 LYS 63 HZ3 LYS 63 -9.890 17.516 -11.383 810 H GLU 64 H GLU 64 -8.273 13.503 -8.751 811 HA GLU 64 HA GLU 64 -6.072 13.968 -8.824 812 HB2 GLU 64 HB2 GLU 64 -7.009 16.856 -8.938 813 HB3 GLU 64 HB3 GLU 64 -5.482 16.188 -9.548 814 HG2 GLU 64 HG2 GLU 64 -6.761 14.770 -11.151 815 HG3 GLU 64 HG3 GLU 64 -8.270 15.480 -10.566 816 H SER 65 H SER 65 -7.366 13.932 -6.068 817 HA SER 65 HA SER 65 -6.135 16.024 -4.545 818 HB2 SER 65 HB2 SER 65 -7.518 13.430 -3.795 819 HB3 SER 65 HB3 SER 65 -6.879 14.582 -2.604 820 HG SER 65 HG SER 65 -8.741 15.188 -4.649 821 H THR 66 H THR 66 -4.911 13.123 -5.805 822 HA THR 66 HA THR 66 -3.024 11.917 -5.606 823 HB THR 66 HB THR 66 -2.075 14.378 -4.145 824 HG1 THR 66 HG1 THR 66 -2.644 14.679 -6.292 825 HG21 THR 66 HG21 THR 66 -0.500 12.008 -5.265 826 HG22 THR 66 HG22 THR 66 0.222 13.535 -4.719 827 HG23 THR 66 HG23 THR 66 -0.608 12.481 -3.554 828 H LEU 67 H LEU 67 -2.590 10.184 -4.480 829 HA LEU 67 HA LEU 67 -2.914 10.132 -1.510 830 HB2 LEU 67 HB2 LEU 67 -4.199 8.464 -3.667 831 HB3 LEU 67 HB3 LEU 67 -3.681 7.663 -2.184 832 HG LEU 67 HG LEU 67 -5.013 9.386 -0.886 833 HD11 LEU 67 HD11 LEU 67 -6.241 9.830 -3.650 834 HD12 LEU 67 HD12 LEU 67 -6.953 10.363 -2.103 835 HD13 LEU 67 HD13 LEU 67 -5.423 11.061 -2.654 836 HD21 LEU 67 HD21 LEU 67 -6.450 7.472 -2.764 837 HD22 LEU 67 HD22 LEU 67 -5.708 7.058 -1.199 838 HD23 LEU 67 HD23 LEU 67 -7.111 8.139 -1.248 839 H HIS 68 H HIS 68 -2.028 7.818 -0.810 840 HA HIS 68 HA HIS 68 0.471 7.250 -2.313 841 HB2 HIS 68 HB2 HIS 68 0.277 7.636 0.694 842 HB3 HIS 68 HB3 HIS 68 1.740 7.276 -0.238 843 HD2 HIS 68 HD2 HIS 68 2.445 9.314 -2.098 844 HE1 HIS 68 HE1 HIS 68 0.625 12.409 0.173 845 HE2 HIS 68 HE2 HIS 68 2.237 11.899 -1.720 846 H LEU 69 H LEU 69 1.349 5.114 -1.849 847 HA LEU 69 HA LEU 69 -0.531 3.199 -0.589 848 HB2 LEU 69 HB2 LEU 69 -1.238 3.445 -2.925 849 HB3 LEU 69 HB3 LEU 69 0.425 3.206 -3.479 850 HG LEU 69 HG LEU 69 0.336 0.864 -2.534 851 HD11 LEU 69 HD11 LEU 69 -1.506 1.210 -0.905 852 HD12 LEU 69 HD12 LEU 69 -2.627 1.540 -2.243 853 HD13 LEU 69 HD13 LEU 69 -1.904 -0.077 -2.068 854 HD21 LEU 69 HD21 LEU 69 -0.028 1.313 -4.907 855 HD22 LEU 69 HD22 LEU 69 -1.104 0.008 -4.359 856 HD23 LEU 69 HD23 LEU 69 -1.744 1.654 -4.608 857 H VAL 70 H VAL 70 0.399 1.256 -0.037 858 HA VAL 70 HA VAL 70 3.271 0.760 -0.592 859 HB VAL 70 HB VAL 70 1.902 0.846 2.121 860 HG11 VAL 70 HG11 VAL 70 3.119 -1.261 2.044 861 HG12 VAL 70 HG12 VAL 70 4.541 -0.452 1.338 862 HG13 VAL 70 HG13 VAL 70 4.032 -0.089 3.009 863 HG21 VAL 70 HG21 VAL 70 4.450 2.080 0.983 864 HG22 VAL 70 HG22 VAL 70 2.935 2.939 1.319 865 HG23 VAL 70 HG23 VAL 70 3.877 2.247 2.657 866 H LEU 71 H LEU 71 3.714 -1.647 -0.258 867 HA LEU 71 HA LEU 71 1.242 -3.261 -0.420 868 HB2 LEU 71 HB2 LEU 71 1.797 -4.288 -2.456 869 HB3 LEU 71 HB3 LEU 71 1.927 -2.558 -2.743 870 HG LEU 71 HG LEU 71 4.265 -4.456 -2.220 871 HD11 LEU 71 HD11 LEU 71 3.282 -3.139 -4.783 872 HD12 LEU 71 HD12 LEU 71 4.725 -4.166 -4.616 873 HD13 LEU 71 HD13 LEU 71 3.111 -4.860 -4.366 874 HD21 LEU 71 HD21 LEU 71 4.894 -2.193 -1.542 875 HD22 LEU 71 HD22 LEU 71 5.645 -2.557 -3.104 876 HD23 LEU 71 HD23 LEU 71 4.204 -1.518 -3.043 877 H ARG 72 H ARG 72 1.751 -5.633 -0.555 878 HA ARG 72 HA ARG 72 4.236 -6.395 0.883 879 HB2 ARG 72 HB2 ARG 72 1.376 -7.180 1.631 880 HB3 ARG 72 HB3 ARG 72 2.837 -7.979 2.225 881 HG2 ARG 72 HG2 ARG 72 2.519 -6.538 3.932 882 HG3 ARG 72 HG3 ARG 72 3.573 -5.557 2.895 883 HD2 ARG 72 HD2 ARG 72 1.457 -4.496 1.932 884 HD3 ARG 72 HD3 ARG 72 0.533 -5.383 3.150 885 HE ARG 72 HE ARG 72 2.088 -2.973 3.513 886 HH11 ARG 72 HH11 ARG 72 1.005 -5.893 5.209 887 HH12 ARG 72 HH12 ARG 72 1.162 -5.148 6.788 888 HH21 ARG 72 HH21 ARG 72 2.244 -2.050 5.587 889 HH22 ARG 72 HH22 ARG 72 1.850 -3.020 6.993 890 H LEU 73 H LEU 73 4.202 -8.918 0.992 891 HA LEU 73 HA LEU 73 3.445 -9.935 -1.666 892 HB2 LEU 73 HB2 LEU 73 5.551 -10.954 -1.925 893 HB3 LEU 73 HB3 LEU 73 5.853 -9.278 -1.437 894 HG LEU 73 HG LEU 73 6.158 -11.816 0.218 895 HD11 LEU 73 HD11 LEU 73 8.033 -9.545 -0.547 896 HD12 LEU 73 HD12 LEU 73 8.472 -10.981 0.410 897 HD13 LEU 73 HD13 LEU 73 7.994 -11.157 -1.296 898 HD21 LEU 73 HD21 LEU 73 6.830 -10.298 2.082 899 HD22 LEU 73 HD22 LEU 73 6.235 -8.914 1.121 900 HD23 LEU 73 HD23 LEU 73 5.101 -10.179 1.667 901 H ARG 74 H ARG 74 2.203 -10.126 0.962 902 HA ARG 74 HA ARG 74 1.093 -11.544 2.336 903 HB2 ARG 74 HB2 ARG 74 0.348 -12.499 0.202 904 HB3 ARG 74 HB3 ARG 74 1.728 -13.601 0.185 905 HG2 ARG 74 HG2 ARG 74 -0.242 -14.796 0.931 906 HG3 ARG 74 HG3 ARG 74 0.928 -14.689 2.250 907 HD2 ARG 74 HD2 ARG 74 -0.364 -12.746 3.176 908 HD3 ARG 74 HD3 ARG 74 -1.568 -12.988 1.890 909 HE ARG 74 HE ARG 74 -0.983 -15.376 3.472 910 HH11 ARG 74 HH11 ARG 74 -3.054 -12.502 3.220 911 HH12 ARG 74 HH12 ARG 74 -4.284 -13.171 4.255 912 HH21 ARG 74 HH21 ARG 74 -2.632 -16.217 4.789 913 HH22 ARG 74 HH22 ARG 74 -4.059 -15.267 5.120 914 H GLY 75 H GLY 75 4.243 -12.671 1.299 915 HA2 GLY 75 HA2 GLY 75 5.546 -13.123 3.570 916 HA3 GLY 75 HA3 GLY 75 4.452 -14.538 3.552 917 H GLY 76 H GLY 76 4.644 -14.180 0.437 918 HA2 GLY 76 HA2 GLY 76 7.252 -14.731 -0.459 919 HA3 GLY 76 HA3 GLY 76 6.513 -16.286 -0.037 Start of MODEL 2 1 H LEU 491 H LEU 491 15.314 6.715 10.830 2 HA LEU 491 HA LEU 491 17.919 6.078 10.660 3 HB2 LEU 491 HB2 LEU 491 16.552 3.765 9.776 4 HB3 LEU 491 HB3 LEU 491 17.107 4.193 11.382 5 HG LEU 491 HG LEU 491 14.890 5.369 11.779 6 HD11 LEU 491 HD11 LEU 491 14.238 5.661 9.370 7 HD12 LEU 491 HD12 LEU 491 14.164 3.895 9.203 8 HD13 LEU 491 HD13 LEU 491 13.026 4.736 10.282 9 HD21 LEU 491 HD21 LEU 491 13.719 3.258 12.149 10 HD22 LEU 491 HD22 LEU 491 14.880 2.419 11.089 11 HD23 LEU 491 HD23 LEU 491 15.436 3.165 12.610 12 HA PRO 492 HA PRO 492 19.022 5.846 6.319 13 HB2 PRO 492 HB2 PRO 492 21.460 4.755 6.635 14 HB3 PRO 492 HB3 PRO 492 21.096 6.395 7.256 15 HG2 PRO 492 HG2 PRO 492 21.181 3.795 8.788 16 HG3 PRO 492 HG3 PRO 492 21.883 5.378 9.248 17 HD2 PRO 492 HD2 PRO 492 19.413 4.415 10.109 18 HD3 PRO 492 HD3 PRO 492 19.780 6.155 10.011 19 H LEU 493 H LEU 493 20.325 3.915 5.117 20 HA LEU 493 HA LEU 493 18.460 1.789 4.860 21 HB2 LEU 493 HB2 LEU 493 20.413 3.122 3.396 22 HB3 LEU 493 HB3 LEU 493 21.222 1.599 3.686 23 HG LEU 493 HG LEU 493 18.416 1.932 2.529 24 HD11 LEU 493 HD11 LEU 493 19.459 1.428 0.336 25 HD12 LEU 493 HD12 LEU 493 20.099 2.924 1.045 26 HD13 LEU 493 HD13 LEU 493 21.064 1.428 1.111 27 HD21 LEU 493 HD21 LEU 493 18.742 -0.420 1.744 28 HD22 LEU 493 HD22 LEU 493 20.290 -0.477 2.615 29 HD23 LEU 493 HD23 LEU 493 18.764 -0.299 3.517 30 H GLN 494 H GLN 494 19.467 1.872 7.497 31 HA GLN 494 HA GLN 494 21.461 -0.171 7.806 32 HB2 GLN 494 HB2 GLN 494 21.167 0.262 10.153 33 HB3 GLN 494 HB3 GLN 494 21.195 1.779 9.236 34 HG2 GLN 494 HG2 GLN 494 19.479 2.245 10.646 35 HG3 GLN 494 HG3 GLN 494 18.594 1.590 9.264 36 HE21 GLN 494 HE21 GLN 494 16.997 1.482 11.170 37 HE22 GLN 494 HE22 GLN 494 16.966 -0.026 12.074 38 H ALA 495 H ALA 495 17.928 -0.086 7.801 39 HA ALA 495 HA ALA 495 17.977 -3.050 7.956 40 HB1 ALA 495 HB1 ALA 495 17.513 -2.322 10.242 41 HB2 ALA 495 HB2 ALA 495 16.185 -1.282 9.670 42 HB3 ALA 495 HB3 ALA 495 16.060 -3.049 9.531 43 H LEU 496 H LEU 496 17.114 -0.416 6.184 44 HA LEU 496 HA LEU 496 14.481 -1.209 5.286 45 HB2 LEU 496 HB2 LEU 496 16.693 0.566 4.164 46 HB3 LEU 496 HB3 LEU 496 15.076 0.444 3.463 47 HG LEU 496 HG LEU 496 15.648 1.348 6.322 48 HD11 LEU 496 HD11 LEU 496 15.098 3.596 5.485 49 HD12 LEU 496 HD12 LEU 496 16.517 2.920 4.645 50 HD13 LEU 496 HD13 LEU 496 14.931 2.947 3.832 51 HD21 LEU 496 HD21 LEU 496 13.308 2.130 6.256 52 HD22 LEU 496 HD22 LEU 496 13.117 1.449 4.623 53 HD23 LEU 496 HD23 LEU 496 13.386 0.373 6.018 54 HA PRO 497 HA PRO 497 15.368 -4.340 2.279 55 HB2 PRO 497 HB2 PRO 497 14.109 -2.481 0.270 56 HB3 PRO 497 HB3 PRO 497 13.794 -4.227 0.518 57 HG2 PRO 497 HG2 PRO 497 12.050 -2.398 1.493 58 HG3 PRO 497 HG3 PRO 497 12.546 -3.783 2.520 59 HD2 PRO 497 HD2 PRO 497 13.568 -0.939 2.584 60 HD3 PRO 497 HD3 PRO 497 13.137 -2.021 3.948 61 H GLU 498 H GLU 498 16.862 -4.835 0.584 62 HA GLU 498 HA GLU 498 19.013 -2.912 0.434 63 HB2 GLU 498 HB2 GLU 498 19.255 -5.400 0.770 64 HB3 GLU 498 HB3 GLU 498 18.794 -5.620 -0.935 65 HG2 GLU 498 HG2 GLU 498 20.734 -4.273 -1.651 66 HG3 GLU 498 HG3 GLU 498 21.109 -3.890 0.033 67 H GLY 499 H GLY 499 17.516 -1.393 -0.624 68 HA2 GLY 499 HA2 GLY 499 18.500 -0.661 -3.107 69 HA3 GLY 499 HA3 GLY 499 17.068 -1.653 -3.461 70 H VAL 500 H VAL 500 15.692 -0.786 -0.955 71 HA VAL 500 HA VAL 500 14.358 1.567 -1.925 72 HB VAL 500 HB VAL 500 14.345 0.047 0.705 73 HG11 VAL 500 HG11 VAL 500 13.634 2.335 1.260 74 HG12 VAL 500 HG12 VAL 500 12.541 2.362 -0.146 75 HG13 VAL 500 HG13 VAL 500 12.222 1.272 1.217 76 HG21 VAL 500 HG21 VAL 500 12.338 0.309 -1.580 77 HG22 VAL 500 HG22 VAL 500 13.409 -1.082 -1.314 78 HG23 VAL 500 HG23 VAL 500 12.143 -0.697 -0.130 79 H ASP 501 H ASP 501 14.175 3.615 -0.701 80 HA ASP 501 HA ASP 501 16.693 4.374 0.744 81 HB2 ASP 501 HB2 ASP 501 16.465 5.090 -1.781 82 HB3 ASP 501 HB3 ASP 501 15.295 6.253 -1.158 83 H GLN 502 H GLN 502 16.493 5.783 2.341 84 HA GLN 502 HA GLN 502 14.039 5.918 3.755 85 HB2 GLN 502 HB2 GLN 502 15.371 7.768 5.005 86 HB3 GLN 502 HB3 GLN 502 15.923 6.095 5.103 87 HG2 GLN 502 HG2 GLN 502 17.024 7.945 2.961 88 HG3 GLN 502 HG3 GLN 502 17.627 8.004 4.622 89 HE21 GLN 502 HE21 GLN 502 16.729 4.799 4.048 90 HE22 GLN 502 HE22 GLN 502 18.306 4.194 3.572 91 H GLU 503 H GLU 503 15.484 8.057 1.295 92 HA GLU 503 HA GLU 503 13.773 10.267 1.951 93 HB2 GLU 503 HB2 GLU 503 14.668 11.329 0.033 94 HB3 GLU 503 HB3 GLU 503 15.993 10.353 0.701 95 HG2 GLU 503 HG2 GLU 503 15.349 8.539 -0.966 96 HG3 GLU 503 HG3 GLU 503 14.222 9.684 -1.692 97 H VAL 504 H VAL 504 12.943 7.277 0.748 98 HA VAL 504 HA VAL 504 10.432 8.415 -0.322 99 HB VAL 504 HB VAL 504 11.993 7.871 -2.151 100 HG11 VAL 504 HG11 VAL 504 11.507 4.984 -1.304 101 HG12 VAL 504 HG12 VAL 504 12.303 5.511 -2.802 102 HG13 VAL 504 HG13 VAL 504 13.061 5.855 -1.237 103 HG21 VAL 504 HG21 VAL 504 9.448 6.198 -2.149 104 HG22 VAL 504 HG22 VAL 504 9.536 7.949 -2.461 105 HG23 VAL 504 HG23 VAL 504 10.330 6.803 -3.563 106 H PHE 505 H PHE 505 11.615 6.959 2.176 107 HA PHE 505 HA PHE 505 9.350 5.030 2.430 108 HB2 PHE 505 HB2 PHE 505 11.053 3.549 2.650 109 HB3 PHE 505 HB3 PHE 505 12.241 4.804 2.991 110 HD1 PHE 505 HD1 PHE 505 12.634 5.649 5.223 111 HD2 PHE 505 HD2 PHE 505 9.844 2.465 4.505 112 HE1 PHE 505 HE1 PHE 505 12.672 5.076 7.637 113 HE2 PHE 505 HE2 PHE 505 9.878 1.891 6.922 114 HZ PHE 505 HZ PHE 505 11.289 3.193 8.486 115 H LYS 506 H LYS 506 11.065 7.831 3.641 116 HA LYS 506 HA LYS 506 9.750 7.918 6.219 117 HB2 LYS 506 HB2 LYS 506 11.221 9.971 4.532 118 HB3 LYS 506 HB3 LYS 506 10.549 10.327 6.139 119 HG2 LYS 506 HG2 LYS 506 11.857 8.473 7.119 120 HG3 LYS 506 HG3 LYS 506 12.588 8.131 5.550 121 HD2 LYS 506 HD2 LYS 506 12.828 10.749 7.090 122 HD3 LYS 506 HD3 LYS 506 14.080 9.495 6.957 123 HE2 LYS 506 HE2 LYS 506 14.189 9.844 4.524 124 HE3 LYS 506 HE3 LYS 506 12.935 11.091 4.635 125 HZ1 LYS 506 HZ1 LYS 506 14.391 12.363 6.037 126 HZ2 LYS 506 HZ2 LYS 506 15.553 11.205 5.982 127 HZ3 LYS 506 HZ3 LYS 506 15.149 12.036 4.618 128 H GLN 507 H GLN 507 8.355 7.933 3.289 129 HA GLN 507 HA GLN 507 6.559 10.224 3.598 130 HB2 GLN 507 HB2 GLN 507 6.081 7.934 1.703 131 HB3 GLN 507 HB3 GLN 507 5.763 9.660 1.479 132 HG2 GLN 507 HG2 GLN 507 8.421 8.191 1.379 133 HG3 GLN 507 HG3 GLN 507 7.600 8.996 0.047 134 HE21 GLN 507 HE21 GLN 507 10.349 9.354 1.234 135 HE22 GLN 507 HE22 GLN 507 10.455 11.041 1.645 136 H LEU 508 H LEU 508 6.783 7.562 5.369 137 HA LEU 508 HA LEU 508 3.893 6.778 5.280 138 HB2 LEU 508 HB2 LEU 508 6.255 5.087 6.147 139 HB3 LEU 508 HB3 LEU 508 4.613 4.546 5.768 140 HG LEU 508 HG LEU 508 6.580 5.705 3.743 141 HD11 LEU 508 HD11 LEU 508 6.960 3.461 3.010 142 HD12 LEU 508 HD12 LEU 508 7.252 3.491 4.757 143 HD13 LEU 508 HD13 LEU 508 5.733 2.814 4.124 144 HD21 LEU 508 HD21 LEU 508 3.883 4.324 3.422 145 HD22 LEU 508 HD22 LEU 508 4.234 6.032 3.080 146 HD23 LEU 508 HD23 LEU 508 4.983 4.764 2.089 147 HA PRO 509 HA PRO 509 3.726 7.848 9.594 148 HB2 PRO 509 HB2 PRO 509 1.951 5.920 10.513 149 HB3 PRO 509 HB3 PRO 509 1.492 7.423 9.671 150 HG2 PRO 509 HG2 PRO 509 1.804 4.629 8.567 151 HG3 PRO 509 HG3 PRO 509 0.527 5.829 8.184 152 HD2 PRO 509 HD2 PRO 509 2.666 5.372 6.540 153 HD3 PRO 509 HD3 PRO 509 1.953 7.003 6.727 154 H ALA 510 H ALA 510 4.133 6.949 11.742 155 HA ALA 510 HA ALA 510 6.480 5.396 11.819 156 HB1 ALA 510 HB1 ALA 510 4.412 6.019 13.966 157 HB2 ALA 510 HB2 ALA 510 6.086 5.474 14.273 158 HB3 ALA 510 HB3 ALA 510 5.781 7.054 13.510 159 H ASP 511 H ASP 511 3.100 4.393 11.795 160 HA ASP 511 HA ASP 511 3.718 1.719 12.827 161 HB2 ASP 511 HB2 ASP 511 1.557 2.965 13.264 162 HB3 ASP 511 HB3 ASP 511 1.169 2.796 11.545 163 H ILE 512 H ILE 512 4.158 3.274 9.863 164 HA ILE 512 HA ILE 512 4.229 0.596 8.548 165 HB ILE 512 HB ILE 512 3.927 3.332 7.273 166 HG12 ILE 512 HG12 ILE 512 2.056 0.965 7.669 167 HG13 ILE 512 HG13 ILE 512 1.893 2.589 8.368 168 HG21 ILE 512 HG21 ILE 512 3.684 2.083 5.154 169 HG22 ILE 512 HG22 ILE 512 5.260 1.748 5.867 170 HG23 ILE 512 HG23 ILE 512 3.948 0.550 6.014 171 HD11 ILE 512 HD11 ILE 512 1.635 3.512 6.049 172 HD12 ILE 512 HD12 ILE 512 1.621 1.841 5.428 173 HD13 ILE 512 HD13 ILE 512 0.350 2.380 6.536 174 H GLN 513 H GLN 513 6.106 3.270 9.777 175 HA GLN 513 HA GLN 513 8.503 2.892 8.314 176 HB2 GLN 513 HB2 GLN 513 8.106 3.339 11.307 177 HB3 GLN 513 HB3 GLN 513 9.661 3.462 10.481 178 HG2 GLN 513 HG2 GLN 513 7.241 5.197 9.857 179 HG3 GLN 513 HG3 GLN 513 8.596 5.666 10.897 180 HE21 GLN 513 HE21 GLN 513 7.510 5.094 7.608 181 HE22 GLN 513 HE22 GLN 513 8.933 5.718 6.803 182 H GLU 514 H GLU 514 6.977 0.993 10.911 183 HA GLU 514 HA GLU 514 9.189 -0.851 11.173 184 HB2 GLU 514 HB2 GLU 514 7.700 -2.015 12.713 185 HB3 GLU 514 HB3 GLU 514 7.648 -0.270 13.024 186 HG2 GLU 514 HG2 GLU 514 5.548 -0.090 11.750 187 HG3 GLU 514 HG3 GLU 514 5.585 -1.831 11.420 188 H GLU 515 H GLU 515 6.752 -0.549 8.760 189 HA GLU 515 HA GLU 515 6.418 -3.461 8.414 190 HB2 GLU 515 HB2 GLU 515 5.359 -1.044 6.900 191 HB3 GLU 515 HB3 GLU 515 4.979 -2.724 6.494 192 HG2 GLU 515 HG2 GLU 515 4.416 -1.512 9.229 193 HG3 GLU 515 HG3 GLU 515 3.255 -1.491 7.897 194 H ILE 516 H ILE 516 8.488 -0.916 7.260 195 HA ILE 516 HA ILE 516 9.297 -2.575 4.906 196 HB ILE 516 HB ILE 516 9.518 0.381 5.554 197 HG12 ILE 516 HG12 ILE 516 8.344 0.788 3.555 198 HG13 ILE 516 HG13 ILE 516 8.497 -0.891 2.994 199 HG21 ILE 516 HG21 ILE 516 10.790 0.624 3.426 200 HG22 ILE 516 HG22 ILE 516 11.687 -0.327 4.623 201 HG23 ILE 516 HG23 ILE 516 10.851 -1.147 3.282 202 HD11 ILE 516 HD11 ILE 516 6.894 -1.631 4.647 203 HD12 ILE 516 HD12 ILE 516 6.871 -0.005 5.403 204 HD13 ILE 516 HD13 ILE 516 6.215 -0.252 3.767 205 H LEU 517 H LEU 517 10.399 -0.891 7.870 206 HA LEU 517 HA LEU 517 13.134 -1.728 7.708 207 HB2 LEU 517 HB2 LEU 517 11.284 -1.094 10.036 208 HB3 LEU 517 HB3 LEU 517 12.997 -1.474 10.249 209 HG LEU 517 HG LEU 517 12.024 0.788 8.463 210 HD11 LEU 517 HD11 LEU 517 13.005 0.873 11.350 211 HD12 LEU 517 HD12 LEU 517 12.595 2.277 10.334 212 HD13 LEU 517 HD13 LEU 517 11.326 1.136 10.830 213 HD21 LEU 517 HD21 LEU 517 14.734 0.243 9.762 214 HD22 LEU 517 HD22 LEU 517 14.353 -0.068 8.050 215 HD23 LEU 517 HD23 LEU 517 14.334 1.587 8.681 216 H SER 518 H SER 518 10.252 -3.559 8.003 217 HA SER 518 HA SER 518 11.188 -5.744 9.588 218 HB2 SER 518 HB2 SER 518 9.175 -5.545 7.321 219 HB3 SER 518 HB3 SER 518 9.509 -7.058 8.190 220 HG SER 518 HG SER 518 8.670 -4.624 9.391 221 H GLY 519 H GLY 519 11.853 -4.784 6.221 222 HA2 GLY 519 HA2 GLY 519 13.977 -5.414 5.305 223 HA3 GLY 519 HA3 GLY 519 13.907 -6.952 6.184 224 H LYS 520 H LYS 520 11.243 -5.440 4.286 225 HA LYS 520 HA LYS 520 10.539 -7.838 3.007 226 HB2 LYS 520 HB2 LYS 520 9.922 -4.937 2.327 227 HB3 LYS 520 HB3 LYS 520 9.072 -6.359 1.690 228 HG2 LYS 520 HG2 LYS 520 8.579 -7.019 4.102 229 HG3 LYS 520 HG3 LYS 520 9.130 -5.397 4.568 230 HD2 LYS 520 HD2 LYS 520 6.859 -6.080 2.646 231 HD3 LYS 520 HD3 LYS 520 6.686 -5.428 4.285 232 HE2 LYS 520 HE2 LYS 520 7.890 -3.374 3.580 233 HE3 LYS 520 HE3 LYS 520 8.049 -4.033 1.943 234 HZ1 LYS 520 HZ1 LYS 520 5.515 -3.419 3.306 235 HZ2 LYS 520 HZ2 LYS 520 6.192 -2.558 2.075 236 HZ3 LYS 520 HZ3 LYS 520 5.642 -4.084 1.810 237 H SER 521 H SER 521 10.070 -7.563 0.609 238 HA SER 521 HA SER 521 12.497 -7.025 -1.010 239 HB2 SER 521 HB2 SER 521 11.098 -9.724 -0.745 240 HB3 SER 521 HB3 SER 521 12.317 -9.325 -1.966 241 HG SER 521 HG SER 521 12.674 -9.302 0.849 242 H ARG 522 H ARG 522 11.704 -8.106 -3.351 243 HA ARG 522 HA ARG 522 10.476 -7.725 -5.193 244 HB2 ARG 522 HB2 ARG 522 8.711 -8.771 -3.470 245 HB3 ARG 522 HB3 ARG 522 7.986 -7.164 -3.616 246 HG2 ARG 522 HG2 ARG 522 6.918 -8.208 -5.360 247 HG3 ARG 522 HG3 ARG 522 8.362 -7.647 -6.229 248 HD2 ARG 522 HD2 ARG 522 7.952 -10.402 -4.986 249 HD3 ARG 522 HD3 ARG 522 7.792 -10.020 -6.709 250 HE ARG 522 HE ARG 522 10.387 -9.515 -5.337 251 HH11 ARG 522 HH11 ARG 522 8.513 -11.410 -7.660 252 HH12 ARG 522 HH12 ARG 522 9.930 -12.111 -8.402 253 HH21 ARG 522 HH21 ARG 522 12.214 -10.451 -6.315 254 HH22 ARG 522 HH22 ARG 522 12.019 -11.572 -7.639 255 H GLU 523 H GLU 523 11.495 -5.416 -3.309 256 HA GLU 523 HA GLU 523 10.527 -3.279 -5.081 257 HB2 GLU 523 HB2 GLU 523 9.921 -1.819 -3.184 258 HB3 GLU 523 HB3 GLU 523 8.888 -3.256 -3.282 259 HG2 GLU 523 HG2 GLU 523 10.347 -4.338 -1.512 260 HG3 GLU 523 HG3 GLU 523 11.210 -2.806 -1.361 261 H ASN 524 H ASN 524 11.960 -1.549 -5.245 262 HA ASN 524 HA ASN 524 14.386 -1.460 -3.614 263 HB2 ASN 524 HB2 ASN 524 14.423 -2.029 -6.628 264 HB3 ASN 524 HB3 ASN 524 15.845 -1.634 -5.659 265 HD21 ASN 524 HD21 ASN 524 13.563 -4.122 -6.580 266 HD22 ASN 524 HD22 ASN 524 14.379 -5.445 -5.767 267 H LEU 525 H LEU 525 11.985 0.120 -4.399 268 HA LEU 525 HA LEU 525 11.324 2.121 -5.021 269 HB2 LEU 525 HB2 LEU 525 12.414 3.682 -3.913 270 HB3 LEU 525 HB3 LEU 525 13.669 2.494 -3.624 271 HG LEU 525 HG LEU 525 14.560 3.323 -5.997 272 HD11 LEU 525 HD11 LEU 525 13.246 5.826 -4.826 273 HD12 LEU 525 HD12 LEU 525 14.229 5.728 -6.301 274 HD13 LEU 525 HD13 LEU 525 12.609 4.987 -6.244 275 HD21 LEU 525 HD21 LEU 525 15.788 3.401 -3.867 276 HD22 LEU 525 HD22 LEU 525 16.004 4.911 -4.778 277 HD23 LEU 525 HD23 LEU 525 14.887 4.864 -3.393 278 H LYS 526 H LYS 526 13.571 0.471 -6.954 279 HA LYS 526 HA LYS 526 13.328 2.248 -9.274 280 HB2 LYS 526 HB2 LYS 526 14.834 -0.157 -8.395 281 HB3 LYS 526 HB3 LYS 526 14.465 -0.098 -10.134 282 HG2 LYS 526 HG2 LYS 526 16.571 0.943 -9.964 283 HG3 LYS 526 HG3 LYS 526 15.403 2.251 -10.178 284 HD2 LYS 526 HD2 LYS 526 16.973 2.936 -8.486 285 HD3 LYS 526 HD3 LYS 526 15.443 2.580 -7.670 286 HE2 LYS 526 HE2 LYS 526 17.247 1.625 -6.377 287 HE3 LYS 526 HE3 LYS 526 16.353 0.288 -7.112 288 HZ1 LYS 526 HZ1 LYS 526 18.731 0.011 -7.314 289 HZ2 LYS 526 HZ2 LYS 526 18.065 0.170 -8.805 290 HZ3 LYS 526 HZ3 LYS 526 18.874 1.428 -8.128 291 H1 MET 1 H1 MET 1 -13.780 11.524 -13.670 292 H2 MET 1 H2 MET 1 -12.458 12.393 -14.106 293 H3 MET 1 H3 MET 1 -13.838 13.167 -13.633 294 HA MET 1 HA MET 1 -12.199 13.223 -11.888 295 HB2 MET 1 HB2 MET 1 -14.531 13.217 -11.184 296 HB3 MET 1 HB3 MET 1 -14.618 11.446 -11.348 297 HG2 MET 1 HG2 MET 1 -12.987 11.138 -9.581 298 HG3 MET 1 HG3 MET 1 -12.740 12.888 -9.452 299 HE1 MET 1 HE1 MET 1 -13.231 11.193 -6.906 300 HE2 MET 1 HE2 MET 1 -13.124 12.969 -6.854 301 HE3 MET 1 HE3 MET 1 -14.472 12.134 -6.044 302 H GLN 2 H GLN 2 -10.460 12.362 -11.050 303 HA GLN 2 HA GLN 2 -10.257 9.508 -10.554 304 HB2 GLN 2 HB2 GLN 2 -8.369 9.108 -12.019 305 HB3 GLN 2 HB3 GLN 2 -9.646 9.852 -13.006 306 HG2 GLN 2 HG2 GLN 2 -8.434 12.095 -12.280 307 HG3 GLN 2 HG3 GLN 2 -7.079 11.052 -11.924 308 HE21 GLN 2 HE21 GLN 2 -5.757 11.938 -13.585 309 HE22 GLN 2 HE22 GLN 2 -6.081 11.667 -15.285 310 H ILE 3 H ILE 3 -7.972 9.076 -9.659 311 HA ILE 3 HA ILE 3 -6.820 11.449 -8.293 312 HB ILE 3 HB ILE 3 -6.799 10.439 -6.168 313 HG12 ILE 3 HG12 ILE 3 -7.451 7.870 -7.596 314 HG13 ILE 3 HG13 ILE 3 -6.238 8.240 -6.391 315 HG21 ILE 3 HG21 ILE 3 -9.560 9.930 -7.320 316 HG22 ILE 3 HG22 ILE 3 -9.144 10.286 -5.623 317 HG23 ILE 3 HG23 ILE 3 -8.892 11.519 -6.862 318 HD11 ILE 3 HD11 ILE 3 -7.935 6.823 -5.402 319 HD12 ILE 3 HD12 ILE 3 -8.050 8.434 -4.657 320 HD13 ILE 3 HD13 ILE 3 -9.227 7.935 -5.894 321 H PHE 4 H PHE 4 -4.759 10.468 -6.972 322 HA PHE 4 HA PHE 4 -3.329 8.668 -8.869 323 HB2 PHE 4 HB2 PHE 4 -2.209 11.200 -7.623 324 HB3 PHE 4 HB3 PHE 4 -1.384 10.115 -8.697 325 HD1 PHE 4 HD1 PHE 4 -2.509 9.759 -11.088 326 HD2 PHE 4 HD2 PHE 4 -3.371 13.072 -8.480 327 HE1 PHE 4 HE1 PHE 4 -3.284 11.083 -13.026 328 HE2 PHE 4 HE2 PHE 4 -4.115 14.408 -10.436 329 HZ PHE 4 HZ PHE 4 -4.081 13.414 -12.703 330 H VAL 5 H VAL 5 -2.968 6.906 -7.685 331 HA VAL 5 HA VAL 5 -2.385 7.238 -4.785 332 HB VAL 5 HB VAL 5 -3.265 4.780 -6.353 333 HG11 VAL 5 HG11 VAL 5 -3.697 3.887 -4.067 334 HG12 VAL 5 HG12 VAL 5 -1.983 4.267 -4.318 335 HG13 VAL 5 HG13 VAL 5 -3.006 5.373 -3.371 336 HG21 VAL 5 HG21 VAL 5 -4.827 6.707 -4.568 337 HG22 VAL 5 HG22 VAL 5 -5.065 6.487 -6.313 338 HG23 VAL 5 HG23 VAL 5 -5.450 5.171 -5.192 339 H LYS 6 H LYS 6 -0.275 7.326 -4.336 340 HA LYS 6 HA LYS 6 1.629 6.191 -6.273 341 HB2 LYS 6 HB2 LYS 6 1.849 8.526 -5.679 342 HB3 LYS 6 HB3 LYS 6 1.948 8.122 -3.955 343 HG2 LYS 6 HG2 LYS 6 4.060 7.062 -4.207 344 HG3 LYS 6 HG3 LYS 6 3.928 6.996 -5.976 345 HD2 LYS 6 HD2 LYS 6 3.914 9.633 -4.495 346 HD3 LYS 6 HD3 LYS 6 5.439 8.822 -4.943 347 HE2 LYS 6 HE2 LYS 6 4.760 8.796 -7.296 348 HE3 LYS 6 HE3 LYS 6 3.217 9.574 -6.881 349 HZ1 LYS 6 HZ1 LYS 6 4.466 11.472 -6.102 350 HZ2 LYS 6 HZ2 LYS 6 5.891 10.746 -6.485 351 HZ3 LYS 6 HZ3 LYS 6 4.834 11.159 -7.672 352 H THR 7 H THR 7 3.156 4.716 -5.879 353 HA THR 7 HA THR 7 2.608 2.854 -3.685 354 HB THR 7 HB THR 7 4.180 1.417 -4.943 355 HG1 THR 7 HG1 THR 7 5.090 2.252 -6.824 356 HG21 THR 7 HG21 THR 7 1.783 1.536 -5.605 357 HG22 THR 7 HG22 THR 7 2.183 2.812 -6.779 358 HG23 THR 7 HG23 THR 7 2.856 1.180 -6.979 359 H LEU 8 H LEU 8 4.628 1.688 -2.828 360 HA LEU 8 HA LEU 8 6.151 3.378 -1.165 361 HB2 LEU 8 HB2 LEU 8 5.505 0.984 -0.859 362 HB3 LEU 8 HB3 LEU 8 6.657 0.515 -2.100 363 HG LEU 8 HG LEU 8 7.235 0.212 0.381 364 HD11 LEU 8 HD11 LEU 8 9.582 0.522 0.062 365 HD12 LEU 8 HD12 LEU 8 8.879 -0.042 -1.465 366 HD13 LEU 8 HD13 LEU 8 9.339 1.664 -1.266 367 HD21 LEU 8 HD21 LEU 8 6.555 2.476 1.087 368 HD22 LEU 8 HD22 LEU 8 8.232 2.084 1.544 369 HD23 LEU 8 HD23 LEU 8 7.917 3.167 0.173 370 H THR 9 H THR 9 6.583 2.571 -4.531 371 HA THR 9 HA THR 9 9.505 2.977 -4.397 372 HB THR 9 HB THR 9 9.466 2.204 -6.747 373 HG1 THR 9 HG1 THR 9 7.484 1.467 -7.576 374 HG21 THR 9 HG21 THR 9 7.836 0.397 -4.902 375 HG22 THR 9 HG22 THR 9 8.785 -0.116 -6.310 376 HG23 THR 9 HG23 THR 9 9.607 0.551 -4.879 377 H GLY 10 H GLY 10 6.748 4.864 -4.719 378 HA2 GLY 10 HA2 GLY 10 6.851 7.179 -4.926 379 HA3 GLY 10 HA3 GLY 10 8.449 7.039 -5.704 380 H LYS 11 H LYS 11 5.729 5.093 -6.830 381 HA LYS 11 HA LYS 11 5.492 6.863 -9.224 382 HB2 LYS 11 HB2 LYS 11 6.776 4.804 -9.550 383 HB3 LYS 11 HB3 LYS 11 5.417 3.819 -9.002 384 HG2 LYS 11 HG2 LYS 11 4.886 5.785 -11.214 385 HG3 LYS 11 HG3 LYS 11 5.847 4.335 -11.599 386 HD2 LYS 11 HD2 LYS 11 4.047 2.882 -10.739 387 HD3 LYS 11 HD3 LYS 11 3.086 4.297 -10.299 388 HE2 LYS 11 HE2 LYS 11 2.286 3.429 -12.409 389 HE3 LYS 11 HE3 LYS 11 3.038 5.008 -12.677 390 HZ1 LYS 11 HZ1 LYS 11 4.315 2.401 -13.175 391 HZ2 LYS 11 HZ2 LYS 11 3.721 3.412 -14.326 392 HZ3 LYS 11 HZ3 LYS 11 5.016 3.867 -13.426 393 H THR 12 H THR 12 3.389 7.245 -9.983 394 HA THR 12 HA THR 12 1.334 6.359 -8.029 395 HB THR 12 HB THR 12 2.094 8.866 -8.457 396 HG1 THR 12 HG1 THR 12 0.132 9.337 -7.489 397 HG21 THR 12 HG21 THR 12 1.298 8.910 -10.829 398 HG22 THR 12 HG22 THR 12 -0.347 8.533 -10.245 399 HG23 THR 12 HG23 THR 12 0.427 10.056 -9.775 400 H ILE 13 H ILE 13 -0.869 6.108 -8.801 401 HA ILE 13 HA ILE 13 -1.025 5.175 -11.634 402 HB ILE 13 HB ILE 13 -2.149 3.784 -9.173 403 HG12 ILE 13 HG12 ILE 13 0.204 3.034 -10.967 404 HG13 ILE 13 HG13 ILE 13 0.296 3.553 -9.275 405 HG21 ILE 13 HG21 ILE 13 -3.518 3.562 -11.246 406 HG22 ILE 13 HG22 ILE 13 -2.095 2.942 -12.106 407 HG23 ILE 13 HG23 ILE 13 -2.806 2.017 -10.759 408 HD11 ILE 13 HD11 ILE 13 0.491 1.152 -9.348 409 HD12 ILE 13 HD12 ILE 13 -1.070 1.576 -8.612 410 HD13 ILE 13 HD13 ILE 13 -0.998 1.002 -10.298 411 H THR 14 H THR 14 -2.725 5.996 -12.706 412 HA THR 14 HA THR 14 -4.481 7.860 -11.326 413 HB THR 14 HB THR 14 -4.560 6.898 -14.211 414 HG1 THR 14 HG1 THR 14 -3.216 8.683 -14.589 415 HG21 THR 14 HG21 THR 14 -6.537 8.178 -13.425 416 HG22 THR 14 HG22 THR 14 -5.451 9.457 -12.821 417 HG23 THR 14 HG23 THR 14 -5.574 9.126 -14.571 418 H LEU 15 H LEU 15 -6.629 7.514 -10.771 419 HA LEU 15 HA LEU 15 -7.904 4.947 -11.551 420 HB2 LEU 15 HB2 LEU 15 -7.505 5.906 -8.692 421 HB3 LEU 15 HB3 LEU 15 -8.434 4.488 -9.188 422 HG LEU 15 HG LEU 15 -5.456 4.843 -9.699 423 HD11 LEU 15 HD11 LEU 15 -6.871 3.220 -7.542 424 HD12 LEU 15 HD12 LEU 15 -5.110 3.362 -7.788 425 HD13 LEU 15 HD13 LEU 15 -6.053 4.776 -7.271 426 HD21 LEU 15 HD21 LEU 15 -6.575 3.203 -11.201 427 HD22 LEU 15 HD22 LEU 15 -5.458 2.426 -10.048 428 HD23 LEU 15 HD23 LEU 15 -7.211 2.352 -9.778 429 H GLU 16 H GLU 16 -10.028 5.172 -11.834 430 HA GLU 16 HA GLU 16 -11.298 7.801 -11.325 431 HB2 GLU 16 HB2 GLU 16 -11.563 6.846 -13.541 432 HB3 GLU 16 HB3 GLU 16 -12.043 5.279 -12.864 433 HG2 GLU 16 HG2 GLU 16 -14.069 6.251 -11.937 434 HG3 GLU 16 HG3 GLU 16 -13.614 7.863 -12.520 435 H VAL 17 H VAL 17 -12.637 8.170 -9.736 436 HA VAL 17 HA VAL 17 -14.006 5.969 -8.312 437 HB VAL 17 HB VAL 17 -13.247 6.807 -6.137 438 HG11 VAL 17 HG11 VAL 17 -10.958 5.974 -6.155 439 HG12 VAL 17 HG12 VAL 17 -11.980 4.959 -7.195 440 HG13 VAL 17 HG13 VAL 17 -10.867 6.147 -7.920 441 HG21 VAL 17 HG21 VAL 17 -12.759 9.145 -6.786 442 HG22 VAL 17 HG22 VAL 17 -11.364 8.401 -5.985 443 HG23 VAL 17 HG23 VAL 17 -11.372 8.590 -7.754 444 H GLU 18 H GLU 18 -15.339 7.076 -6.445 445 HA GLU 18 HA GLU 18 -16.412 9.725 -7.233 446 HB2 GLU 18 HB2 GLU 18 -18.015 7.195 -6.675 447 HB3 GLU 18 HB3 GLU 18 -18.715 8.782 -6.975 448 HG2 GLU 18 HG2 GLU 18 -17.020 7.223 -8.978 449 HG3 GLU 18 HG3 GLU 18 -18.778 7.210 -8.901 450 HA PRO 19 HA PRO 19 -16.658 10.417 -2.805 451 HB2 PRO 19 HB2 PRO 19 -19.531 11.151 -3.214 452 HB3 PRO 19 HB3 PRO 19 -18.221 12.102 -2.449 453 HG2 PRO 19 HG2 PRO 19 -19.085 12.746 -4.927 454 HG3 PRO 19 HG3 PRO 19 -17.342 12.792 -4.508 455 HD2 PRO 19 HD2 PRO 19 -18.862 10.651 -5.989 456 HD3 PRO 19 HD3 PRO 19 -17.250 11.349 -6.345 457 H SER 20 H SER 20 -18.197 7.842 -4.284 458 HA SER 20 HA SER 20 -19.173 6.825 -1.668 459 HB2 SER 20 HB2 SER 20 -21.067 7.656 -3.066 460 HB3 SER 20 HB3 SER 20 -20.615 6.482 -4.318 461 HG SER 20 HG SER 20 -22.233 5.695 -2.879 462 H ASP 21 H ASP 21 -17.237 6.379 -4.471 463 HA ASP 21 HA ASP 21 -17.023 3.466 -4.263 464 HB2 ASP 21 HB2 ASP 21 -15.307 5.604 -5.506 465 HB3 ASP 21 HB3 ASP 21 -14.946 3.877 -5.600 466 H THR 22 H THR 22 -16.969 3.751 -1.920 467 HA THR 22 HA THR 22 -14.787 4.960 -0.527 468 HB THR 22 HB THR 22 -16.883 4.505 0.561 469 HG1 THR 22 HG1 THR 22 -16.016 3.658 2.422 470 HG21 THR 22 HG21 THR 22 -17.531 2.252 1.256 471 HG22 THR 22 HG22 THR 22 -17.600 2.464 -0.506 472 HG23 THR 22 HG23 THR 22 -16.231 1.572 0.227 473 H ILE 23 H ILE 23 -13.528 3.358 1.102 474 HA ILE 23 HA ILE 23 -11.339 2.676 -0.442 475 HB ILE 23 HB ILE 23 -11.955 1.511 2.282 476 HG12 ILE 23 HG12 ILE 23 -12.496 3.846 2.460 477 HG13 ILE 23 HG13 ILE 23 -10.910 3.592 3.185 478 HG21 ILE 23 HG21 ILE 23 -9.516 1.754 2.581 479 HG22 ILE 23 HG22 ILE 23 -9.918 0.680 1.225 480 HG23 ILE 23 HG23 ILE 23 -9.370 2.340 0.904 481 HD11 ILE 23 HD11 ILE 23 -10.999 5.651 1.840 482 HD12 ILE 23 HD12 ILE 23 -9.827 4.502 1.151 483 HD13 ILE 23 HD13 ILE 23 -11.425 4.717 0.395 484 H GLU 24 H GLU 24 -14.015 0.452 0.503 485 HA GLU 24 HA GLU 24 -12.511 -1.882 -0.287 486 HB2 GLU 24 HB2 GLU 24 -14.536 -3.096 -0.034 487 HB3 GLU 24 HB3 GLU 24 -14.490 -1.884 1.260 488 HG2 GLU 24 HG2 GLU 24 -16.007 -0.435 -0.080 489 HG3 GLU 24 HG3 GLU 24 -16.063 -1.674 -1.346 490 H ASN 25 H ASN 25 -14.303 0.545 -2.047 491 HA ASN 25 HA ASN 25 -14.590 -1.035 -4.474 492 HB2 ASN 25 HB2 ASN 25 -14.820 1.945 -3.958 493 HB3 ASN 25 HB3 ASN 25 -15.204 1.174 -5.475 494 HD21 ASN 25 HD21 ASN 25 -16.192 1.763 -2.277 495 HD22 ASN 25 HD22 ASN 25 -17.763 0.941 -2.316 496 H VAL 26 H VAL 26 -12.426 1.385 -3.047 497 HA VAL 26 HA VAL 26 -10.872 2.086 -5.336 498 HB VAL 26 HB VAL 26 -10.236 2.081 -2.367 499 HG11 VAL 26 HG11 VAL 26 -8.788 3.388 -4.692 500 HG12 VAL 26 HG12 VAL 26 -8.499 3.758 -2.972 501 HG13 VAL 26 HG13 VAL 26 -8.178 2.125 -3.591 502 HG21 VAL 26 HG21 VAL 26 -10.798 4.475 -2.490 503 HG22 VAL 26 HG22 VAL 26 -11.201 4.305 -4.218 504 HG23 VAL 26 HG23 VAL 26 -12.178 3.481 -2.980 505 H LYS 27 H LYS 27 -10.458 -0.363 -2.738 506 HA LYS 27 HA LYS 27 -7.947 -1.334 -3.510 507 HB2 LYS 27 HB2 LYS 27 -10.381 -2.605 -2.212 508 HB3 LYS 27 HB3 LYS 27 -8.834 -3.454 -2.427 509 HG2 LYS 27 HG2 LYS 27 -7.647 -1.856 -1.090 510 HG3 LYS 27 HG3 LYS 27 -9.042 -0.763 -1.023 511 HD2 LYS 27 HD2 LYS 27 -10.333 -2.430 0.244 512 HD3 LYS 27 HD3 LYS 27 -8.987 -3.590 0.122 513 HE2 LYS 27 HE2 LYS 27 -7.529 -2.047 1.352 514 HE3 LYS 27 HE3 LYS 27 -8.833 -0.856 1.459 515 HZ1 LYS 27 HZ1 LYS 27 -10.112 -2.423 2.719 516 HZ2 LYS 27 HZ2 LYS 27 -8.926 -3.559 2.630 517 HZ3 LYS 27 HZ3 LYS 27 -8.680 -2.158 3.463 518 H ALA 28 H ALA 28 -11.115 -1.855 -5.061 519 HA ALA 28 HA ALA 28 -10.121 -4.070 -6.676 520 HB1 ALA 28 HB1 ALA 28 -12.522 -3.826 -6.113 521 HB2 ALA 28 HB2 ALA 28 -12.573 -2.292 -7.019 522 HB3 ALA 28 HB3 ALA 28 -12.243 -3.811 -7.872 523 H LYS 29 H LYS 29 -10.059 -0.572 -6.824 524 HA LYS 29 HA LYS 29 -9.750 -0.263 -9.672 525 HB2 LYS 29 HB2 LYS 29 -8.647 1.511 -7.428 526 HB3 LYS 29 HB3 LYS 29 -9.098 2.016 -9.064 527 HG2 LYS 29 HG2 LYS 29 -11.039 0.972 -6.975 528 HG3 LYS 29 HG3 LYS 29 -10.634 2.689 -7.223 529 HD2 LYS 29 HD2 LYS 29 -11.331 2.523 -9.527 530 HD3 LYS 29 HD3 LYS 29 -11.923 0.851 -9.268 531 HE2 LYS 29 HE2 LYS 29 -13.417 1.624 -7.479 532 HE3 LYS 29 HE3 LYS 29 -12.805 3.268 -7.619 533 HZ1 LYS 29 HZ1 LYS 29 -14.293 1.844 -9.722 534 HZ2 LYS 29 HZ2 LYS 29 -14.871 3.060 -8.773 535 HZ3 LYS 29 HZ3 LYS 29 -13.674 3.367 -9.850 536 H ILE 30 H ILE 30 -7.561 -0.412 -6.906 537 HA ILE 30 HA ILE 30 -5.124 -0.202 -8.454 538 HB ILE 30 HB ILE 30 -5.738 -1.083 -5.604 539 HG12 ILE 30 HG12 ILE 30 -4.582 1.528 -6.662 540 HG13 ILE 30 HG13 ILE 30 -6.310 1.292 -6.339 541 HG21 ILE 30 HG21 ILE 30 -3.054 -0.376 -6.869 542 HG22 ILE 30 HG22 ILE 30 -3.337 -0.709 -5.143 543 HG23 ILE 30 HG23 ILE 30 -3.554 -1.997 -6.335 544 HD11 ILE 30 HD11 ILE 30 -5.247 2.413 -4.463 545 HD12 ILE 30 HD12 ILE 30 -5.836 0.810 -3.977 546 HD13 ILE 30 HD13 ILE 30 -4.098 1.076 -4.264 547 H GLN 31 H GLN 31 -7.182 -2.858 -7.288 548 HA GLN 31 HA GLN 31 -5.338 -4.982 -7.882 549 HB2 GLN 31 HB2 GLN 31 -7.273 -5.360 -6.434 550 HB3 GLN 31 HB3 GLN 31 -8.382 -4.832 -7.715 551 HG2 GLN 31 HG2 GLN 31 -7.743 -6.697 -9.136 552 HG3 GLN 31 HG3 GLN 31 -6.492 -7.193 -8.011 553 HE21 GLN 31 HE21 GLN 31 -7.296 -9.252 -7.487 554 HE22 GLN 31 HE22 GLN 31 -8.813 -9.493 -6.650 555 H ASP 32 H ASP 32 -7.850 -3.236 -9.754 556 HA ASP 32 HA ASP 32 -7.862 -5.068 -11.937 557 HB2 ASP 32 HB2 ASP 32 -9.650 -3.428 -11.386 558 HB3 ASP 32 HB3 ASP 32 -8.547 -2.110 -11.668 559 H LYS 33 H LYS 33 -5.928 -2.314 -11.068 560 HA LYS 33 HA LYS 33 -4.816 -1.825 -13.708 561 HB2 LYS 33 HB2 LYS 33 -4.409 -0.815 -10.886 562 HB3 LYS 33 HB3 LYS 33 -3.354 -0.267 -12.205 563 HG2 LYS 33 HG2 LYS 33 -6.393 -0.118 -12.373 564 HG3 LYS 33 HG3 LYS 33 -5.409 1.185 -11.676 565 HD2 LYS 33 HD2 LYS 33 -4.109 1.352 -13.763 566 HD3 LYS 33 HD3 LYS 33 -5.138 0.114 -14.515 567 HE2 LYS 33 HE2 LYS 33 -6.145 2.748 -13.358 568 HE3 LYS 33 HE3 LYS 33 -5.790 2.483 -15.067 569 HZ1 LYS 33 HZ1 LYS 33 -7.447 0.739 -15.079 570 HZ2 LYS 33 HZ2 LYS 33 -7.790 0.995 -13.491 571 HZ3 LYS 33 HZ3 LYS 33 -8.118 2.159 -14.603 572 H GLU 34 H GLU 34 -3.863 -3.796 -10.925 573 HA GLU 34 HA GLU 34 -1.353 -4.431 -12.404 574 HB2 GLU 34 HB2 GLU 34 -1.607 -3.806 -9.439 575 HB3 GLU 34 HB3 GLU 34 -0.148 -4.437 -10.207 576 HG2 GLU 34 HG2 GLU 34 -1.486 -1.785 -10.898 577 HG3 GLU 34 HG3 GLU 34 -0.097 -1.977 -9.832 578 H GLY 35 H GLY 35 -3.765 -5.439 -9.959 579 HA2 GLY 35 HA2 GLY 35 -4.626 -7.717 -10.213 580 HA3 GLY 35 HA3 GLY 35 -2.962 -8.277 -10.465 581 H ILE 36 H ILE 36 -3.163 -5.757 -8.176 582 HA ILE 36 HA ILE 36 -2.174 -7.490 -6.087 583 HB ILE 36 HB ILE 36 -2.948 -4.548 -6.129 584 HG12 ILE 36 HG12 ILE 36 -0.190 -5.839 -6.266 585 HG13 ILE 36 HG13 ILE 36 -1.103 -5.355 -7.701 586 HG21 ILE 36 HG21 ILE 36 -1.268 -6.113 -4.125 587 HG22 ILE 36 HG22 ILE 36 -1.606 -4.362 -4.083 588 HG23 ILE 36 HG23 ILE 36 -2.923 -5.521 -3.840 589 HD11 ILE 36 HD11 ILE 36 -1.176 -3.017 -6.879 590 HD12 ILE 36 HD12 ILE 36 -0.215 -3.488 -5.458 591 HD13 ILE 36 HD13 ILE 36 0.489 -3.601 -7.084 592 HA PRO 37 HA PRO 37 -6.260 -8.463 -4.663 593 HB2 PRO 37 HB2 PRO 37 -5.621 -9.696 -2.279 594 HB3 PRO 37 HB3 PRO 37 -5.409 -10.463 -3.882 595 HG2 PRO 37 HG2 PRO 37 -3.360 -9.040 -2.186 596 HG3 PRO 37 HG3 PRO 37 -3.173 -10.594 -3.062 597 HD2 PRO 37 HD2 PRO 37 -2.240 -8.228 -4.056 598 HD3 PRO 37 HD3 PRO 37 -2.916 -9.483 -5.138 599 HA PRO 38 HA PRO 38 -7.358 -5.146 -2.006 600 HB2 PRO 38 HB2 PRO 38 -9.688 -6.066 -0.878 601 HB3 PRO 38 HB3 PRO 38 -9.537 -5.597 -2.604 602 HG2 PRO 38 HG2 PRO 38 -9.376 -8.377 -1.399 603 HG3 PRO 38 HG3 PRO 38 -10.335 -7.844 -2.821 604 HD2 PRO 38 HD2 PRO 38 -7.909 -9.047 -3.091 605 HD3 PRO 38 HD3 PRO 38 -8.406 -7.715 -4.179 606 H ASP 39 H ASP 39 -6.679 -8.335 -0.723 607 HA ASP 39 HA ASP 39 -6.916 -7.374 2.027 608 HB2 ASP 39 HB2 ASP 39 -6.500 -9.738 2.602 609 HB3 ASP 39 HB3 ASP 39 -7.883 -9.518 1.521 610 H GLN 40 H GLN 40 -4.520 -7.102 -0.291 611 HA GLN 40 HA GLN 40 -2.414 -7.274 1.823 612 HB2 GLN 40 HB2 GLN 40 -2.215 -7.605 -1.188 613 HB3 GLN 40 HB3 GLN 40 -0.825 -7.399 -0.113 614 HG2 GLN 40 HG2 GLN 40 -1.463 -9.387 1.175 615 HG3 GLN 40 HG3 GLN 40 -2.892 -9.616 0.145 616 HE21 GLN 40 HE21 GLN 40 0.499 -8.737 -0.787 617 HE22 GLN 40 HE22 GLN 40 0.740 -10.150 -1.793 618 H GLN 41 H GLN 41 -4.153 -5.082 -0.305 619 HA GLN 41 HA GLN 41 -2.135 -3.040 -0.403 620 HB2 GLN 41 HB2 GLN 41 -5.172 -2.935 -0.543 621 HB3 GLN 41 HB3 GLN 41 -4.102 -1.575 -0.912 622 HG2 GLN 41 HG2 GLN 41 -3.111 -2.801 -2.788 623 HG3 GLN 41 HG3 GLN 41 -4.031 -4.253 -2.350 624 HE21 GLN 41 HE21 GLN 41 -5.220 -4.369 -4.340 625 HE22 GLN 41 HE22 GLN 41 -6.507 -3.232 -4.644 626 H ARG 42 H ARG 42 -2.274 -0.960 0.657 627 HA ARG 42 HA ARG 42 -3.898 -0.618 3.064 628 HB2 ARG 42 HB2 ARG 42 -1.804 -1.825 3.829 629 HB3 ARG 42 HB3 ARG 42 -0.848 -0.461 3.212 630 HG2 ARG 42 HG2 ARG 42 -2.030 1.067 4.754 631 HG3 ARG 42 HG3 ARG 42 -3.064 -0.271 5.298 632 HD2 ARG 42 HD2 ARG 42 -1.047 -1.481 6.103 633 HD3 ARG 42 HD3 ARG 42 -0.043 -0.090 5.634 634 HE ARG 42 HE ARG 42 -2.107 0.893 7.281 635 HH11 ARG 42 HH11 ARG 42 0.666 -1.292 7.626 636 HH12 ARG 42 HH12 ARG 42 0.858 -0.916 9.327 637 HH21 ARG 42 HH21 ARG 42 -1.847 1.299 9.455 638 HH22 ARG 42 HH22 ARG 42 -0.547 0.541 10.357 639 H LEU 43 H LEU 43 -4.576 1.522 2.997 640 HA LEU 43 HA LEU 43 -3.108 3.266 1.071 641 HB2 LEU 43 HB2 LEU 43 -5.555 2.006 0.741 642 HB3 LEU 43 HB3 LEU 43 -6.039 3.615 1.279 643 HG LEU 43 HG LEU 43 -4.123 3.047 -1.024 644 HD11 LEU 43 HD11 LEU 43 -6.049 3.604 -2.476 645 HD12 LEU 43 HD12 LEU 43 -6.389 2.170 -1.484 646 HD13 LEU 43 HD13 LEU 43 -7.093 3.740 -1.041 647 HD21 LEU 43 HD21 LEU 43 -5.620 5.584 -0.219 648 HD22 LEU 43 HD22 LEU 43 -3.868 5.320 -0.056 649 HD23 LEU 43 HD23 LEU 43 -4.600 5.387 -1.664 650 H ILE 44 H ILE 44 -2.784 5.337 1.597 651 HA ILE 44 HA ILE 44 -3.904 6.376 4.158 652 HB ILE 44 HB ILE 44 -1.011 6.303 3.213 653 HG12 ILE 44 HG12 ILE 44 -0.710 5.625 5.677 654 HG13 ILE 44 HG13 ILE 44 -2.457 5.405 5.739 655 HG21 ILE 44 HG21 ILE 44 -2.117 7.946 5.529 656 HG22 ILE 44 HG22 ILE 44 -0.421 7.776 5.084 657 HG23 ILE 44 HG23 ILE 44 -1.512 8.630 3.994 658 HD11 ILE 44 HD11 ILE 44 -0.624 3.960 3.776 659 HD12 ILE 44 HD12 ILE 44 -1.115 3.309 5.358 660 HD13 ILE 44 HD13 ILE 44 -2.337 3.588 4.130 661 H PHE 45 H PHE 45 -4.153 8.624 4.232 662 HA PHE 45 HA PHE 45 -3.564 10.308 1.886 663 HB2 PHE 45 HB2 PHE 45 -5.777 9.237 1.455 664 HB3 PHE 45 HB3 PHE 45 -6.352 9.830 3.010 665 HD1 PHE 45 HD1 PHE 45 -4.626 11.297 -0.001 666 HD2 PHE 45 HD2 PHE 45 -7.735 11.687 2.942 667 HE1 PHE 45 HE1 PHE 45 -5.439 13.334 -1.142 668 HE2 PHE 45 HE2 PHE 45 -8.519 13.761 1.840 669 HZ PHE 45 HZ PHE 45 -7.373 14.597 -0.200 670 H ALA 46 H ALA 46 -3.445 12.477 2.446 671 HA ALA 46 HA ALA 46 -2.727 14.102 3.823 672 HB1 ALA 46 HB1 ALA 46 -5.216 13.323 5.391 673 HB2 ALA 46 HB2 ALA 46 -4.369 14.883 5.472 674 HB3 ALA 46 HB3 ALA 46 -5.169 14.386 3.965 675 H GLY 47 H GLY 47 -2.068 11.117 4.582 676 HA2 GLY 47 HA2 GLY 47 -0.269 10.480 5.928 677 HA3 GLY 47 HA3 GLY 47 -0.546 11.845 7.008 678 H LYS 48 H LYS 48 -3.456 10.066 6.214 679 HA LYS 48 HA LYS 48 -3.016 8.241 8.507 680 HB2 LYS 48 HB2 LYS 48 -5.290 8.616 9.339 681 HB3 LYS 48 HB3 LYS 48 -4.237 10.024 9.485 682 HG2 LYS 48 HG2 LYS 48 -6.330 10.823 8.840 683 HG3 LYS 48 HG3 LYS 48 -5.274 10.965 7.418 684 HD2 LYS 48 HD2 LYS 48 -6.366 8.992 6.407 685 HD3 LYS 48 HD3 LYS 48 -7.397 8.789 7.841 686 HE2 LYS 48 HE2 LYS 48 -7.302 11.220 6.010 687 HE3 LYS 48 HE3 LYS 48 -8.555 9.967 6.004 688 HZ1 LYS 48 HZ1 LYS 48 -9.228 11.894 7.260 689 HZ2 LYS 48 HZ2 LYS 48 -9.113 10.587 8.248 690 HZ3 LYS 48 HZ3 LYS 48 -7.945 11.741 8.275 691 H GLN 49 H GLN 49 -4.702 6.550 8.589 692 HA GLN 49 HA GLN 49 -4.784 5.417 5.834 693 HB2 GLN 49 HB2 GLN 49 -3.445 4.175 7.400 694 HB3 GLN 49 HB3 GLN 49 -4.725 4.216 8.618 695 HG2 GLN 49 HG2 GLN 49 -6.161 2.818 7.148 696 HG3 GLN 49 HG3 GLN 49 -4.881 2.781 5.923 697 HE21 GLN 49 HE21 GLN 49 -5.931 0.413 6.971 698 HE22 GLN 49 HE22 GLN 49 -4.729 -0.358 7.985 699 H LEU 50 H LEU 50 -6.641 5.048 4.843 700 HA LEU 50 HA LEU 50 -9.110 5.923 6.097 701 HB2 LEU 50 HB2 LEU 50 -8.743 4.545 3.416 702 HB3 LEU 50 HB3 LEU 50 -10.100 5.533 3.960 703 HG LEU 50 HG LEU 50 -9.078 7.019 2.609 704 HD11 LEU 50 HD11 LEU 50 -9.004 7.937 5.009 705 HD12 LEU 50 HD12 LEU 50 -7.262 7.589 4.970 706 HD13 LEU 50 HD13 LEU 50 -7.971 8.728 3.806 707 HD21 LEU 50 HD21 LEU 50 -6.318 6.046 3.419 708 HD22 LEU 50 HD22 LEU 50 -7.212 5.535 1.963 709 HD23 LEU 50 HD23 LEU 50 -6.711 7.225 2.155 710 H GLU 51 H GLU 51 -11.163 4.421 5.722 711 HA GLU 51 HA GLU 51 -10.460 1.585 6.303 712 HB2 GLU 51 HB2 GLU 51 -12.241 3.418 7.932 713 HB3 GLU 51 HB3 GLU 51 -12.390 1.649 7.987 714 HG2 GLU 51 HG2 GLU 51 -10.064 1.427 8.678 715 HG3 GLU 51 HG3 GLU 51 -9.829 3.174 8.553 716 H ASP 52 H ASP 52 -12.156 0.104 5.990 717 HA ASP 52 HA ASP 52 -13.508 0.583 3.492 718 HB2 ASP 52 HB2 ASP 52 -13.610 -1.760 5.432 719 HB3 ASP 52 HB3 ASP 52 -14.194 -1.765 3.763 720 H GLY 53 H GLY 53 -14.369 1.615 6.493 721 HA2 GLY 53 HA2 GLY 53 -17.272 1.069 6.102 722 HA3 GLY 53 HA3 GLY 53 -16.487 1.340 7.669 723 H ARG 54 H ARG 54 -15.259 3.314 5.132 724 HA ARG 54 HA ARG 54 -16.821 5.673 6.084 725 HB2 ARG 54 HB2 ARG 54 -14.064 5.670 4.826 726 HB3 ARG 54 HB3 ARG 54 -14.843 6.962 5.737 727 HG2 ARG 54 HG2 ARG 54 -13.969 4.283 6.914 728 HG3 ARG 54 HG3 ARG 54 -13.043 5.783 7.015 729 HD2 ARG 54 HD2 ARG 54 -14.843 6.874 8.241 730 HD3 ARG 54 HD3 ARG 54 -15.848 5.411 8.133 731 HE ARG 54 HE ARG 54 -13.500 4.519 9.276 732 HH11 ARG 54 HH11 ARG 54 -15.831 7.045 10.099 733 HH12 ARG 54 HH12 ARG 54 -15.521 6.926 11.818 734 HH21 ARG 54 HH21 ARG 54 -13.090 4.411 11.472 735 HH22 ARG 54 HH22 ARG 54 -13.967 5.423 12.605 736 H THR 55 H THR 55 -15.734 7.334 4.001 737 HA THR 55 HA THR 55 -16.124 6.038 1.409 738 HB THR 55 HB THR 55 -17.643 7.862 0.604 739 HG1 THR 55 HG1 THR 55 -18.806 8.978 2.220 740 HG21 THR 55 HG21 THR 55 -19.707 6.899 1.395 741 HG22 THR 55 HG22 THR 55 -18.525 5.586 1.239 742 HG23 THR 55 HG23 THR 55 -18.915 6.248 2.845 743 H LEU 56 H LEU 56 -15.489 7.605 -0.372 744 HA LEU 56 HA LEU 56 -13.025 8.878 0.308 745 HB2 LEU 56 HB2 LEU 56 -14.885 9.114 -2.098 746 HB3 LEU 56 HB3 LEU 56 -13.311 9.890 -2.020 747 HG LEU 56 HG LEU 56 -13.952 6.912 -2.048 748 HD11 LEU 56 HD11 LEU 56 -12.441 6.942 -3.984 749 HD12 LEU 56 HD12 LEU 56 -13.746 8.129 -4.211 750 HD13 LEU 56 HD13 LEU 56 -12.122 8.674 -3.731 751 HD21 LEU 56 HD21 LEU 56 -11.262 8.217 -1.457 752 HD22 LEU 56 HD22 LEU 56 -12.188 7.156 -0.356 753 HD23 LEU 56 HD23 LEU 56 -11.503 6.502 -1.847 754 H SER 57 H SER 57 -16.358 9.987 0.196 755 HA SER 57 HA SER 57 -15.759 12.814 0.368 756 HB2 SER 57 HB2 SER 57 -17.788 12.080 -0.595 757 HB3 SER 57 HB3 SER 57 -18.192 11.038 0.745 758 HG SER 57 HG SER 57 -19.345 13.029 0.820 759 H ASP 58 H ASP 58 -16.216 10.166 2.665 760 HA ASP 58 HA ASP 58 -16.625 11.739 5.012 761 HB2 ASP 58 HB2 ASP 58 -16.919 9.198 4.637 762 HB3 ASP 58 HB3 ASP 58 -15.187 9.074 4.923 763 H TYR 59 H TYR 59 -13.845 11.269 3.051 764 HA TYR 59 HA TYR 59 -12.122 12.543 5.112 765 HB2 TYR 59 HB2 TYR 59 -11.433 10.246 3.235 766 HB3 TYR 59 HB3 TYR 59 -10.234 11.181 4.120 767 HD1 TYR 59 HD1 TYR 59 -11.595 11.492 6.794 768 HD2 TYR 59 HD2 TYR 59 -11.231 8.115 4.154 769 HE1 TYR 59 HE1 TYR 59 -11.715 9.968 8.739 770 HE2 TYR 59 HE2 TYR 59 -11.268 6.584 6.107 771 HH TYR 59 HH TYR 59 -11.440 6.410 8.392 772 H ASN 60 H ASN 60 -13.773 13.510 2.826 773 HA ASN 60 HA ASN 60 -13.652 14.929 1.118 774 HB2 ASN 60 HB2 ASN 60 -12.500 16.913 1.643 775 HB3 ASN 60 HB3 ASN 60 -13.044 16.184 3.152 776 HD21 ASN 60 HD21 ASN 60 -11.579 15.501 4.703 777 HD22 ASN 60 HD22 ASN 60 -9.857 15.808 4.582 778 H ILE 61 H ILE 61 -11.936 12.482 0.642 779 HA ILE 61 HA ILE 61 -9.820 13.368 -1.115 780 HB ILE 61 HB ILE 61 -11.457 10.800 -1.010 781 HG12 ILE 61 HG12 ILE 61 -8.565 11.245 -0.202 782 HG13 ILE 61 HG13 ILE 61 -9.900 11.464 0.945 783 HG21 ILE 61 HG21 ILE 61 -9.637 9.853 -2.447 784 HG22 ILE 61 HG22 ILE 61 -10.519 11.145 -3.275 785 HG23 ILE 61 HG23 ILE 61 -8.919 11.474 -2.574 786 HD11 ILE 61 HD11 ILE 61 -9.303 8.878 -0.548 787 HD12 ILE 61 HD12 ILE 61 -8.926 9.222 1.152 788 HD13 ILE 61 HD13 ILE 61 -10.617 9.145 0.620 789 H GLN 62 H GLN 62 -9.956 14.229 -3.074 790 HA GLN 62 HA GLN 62 -12.472 14.046 -4.674 791 HB2 GLN 62 HB2 GLN 62 -10.699 16.476 -4.231 792 HB3 GLN 62 HB3 GLN 62 -12.183 16.426 -5.197 793 HG2 GLN 62 HG2 GLN 62 -12.080 15.849 -2.203 794 HG3 GLN 62 HG3 GLN 62 -12.373 17.437 -2.870 795 HE21 GLN 62 HE21 GLN 62 -14.216 16.232 -1.176 796 HE22 GLN 62 HE22 GLN 62 -15.658 15.801 -2.077 797 H LYS 63 H LYS 63 -11.738 15.363 -6.866 798 HA LYS 63 HA LYS 63 -10.025 13.580 -8.239 799 HB2 LYS 63 HB2 LYS 63 -10.293 15.070 -10.059 800 HB3 LYS 63 HB3 LYS 63 -11.827 15.016 -9.187 801 HG2 LYS 63 HG2 LYS 63 -11.251 17.169 -8.058 802 HG3 LYS 63 HG3 LYS 63 -9.714 17.209 -8.950 803 HD2 LYS 63 HD2 LYS 63 -11.302 18.636 -10.077 804 HD3 LYS 63 HD3 LYS 63 -10.974 17.215 -11.090 805 HE2 LYS 63 HE2 LYS 63 -13.071 16.164 -10.307 806 HE3 LYS 63 HE3 LYS 63 -13.375 17.550 -9.244 807 HZ1 LYS 63 HZ1 LYS 63 -14.596 17.723 -11.291 808 HZ2 LYS 63 HZ2 LYS 63 -13.498 18.938 -11.194 809 HZ3 LYS 63 HZ3 LYS 63 -13.212 17.656 -12.185 810 H GLU 64 H GLU 64 -7.988 13.540 -8.774 811 HA GLU 64 HA GLU 64 -5.767 13.888 -8.694 812 HB2 GLU 64 HB2 GLU 64 -6.572 16.819 -8.770 813 HB3 GLU 64 HB3 GLU 64 -5.030 16.115 -9.293 814 HG2 GLU 64 HG2 GLU 64 -6.259 14.776 -11.012 815 HG3 GLU 64 HG3 GLU 64 -7.761 15.577 -10.529 816 H SER 65 H SER 65 -7.179 13.790 -6.017 817 HA SER 65 HA SER 65 -5.972 15.774 -4.348 818 HB2 SER 65 HB2 SER 65 -7.475 13.201 -3.815 819 HB3 SER 65 HB3 SER 65 -6.797 14.190 -2.510 820 HG SER 65 HG SER 65 -7.977 15.962 -3.306 821 H THR 66 H THR 66 -4.809 12.810 -5.611 822 HA THR 66 HA THR 66 -2.989 11.519 -5.347 823 HB THR 66 HB THR 66 -1.959 13.972 -3.939 824 HG1 THR 66 HG1 THR 66 -0.970 14.256 -5.956 825 HG21 THR 66 HG21 THR 66 0.302 13.004 -4.414 826 HG22 THR 66 HG22 THR 66 -0.601 12.032 -3.240 827 HG23 THR 66 HG23 THR 66 -0.478 11.489 -4.927 828 H LEU 67 H LEU 67 -2.407 9.835 -4.099 829 HA LEU 67 HA LEU 67 -2.805 9.944 -1.160 830 HB2 LEU 67 HB2 LEU 67 -4.004 7.785 -2.946 831 HB3 LEU 67 HB3 LEU 67 -4.053 7.863 -1.186 832 HG LEU 67 HG LEU 67 -5.293 10.157 -1.561 833 HD11 LEU 67 HD11 LEU 67 -6.764 10.086 -3.553 834 HD12 LEU 67 HD12 LEU 67 -5.071 10.224 -4.056 835 HD13 LEU 67 HD13 LEU 67 -5.890 8.653 -4.148 836 HD21 LEU 67 HD21 LEU 67 -6.243 8.141 -0.507 837 HD22 LEU 67 HD22 LEU 67 -7.425 8.943 -1.559 838 HD23 LEU 67 HD23 LEU 67 -6.603 7.463 -2.112 839 H HIS 68 H HIS 68 -2.154 7.513 -0.361 840 HA HIS 68 HA HIS 68 0.310 6.747 -1.847 841 HB2 HIS 68 HB2 HIS 68 0.153 7.271 1.137 842 HB3 HIS 68 HB3 HIS 68 1.584 6.776 0.226 843 HD2 HIS 68 HD2 HIS 68 2.320 8.663 -1.823 844 HE1 HIS 68 HE1 HIS 68 0.882 11.981 0.414 845 HE2 HIS 68 HE2 HIS 68 2.340 11.265 -1.550 846 H LEU 69 H LEU 69 0.946 4.638 -1.629 847 HA LEU 69 HA LEU 69 -0.940 2.750 -0.308 848 HB2 LEU 69 HB2 LEU 69 -1.640 2.975 -2.607 849 HB3 LEU 69 HB3 LEU 69 0.031 2.903 -3.181 850 HG LEU 69 HG LEU 69 0.149 0.516 -2.368 851 HD11 LEU 69 HD11 LEU 69 -2.862 0.918 -2.078 852 HD12 LEU 69 HD12 LEU 69 -2.011 -0.646 -2.027 853 HD13 LEU 69 HD13 LEU 69 -1.719 0.561 -0.758 854 HD21 LEU 69 HD21 LEU 69 -0.218 1.097 -4.715 855 HD22 LEU 69 HD22 LEU 69 -1.159 -0.346 -4.274 856 HD23 LEU 69 HD23 LEU 69 -1.963 1.236 -4.431 857 H VAL 70 H VAL 70 -0.036 0.959 0.489 858 HA VAL 70 HA VAL 70 2.718 0.135 -0.198 859 HB VAL 70 HB VAL 70 1.714 0.662 2.633 860 HG11 VAL 70 HG11 VAL 70 4.323 -0.559 1.635 861 HG12 VAL 70 HG12 VAL 70 4.001 -0.050 3.308 862 HG13 VAL 70 HG13 VAL 70 3.071 -1.382 2.609 863 HG21 VAL 70 HG21 VAL 70 3.964 1.883 0.976 864 HG22 VAL 70 HG22 VAL 70 2.489 2.710 1.521 865 HG23 VAL 70 HG23 VAL 70 3.695 2.182 2.710 866 H LEU 71 H LEU 71 3.004 -2.220 0.524 867 HA LEU 71 HA LEU 71 0.461 -3.562 1.130 868 HB2 LEU 71 HB2 LEU 71 0.730 -5.075 -0.880 869 HB3 LEU 71 HB3 LEU 71 0.214 -3.423 -1.199 870 HG LEU 71 HG LEU 71 2.524 -2.813 -1.884 871 HD11 LEU 71 HD11 LEU 71 4.097 -4.674 -2.444 872 HD12 LEU 71 HD12 LEU 71 3.887 -4.469 -0.700 873 HD13 LEU 71 HD13 LEU 71 3.051 -5.799 -1.551 874 HD21 LEU 71 HD21 LEU 71 1.316 -5.220 -3.300 875 HD22 LEU 71 HD22 LEU 71 0.809 -3.523 -3.496 876 HD23 LEU 71 HD23 LEU 71 2.430 -4.032 -4.018 877 H ARG 72 H ARG 72 0.737 -6.003 1.157 878 HA ARG 72 HA ARG 72 3.246 -6.674 2.617 879 HB2 ARG 72 HB2 ARG 72 0.368 -7.610 2.688 880 HB3 ARG 72 HB3 ARG 72 1.657 -8.678 3.259 881 HG2 ARG 72 HG2 ARG 72 0.559 -7.312 5.050 882 HG3 ARG 72 HG3 ARG 72 2.327 -7.178 4.969 883 HD2 ARG 72 HD2 ARG 72 2.188 -5.037 3.870 884 HD3 ARG 72 HD3 ARG 72 0.428 -5.162 3.719 885 HE ARG 72 HE ARG 72 1.986 -4.622 6.195 886 HH11 ARG 72 HH11 ARG 72 -1.184 -5.083 4.681 887 HH12 ARG 72 HH12 ARG 72 -2.048 -4.452 6.065 888 HH21 ARG 72 HH21 ARG 72 0.860 -3.848 7.940 889 HH22 ARG 72 HH22 ARG 72 -0.892 -3.741 7.924 890 H LEU 73 H LEU 73 3.606 -9.190 2.421 891 HA LEU 73 HA LEU 73 3.571 -9.821 -0.478 892 HB2 LEU 73 HB2 LEU 73 5.768 -8.999 1.020 893 HB3 LEU 73 HB3 LEU 73 5.862 -10.753 1.193 894 HG LEU 73 HG LEU 73 5.727 -10.890 -1.358 895 HD11 LEU 73 HD11 LEU 73 6.097 -7.870 -1.046 896 HD12 LEU 73 HD12 LEU 73 6.229 -8.764 -2.579 897 HD13 LEU 73 HD13 LEU 73 4.670 -8.662 -1.734 898 HD21 LEU 73 HD21 LEU 73 7.853 -11.009 -0.104 899 HD22 LEU 73 HD22 LEU 73 8.077 -10.176 -1.659 900 HD23 LEU 73 HD23 LEU 73 7.985 -9.236 -0.146 901 H ARG 74 H ARG 74 1.935 -10.592 1.822 902 HA ARG 74 HA ARG 74 0.921 -12.328 2.853 903 HB2 ARG 74 HB2 ARG 74 0.622 -13.024 0.501 904 HB3 ARG 74 HB3 ARG 74 2.107 -13.976 0.581 905 HG2 ARG 74 HG2 ARG 74 0.106 -15.391 0.869 906 HG3 ARG 74 HG3 ARG 74 1.165 -15.440 2.284 907 HD2 ARG 74 HD2 ARG 74 -0.315 -13.793 3.432 908 HD3 ARG 74 HD3 ARG 74 -1.364 -13.766 2.003 909 HE ARG 74 HE ARG 74 -2.264 -15.808 2.637 910 HH11 ARG 74 HH11 ARG 74 0.670 -15.199 4.529 911 HH12 ARG 74 HH12 ARG 74 0.376 -16.534 5.617 912 HH21 ARG 74 HH21 ARG 74 -2.601 -17.545 4.063 913 HH22 ARG 74 HH22 ARG 74 -1.463 -17.861 5.350 914 H GLY 75 H GLY 75 4.305 -12.758 2.186 915 HA2 GLY 75 HA2 GLY 75 5.389 -13.323 4.510 916 HA3 GLY 75 HA3 GLY 75 4.551 -14.877 4.206 917 H GLY 76 H GLY 76 5.100 -14.017 1.190 918 HA2 GLY 76 HA2 GLY 76 7.846 -14.110 0.642 919 HA3 GLY 76 HA3 GLY 76 7.305 -15.794 0.762 Start of MODEL 3 1 H LEU 491 H LEU 491 15.265 5.313 11.711 2 HA LEU 491 HA LEU 491 17.750 4.371 11.455 3 HB2 LEU 491 HB2 LEU 491 16.086 2.386 10.256 4 HB3 LEU 491 HB3 LEU 491 16.748 2.507 11.880 5 HG LEU 491 HG LEU 491 14.742 3.888 12.553 6 HD11 LEU 491 HD11 LEU 491 14.023 4.580 10.259 7 HD12 LEU 491 HD12 LEU 491 13.732 2.877 9.856 8 HD13 LEU 491 HD13 LEU 491 12.742 3.678 11.097 9 HD21 LEU 491 HD21 LEU 491 14.994 1.529 13.081 10 HD22 LEU 491 HD22 LEU 491 13.297 1.901 12.693 11 HD23 LEU 491 HD23 LEU 491 14.325 1.074 11.494 12 HA PRO 492 HA PRO 492 18.976 4.845 7.154 13 HB2 PRO 492 HB2 PRO 492 21.354 3.570 7.356 14 HB3 PRO 492 HB3 PRO 492 21.059 5.147 8.146 15 HG2 PRO 492 HG2 PRO 492 20.980 2.398 9.388 16 HG3 PRO 492 HG3 PRO 492 21.759 3.885 10.022 17 HD2 PRO 492 HD2 PRO 492 19.266 2.997 10.797 18 HD3 PRO 492 HD3 PRO 492 19.683 4.726 10.795 19 H LEU 493 H LEU 493 20.327 2.977 5.770 20 HA LEU 493 HA LEU 493 18.346 1.026 5.123 21 HB2 LEU 493 HB2 LEU 493 20.456 2.377 3.952 22 HB3 LEU 493 HB3 LEU 493 21.171 0.790 4.151 23 HG LEU 493 HG LEU 493 18.491 1.420 2.829 24 HD11 LEU 493 HD11 LEU 493 20.373 2.354 1.562 25 HD12 LEU 493 HD12 LEU 493 21.175 0.768 1.546 26 HD13 LEU 493 HD13 LEU 493 19.637 0.998 0.680 27 HD21 LEU 493 HD21 LEU 493 20.128 -1.160 2.838 28 HD22 LEU 493 HD22 LEU 493 18.569 -0.902 3.663 29 HD23 LEU 493 HD23 LEU 493 18.647 -0.891 1.892 30 H GLN 494 H GLN 494 19.166 0.771 7.829 31 HA GLN 494 HA GLN 494 21.080 -1.329 8.137 32 HB2 GLN 494 HB2 GLN 494 19.693 -1.507 10.425 33 HB3 GLN 494 HB3 GLN 494 20.876 -0.231 10.079 34 HG2 GLN 494 HG2 GLN 494 19.068 0.825 11.114 35 HG3 GLN 494 HG3 GLN 494 19.026 1.289 9.420 36 HE21 GLN 494 HE21 GLN 494 17.372 -0.177 12.070 37 HE22 GLN 494 HE22 GLN 494 15.895 -0.625 11.227 38 H ALA 495 H ALA 495 17.594 -1.257 7.827 39 HA ALA 495 HA ALA 495 17.568 -4.194 7.403 40 HB1 ALA 495 HB1 ALA 495 15.796 -2.649 9.344 41 HB2 ALA 495 HB2 ALA 495 15.567 -4.361 8.900 42 HB3 ALA 495 HB3 ALA 495 17.030 -3.852 9.777 43 H LEU 496 H LEU 496 16.834 -1.217 6.189 44 HA LEU 496 HA LEU 496 14.211 -1.638 5.119 45 HB2 LEU 496 HB2 LEU 496 16.573 0.114 4.311 46 HB3 LEU 496 HB3 LEU 496 14.962 0.246 3.597 47 HG LEU 496 HG LEU 496 15.557 0.577 6.573 48 HD11 LEU 496 HD11 LEU 496 14.959 2.638 4.409 49 HD12 LEU 496 HD12 LEU 496 15.142 2.970 6.150 50 HD13 LEU 496 HD13 LEU 496 16.532 2.391 5.213 51 HD21 LEU 496 HD21 LEU 496 13.268 1.488 6.656 52 HD22 LEU 496 HD22 LEU 496 13.042 1.123 4.929 53 HD23 LEU 496 HD23 LEU 496 13.249 -0.194 6.106 54 HA PRO 497 HA PRO 497 14.693 -4.315 1.705 55 HB2 PRO 497 HB2 PRO 497 13.760 -2.051 -0.040 56 HB3 PRO 497 HB3 PRO 497 13.157 -3.734 -0.004 57 HG2 PRO 497 HG2 PRO 497 11.735 -1.782 1.202 58 HG3 PRO 497 HG3 PRO 497 12.002 -3.335 2.073 59 HD2 PRO 497 HD2 PRO 497 13.473 -0.722 2.411 60 HD3 PRO 497 HD3 PRO 497 12.858 -1.836 3.667 61 H GLU 498 H GLU 498 16.056 -4.849 -0.037 62 HA GLU 498 HA GLU 498 18.442 -3.206 -0.253 63 HB2 GLU 498 HB2 GLU 498 19.285 -5.112 -1.593 64 HB3 GLU 498 HB3 GLU 498 18.593 -5.646 -0.043 65 HG2 GLU 498 HG2 GLU 498 16.498 -6.285 -1.176 66 HG3 GLU 498 HG3 GLU 498 17.151 -5.754 -2.728 67 H GLY 499 H GLY 499 16.242 -1.896 -1.144 68 HA2 GLY 499 HA2 GLY 499 17.097 -0.943 -3.707 69 HA3 GLY 499 HA3 GLY 499 15.690 -2.039 -3.852 70 H VAL 500 H VAL 500 16.239 -0.015 -1.000 71 HA VAL 500 HA VAL 500 14.217 1.978 -1.874 72 HB VAL 500 HB VAL 500 14.078 0.140 0.529 73 HG11 VAL 500 HG11 VAL 500 12.517 2.730 0.090 74 HG12 VAL 500 HG12 VAL 500 12.109 1.490 1.287 75 HG13 VAL 500 HG13 VAL 500 13.632 2.370 1.436 76 HG21 VAL 500 HG21 VAL 500 12.096 0.922 -1.656 77 HG22 VAL 500 HG22 VAL 500 12.971 -0.620 -1.550 78 HG23 VAL 500 HG23 VAL 500 11.760 -0.195 -0.317 79 H ASP 501 H ASP 501 14.186 3.855 -0.390 80 HA ASP 501 HA ASP 501 16.803 4.280 1.012 81 HB2 ASP 501 HB2 ASP 501 16.485 5.280 -1.413 82 HB3 ASP 501 HB3 ASP 501 15.444 6.440 -0.594 83 H GLN 502 H GLN 502 16.756 5.451 2.796 84 HA GLN 502 HA GLN 502 14.362 5.618 4.317 85 HB2 GLN 502 HB2 GLN 502 15.883 7.210 5.711 86 HB3 GLN 502 HB3 GLN 502 16.250 5.486 5.630 87 HG2 GLN 502 HG2 GLN 502 17.517 7.427 3.667 88 HG3 GLN 502 HG3 GLN 502 18.160 7.217 5.304 89 HE21 GLN 502 HE21 GLN 502 16.889 4.222 4.422 90 HE22 GLN 502 HE22 GLN 502 18.373 3.509 3.819 91 H GLU 503 H GLU 503 15.922 7.925 2.082 92 HA GLU 503 HA GLU 503 14.409 10.165 3.048 93 HB2 GLU 503 HB2 GLU 503 15.302 11.377 1.199 94 HB3 GLU 503 HB3 GLU 503 16.575 10.265 1.734 95 HG2 GLU 503 HG2 GLU 503 15.808 8.665 -0.080 96 HG3 GLU 503 HG3 GLU 503 14.690 9.912 -0.639 97 H VAL 504 H VAL 504 13.302 7.409 1.554 98 HA VAL 504 HA VAL 504 10.844 8.844 0.755 99 HB VAL 504 HB VAL 504 12.273 8.440 -1.217 100 HG11 VAL 504 HG11 VAL 504 11.609 5.505 -0.727 101 HG12 VAL 504 HG12 VAL 504 12.370 6.170 -2.189 102 HG13 VAL 504 HG13 VAL 504 13.226 6.249 -0.636 103 HG21 VAL 504 HG21 VAL 504 9.609 6.968 -1.285 104 HG22 VAL 504 HG22 VAL 504 9.821 8.735 -1.370 105 HG23 VAL 504 HG23 VAL 504 10.461 7.694 -2.658 106 H PHE 505 H PHE 505 11.999 7.029 3.004 107 HA PHE 505 HA PHE 505 9.622 5.225 3.124 108 HB2 PHE 505 HB2 PHE 505 11.268 3.648 3.131 109 HB3 PHE 505 HB3 PHE 505 12.515 4.799 3.600 110 HD1 PHE 505 HD1 PHE 505 12.980 5.339 5.909 111 HD2 PHE 505 HD2 PHE 505 9.997 2.443 4.859 112 HE1 PHE 505 HE1 PHE 505 13.013 4.466 8.235 113 HE2 PHE 505 HE2 PHE 505 10.026 1.556 7.176 114 HZ PHE 505 HZ PHE 505 11.534 2.569 8.869 115 H LYS 506 H LYS 506 11.577 7.747 4.593 116 HA LYS 506 HA LYS 506 10.323 7.658 7.196 117 HB2 LYS 506 HB2 LYS 506 11.892 9.780 5.689 118 HB3 LYS 506 HB3 LYS 506 11.306 9.988 7.356 119 HG2 LYS 506 HG2 LYS 506 12.522 7.971 8.070 120 HG3 LYS 506 HG3 LYS 506 13.145 7.735 6.430 121 HD2 LYS 506 HD2 LYS 506 13.668 10.149 8.216 122 HD3 LYS 506 HD3 LYS 506 14.804 8.824 7.890 123 HE2 LYS 506 HE2 LYS 506 14.829 9.411 5.500 124 HE3 LYS 506 HE3 LYS 506 13.693 10.736 5.801 125 HZ1 LYS 506 HZ1 LYS 506 15.328 11.739 7.236 126 HZ2 LYS 506 HZ2 LYS 506 16.373 10.502 6.996 127 HZ3 LYS 506 HZ3 LYS 506 15.978 11.497 5.747 128 H GLN 507 H GLN 507 8.750 7.946 4.445 129 HA GLN 507 HA GLN 507 7.179 10.370 5.027 130 HB2 GLN 507 HB2 GLN 507 6.542 8.423 2.823 131 HB3 GLN 507 HB3 GLN 507 6.387 10.189 2.843 132 HG2 GLN 507 HG2 GLN 507 8.921 8.528 2.559 133 HG3 GLN 507 HG3 GLN 507 8.156 9.517 1.321 134 HE21 GLN 507 HE21 GLN 507 10.926 9.610 2.381 135 HE22 GLN 507 HE22 GLN 507 11.153 11.215 3.002 136 H LEU 508 H LEU 508 7.207 7.529 6.454 137 HA LEU 508 HA LEU 508 4.285 6.892 6.210 138 HB2 LEU 508 HB2 LEU 508 6.602 5.037 6.788 139 HB3 LEU 508 HB3 LEU 508 4.927 4.563 6.464 140 HG LEU 508 HG LEU 508 6.790 5.904 4.443 141 HD11 LEU 508 HD11 LEU 508 7.542 3.633 5.134 142 HD12 LEU 508 HD12 LEU 508 5.942 2.993 4.710 143 HD13 LEU 508 HD13 LEU 508 6.984 3.684 3.447 144 HD21 LEU 508 HD21 LEU 508 4.405 6.317 3.983 145 HD22 LEU 508 HD22 LEU 508 5.067 5.155 2.815 146 HD23 LEU 508 HD23 LEU 508 4.055 4.586 4.164 147 HA PRO 509 HA PRO 509 4.222 7.033 10.698 148 HB2 PRO 509 HB2 PRO 509 2.196 5.229 11.191 149 HB3 PRO 509 HB3 PRO 509 1.938 6.913 10.670 150 HG2 PRO 509 HG2 PRO 509 1.939 4.379 9.015 151 HG3 PRO 509 HG3 PRO 509 0.809 5.766 8.895 152 HD2 PRO 509 HD2 PRO 509 2.934 5.411 7.186 153 HD3 PRO 509 HD3 PRO 509 2.361 7.035 7.675 154 H ALA 510 H ALA 510 4.605 5.666 12.510 155 HA ALA 510 HA ALA 510 6.691 3.834 12.121 156 HB1 ALA 510 HB1 ALA 510 4.804 4.294 14.464 157 HB2 ALA 510 HB2 ALA 510 6.390 3.474 14.569 158 HB3 ALA 510 HB3 ALA 510 6.290 5.202 14.128 159 H ASP 511 H ASP 511 3.178 3.227 12.143 160 HA ASP 511 HA ASP 511 3.599 0.383 12.692 161 HB2 ASP 511 HB2 ASP 511 1.221 0.171 12.592 162 HB3 ASP 511 HB3 ASP 511 1.567 1.656 13.491 163 H ILE 512 H ILE 512 3.878 2.381 9.956 164 HA ILE 512 HA ILE 512 3.595 -0.001 8.179 165 HB ILE 512 HB ILE 512 3.987 2.946 7.552 166 HG12 ILE 512 HG12 ILE 512 1.646 1.007 7.367 167 HG13 ILE 512 HG13 ILE 512 1.764 2.445 8.387 168 HG21 ILE 512 HG21 ILE 512 3.674 2.282 5.199 169 HG22 ILE 512 HG22 ILE 512 5.084 1.459 5.875 170 HG23 ILE 512 HG23 ILE 512 3.557 0.570 5.683 171 HD11 ILE 512 HD11 ILE 512 1.836 3.852 6.294 172 HD12 ILE 512 HD12 ILE 512 1.536 2.375 5.346 173 HD13 ILE 512 HD13 ILE 512 0.329 2.942 6.515 174 H GLN 513 H GLN 513 5.971 1.967 9.900 175 HA GLN 513 HA GLN 513 8.170 1.306 8.173 176 HB2 GLN 513 HB2 GLN 513 8.216 1.777 11.190 177 HB3 GLN 513 HB3 GLN 513 9.588 1.917 10.088 178 HG2 GLN 513 HG2 GLN 513 7.142 3.719 10.175 179 HG3 GLN 513 HG3 GLN 513 8.784 4.116 10.684 180 HE21 GLN 513 HE21 GLN 513 9.554 5.613 9.270 181 HE22 GLN 513 HE22 GLN 513 9.436 5.461 7.517 182 H GLU 514 H GLU 514 6.606 -0.428 10.854 183 HA GLU 514 HA GLU 514 8.596 -2.488 11.022 184 HB2 GLU 514 HB2 GLU 514 6.904 -3.676 12.340 185 HB3 GLU 514 HB3 GLU 514 6.996 -1.977 12.830 186 HG2 GLU 514 HG2 GLU 514 5.009 -1.474 11.425 187 HG3 GLU 514 HG3 GLU 514 4.917 -3.171 10.938 188 H GLU 515 H GLU 515 6.589 -1.720 8.462 189 HA GLU 515 HA GLU 515 6.729 -4.522 7.496 190 HB2 GLU 515 HB2 GLU 515 4.652 -3.997 6.141 191 HB3 GLU 515 HB3 GLU 515 4.465 -4.213 7.897 192 HG2 GLU 515 HG2 GLU 515 4.312 -1.826 8.209 193 HG3 GLU 515 HG3 GLU 515 4.640 -1.553 6.473 194 H ILE 516 H ILE 516 8.124 -1.566 7.117 195 HA ILE 516 HA ILE 516 8.775 -2.255 4.268 196 HB ILE 516 HB ILE 516 9.754 0.188 5.775 197 HG12 ILE 516 HG12 ILE 516 7.410 0.580 5.716 198 HG13 ILE 516 HG13 ILE 516 8.135 1.512 4.404 199 HG21 ILE 516 HG21 ILE 516 9.654 -0.633 2.846 200 HG22 ILE 516 HG22 ILE 516 10.170 0.967 3.412 201 HG23 ILE 516 HG23 ILE 516 11.096 -0.469 3.869 202 HD11 ILE 516 HD11 ILE 516 6.638 -1.115 4.132 203 HD12 ILE 516 HD12 ILE 516 6.107 0.499 3.621 204 HD13 ILE 516 HD13 ILE 516 7.475 -0.284 2.790 205 H LEU 517 H LEU 517 10.088 -1.627 7.532 206 HA LEU 517 HA LEU 517 12.747 -2.561 7.105 207 HB2 LEU 517 HB2 LEU 517 10.872 -2.553 9.504 208 HB3 LEU 517 HB3 LEU 517 12.564 -3.019 9.628 209 HG LEU 517 HG LEU 517 11.681 -0.330 8.492 210 HD11 LEU 517 HD11 LEU 517 10.874 -0.579 10.826 211 HD12 LEU 517 HD12 LEU 517 12.532 -0.988 11.340 212 HD13 LEU 517 HD13 LEU 517 12.172 0.629 10.683 213 HD21 LEU 517 HD21 LEU 517 14.320 -1.213 9.747 214 HD22 LEU 517 HD22 LEU 517 14.038 -1.128 7.999 215 HD23 LEU 517 HD23 LEU 517 13.978 0.348 8.980 216 H SER 518 H SER 518 9.840 -4.096 6.714 217 HA SER 518 HA SER 518 11.095 -6.776 6.655 218 HB2 SER 518 HB2 SER 518 8.405 -6.192 7.958 219 HB3 SER 518 HB3 SER 518 9.140 -7.797 7.736 220 HG SER 518 HG SER 518 9.496 -6.924 9.829 221 H GLY 519 H GLY 519 10.357 -4.723 4.658 222 HA2 GLY 519 HA2 GLY 519 8.284 -6.193 3.090 223 HA3 GLY 519 HA3 GLY 519 8.394 -4.419 3.130 224 H LYS 520 H LYS 520 10.977 -6.816 3.066 225 HA LYS 520 HA LYS 520 12.681 -5.303 1.409 226 HB2 LYS 520 HB2 LYS 520 12.735 -8.212 2.291 227 HB3 LYS 520 HB3 LYS 520 14.108 -7.332 1.585 228 HG2 LYS 520 HG2 LYS 520 14.093 -5.727 3.431 229 HG3 LYS 520 HG3 LYS 520 12.648 -6.477 4.128 230 HD2 LYS 520 HD2 LYS 520 13.866 -8.570 4.514 231 HD3 LYS 520 HD3 LYS 520 15.323 -7.879 3.758 232 HE2 LYS 520 HE2 LYS 520 15.357 -6.102 5.494 233 HE3 LYS 520 HE3 LYS 520 13.913 -6.808 6.241 234 HZ1 LYS 520 HZ1 LYS 520 15.915 -7.517 7.339 235 HZ2 LYS 520 HZ2 LYS 520 15.181 -8.811 6.641 236 HZ3 LYS 520 HZ3 LYS 520 16.518 -8.150 5.946 237 H SER 521 H SER 521 9.999 -6.608 0.136 238 HA SER 521 HA SER 521 11.304 -7.176 -2.459 239 HB2 SER 521 HB2 SER 521 9.229 -8.950 -1.115 240 HB3 SER 521 HB3 SER 521 9.864 -9.136 -2.763 241 HG SER 521 HG SER 521 10.937 -10.479 -1.250 242 H ARG 522 H ARG 522 9.610 -7.419 -4.130 243 HA ARG 522 HA ARG 522 8.084 -6.479 -5.461 244 HB2 ARG 522 HB2 ARG 522 6.687 -7.573 -3.486 245 HB3 ARG 522 HB3 ARG 522 6.265 -5.889 -3.148 246 HG2 ARG 522 HG2 ARG 522 4.593 -6.351 -4.643 247 HG3 ARG 522 HG3 ARG 522 5.833 -5.910 -5.830 248 HD2 ARG 522 HD2 ARG 522 5.203 -8.728 -4.855 249 HD3 ARG 522 HD3 ARG 522 4.634 -8.035 -6.382 250 HE ARG 522 HE ARG 522 7.445 -7.816 -6.397 251 HH11 ARG 522 HH11 ARG 522 4.996 -10.364 -6.324 252 HH12 ARG 522 HH12 ARG 522 6.005 -11.512 -7.170 253 HH21 ARG 522 HH21 ARG 522 8.735 -9.329 -7.496 254 HH22 ARG 522 HH22 ARG 522 8.119 -10.930 -7.831 255 H GLU 523 H GLU 523 9.946 -4.601 -3.727 256 HA GLU 523 HA GLU 523 8.996 -2.227 -5.157 257 HB2 GLU 523 HB2 GLU 523 9.166 -0.782 -3.152 258 HB3 GLU 523 HB3 GLU 523 7.848 -1.967 -3.050 259 HG2 GLU 523 HG2 GLU 523 9.381 -3.431 -1.670 260 HG3 GLU 523 HG3 GLU 523 10.544 -2.096 -1.647 261 H ASN 524 H ASN 524 10.687 -0.853 -5.726 262 HA ASN 524 HA ASN 524 13.421 -1.518 -4.891 263 HB2 ASN 524 HB2 ASN 524 12.402 -1.902 -7.758 264 HB3 ASN 524 HB3 ASN 524 14.087 -2.046 -7.243 265 HD21 ASN 524 HD21 ASN 524 10.944 -3.573 -7.377 266 HD22 ASN 524 HD22 ASN 524 11.446 -5.139 -6.760 267 H LEU 525 H LEU 525 11.751 0.787 -4.720 268 HA LEU 525 HA LEU 525 11.679 2.997 -5.093 269 HB2 LEU 525 HB2 LEU 525 13.643 4.149 -4.726 270 HB3 LEU 525 HB3 LEU 525 13.665 2.651 -3.810 271 HG LEU 525 HG LEU 525 15.202 1.679 -5.593 272 HD11 LEU 525 HD11 LEU 525 15.166 4.603 -6.442 273 HD12 LEU 525 HD12 LEU 525 16.441 3.443 -6.928 274 HD13 LEU 525 HD13 LEU 525 14.759 3.193 -7.446 275 HD21 LEU 525 HD21 LEU 525 17.157 2.914 -4.700 276 HD22 LEU 525 HD22 LEU 525 16.062 4.196 -4.108 277 HD23 LEU 525 HD23 LEU 525 15.974 2.559 -3.420 278 H LYS 526 H LYS 526 11.957 1.177 -7.652 279 HA LYS 526 HA LYS 526 12.252 3.417 -9.605 280 HB2 LYS 526 HB2 LYS 526 12.673 0.425 -9.697 281 HB3 LYS 526 HB3 LYS 526 12.648 1.409 -11.185 282 HG2 LYS 526 HG2 LYS 526 14.585 2.707 -10.344 283 HG3 LYS 526 HG3 LYS 526 14.645 1.688 -8.890 284 HD2 LYS 526 HD2 LYS 526 14.945 0.718 -11.749 285 HD3 LYS 526 HD3 LYS 526 16.264 0.919 -10.579 286 HE2 LYS 526 HE2 LYS 526 15.195 -0.777 -9.100 287 HE3 LYS 526 HE3 LYS 526 13.891 -0.970 -10.283 288 HZ1 LYS 526 HZ1 LYS 526 16.731 -1.563 -10.763 289 HZ2 LYS 526 HZ2 LYS 526 15.531 -2.661 -10.549 290 HZ3 LYS 526 HZ3 LYS 526 15.528 -1.700 -11.879 291 H1 MET 1 H1 MET 1 -13.448 10.816 -14.501 292 H2 MET 1 H2 MET 1 -14.798 11.566 -13.939 293 H3 MET 1 H3 MET 1 -14.573 9.954 -13.677 294 HA MET 1 HA MET 1 -12.907 12.113 -12.562 295 HB2 MET 1 HB2 MET 1 -15.044 12.111 -11.430 296 HB3 MET 1 HB3 MET 1 -15.063 10.336 -11.344 297 HG2 MET 1 HG2 MET 1 -13.161 10.332 -9.832 298 HG3 MET 1 HG3 MET 1 -12.995 12.085 -9.974 299 HE1 MET 1 HE1 MET 1 -12.940 12.387 -7.360 300 HE2 MET 1 HE2 MET 1 -14.117 11.625 -6.262 301 HE3 MET 1 HE3 MET 1 -13.013 10.615 -7.222 302 H GLN 2 H GLN 2 -11.098 11.565 -11.515 303 HA GLN 2 HA GLN 2 -10.556 8.795 -10.823 304 HB2 GLN 2 HB2 GLN 2 -8.635 8.527 -12.264 305 HB3 GLN 2 HB3 GLN 2 -9.978 9.062 -13.295 306 HG2 GLN 2 HG2 GLN 2 -8.983 11.476 -12.651 307 HG3 GLN 2 HG3 GLN 2 -7.532 10.556 -12.347 308 HE21 GLN 2 HE21 GLN 2 -6.373 11.516 -14.088 309 HE22 GLN 2 HE22 GLN 2 -6.758 11.188 -15.762 310 H ILE 3 H ILE 3 -8.247 8.700 -9.902 311 HA ILE 3 HA ILE 3 -7.306 11.271 -8.784 312 HB ILE 3 HB ILE 3 -7.199 10.509 -6.573 313 HG12 ILE 3 HG12 ILE 3 -7.593 7.727 -7.677 314 HG13 ILE 3 HG13 ILE 3 -6.341 8.379 -6.634 315 HG21 ILE 3 HG21 ILE 3 -9.873 9.512 -7.610 316 HG22 ILE 3 HG22 ILE 3 -9.512 10.082 -5.963 317 HG23 ILE 3 HG23 ILE 3 -9.439 11.217 -7.317 318 HD11 ILE 3 HD11 ILE 3 -8.028 8.626 -4.801 319 HD12 ILE 3 HD12 ILE 3 -9.224 7.819 -5.853 320 HD13 ILE 3 HD13 ILE 3 -7.778 6.943 -5.325 321 H PHE 4 H PHE 4 -5.147 10.620 -7.472 322 HA PHE 4 HA PHE 4 -3.666 8.588 -9.087 323 HB2 PHE 4 HB2 PHE 4 -2.599 11.258 -8.090 324 HB3 PHE 4 HB3 PHE 4 -1.745 10.063 -9.016 325 HD1 PHE 4 HD1 PHE 4 -2.865 9.447 -11.395 326 HD2 PHE 4 HD2 PHE 4 -3.748 13.013 -9.154 327 HE1 PHE 4 HE1 PHE 4 -3.732 10.532 -13.447 328 HE2 PHE 4 HE2 PHE 4 -4.664 14.070 -11.198 329 HZ PHE 4 HZ PHE 4 -4.629 12.845 -13.355 330 H VAL 5 H VAL 5 -2.610 7.127 -7.890 331 HA VAL 5 HA VAL 5 -2.355 7.706 -4.968 332 HB VAL 5 HB VAL 5 -3.188 5.085 -6.260 333 HG11 VAL 5 HG11 VAL 5 -3.549 4.399 -3.899 334 HG12 VAL 5 HG12 VAL 5 -1.847 4.803 -4.225 335 HG13 VAL 5 HG13 VAL 5 -2.887 5.955 -3.351 336 HG21 VAL 5 HG21 VAL 5 -4.742 7.194 -4.695 337 HG22 VAL 5 HG22 VAL 5 -5.033 6.709 -6.369 338 HG23 VAL 5 HG23 VAL 5 -5.355 5.566 -5.056 339 H LYS 6 H LYS 6 -0.247 7.959 -4.573 340 HA LYS 6 HA LYS 6 1.674 6.798 -6.416 341 HB2 LYS 6 HB2 LYS 6 1.692 9.183 -5.514 342 HB3 LYS 6 HB3 LYS 6 2.254 8.499 -3.976 343 HG2 LYS 6 HG2 LYS 6 4.200 7.479 -5.178 344 HG3 LYS 6 HG3 LYS 6 3.568 8.123 -6.709 345 HD2 LYS 6 HD2 LYS 6 5.305 9.594 -6.013 346 HD3 LYS 6 HD3 LYS 6 3.767 10.438 -5.753 347 HE2 LYS 6 HE2 LYS 6 3.843 9.765 -3.349 348 HE3 LYS 6 HE3 LYS 6 5.393 8.952 -3.644 349 HZ1 LYS 6 HZ1 LYS 6 5.708 11.157 -2.748 350 HZ2 LYS 6 HZ2 LYS 6 6.316 11.074 -4.269 351 HZ3 LYS 6 HZ3 LYS 6 4.884 11.831 -4.002 352 H THR 7 H THR 7 3.040 5.153 -6.068 353 HA THR 7 HA THR 7 2.645 3.395 -3.804 354 HB THR 7 HB THR 7 4.348 2.027 -4.965 355 HG1 THR 7 HG1 THR 7 5.348 2.861 -6.775 356 HG21 THR 7 HG21 THR 7 2.393 3.277 -6.943 357 HG22 THR 7 HG22 THR 7 3.162 1.677 -7.071 358 HG23 THR 7 HG23 THR 7 1.987 1.997 -5.774 359 H LEU 8 H LEU 8 4.662 2.422 -2.767 360 HA LEU 8 HA LEU 8 6.053 4.341 -1.216 361 HB2 LEU 8 HB2 LEU 8 5.479 1.997 -0.648 362 HB3 LEU 8 HB3 LEU 8 6.640 1.404 -1.826 363 HG LEU 8 HG LEU 8 7.232 1.377 0.659 364 HD11 LEU 8 HD11 LEU 8 9.581 1.702 0.270 365 HD12 LEU 8 HD12 LEU 8 8.868 0.986 -1.183 366 HD13 LEU 8 HD13 LEU 8 9.284 2.714 -1.153 367 HD21 LEU 8 HD21 LEU 8 7.837 4.318 0.155 368 HD22 LEU 8 HD22 LEU 8 6.526 3.676 1.170 369 HD23 LEU 8 HD23 LEU 8 8.229 3.384 1.608 370 H THR 9 H THR 9 6.636 3.142 -4.455 371 HA THR 9 HA THR 9 9.548 3.553 -4.282 372 HB THR 9 HB THR 9 9.481 2.620 -6.600 373 HG1 THR 9 HG1 THR 9 7.394 3.279 -7.151 374 HG21 THR 9 HG21 THR 9 9.724 1.129 -4.617 375 HG22 THR 9 HG22 THR 9 7.953 0.983 -4.525 376 HG23 THR 9 HG23 THR 9 8.822 0.343 -5.936 377 H GLY 10 H GLY 10 6.742 5.369 -5.095 378 HA2 GLY 10 HA2 GLY 10 6.957 7.685 -5.463 379 HA3 GLY 10 HA3 GLY 10 8.559 7.424 -6.186 380 H LYS 11 H LYS 11 5.728 5.493 -7.064 381 HA LYS 11 HA LYS 11 5.452 7.028 -9.619 382 HB2 LYS 11 HB2 LYS 11 6.481 4.777 -9.831 383 HB3 LYS 11 HB3 LYS 11 5.072 4.064 -9.032 384 HG2 LYS 11 HG2 LYS 11 3.601 5.108 -10.857 385 HG3 LYS 11 HG3 LYS 11 5.098 5.528 -11.710 386 HD2 LYS 11 HD2 LYS 11 4.176 3.481 -12.614 387 HD3 LYS 11 HD3 LYS 11 5.681 3.097 -11.727 388 HE2 LYS 11 HE2 LYS 11 4.339 2.369 -9.788 389 HE3 LYS 11 HE3 LYS 11 2.854 2.827 -10.643 390 HZ1 LYS 11 HZ1 LYS 11 4.746 0.722 -11.474 391 HZ2 LYS 11 HZ2 LYS 11 3.240 0.482 -10.862 392 HZ3 LYS 11 HZ3 LYS 11 3.416 1.183 -12.325 393 H THR 12 H THR 12 3.290 7.420 -10.300 394 HA THR 12 HA THR 12 1.217 6.561 -8.316 395 HB THR 12 HB THR 12 1.884 9.122 -8.573 396 HG1 THR 12 HG1 THR 12 -0.158 9.479 -7.777 397 HG21 THR 12 HG21 THR 12 1.325 9.275 -10.997 398 HG22 THR 12 HG22 THR 12 -0.336 8.735 -10.629 399 HG23 THR 12 HG23 THR 12 0.247 10.279 -9.992 400 H ILE 13 H ILE 13 -0.921 6.285 -9.162 401 HA ILE 13 HA ILE 13 -0.947 5.395 -12.009 402 HB ILE 13 HB ILE 13 -1.921 3.851 -9.581 403 HG12 ILE 13 HG12 ILE 13 0.456 3.308 -11.430 404 HG13 ILE 13 HG13 ILE 13 0.539 3.843 -9.743 405 HG21 ILE 13 HG21 ILE 13 -3.304 3.527 -11.633 406 HG22 ILE 13 HG22 ILE 13 -1.841 3.058 -12.527 407 HG23 ILE 13 HG23 ILE 13 -2.436 2.050 -11.189 408 HD11 ILE 13 HD11 ILE 13 -0.620 1.750 -9.041 409 HD12 ILE 13 HD12 ILE 13 -0.549 1.181 -10.730 410 HD13 ILE 13 HD13 ILE 13 0.948 1.476 -9.824 411 H THR 14 H THR 14 -2.793 5.949 -13.054 412 HA THR 14 HA THR 14 -4.628 7.749 -11.707 413 HB THR 14 HB THR 14 -4.837 6.545 -14.498 414 HG1 THR 14 HG1 THR 14 -3.606 8.336 -15.129 415 HG21 THR 14 HG21 THR 14 -6.802 7.793 -13.675 416 HG22 THR 14 HG22 THR 14 -5.747 9.169 -13.256 417 HG23 THR 14 HG23 THR 14 -5.972 8.690 -14.960 418 H LEU 15 H LEU 15 -6.595 7.221 -10.825 419 HA LEU 15 HA LEU 15 -7.699 4.512 -11.440 420 HB2 LEU 15 HB2 LEU 15 -7.329 5.705 -8.680 421 HB3 LEU 15 HB3 LEU 15 -8.081 4.146 -9.046 422 HG LEU 15 HG LEU 15 -5.196 4.857 -9.703 423 HD11 LEU 15 HD11 LEU 15 -6.308 3.178 -7.411 424 HD12 LEU 15 HD12 LEU 15 -4.591 3.511 -7.752 425 HD13 LEU 15 HD13 LEU 15 -5.676 4.831 -7.249 426 HD21 LEU 15 HD21 LEU 15 -6.146 3.013 -11.080 427 HD22 LEU 15 HD22 LEU 15 -4.876 2.466 -9.961 428 HD23 LEU 15 HD23 LEU 15 -6.589 2.156 -9.585 429 H GLU 16 H GLU 16 -9.795 4.496 -11.751 430 HA GLU 16 HA GLU 16 -11.379 6.971 -11.446 431 HB2 GLU 16 HB2 GLU 16 -11.512 5.798 -13.555 432 HB3 GLU 16 HB3 GLU 16 -11.806 4.249 -12.744 433 HG2 GLU 16 HG2 GLU 16 -13.941 5.034 -11.906 434 HG3 GLU 16 HG3 GLU 16 -13.687 6.636 -12.623 435 H VAL 17 H VAL 17 -12.698 7.340 -9.852 436 HA VAL 17 HA VAL 17 -13.958 5.173 -8.306 437 HB VAL 17 HB VAL 17 -13.242 6.167 -6.167 438 HG11 VAL 17 HG11 VAL 17 -10.953 5.322 -6.115 439 HG12 VAL 17 HG12 VAL 17 -11.983 4.238 -7.071 440 HG13 VAL 17 HG13 VAL 17 -10.860 5.362 -7.885 441 HG21 VAL 17 HG21 VAL 17 -11.321 7.809 -7.870 442 HG22 VAL 17 HG22 VAL 17 -12.729 8.452 -6.992 443 HG23 VAL 17 HG23 VAL 17 -11.371 7.762 -6.090 444 H GLU 18 H GLU 18 -15.370 6.317 -6.534 445 HA GLU 18 HA GLU 18 -16.430 8.944 -7.448 446 HB2 GLU 18 HB2 GLU 18 -18.004 6.449 -6.685 447 HB3 GLU 18 HB3 GLU 18 -18.722 8.025 -7.010 448 HG2 GLU 18 HG2 GLU 18 -17.123 6.398 -9.037 449 HG3 GLU 18 HG3 GLU 18 -18.880 6.397 -8.879 450 HA PRO 19 HA PRO 19 -16.415 9.877 -3.115 451 HB2 PRO 19 HB2 PRO 19 -19.251 10.810 -3.287 452 HB3 PRO 19 HB3 PRO 19 -17.804 11.698 -2.738 453 HG2 PRO 19 HG2 PRO 19 -18.917 12.200 -5.179 454 HG3 PRO 19 HG3 PRO 19 -17.138 12.204 -4.937 455 HD2 PRO 19 HD2 PRO 19 -18.866 10.019 -6.098 456 HD3 PRO 19 HD3 PRO 19 -17.275 10.631 -6.657 457 H SER 20 H SER 20 -18.136 7.326 -4.318 458 HA SER 20 HA SER 20 -19.110 6.549 -1.614 459 HB2 SER 20 HB2 SER 20 -20.987 7.238 -3.093 460 HB3 SER 20 HB3 SER 20 -20.513 5.971 -4.245 461 HG SER 20 HG SER 20 -22.150 5.294 -2.784 462 H ASP 21 H ASP 21 -17.128 5.879 -4.319 463 HA ASP 21 HA ASP 21 -16.955 2.985 -3.883 464 HB2 ASP 21 HB2 ASP 21 -15.205 4.960 -5.350 465 HB3 ASP 21 HB3 ASP 21 -14.978 3.206 -5.372 466 H THR 22 H THR 22 -16.744 3.220 -1.627 467 HA THR 22 HA THR 22 -14.603 4.657 -0.345 468 HB THR 22 HB THR 22 -16.604 4.213 0.859 469 HG1 THR 22 HG1 THR 22 -15.712 3.383 2.697 470 HG21 THR 22 HG21 THR 22 -17.420 2.214 -0.155 471 HG22 THR 22 HG22 THR 22 -16.028 1.275 0.453 472 HG23 THR 22 HG23 THR 22 -17.244 1.950 1.589 473 H ILE 23 H ILE 23 -13.194 3.177 1.323 474 HA ILE 23 HA ILE 23 -11.059 2.531 -0.307 475 HB ILE 23 HB ILE 23 -11.463 1.438 2.485 476 HG12 ILE 23 HG12 ILE 23 -12.115 3.730 2.644 477 HG13 ILE 23 HG13 ILE 23 -10.456 3.621 3.234 478 HG21 ILE 23 HG21 ILE 23 -9.453 0.681 1.330 479 HG22 ILE 23 HG22 ILE 23 -9.007 2.354 0.927 480 HG23 ILE 23 HG23 ILE 23 -9.020 1.816 2.624 481 HD11 ILE 23 HD11 ILE 23 -9.626 4.499 1.080 482 HD12 ILE 23 HD12 ILE 23 -11.300 4.578 0.457 483 HD13 ILE 23 HD13 ILE 23 -10.820 5.595 1.817 484 H GLU 24 H GLU 24 -13.532 0.202 0.919 485 HA GLU 24 HA GLU 24 -11.951 -2.082 0.180 486 HB2 GLU 24 HB2 GLU 24 -13.948 -3.369 0.496 487 HB3 GLU 24 HB3 GLU 24 -13.870 -2.130 1.765 488 HG2 GLU 24 HG2 GLU 24 -15.460 -0.727 0.473 489 HG3 GLU 24 HG3 GLU 24 -15.546 -1.973 -0.778 490 H ASN 25 H ASN 25 -13.882 0.170 -1.663 491 HA ASN 25 HA ASN 25 -14.050 -1.519 -4.022 492 HB2 ASN 25 HB2 ASN 25 -14.485 1.460 -3.628 493 HB3 ASN 25 HB3 ASN 25 -14.864 0.587 -5.097 494 HD21 ASN 25 HD21 ASN 25 -15.778 1.260 -1.891 495 HD22 ASN 25 HD22 ASN 25 -17.293 0.342 -1.843 496 H VAL 26 H VAL 26 -12.107 1.194 -2.755 497 HA VAL 26 HA VAL 26 -10.599 1.850 -5.101 498 HB VAL 26 HB VAL 26 -10.008 2.151 -2.121 499 HG11 VAL 26 HG11 VAL 26 -8.687 3.409 -4.550 500 HG12 VAL 26 HG12 VAL 26 -8.457 3.959 -2.873 501 HG13 VAL 26 HG13 VAL 26 -7.950 2.322 -3.344 502 HG21 VAL 26 HG21 VAL 26 -10.827 4.450 -2.430 503 HG22 VAL 26 HG22 VAL 26 -11.198 4.100 -4.142 504 HG23 VAL 26 HG23 VAL 26 -12.079 3.270 -2.839 505 H LYS 27 H LYS 27 -9.966 -0.343 -2.327 506 HA LYS 27 HA LYS 27 -7.359 -1.063 -3.057 507 HB2 LYS 27 HB2 LYS 27 -9.627 -2.452 -1.601 508 HB3 LYS 27 HB3 LYS 27 -8.021 -3.189 -1.785 509 HG2 LYS 27 HG2 LYS 27 -6.940 -1.383 -0.625 510 HG3 LYS 27 HG3 LYS 27 -8.411 -0.398 -0.631 511 HD2 LYS 27 HD2 LYS 27 -9.535 -1.936 0.869 512 HD3 LYS 27 HD3 LYS 27 -8.193 -3.106 0.742 513 HE2 LYS 27 HE2 LYS 27 -6.657 -1.491 1.734 514 HE3 LYS 27 HE3 LYS 27 -7.932 -0.278 1.857 515 HZ1 LYS 27 HZ1 LYS 27 -7.643 -1.431 3.941 516 HZ2 LYS 27 HZ2 LYS 27 -9.133 -1.742 3.327 517 HZ3 LYS 27 HZ3 LYS 27 -7.958 -2.884 3.230 518 H ALA 28 H ALA 28 -10.447 -1.961 -4.568 519 HA ALA 28 HA ALA 28 -9.246 -4.197 -6.025 520 HB1 ALA 28 HB1 ALA 28 -11.368 -4.254 -7.219 521 HB2 ALA 28 HB2 ALA 28 -11.667 -4.144 -5.468 522 HB3 ALA 28 HB3 ALA 28 -11.858 -2.708 -6.506 523 H LYS 29 H LYS 29 -9.645 -0.704 -6.464 524 HA LYS 29 HA LYS 29 -9.197 -0.650 -9.312 525 HB2 LYS 29 HB2 LYS 29 -8.971 1.376 -7.063 526 HB3 LYS 29 HB3 LYS 29 -8.377 1.756 -8.670 527 HG2 LYS 29 HG2 LYS 29 -10.580 2.617 -8.426 528 HG3 LYS 29 HG3 LYS 29 -10.615 1.316 -9.632 529 HD2 LYS 29 HD2 LYS 29 -11.627 -0.211 -8.070 530 HD3 LYS 29 HD3 LYS 29 -11.270 0.885 -6.712 531 HE2 LYS 29 HE2 LYS 29 -13.646 0.943 -7.301 532 HE3 LYS 29 HE3 LYS 29 -12.876 2.516 -7.534 533 HZ1 LYS 29 HZ1 LYS 29 -12.754 2.079 -9.868 534 HZ2 LYS 29 HZ2 LYS 29 -13.425 0.582 -9.686 535 HZ3 LYS 29 HZ3 LYS 29 -14.306 1.931 -9.368 536 H ILE 30 H ILE 30 -7.064 -0.741 -6.448 537 HA ILE 30 HA ILE 30 -4.679 -0.234 -8.085 538 HB ILE 30 HB ILE 30 -5.095 -0.964 -5.156 539 HG12 ILE 30 HG12 ILE 30 -4.433 1.664 -6.557 540 HG13 ILE 30 HG13 ILE 30 -6.003 1.236 -5.849 541 HG21 ILE 30 HG21 ILE 30 -2.563 -0.041 -6.589 542 HG22 ILE 30 HG22 ILE 30 -2.737 -0.320 -4.838 543 HG23 ILE 30 HG23 ILE 30 -2.854 -1.680 -5.960 544 HD11 ILE 30 HD11 ILE 30 -4.893 1.049 -3.612 545 HD12 ILE 30 HD12 ILE 30 -3.387 1.655 -4.354 546 HD13 ILE 30 HD13 ILE 30 -4.836 2.678 -4.318 547 H GLN 31 H GLN 31 -6.449 -2.970 -6.652 548 HA GLN 31 HA GLN 31 -4.445 -4.961 -7.130 549 HB2 GLN 31 HB2 GLN 31 -6.371 -5.438 -5.701 550 HB3 GLN 31 HB3 GLN 31 -7.497 -5.053 -7.022 551 HG2 GLN 31 HG2 GLN 31 -6.679 -6.919 -8.351 552 HG3 GLN 31 HG3 GLN 31 -5.426 -7.267 -7.180 553 HE21 GLN 31 HE21 GLN 31 -6.066 -9.343 -6.546 554 HE22 GLN 31 HE22 GLN 31 -7.588 -9.672 -5.744 555 H ASP 32 H ASP 32 -7.046 -3.521 -9.121 556 HA ASP 32 HA ASP 32 -6.858 -5.419 -11.230 557 HB2 ASP 32 HB2 ASP 32 -8.775 -3.910 -10.795 558 HB3 ASP 32 HB3 ASP 32 -7.765 -2.514 -11.077 559 H LYS 33 H LYS 33 -5.160 -2.486 -10.420 560 HA LYS 33 HA LYS 33 -3.962 -2.119 -13.059 561 HB2 LYS 33 HB2 LYS 33 -3.924 -0.759 -10.364 562 HB3 LYS 33 HB3 LYS 33 -2.812 -0.237 -11.649 563 HG2 LYS 33 HG2 LYS 33 -5.824 -0.459 -12.064 564 HG3 LYS 33 HG3 LYS 33 -5.043 1.021 -11.476 565 HD2 LYS 33 HD2 LYS 33 -3.611 1.088 -13.474 566 HD3 LYS 33 HD3 LYS 33 -4.429 -0.350 -14.123 567 HE2 LYS 33 HE2 LYS 33 -5.816 2.266 -13.397 568 HE3 LYS 33 HE3 LYS 33 -5.314 1.822 -15.032 569 HZ1 LYS 33 HZ1 LYS 33 -7.231 0.320 -13.370 570 HZ2 LYS 33 HZ2 LYS 33 -7.617 1.296 -14.639 571 HZ3 LYS 33 HZ3 LYS 33 -6.765 -0.089 -14.892 572 H GLU 34 H GLU 34 -3.004 -3.687 -10.054 573 HA GLU 34 HA GLU 34 -0.306 -4.083 -11.269 574 HB2 GLU 34 HB2 GLU 34 -0.976 -3.227 -8.435 575 HB3 GLU 34 HB3 GLU 34 0.602 -3.888 -8.886 576 HG2 GLU 34 HG2 GLU 34 -0.617 -1.461 -10.265 577 HG3 GLU 34 HG3 GLU 34 0.381 -1.331 -8.826 578 H GLY 35 H GLY 35 -2.829 -5.330 -9.039 579 HA2 GLY 35 HA2 GLY 35 -3.423 -7.659 -9.317 580 HA3 GLY 35 HA3 GLY 35 -1.713 -8.057 -9.539 581 H ILE 36 H ILE 36 -2.240 -5.651 -7.181 582 HA ILE 36 HA ILE 36 -1.237 -7.418 -5.089 583 HB ILE 36 HB ILE 36 -1.955 -4.461 -5.204 584 HG12 ILE 36 HG12 ILE 36 0.750 -5.868 -5.156 585 HG13 ILE 36 HG13 ILE 36 -0.040 -5.291 -6.634 586 HG21 ILE 36 HG21 ILE 36 -0.455 -5.999 -3.050 587 HG22 ILE 36 HG22 ILE 36 -0.776 -4.243 -3.069 588 HG23 ILE 36 HG23 ILE 36 -2.124 -5.387 -2.908 589 HD11 ILE 36 HD11 ILE 36 -0.049 -2.976 -5.721 590 HD12 ILE 36 HD12 ILE 36 0.818 -3.556 -4.279 591 HD13 ILE 36 HD13 ILE 36 1.594 -3.643 -5.872 592 HA PRO 37 HA PRO 37 -5.368 -8.338 -3.743 593 HB2 PRO 37 HB2 PRO 37 -4.817 -9.489 -1.302 594 HB3 PRO 37 HB3 PRO 37 -4.520 -10.293 -2.871 595 HG2 PRO 37 HG2 PRO 37 -2.558 -8.798 -1.134 596 HG3 PRO 37 HG3 PRO 37 -2.336 -10.388 -1.939 597 HD2 PRO 37 HD2 PRO 37 -1.373 -8.048 -2.989 598 HD3 PRO 37 HD3 PRO 37 -1.991 -9.352 -4.050 599 HA PRO 38 HA PRO 38 -6.524 -4.857 -1.310 600 HB2 PRO 38 HB2 PRO 38 -8.923 -5.701 -0.246 601 HB3 PRO 38 HB3 PRO 38 -8.691 -5.276 -1.972 602 HG2 PRO 38 HG2 PRO 38 -8.638 -8.030 -0.705 603 HG3 PRO 38 HG3 PRO 38 -9.510 -7.507 -2.189 604 HD2 PRO 38 HD2 PRO 38 -7.116 -8.773 -2.312 605 HD3 PRO 38 HD3 PRO 38 -7.518 -7.446 -3.445 606 H ASP 39 H ASP 39 -5.897 -7.957 0.065 607 HA ASP 39 HA ASP 39 -6.339 -7.062 2.805 608 HB2 ASP 39 HB2 ASP 39 -6.921 -9.345 2.022 609 HB3 ASP 39 HB3 ASP 39 -5.210 -9.658 1.712 610 H GLN 40 H GLN 40 -3.786 -6.725 0.557 611 HA GLN 40 HA GLN 40 -1.796 -6.596 2.782 612 HB2 GLN 40 HB2 GLN 40 -1.436 -7.333 -0.137 613 HB3 GLN 40 HB3 GLN 40 -0.103 -7.031 0.993 614 HG2 GLN 40 HG2 GLN 40 -0.848 -8.821 2.462 615 HG3 GLN 40 HG3 GLN 40 -2.278 -9.104 1.447 616 HE21 GLN 40 HE21 GLN 40 1.213 -8.609 0.549 617 HE22 GLN 40 HE22 GLN 40 1.336 -10.138 -0.294 618 H GLN 41 H GLN 41 -3.514 -4.674 0.460 619 HA GLN 41 HA GLN 41 -1.490 -2.676 0.055 620 HB2 GLN 41 HB2 GLN 41 -4.525 -2.605 -0.034 621 HB3 GLN 41 HB3 GLN 41 -3.484 -1.261 -0.542 622 HG2 GLN 41 HG2 GLN 41 -2.457 -2.621 -2.279 623 HG3 GLN 41 HG3 GLN 41 -3.341 -4.052 -1.721 624 HE21 GLN 41 HE21 GLN 41 -4.475 -4.371 -3.712 625 HE22 GLN 41 HE22 GLN 41 -5.801 -3.311 -4.120 626 H ARG 42 H ARG 42 -1.989 -0.406 0.674 627 HA ARG 42 HA ARG 42 -3.129 0.167 3.340 628 HB2 ARG 42 HB2 ARG 42 -0.297 0.725 2.362 629 HB3 ARG 42 HB3 ARG 42 -1.040 1.663 3.652 630 HG2 ARG 42 HG2 ARG 42 -0.619 -1.356 3.789 631 HG3 ARG 42 HG3 ARG 42 0.522 -0.149 4.400 632 HD2 ARG 42 HD2 ARG 42 -1.348 0.797 5.808 633 HD3 ARG 42 HD3 ARG 42 -2.302 -0.645 5.390 634 HE ARG 42 HE ARG 42 -0.201 -1.904 6.303 635 HH11 ARG 42 HH11 ARG 42 -1.496 1.119 7.662 636 HH12 ARG 42 HH12 ARG 42 -0.740 0.837 9.214 637 HH21 ARG 42 HH21 ARG 42 0.738 -2.191 8.355 638 HH22 ARG 42 HH22 ARG 42 0.432 -1.023 9.621 639 H LEU 43 H LEU 43 -3.843 2.489 3.330 640 HA LEU 43 HA LEU 43 -3.177 3.958 0.871 641 HB2 LEU 43 HB2 LEU 43 -5.198 2.574 0.401 642 HB3 LEU 43 HB3 LEU 43 -6.022 3.352 1.765 643 HG LEU 43 HG LEU 43 -5.768 5.535 0.679 644 HD11 LEU 43 HD11 LEU 43 -5.122 5.593 -1.762 645 HD12 LEU 43 HD12 LEU 43 -3.765 5.182 -0.706 646 HD13 LEU 43 HD13 LEU 43 -4.593 3.900 -1.625 647 HD21 LEU 43 HD21 LEU 43 -6.994 3.380 -1.112 648 HD22 LEU 43 HD22 LEU 43 -7.776 4.122 0.299 649 HD23 LEU 43 HD23 LEU 43 -7.415 5.108 -1.139 650 H ILE 44 H ILE 44 -2.517 5.896 1.503 651 HA ILE 44 HA ILE 44 -3.662 7.083 3.991 652 HB ILE 44 HB ILE 44 -0.770 6.985 3.066 653 HG12 ILE 44 HG12 ILE 44 -0.501 6.223 5.513 654 HG13 ILE 44 HG13 ILE 44 -2.246 5.984 5.534 655 HG21 ILE 44 HG21 ILE 44 -1.301 9.290 3.899 656 HG22 ILE 44 HG22 ILE 44 -1.946 8.580 5.394 657 HG23 ILE 44 HG23 ILE 44 -0.235 8.426 4.999 658 HD11 ILE 44 HD11 ILE 44 -0.345 4.637 3.560 659 HD12 ILE 44 HD12 ILE 44 -0.909 3.912 5.084 660 HD13 ILE 44 HD13 ILE 44 -2.070 4.252 3.805 661 H PHE 45 H PHE 45 -4.141 9.251 3.887 662 HA PHE 45 HA PHE 45 -2.918 11.049 1.988 663 HB2 PHE 45 HB2 PHE 45 -4.297 10.579 0.371 664 HB3 PHE 45 HB3 PHE 45 -5.563 9.859 1.330 665 HD1 PHE 45 HD1 PHE 45 -7.183 11.403 2.594 666 HD2 PHE 45 HD2 PHE 45 -4.478 12.813 -0.427 667 HE1 PHE 45 HE1 PHE 45 -8.599 13.423 2.262 668 HE2 PHE 45 HE2 PHE 45 -5.906 14.823 -0.769 669 HZ PHE 45 HZ PHE 45 -7.955 15.126 0.588 670 H ALA 46 H ALA 46 -3.704 13.299 2.311 671 HA ALA 46 HA ALA 46 -3.514 14.922 3.862 672 HB1 ALA 46 HB1 ALA 46 -5.970 14.649 3.879 673 HB2 ALA 46 HB2 ALA 46 -5.834 13.443 5.180 674 HB3 ALA 46 HB3 ALA 46 -5.363 15.131 5.476 675 H GLY 47 H GLY 47 -2.061 12.339 4.153 676 HA2 GLY 47 HA2 GLY 47 -0.501 11.397 5.483 677 HA3 GLY 47 HA3 GLY 47 -0.615 12.776 6.574 678 H LYS 48 H LYS 48 -3.459 10.754 5.790 679 HA LYS 48 HA LYS 48 -2.986 9.173 8.244 680 HB2 LYS 48 HB2 LYS 48 -5.285 9.444 9.032 681 HB3 LYS 48 HB3 LYS 48 -4.363 10.944 9.061 682 HG2 LYS 48 HG2 LYS 48 -6.481 11.533 8.336 683 HG3 LYS 48 HG3 LYS 48 -5.450 11.580 6.893 684 HD2 LYS 48 HD2 LYS 48 -6.411 9.409 6.153 685 HD3 LYS 48 HD3 LYS 48 -7.457 9.359 7.588 686 HE2 LYS 48 HE2 LYS 48 -7.436 11.544 5.474 687 HE3 LYS 48 HE3 LYS 48 -8.607 10.222 5.567 688 HZ1 LYS 48 HZ1 LYS 48 -9.281 11.059 7.720 689 HZ2 LYS 48 HZ2 LYS 48 -8.188 12.284 7.630 690 HZ3 LYS 48 HZ3 LYS 48 -9.442 12.234 6.578 691 H GLN 49 H GLN 49 -4.470 7.346 8.396 692 HA GLN 49 HA GLN 49 -4.536 6.121 5.689 693 HB2 GLN 49 HB2 GLN 49 -3.158 5.000 7.340 694 HB3 GLN 49 HB3 GLN 49 -4.530 4.874 8.460 695 HG2 GLN 49 HG2 GLN 49 -5.738 3.438 6.903 696 HG3 GLN 49 HG3 GLN 49 -4.510 3.680 5.650 697 HE21 GLN 49 HE21 GLN 49 -5.569 1.249 7.258 698 HE22 GLN 49 HE22 GLN 49 -4.100 0.451 7.788 699 H LEU 50 H LEU 50 -6.331 5.709 4.696 700 HA LEU 50 HA LEU 50 -8.869 6.554 5.812 701 HB2 LEU 50 HB2 LEU 50 -8.040 5.219 3.199 702 HB3 LEU 50 HB3 LEU 50 -9.680 5.749 3.570 703 HG LEU 50 HG LEU 50 -8.976 8.080 3.668 704 HD11 LEU 50 HD11 LEU 50 -6.696 7.964 4.537 705 HD12 LEU 50 HD12 LEU 50 -6.166 7.065 3.085 706 HD13 LEU 50 HD13 LEU 50 -6.688 8.758 2.964 707 HD21 LEU 50 HD21 LEU 50 -9.538 7.200 1.458 708 HD22 LEU 50 HD22 LEU 50 -8.173 8.326 1.305 709 HD23 LEU 50 HD23 LEU 50 -7.879 6.581 1.253 710 H GLU 51 H GLU 51 -10.822 5.074 5.879 711 HA GLU 51 HA GLU 51 -9.997 2.280 6.570 712 HB2 GLU 51 HB2 GLU 51 -11.748 4.248 8.040 713 HB3 GLU 51 HB3 GLU 51 -11.952 2.497 8.251 714 HG2 GLU 51 HG2 GLU 51 -9.629 2.256 8.933 715 HG3 GLU 51 HG3 GLU 51 -9.317 3.964 8.610 716 H ASP 52 H ASP 52 -11.431 0.651 6.228 717 HA ASP 52 HA ASP 52 -12.959 0.896 3.812 718 HB2 ASP 52 HB2 ASP 52 -12.711 -1.388 5.814 719 HB3 ASP 52 HB3 ASP 52 -13.349 -1.508 4.175 720 H GLY 53 H GLY 53 -13.781 1.924 6.813 721 HA2 GLY 53 HA2 GLY 53 -16.625 1.068 6.582 722 HA3 GLY 53 HA3 GLY 53 -15.805 1.495 8.099 723 H ARG 54 H ARG 54 -14.916 3.441 5.389 724 HA ARG 54 HA ARG 54 -16.717 5.654 6.240 725 HB2 ARG 54 HB2 ARG 54 -13.970 5.910 5.047 726 HB3 ARG 54 HB3 ARG 54 -14.896 7.149 5.898 727 HG2 ARG 54 HG2 ARG 54 -13.740 4.639 7.196 728 HG3 ARG 54 HG3 ARG 54 -12.945 6.221 7.182 729 HD2 ARG 54 HD2 ARG 54 -14.711 7.229 8.435 730 HD3 ARG 54 HD3 ARG 54 -15.707 5.750 8.341 731 HE ARG 54 HE ARG 54 -13.271 4.989 9.483 732 HH11 ARG 54 HH11 ARG 54 -15.915 7.183 10.319 733 HH12 ARG 54 HH12 ARG 54 -15.664 7.016 12.039 734 HH21 ARG 54 HH21 ARG 54 -12.938 4.817 11.689 735 HH22 ARG 54 HH22 ARG 54 -13.975 5.654 12.828 736 H THR 55 H THR 55 -15.563 7.270 4.051 737 HA THR 55 HA THR 55 -16.073 5.894 1.514 738 HB THR 55 HB THR 55 -17.619 7.928 0.924 739 HG1 THR 55 HG1 THR 55 -18.673 8.795 2.629 740 HG21 THR 55 HG21 THR 55 -18.293 5.466 1.155 741 HG22 THR 55 HG22 THR 55 -18.704 5.822 2.842 742 HG23 THR 55 HG23 THR 55 -19.584 6.636 1.522 743 H LEU 56 H LEU 56 -15.270 7.198 -0.305 744 HA LEU 56 HA LEU 56 -12.942 8.684 0.296 745 HB2 LEU 56 HB2 LEU 56 -14.698 8.492 -2.172 746 HB3 LEU 56 HB3 LEU 56 -13.237 9.490 -2.125 747 HG LEU 56 HG LEU 56 -13.310 6.496 -1.554 748 HD11 LEU 56 HD11 LEU 56 -12.372 8.076 -3.991 749 HD12 LEU 56 HD12 LEU 56 -12.156 6.328 -3.755 750 HD13 LEU 56 HD13 LEU 56 -13.791 7.002 -3.915 751 HD21 LEU 56 HD21 LEU 56 -10.988 8.436 -1.941 752 HD22 LEU 56 HD22 LEU 56 -11.412 7.607 -0.421 753 HD23 LEU 56 HD23 LEU 56 -10.840 6.672 -1.810 754 H SER 57 H SER 57 -16.320 9.579 0.155 755 HA SER 57 HA SER 57 -15.984 12.422 -0.033 756 HB2 SER 57 HB2 SER 57 -18.392 12.351 0.521 757 HB3 SER 57 HB3 SER 57 -17.987 11.134 -0.702 758 HG SER 57 HG SER 57 -19.308 10.304 0.951 759 H ASP 58 H ASP 58 -15.824 10.060 2.561 760 HA ASP 58 HA ASP 58 -16.303 11.928 4.723 761 HB2 ASP 58 HB2 ASP 58 -16.703 9.452 4.838 762 HB3 ASP 58 HB3 ASP 58 -14.949 9.206 4.794 763 H TYR 59 H TYR 59 -13.564 11.228 2.703 764 HA TYR 59 HA TYR 59 -11.832 12.707 4.642 765 HB2 TYR 59 HB2 TYR 59 -10.520 11.434 2.336 766 HB3 TYR 59 HB3 TYR 59 -10.016 11.541 4.015 767 HD1 TYR 59 HD1 TYR 59 -10.907 9.783 5.655 768 HD2 TYR 59 HD2 TYR 59 -11.582 9.621 1.419 769 HE1 TYR 59 HE1 TYR 59 -11.426 7.326 5.818 770 HE2 TYR 59 HE2 TYR 59 -12.191 7.212 1.597 771 HH TYR 59 HH TYR 59 -12.136 5.458 4.691 772 H ASN 60 H ASN 60 -13.892 13.586 2.507 773 HA ASN 60 HA ASN 60 -14.143 15.139 0.940 774 HB2 ASN 60 HB2 ASN 60 -13.703 17.146 1.795 775 HB3 ASN 60 HB3 ASN 60 -13.073 16.209 3.155 776 HD21 ASN 60 HD21 ASN 60 -10.677 15.662 3.064 777 HD22 ASN 60 HD22 ASN 60 -9.622 16.954 2.539 778 H ILE 61 H ILE 61 -12.119 13.005 0.228 779 HA ILE 61 HA ILE 61 -10.165 14.170 -1.498 780 HB ILE 61 HB ILE 61 -11.583 11.489 -1.393 781 HG12 ILE 61 HG12 ILE 61 -8.718 12.330 -0.802 782 HG13 ILE 61 HG13 ILE 61 -9.987 12.179 0.423 783 HG21 ILE 61 HG21 ILE 61 -9.892 10.659 -3.013 784 HG22 ILE 61 HG22 ILE 61 -10.918 11.889 -3.754 785 HG23 ILE 61 HG23 ILE 61 -9.279 12.321 -3.204 786 HD11 ILE 61 HD11 ILE 61 -10.275 9.775 -0.214 787 HD12 ILE 61 HD12 ILE 61 -8.890 9.930 -1.318 788 HD13 ILE 61 HD13 ILE 61 -8.657 10.166 0.425 789 H GLN 62 H GLN 62 -10.202 14.653 -3.693 790 HA GLN 62 HA GLN 62 -12.846 14.685 -5.074 791 HB2 GLN 62 HB2 GLN 62 -10.767 16.884 -5.193 792 HB3 GLN 62 HB3 GLN 62 -12.427 16.940 -5.791 793 HG2 GLN 62 HG2 GLN 62 -11.634 16.740 -2.844 794 HG3 GLN 62 HG3 GLN 62 -12.005 18.231 -3.673 795 HE21 GLN 62 HE21 GLN 62 -13.385 16.903 -1.348 796 HE22 GLN 62 HE22 GLN 62 -15.055 16.759 -1.852 797 H LYS 63 H LYS 63 -12.312 15.409 -7.479 798 HA LYS 63 HA LYS 63 -10.738 13.327 -8.633 799 HB2 LYS 63 HB2 LYS 63 -11.280 14.362 -10.694 800 HB3 LYS 63 HB3 LYS 63 -12.697 14.517 -9.645 801 HG2 LYS 63 HG2 LYS 63 -12.028 16.866 -9.115 802 HG3 LYS 63 HG3 LYS 63 -10.618 16.686 -10.179 803 HD2 LYS 63 HD2 LYS 63 -12.371 17.835 -11.390 804 HD3 LYS 63 HD3 LYS 63 -12.145 16.213 -12.085 805 HE2 LYS 63 HE2 LYS 63 -14.097 15.391 -10.821 806 HE3 LYS 63 HE3 LYS 63 -14.297 16.987 -10.069 807 HZ1 LYS 63 HZ1 LYS 63 -14.695 17.894 -12.250 808 HZ2 LYS 63 HZ2 LYS 63 -14.505 16.417 -12.949 809 HZ3 LYS 63 HZ3 LYS 63 -15.769 16.691 -11.940 810 H GLU 64 H GLU 64 -8.869 13.300 -9.722 811 HA GLU 64 HA GLU 64 -6.723 13.701 -10.161 812 HB2 GLU 64 HB2 GLU 64 -7.596 16.611 -10.047 813 HB3 GLU 64 HB3 GLU 64 -6.090 15.988 -10.750 814 HG2 GLU 64 HG2 GLU 64 -7.403 14.600 -12.332 815 HG3 GLU 64 HG3 GLU 64 -8.904 15.256 -11.666 816 H SER 65 H SER 65 -7.752 13.777 -7.166 817 HA SER 65 HA SER 65 -5.770 15.269 -5.783 818 HB2 SER 65 HB2 SER 65 -6.508 13.868 -3.880 819 HB3 SER 65 HB3 SER 65 -7.903 14.508 -4.767 820 HG SER 65 HG SER 65 -8.122 12.278 -4.363 821 H THR 66 H THR 66 -4.446 13.827 -4.149 822 HA THR 66 HA THR 66 -3.004 11.653 -5.604 823 HB THR 66 HB THR 66 -1.744 14.017 -4.164 824 HG1 THR 66 HG1 THR 66 -2.416 14.404 -6.306 825 HG21 THR 66 HG21 THR 66 -0.469 11.972 -3.703 826 HG22 THR 66 HG22 THR 66 -0.509 11.530 -5.428 827 HG23 THR 66 HG23 THR 66 0.403 12.959 -4.885 828 H LEU 67 H LEU 67 -2.874 9.892 -4.341 829 HA LEU 67 HA LEU 67 -2.919 10.243 -1.364 830 HB2 LEU 67 HB2 LEU 67 -3.889 7.761 -2.765 831 HB3 LEU 67 HB3 LEU 67 -4.153 8.245 -1.093 832 HG LEU 67 HG LEU 67 -5.373 9.519 -3.553 833 HD11 LEU 67 HD11 LEU 67 -6.561 7.703 -1.398 834 HD12 LEU 67 HD12 LEU 67 -7.485 8.460 -2.711 835 HD13 LEU 67 HD13 LEU 67 -6.244 7.242 -3.082 836 HD21 LEU 67 HD21 LEU 67 -6.223 9.992 -0.696 837 HD22 LEU 67 HD22 LEU 67 -5.160 11.100 -1.628 838 HD23 LEU 67 HD23 LEU 67 -6.824 10.786 -2.162 839 H HIS 68 H HIS 68 -2.235 7.737 -0.606 840 HA HIS 68 HA HIS 68 0.313 7.125 -2.015 841 HB2 HIS 68 HB2 HIS 68 0.071 7.650 0.971 842 HB3 HIS 68 HB3 HIS 68 1.540 7.183 0.102 843 HD2 HIS 68 HD2 HIS 68 2.450 9.046 -1.783 844 HE1 HIS 68 HE1 HIS 68 0.553 12.373 0.073 845 HE2 HIS 68 HE2 HIS 68 2.308 11.660 -1.638 846 H LEU 69 H LEU 69 1.061 5.030 -1.784 847 HA LEU 69 HA LEU 69 -0.772 3.064 -0.505 848 HB2 LEU 69 HB2 LEU 69 -1.450 3.327 -2.783 849 HB3 LEU 69 HB3 LEU 69 0.209 3.278 -3.371 850 HG LEU 69 HG LEU 69 -1.152 1.306 -3.918 851 HD11 LEU 69 HD11 LEU 69 0.501 -0.357 -3.550 852 HD12 LEU 69 HD12 LEU 69 1.343 1.191 -3.772 853 HD13 LEU 69 HD13 LEU 69 1.168 0.484 -2.147 854 HD21 LEU 69 HD21 LEU 69 -1.683 -0.385 -2.254 855 HD22 LEU 69 HD22 LEU 69 -1.014 0.630 -0.961 856 HD23 LEU 69 HD23 LEU 69 -2.469 1.156 -1.840 857 H VAL 70 H VAL 70 0.190 1.369 0.388 858 HA VAL 70 HA VAL 70 3.032 0.723 -0.162 859 HB VAL 70 HB VAL 70 1.790 1.192 2.585 860 HG11 VAL 70 HG11 VAL 70 4.072 0.702 3.430 861 HG12 VAL 70 HG12 VAL 70 3.293 -0.720 2.735 862 HG13 VAL 70 HG13 VAL 70 4.545 0.151 1.805 863 HG21 VAL 70 HG21 VAL 70 4.054 2.577 1.089 864 HG22 VAL 70 HG22 VAL 70 2.460 3.276 1.485 865 HG23 VAL 70 HG23 VAL 70 3.599 2.882 2.780 866 H LEU 71 H LEU 71 3.478 -1.567 0.797 867 HA LEU 71 HA LEU 71 0.994 -3.167 0.899 868 HB2 LEU 71 HB2 LEU 71 1.895 -4.745 -0.781 869 HB3 LEU 71 HB3 LEU 71 1.558 -3.140 -1.420 870 HG LEU 71 HG LEU 71 4.035 -2.612 -1.226 871 HD11 LEU 71 HD11 LEU 71 4.804 -4.330 0.338 872 HD12 LEU 71 HD12 LEU 71 4.176 -5.621 -0.724 873 HD13 LEU 71 HD13 LEU 71 5.547 -4.616 -1.237 874 HD21 LEU 71 HD21 LEU 71 3.185 -4.953 -2.977 875 HD22 LEU 71 HD22 LEU 71 2.931 -3.228 -3.334 876 HD23 LEU 71 HD23 LEU 71 4.580 -3.881 -3.263 877 H ARG 72 H ARG 72 1.548 -5.557 1.324 878 HA ARG 72 HA ARG 72 3.807 -5.751 3.259 879 HB2 ARG 72 HB2 ARG 72 0.931 -6.711 3.491 880 HB3 ARG 72 HB3 ARG 72 2.257 -7.410 4.436 881 HG2 ARG 72 HG2 ARG 72 1.497 -5.790 5.886 882 HG3 ARG 72 HG3 ARG 72 2.850 -4.985 5.074 883 HD2 ARG 72 HD2 ARG 72 1.091 -3.385 5.158 884 HD3 ARG 72 HD3 ARG 72 1.124 -3.947 3.486 885 HE ARG 72 HE ARG 72 -0.986 -4.859 3.771 886 HH11 ARG 72 HH11 ARG 72 0.423 -4.131 6.935 887 HH12 ARG 72 HH12 ARG 72 -1.053 -4.470 7.805 888 HH21 ARG 72 HH21 ARG 72 -2.907 -5.319 4.949 889 HH22 ARG 72 HH22 ARG 72 -2.932 -5.132 6.684 890 H LEU 73 H LEU 73 4.252 -8.158 3.751 891 HA LEU 73 HA LEU 73 4.620 -9.422 1.103 892 HB2 LEU 73 HB2 LEU 73 6.357 -8.512 3.274 893 HB3 LEU 73 HB3 LEU 73 6.522 -10.247 3.093 894 HG LEU 73 HG LEU 73 6.997 -9.881 0.629 895 HD11 LEU 73 HD11 LEU 73 6.905 -6.947 1.477 896 HD12 LEU 73 HD12 LEU 73 7.504 -7.546 -0.089 897 HD13 LEU 73 HD13 LEU 73 5.792 -7.738 0.345 898 HD21 LEU 73 HD21 LEU 73 9.260 -8.924 1.013 899 HD22 LEU 73 HD22 LEU 73 8.727 -8.317 2.600 900 HD23 LEU 73 HD23 LEU 73 8.811 -10.063 2.299 901 H ARG 74 H ARG 74 2.589 -9.755 3.297 902 HA ARG 74 HA ARG 74 1.337 -11.359 4.331 903 HB2 ARG 74 HB2 ARG 74 1.456 -12.286 2.042 904 HB3 ARG 74 HB3 ARG 74 2.837 -13.282 2.517 905 HG2 ARG 74 HG2 ARG 74 0.778 -14.613 2.521 906 HG3 ARG 74 HG3 ARG 74 1.546 -14.534 4.114 907 HD2 ARG 74 HD2 ARG 74 -0.843 -14.263 4.378 908 HD3 ARG 74 HD3 ARG 74 -0.018 -12.740 4.770 909 HE ARG 74 HE ARG 74 -0.770 -12.728 2.011 910 HH11 ARG 74 HH11 ARG 74 -2.236 -12.569 5.235 911 HH12 ARG 74 HH12 ARG 74 -3.611 -11.637 4.660 912 HH21 ARG 74 HH21 ARG 74 -2.602 -11.539 1.333 913 HH22 ARG 74 HH22 ARG 74 -3.831 -11.101 2.513 914 H GLY 75 H GLY 75 4.786 -11.980 4.234 915 HA2 GLY 75 HA2 GLY 75 4.617 -13.422 6.834 916 HA3 GLY 75 HA3 GLY 75 5.957 -13.521 5.657 917 H GLY 76 H GLY 76 4.760 -10.403 5.692 918 HA2 GLY 76 HA2 GLY 76 6.025 -9.283 8.015 919 HA3 GLY 76 HA3 GLY 76 7.066 -9.120 6.584 Start of MODEL 4 1 H LEU 491 H LEU 491 15.832 6.476 11.058 2 HA LEU 491 HA LEU 491 18.314 5.448 10.692 3 HB2 LEU 491 HB2 LEU 491 16.696 3.309 9.981 4 HB3 LEU 491 HB3 LEU 491 17.254 3.764 11.576 5 HG LEU 491 HG LEU 491 15.145 5.121 11.889 6 HD11 LEU 491 HD11 LEU 491 14.608 5.468 9.475 7 HD12 LEU 491 HD12 LEU 491 14.379 3.713 9.285 8 HD13 LEU 491 HD13 LEU 491 13.283 4.652 10.328 9 HD21 LEU 491 HD21 LEU 491 13.751 3.108 12.204 10 HD22 LEU 491 HD22 LEU 491 14.905 2.176 11.214 11 HD23 LEU 491 HD23 LEU 491 15.418 2.869 12.766 12 HA PRO 492 HA PRO 492 18.959 5.435 6.225 13 HB2 PRO 492 HB2 PRO 492 21.449 4.382 6.277 14 HB3 PRO 492 HB3 PRO 492 21.116 6.017 6.923 15 HG2 PRO 492 HG2 PRO 492 21.360 3.419 8.456 16 HG3 PRO 492 HG3 PRO 492 22.144 4.996 8.812 17 HD2 PRO 492 HD2 PRO 492 19.811 4.135 10.005 18 HD3 PRO 492 HD3 PRO 492 20.132 5.870 9.718 19 H LEU 493 H LEU 493 20.297 3.476 4.965 20 HA LEU 493 HA LEU 493 18.442 1.337 4.818 21 HB2 LEU 493 HB2 LEU 493 20.344 2.623 3.255 22 HB3 LEU 493 HB3 LEU 493 21.188 1.135 3.606 23 HG LEU 493 HG LEU 493 18.362 1.367 2.488 24 HD11 LEU 493 HD11 LEU 493 19.353 0.770 0.296 25 HD12 LEU 493 HD12 LEU 493 20.025 2.292 0.923 26 HD13 LEU 493 HD13 LEU 493 20.977 0.796 1.027 27 HD21 LEU 493 HD21 LEU 493 18.769 -0.819 3.579 28 HD22 LEU 493 HD22 LEU 493 18.673 -1.025 1.819 29 HD23 LEU 493 HD23 LEU 493 20.258 -1.025 2.627 30 H GLN 494 H GLN 494 19.541 1.550 7.422 31 HA GLN 494 HA GLN 494 21.497 -0.514 7.775 32 HB2 GLN 494 HB2 GLN 494 21.119 -0.087 10.156 33 HB3 GLN 494 HB3 GLN 494 21.390 1.384 9.183 34 HG2 GLN 494 HG2 GLN 494 19.736 2.032 10.657 35 HG3 GLN 494 HG3 GLN 494 18.903 1.726 9.129 36 HE21 GLN 494 HE21 GLN 494 16.892 1.398 10.050 37 HE22 GLN 494 HE22 GLN 494 16.517 0.026 11.071 38 H ALA 495 H ALA 495 17.981 -0.382 7.792 39 HA ALA 495 HA ALA 495 18.026 -3.344 7.818 40 HB1 ALA 495 HB1 ALA 495 17.567 -2.710 10.152 41 HB2 ALA 495 HB2 ALA 495 16.188 -1.718 9.621 42 HB3 ALA 495 HB3 ALA 495 16.154 -3.485 9.407 43 H LEU 496 H LEU 496 17.201 -0.662 6.137 44 HA LEU 496 HA LEU 496 14.531 -1.299 5.310 45 HB2 LEU 496 HB2 LEU 496 16.806 0.299 4.057 46 HB3 LEU 496 HB3 LEU 496 15.159 0.257 3.417 47 HG LEU 496 HG LEU 496 15.891 1.212 6.218 48 HD11 LEU 496 HD11 LEU 496 15.148 2.762 3.702 49 HD12 LEU 496 HD12 LEU 496 15.424 3.457 5.320 50 HD13 LEU 496 HD13 LEU 496 16.768 2.690 4.447 51 HD21 LEU 496 HD21 LEU 496 13.587 2.107 6.213 52 HD22 LEU 496 HD22 LEU 496 13.302 1.402 4.607 53 HD23 LEU 496 HD23 LEU 496 13.562 0.346 6.017 54 HA PRO 497 HA PRO 497 15.070 -4.565 2.405 55 HB2 PRO 497 HB2 PRO 497 13.638 -2.805 0.426 56 HB3 PRO 497 HB3 PRO 497 13.282 -4.507 0.866 57 HG2 PRO 497 HG2 PRO 497 11.739 -2.524 1.856 58 HG3 PRO 497 HG3 PRO 497 12.304 -3.840 2.942 59 HD2 PRO 497 HD2 PRO 497 13.470 -1.064 2.609 60 HD3 PRO 497 HD3 PRO 497 13.104 -1.957 4.116 61 H GLU 498 H GLU 498 16.261 -5.195 0.511 62 HA GLU 498 HA GLU 498 18.310 -3.288 -0.316 63 HB2 GLU 498 HB2 GLU 498 18.713 -5.730 0.194 64 HB3 GLU 498 HB3 GLU 498 17.848 -6.124 -1.313 65 HG2 GLU 498 HG2 GLU 498 19.491 -4.854 -2.623 66 HG3 GLU 498 HG3 GLU 498 20.216 -4.223 -1.149 67 H GLY 499 H GLY 499 16.348 -2.005 -0.993 68 HA2 GLY 499 HA2 GLY 499 16.342 -1.586 -3.766 69 HA3 GLY 499 HA3 GLY 499 14.989 -2.692 -3.413 70 H VAL 500 H VAL 500 16.065 -0.227 -1.096 71 HA VAL 500 HA VAL 500 13.816 1.566 -1.796 72 HB VAL 500 HB VAL 500 14.194 0.154 0.878 73 HG11 VAL 500 HG11 VAL 500 12.291 2.418 0.140 74 HG12 VAL 500 HG12 VAL 500 12.155 1.404 1.598 75 HG13 VAL 500 HG13 VAL 500 13.564 2.449 1.389 76 HG21 VAL 500 HG21 VAL 500 11.882 0.222 -1.114 77 HG22 VAL 500 HG22 VAL 500 12.951 -1.162 -0.803 78 HG23 VAL 500 HG23 VAL 500 11.855 -0.583 0.467 79 H ASP 501 H ASP 501 13.955 3.611 -0.548 80 HA ASP 501 HA ASP 501 16.665 4.269 0.519 81 HB2 ASP 501 HB2 ASP 501 16.309 4.914 -1.964 82 HB3 ASP 501 HB3 ASP 501 15.086 6.046 -1.375 83 H GLN 502 H GLN 502 16.657 5.753 2.101 84 HA GLN 502 HA GLN 502 14.299 5.853 3.713 85 HB2 GLN 502 HB2 GLN 502 15.803 7.618 4.946 86 HB3 GLN 502 HB3 GLN 502 16.234 5.905 4.971 87 HG2 GLN 502 HG2 GLN 502 17.342 7.541 2.704 88 HG3 GLN 502 HG3 GLN 502 17.957 7.866 4.322 89 HE21 GLN 502 HE21 GLN 502 16.915 4.569 3.415 90 HE22 GLN 502 HE22 GLN 502 18.532 3.906 3.351 91 H GLU 503 H GLU 503 15.699 8.138 1.333 92 HA GLU 503 HA GLU 503 13.841 10.229 2.128 93 HB2 GLU 503 HB2 GLU 503 15.808 9.885 -0.163 94 HB3 GLU 503 HB3 GLU 503 14.691 11.270 -0.079 95 HG2 GLU 503 HG2 GLU 503 15.466 11.828 2.153 96 HG3 GLU 503 HG3 GLU 503 16.528 10.428 2.192 97 H VAL 504 H VAL 504 13.246 7.352 0.925 98 HA VAL 504 HA VAL 504 10.799 8.300 -0.473 99 HB VAL 504 HB VAL 504 12.570 5.898 -1.151 100 HG11 VAL 504 HG11 VAL 504 10.329 5.141 -1.545 101 HG12 VAL 504 HG12 VAL 504 9.867 6.695 -2.291 102 HG13 VAL 504 HG13 VAL 504 11.003 5.592 -3.108 103 HG21 VAL 504 HG21 VAL 504 11.830 8.397 -2.726 104 HG22 VAL 504 HG22 VAL 504 13.423 8.028 -2.023 105 HG23 VAL 504 HG23 VAL 504 12.786 7.034 -3.342 106 H PHE 505 H PHE 505 11.818 7.266 2.390 107 HA PHE 505 HA PHE 505 9.419 5.560 2.775 108 HB2 PHE 505 HB2 PHE 505 10.877 3.842 2.740 109 HB3 PHE 505 HB3 PHE 505 12.274 4.872 3.017 110 HD1 PHE 505 HD1 PHE 505 12.909 5.655 5.261 111 HD2 PHE 505 HD2 PHE 505 9.914 2.642 4.644 112 HE1 PHE 505 HE1 PHE 505 13.170 4.920 7.615 113 HE2 PHE 505 HE2 PHE 505 10.205 1.873 6.995 114 HZ PHE 505 HZ PHE 505 11.823 3.017 8.479 115 H LYS 506 H LYS 506 11.684 7.964 4.073 116 HA LYS 506 HA LYS 506 10.702 7.886 6.774 117 HB2 LYS 506 HB2 LYS 506 12.127 10.010 5.134 118 HB3 LYS 506 HB3 LYS 506 11.752 10.199 6.854 119 HG2 LYS 506 HG2 LYS 506 13.047 8.198 7.412 120 HG3 LYS 506 HG3 LYS 506 13.435 7.929 5.710 121 HD2 LYS 506 HD2 LYS 506 14.234 10.322 7.415 122 HD3 LYS 506 HD3 LYS 506 15.309 9.033 6.833 123 HE2 LYS 506 HE2 LYS 506 14.888 9.733 4.502 124 HE3 LYS 506 HE3 LYS 506 13.824 11.027 5.088 125 HZ1 LYS 506 HZ1 LYS 506 16.688 10.752 5.716 126 HZ2 LYS 506 HZ2 LYS 506 16.037 11.840 4.665 127 HZ3 LYS 506 HZ3 LYS 506 15.702 11.936 6.274 128 H GLN 507 H GLN 507 9.125 8.850 3.909 129 HA GLN 507 HA GLN 507 7.684 11.094 5.088 130 HB2 GLN 507 HB2 GLN 507 6.976 9.585 2.544 131 HB3 GLN 507 HB3 GLN 507 6.544 11.238 2.997 132 HG2 GLN 507 HG2 GLN 507 8.284 11.539 1.444 133 HG3 GLN 507 HG3 GLN 507 9.106 11.710 2.999 134 HE21 GLN 507 HE21 GLN 507 11.151 10.814 2.796 135 HE22 GLN 507 HE22 GLN 507 11.453 9.268 2.047 136 H LEU 508 H LEU 508 7.482 7.721 5.297 137 HA LEU 508 HA LEU 508 4.606 7.377 5.570 138 HB2 LEU 508 HB2 LEU 508 7.009 5.722 6.446 139 HB3 LEU 508 HB3 LEU 508 5.340 5.145 6.411 140 HG LEU 508 HG LEU 508 6.890 6.108 3.961 141 HD11 LEU 508 HD11 LEU 508 7.047 3.730 3.393 142 HD12 LEU 508 HD12 LEU 508 7.843 4.049 4.954 143 HD13 LEU 508 HD13 LEU 508 6.235 3.295 4.919 144 HD21 LEU 508 HD21 LEU 508 4.454 6.338 3.697 145 HD22 LEU 508 HD22 LEU 508 5.049 4.986 2.724 146 HD23 LEU 508 HD23 LEU 508 4.223 4.664 4.267 147 HA PRO 509 HA PRO 509 4.383 8.259 9.976 148 HB2 PRO 509 HB2 PRO 509 2.520 6.443 10.833 149 HB3 PRO 509 HB3 PRO 509 2.106 7.890 9.879 150 HG2 PRO 509 HG2 PRO 509 2.528 5.054 8.929 151 HG3 PRO 509 HG3 PRO 509 1.201 6.171 8.466 152 HD2 PRO 509 HD2 PRO 509 3.402 5.765 6.888 153 HD3 PRO 509 HD3 PRO 509 2.603 7.362 6.999 154 H ALA 510 H ALA 510 4.716 7.253 12.058 155 HA ALA 510 HA ALA 510 6.918 5.495 12.164 156 HB1 ALA 510 HB1 ALA 510 4.852 6.321 14.239 157 HB2 ALA 510 HB2 ALA 510 6.434 5.574 14.609 158 HB3 ALA 510 HB3 ALA 510 6.351 7.186 13.851 159 H ASP 511 H ASP 511 3.654 4.716 11.546 160 HA ASP 511 HA ASP 511 3.904 2.018 12.763 161 HB2 ASP 511 HB2 ASP 511 1.931 3.432 13.349 162 HB3 ASP 511 HB3 ASP 511 1.483 3.494 11.642 163 H ILE 512 H ILE 512 4.450 3.558 9.812 164 HA ILE 512 HA ILE 512 4.273 0.859 8.550 165 HB ILE 512 HB ILE 512 4.260 3.532 7.120 166 HG12 ILE 512 HG12 ILE 512 2.051 1.506 7.703 167 HG13 ILE 512 HG13 ILE 512 2.158 3.170 8.305 168 HG21 ILE 512 HG21 ILE 512 3.828 0.690 6.093 169 HG22 ILE 512 HG22 ILE 512 3.776 2.180 5.119 170 HG23 ILE 512 HG23 ILE 512 5.300 1.655 5.827 171 HD11 ILE 512 HD11 ILE 512 2.018 3.995 5.941 172 HD12 ILE 512 HD12 ILE 512 1.694 2.314 5.427 173 HD13 ILE 512 HD13 ILE 512 0.565 3.135 6.509 174 H GLN 513 H GLN 513 6.347 3.367 9.769 175 HA GLN 513 HA GLN 513 8.756 2.828 8.420 176 HB2 GLN 513 HB2 GLN 513 7.866 3.887 11.007 177 HB3 GLN 513 HB3 GLN 513 9.313 2.884 11.206 178 HG2 GLN 513 HG2 GLN 513 9.919 5.218 10.880 179 HG3 GLN 513 HG3 GLN 513 10.535 4.177 9.589 180 HE21 GLN 513 HE21 GLN 513 9.933 4.540 7.472 181 HE22 GLN 513 HE22 GLN 513 8.846 5.810 6.977 182 H GLU 514 H GLU 514 7.062 1.035 11.003 183 HA GLU 514 HA GLU 514 9.117 -0.980 11.250 184 HB2 GLU 514 HB2 GLU 514 7.562 -1.991 12.836 185 HB3 GLU 514 HB3 GLU 514 7.679 -0.242 13.120 186 HG2 GLU 514 HG2 GLU 514 5.572 0.112 11.895 187 HG3 GLU 514 HG3 GLU 514 5.441 -1.628 11.585 188 H GLU 515 H GLU 515 6.903 -0.470 8.765 189 HA GLU 515 HA GLU 515 6.358 -3.378 8.392 190 HB2 GLU 515 HB2 GLU 515 5.287 -0.895 6.999 191 HB3 GLU 515 HB3 GLU 515 4.853 -2.556 6.582 192 HG2 GLU 515 HG2 GLU 515 4.404 -1.256 9.303 193 HG3 GLU 515 HG3 GLU 515 3.173 -1.456 8.057 194 H ILE 516 H ILE 516 8.491 -0.867 7.327 195 HA ILE 516 HA ILE 516 9.157 -2.438 4.868 196 HB ILE 516 HB ILE 516 9.480 0.465 5.681 197 HG12 ILE 516 HG12 ILE 516 8.455 0.954 3.582 198 HG13 ILE 516 HG13 ILE 516 8.550 -0.734 3.045 199 HG21 ILE 516 HG21 ILE 516 11.680 -0.220 4.835 200 HG22 ILE 516 HG22 ILE 516 10.912 -0.947 3.399 201 HG23 ILE 516 HG23 ILE 516 10.862 0.810 3.654 202 HD11 ILE 516 HD11 ILE 516 6.838 -1.390 4.619 203 HD12 ILE 516 HD12 ILE 516 6.870 0.230 5.383 204 HD13 ILE 516 HD13 ILE 516 6.266 0.023 3.720 205 H LEU 517 H LEU 517 10.436 -1.001 7.894 206 HA LEU 517 HA LEU 517 13.115 -1.978 7.573 207 HB2 LEU 517 HB2 LEU 517 11.394 -1.304 9.987 208 HB3 LEU 517 HB3 LEU 517 13.098 -1.748 10.125 209 HG LEU 517 HG LEU 517 12.151 0.568 8.393 210 HD11 LEU 517 HD11 LEU 517 12.799 2.020 10.271 211 HD12 LEU 517 HD12 LEU 517 11.500 0.921 10.771 212 HD13 LEU 517 HD13 LEU 517 13.176 0.585 11.263 213 HD21 LEU 517 HD21 LEU 517 14.853 -0.072 9.652 214 HD22 LEU 517 HD22 LEU 517 14.452 -0.365 7.945 215 HD23 LEU 517 HD23 LEU 517 14.491 1.292 8.583 216 H SER 518 H SER 518 10.134 -3.618 7.977 217 HA SER 518 HA SER 518 11.064 -5.851 9.565 218 HB2 SER 518 HB2 SER 518 8.660 -5.177 9.249 219 HB3 SER 518 HB3 SER 518 8.795 -5.664 7.542 220 HG SER 518 HG SER 518 7.941 -7.322 8.897 221 H GLY 519 H GLY 519 10.665 -5.233 6.042 222 HA2 GLY 519 HA2 GLY 519 12.520 -6.280 4.672 223 HA3 GLY 519 HA3 GLY 519 12.033 -7.813 5.432 224 H LYS 520 H LYS 520 11.719 -6.144 2.645 225 HA LYS 520 HA LYS 520 9.117 -7.312 1.943 226 HB2 LYS 520 HB2 LYS 520 9.883 -4.363 1.826 227 HB3 LYS 520 HB3 LYS 520 8.547 -5.048 0.893 228 HG2 LYS 520 HG2 LYS 520 8.735 -5.086 3.929 229 HG3 LYS 520 HG3 LYS 520 7.786 -3.944 2.966 230 HD2 LYS 520 HD2 LYS 520 6.444 -5.795 2.034 231 HD3 LYS 520 HD3 LYS 520 7.401 -6.970 2.955 232 HE2 LYS 520 HE2 LYS 520 5.334 -6.546 4.135 233 HE3 LYS 520 HE3 LYS 520 6.689 -5.904 5.073 234 HZ1 LYS 520 HZ1 LYS 520 4.931 -4.307 3.331 235 HZ2 LYS 520 HZ2 LYS 520 4.847 -4.377 4.974 236 HZ3 LYS 520 HZ3 LYS 520 6.176 -3.734 4.256 237 H SER 521 H SER 521 8.770 -6.768 -0.432 238 HA SER 521 HA SER 521 11.192 -6.748 -2.098 239 HB2 SER 521 HB2 SER 521 10.982 -9.092 -1.216 240 HB3 SER 521 HB3 SER 521 9.376 -9.189 -1.974 241 HG SER 521 HG SER 521 11.088 -10.027 -3.280 242 H ARG 522 H ARG 522 10.158 -7.642 -4.428 243 HA ARG 522 HA ARG 522 8.987 -7.008 -6.222 244 HB2 ARG 522 HB2 ARG 522 7.125 -7.863 -4.385 245 HB3 ARG 522 HB3 ARG 522 6.514 -6.247 -4.762 246 HG2 ARG 522 HG2 ARG 522 5.514 -7.773 -6.336 247 HG3 ARG 522 HG3 ARG 522 6.743 -6.832 -7.212 248 HD2 ARG 522 HD2 ARG 522 6.811 -9.246 -7.798 249 HD3 ARG 522 HD3 ARG 522 8.325 -8.689 -7.082 250 HE ARG 522 HE ARG 522 7.925 -9.979 -5.169 251 HH11 ARG 522 HH11 ARG 522 5.128 -10.098 -7.337 252 HH12 ARG 522 HH12 ARG 522 4.394 -11.444 -6.497 253 HH21 ARG 522 HH21 ARG 522 6.943 -11.725 -4.096 254 HH22 ARG 522 HH22 ARG 522 5.423 -12.367 -4.672 255 H GLU 523 H GLU 523 10.418 -4.990 -4.518 256 HA GLU 523 HA GLU 523 9.453 -2.603 -5.955 257 HB2 GLU 523 HB2 GLU 523 9.557 -1.253 -3.886 258 HB3 GLU 523 HB3 GLU 523 8.311 -2.510 -3.813 259 HG2 GLU 523 HG2 GLU 523 9.968 -3.966 -2.545 260 HG3 GLU 523 HG3 GLU 523 11.058 -2.574 -2.492 261 H ASN 524 H ASN 524 11.113 -0.903 -6.053 262 HA ASN 524 HA ASN 524 13.849 -1.742 -5.402 263 HB2 ASN 524 HB2 ASN 524 13.837 -0.902 -8.148 264 HB3 ASN 524 HB3 ASN 524 14.358 -2.459 -7.538 265 HD21 ASN 524 HD21 ASN 524 12.414 -4.099 -7.274 266 HD22 ASN 524 HD22 ASN 524 11.106 -3.955 -8.436 267 H LEU 525 H LEU 525 11.781 0.447 -5.101 268 HA LEU 525 HA LEU 525 11.652 2.705 -5.043 269 HB2 LEU 525 HB2 LEU 525 13.344 3.615 -3.919 270 HB3 LEU 525 HB3 LEU 525 14.029 2.002 -3.976 271 HG LEU 525 HG LEU 525 14.956 3.069 -6.362 272 HD11 LEU 525 HD11 LEU 525 13.967 5.273 -5.551 273 HD12 LEU 525 HD12 LEU 525 15.104 5.217 -4.199 274 HD13 LEU 525 HD13 LEU 525 15.727 5.324 -5.866 275 HD21 LEU 525 HD21 LEU 525 16.246 3.152 -3.606 276 HD22 LEU 525 HD22 LEU 525 16.257 1.772 -4.733 277 HD23 LEU 525 HD23 LEU 525 17.104 3.268 -5.163 278 H LYS 526 H LYS 526 11.981 1.143 -7.653 279 HA LYS 526 HA LYS 526 12.472 3.451 -9.459 280 HB2 LYS 526 HB2 LYS 526 13.362 0.562 -9.555 281 HB3 LYS 526 HB3 LYS 526 13.355 1.579 -11.023 282 HG2 LYS 526 HG2 LYS 526 14.895 3.149 -9.978 283 HG3 LYS 526 HG3 LYS 526 14.871 2.240 -8.455 284 HD2 LYS 526 HD2 LYS 526 15.672 0.978 -11.088 285 HD3 LYS 526 HD3 LYS 526 16.842 1.825 -10.044 286 HE2 LYS 526 HE2 LYS 526 16.296 0.277 -8.187 287 HE3 LYS 526 HE3 LYS 526 15.187 -0.617 -9.238 288 HZ1 LYS 526 HZ1 LYS 526 17.360 -1.618 -9.132 289 HZ2 LYS 526 HZ2 LYS 526 17.012 -1.128 -10.665 290 HZ3 LYS 526 HZ3 LYS 526 18.061 -0.264 -9.736 291 H1 MET 1 H1 MET 1 -12.252 11.969 -13.817 292 H2 MET 1 H2 MET 1 -13.743 12.576 -13.477 293 H3 MET 1 H3 MET 1 -13.528 10.947 -13.627 294 HA MET 1 HA MET 1 -12.332 12.632 -11.539 295 HB2 MET 1 HB2 MET 1 -14.754 12.363 -11.160 296 HB3 MET 1 HB3 MET 1 -14.632 10.628 -11.484 297 HG2 MET 1 HG2 MET 1 -14.792 10.916 -9.130 298 HG3 MET 1 HG3 MET 1 -13.152 10.381 -9.493 299 HE1 MET 1 HE1 MET 1 -12.588 11.012 -6.945 300 HE2 MET 1 HE2 MET 1 -12.910 12.607 -6.240 301 HE3 MET 1 HE3 MET 1 -14.265 11.573 -6.735 302 H GLN 2 H GLN 2 -10.452 11.935 -10.928 303 HA GLN 2 HA GLN 2 -10.096 9.125 -10.292 304 HB2 GLN 2 HB2 GLN 2 -8.270 8.716 -11.820 305 HB3 GLN 2 HB3 GLN 2 -9.601 9.379 -12.796 306 HG2 GLN 2 HG2 GLN 2 -8.437 11.686 -12.219 307 HG3 GLN 2 HG3 GLN 2 -7.050 10.709 -11.832 308 HE21 GLN 2 HE21 GLN 2 -5.788 11.568 -13.555 309 HE22 GLN 2 HE22 GLN 2 -6.124 11.195 -15.233 310 H ILE 3 H ILE 3 -7.793 8.829 -9.454 311 HA ILE 3 HA ILE 3 -6.672 11.304 -8.257 312 HB ILE 3 HB ILE 3 -6.690 10.514 -6.066 313 HG12 ILE 3 HG12 ILE 3 -7.084 7.783 -7.248 314 HG13 ILE 3 HG13 ILE 3 -6.035 8.352 -5.968 315 HG21 ILE 3 HG21 ILE 3 -9.396 9.749 -7.211 316 HG22 ILE 3 HG22 ILE 3 -9.038 10.309 -5.559 317 HG23 ILE 3 HG23 ILE 3 -8.819 11.409 -6.925 318 HD11 ILE 3 HD11 ILE 3 -9.035 7.909 -5.737 319 HD12 ILE 3 HD12 ILE 3 -7.752 6.908 -5.031 320 HD13 ILE 3 HD13 ILE 3 -7.993 8.565 -4.443 321 H PHE 4 H PHE 4 -4.592 10.422 -6.870 322 HA PHE 4 HA PHE 4 -3.127 8.568 -8.691 323 HB2 PHE 4 HB2 PHE 4 -2.122 11.232 -7.634 324 HB3 PHE 4 HB3 PHE 4 -1.229 10.121 -8.610 325 HD1 PHE 4 HD1 PHE 4 -2.461 9.482 -10.963 326 HD2 PHE 4 HD2 PHE 4 -3.217 13.030 -8.646 327 HE1 PHE 4 HE1 PHE 4 -3.308 10.629 -12.989 328 HE2 PHE 4 HE2 PHE 4 -4.019 14.186 -10.686 329 HZ PHE 4 HZ PHE 4 -4.075 12.985 -12.855 330 H VAL 5 H VAL 5 -2.649 6.889 -7.352 331 HA VAL 5 HA VAL 5 -1.938 7.577 -4.556 332 HB VAL 5 HB VAL 5 -2.674 5.495 -3.904 333 HG11 VAL 5 HG11 VAL 5 -4.493 6.229 -6.261 334 HG12 VAL 5 HG12 VAL 5 -4.936 5.260 -4.840 335 HG13 VAL 5 HG13 VAL 5 -4.540 6.981 -4.677 336 HG21 VAL 5 HG21 VAL 5 -2.529 4.543 -6.778 337 HG22 VAL 5 HG22 VAL 5 -1.534 4.014 -5.387 338 HG23 VAL 5 HG23 VAL 5 -3.259 3.630 -5.438 339 H LYS 6 H LYS 6 0.144 7.663 -4.024 340 HA LYS 6 HA LYS 6 2.086 6.676 -5.994 341 HB2 LYS 6 HB2 LYS 6 2.063 9.027 -5.038 342 HB3 LYS 6 HB3 LYS 6 2.644 8.329 -3.513 343 HG2 LYS 6 HG2 LYS 6 4.622 7.409 -4.694 344 HG3 LYS 6 HG3 LYS 6 3.969 7.980 -6.243 345 HD2 LYS 6 HD2 LYS 6 5.665 9.541 -5.520 346 HD3 LYS 6 HD3 LYS 6 4.079 10.326 -5.414 347 HE2 LYS 6 HE2 LYS 6 4.004 9.844 -2.984 348 HE3 LYS 6 HE3 LYS 6 5.588 9.048 -3.093 349 HZ1 LYS 6 HZ1 LYS 6 5.785 11.321 -2.350 350 HZ2 LYS 6 HZ2 LYS 6 6.510 11.148 -3.811 351 HZ3 LYS 6 HZ3 LYS 6 5.041 11.878 -3.705 352 H THR 7 H THR 7 3.528 5.049 -5.681 353 HA THR 7 HA THR 7 2.947 3.183 -3.526 354 HB THR 7 HB THR 7 4.508 1.741 -4.804 355 HG1 THR 7 HG1 THR 7 5.469 2.587 -6.637 356 HG21 THR 7 HG21 THR 7 3.193 1.587 -6.867 357 HG22 THR 7 HG22 THR 7 2.121 1.888 -5.480 358 HG23 THR 7 HG23 THR 7 2.527 3.212 -6.602 359 H LEU 8 H LEU 8 4.986 1.903 -2.760 360 HA LEU 8 HA LEU 8 6.624 3.547 -1.124 361 HB2 LEU 8 HB2 LEU 8 5.730 1.120 -0.907 362 HB3 LEU 8 HB3 LEU 8 7.110 0.635 -1.878 363 HG LEU 8 HG LEU 8 7.227 0.362 0.639 364 HD11 LEU 8 HD11 LEU 8 9.513 0.730 0.858 365 HD12 LEU 8 HD12 LEU 8 9.293 0.471 -0.883 366 HD13 LEU 8 HD13 LEU 8 9.516 2.122 -0.235 367 HD21 LEU 8 HD21 LEU 8 7.669 3.370 0.638 368 HD22 LEU 8 HD22 LEU 8 6.215 2.538 1.243 369 HD23 LEU 8 HD23 LEU 8 7.791 2.274 2.023 370 H THR 9 H THR 9 6.777 3.455 -4.367 371 HA THR 9 HA THR 9 9.756 3.531 -4.407 372 HB THR 9 HB THR 9 9.720 2.584 -6.662 373 HG1 THR 9 HG1 THR 9 7.675 3.245 -7.328 374 HG21 THR 9 HG21 THR 9 9.850 1.066 -4.676 375 HG22 THR 9 HG22 THR 9 8.087 0.869 -4.741 376 HG23 THR 9 HG23 THR 9 9.082 0.304 -6.094 377 H GLY 10 H GLY 10 7.278 5.547 -4.376 378 HA2 GLY 10 HA2 GLY 10 7.204 7.764 -4.937 379 HA3 GLY 10 HA3 GLY 10 8.804 7.624 -5.671 380 H LYS 11 H LYS 11 6.068 5.595 -6.648 381 HA LYS 11 HA LYS 11 5.729 7.197 -9.148 382 HB2 LYS 11 HB2 LYS 11 7.101 5.162 -9.410 383 HB3 LYS 11 HB3 LYS 11 5.796 4.164 -8.766 384 HG2 LYS 11 HG2 LYS 11 5.149 5.980 -11.077 385 HG3 LYS 11 HG3 LYS 11 6.147 4.538 -11.393 386 HD2 LYS 11 HD2 LYS 11 4.400 3.079 -10.439 387 HD3 LYS 11 HD3 LYS 11 3.413 4.488 -10.037 388 HE2 LYS 11 HE2 LYS 11 2.592 3.509 -12.094 389 HE3 LYS 11 HE3 LYS 11 3.297 5.093 -12.440 390 HZ1 LYS 11 HZ1 LYS 11 3.987 3.444 -14.035 391 HZ2 LYS 11 HZ2 LYS 11 5.292 3.972 -13.183 392 HZ3 LYS 11 HZ3 LYS 11 4.631 2.497 -12.861 393 H THR 12 H THR 12 3.546 7.278 -9.942 394 HA THR 12 HA THR 12 1.602 6.404 -7.852 395 HB THR 12 HB THR 12 2.253 8.949 -8.322 396 HG1 THR 12 HG1 THR 12 0.305 9.382 -7.349 397 HG21 THR 12 HG21 THR 12 1.452 8.867 -10.703 398 HG22 THR 12 HG22 THR 12 -0.185 8.504 -10.092 399 HG23 THR 12 HG23 THR 12 0.579 10.050 -9.692 400 H ILE 13 H ILE 13 -0.603 6.059 -8.557 401 HA ILE 13 HA ILE 13 -0.754 5.075 -11.375 402 HB ILE 13 HB ILE 13 -1.813 3.703 -8.877 403 HG12 ILE 13 HG12 ILE 13 0.536 2.985 -10.693 404 HG13 ILE 13 HG13 ILE 13 0.636 3.530 -9.015 405 HG21 ILE 13 HG21 ILE 13 -1.781 2.813 -11.795 406 HG22 ILE 13 HG22 ILE 13 -2.450 1.894 -10.424 407 HG23 ILE 13 HG23 ILE 13 -3.215 3.403 -10.922 408 HD11 ILE 13 HD11 ILE 13 0.884 1.132 -9.054 409 HD12 ILE 13 HD12 ILE 13 -0.676 1.532 -8.303 410 HD13 ILE 13 HD13 ILE 13 -0.613 0.930 -9.982 411 H THR 14 H THR 14 -2.391 5.941 -12.452 412 HA THR 14 HA THR 14 -4.264 7.709 -11.155 413 HB THR 14 HB THR 14 -4.348 6.565 -13.980 414 HG1 THR 14 HG1 THR 14 -3.107 8.374 -14.507 415 HG21 THR 14 HG21 THR 14 -6.375 7.782 -13.251 416 HG22 THR 14 HG22 THR 14 -5.366 9.157 -12.744 417 HG23 THR 14 HG23 THR 14 -5.476 8.717 -14.465 418 H LEU 15 H LEU 15 -6.356 7.268 -10.497 419 HA LEU 15 HA LEU 15 -7.530 4.627 -11.203 420 HB2 LEU 15 HB2 LEU 15 -7.214 5.730 -8.394 421 HB3 LEU 15 HB3 LEU 15 -8.108 4.268 -8.824 422 HG LEU 15 HG LEU 15 -5.133 4.652 -9.340 423 HD11 LEU 15 HD11 LEU 15 -6.526 3.099 -7.112 424 HD12 LEU 15 HD12 LEU 15 -4.769 3.305 -7.348 425 HD13 LEU 15 HD13 LEU 15 -5.786 4.698 -6.910 426 HD21 LEU 15 HD21 LEU 15 -6.221 2.923 -10.763 427 HD22 LEU 15 HD22 LEU 15 -5.112 2.207 -9.569 428 HD23 LEU 15 HD23 LEU 15 -6.865 2.143 -9.301 429 H GLU 16 H GLU 16 -9.616 4.786 -11.623 430 HA GLU 16 HA GLU 16 -10.972 7.385 -11.233 431 HB2 GLU 16 HB2 GLU 16 -11.077 6.421 -13.456 432 HB3 GLU 16 HB3 GLU 16 -11.546 4.837 -12.809 433 HG2 GLU 16 HG2 GLU 16 -13.671 5.724 -12.038 434 HG3 GLU 16 HG3 GLU 16 -13.245 7.354 -12.583 435 H VAL 17 H VAL 17 -12.431 7.754 -9.787 436 HA VAL 17 HA VAL 17 -13.851 5.565 -8.390 437 HB VAL 17 HB VAL 17 -13.250 6.500 -6.192 438 HG11 VAL 17 HG11 VAL 17 -10.779 5.763 -7.814 439 HG12 VAL 17 HG12 VAL 17 -10.956 5.664 -6.051 440 HG13 VAL 17 HG13 VAL 17 -11.927 4.610 -7.102 441 HG21 VAL 17 HG21 VAL 17 -11.258 8.218 -7.733 442 HG22 VAL 17 HG22 VAL 17 -12.716 8.815 -6.905 443 HG23 VAL 17 HG23 VAL 17 -11.393 8.098 -5.966 444 H GLU 18 H GLU 18 -15.265 6.788 -6.599 445 HA GLU 18 HA GLU 18 -16.169 9.462 -7.458 446 HB2 GLU 18 HB2 GLU 18 -18.062 7.112 -6.977 447 HB3 GLU 18 HB3 GLU 18 -18.527 8.785 -7.344 448 HG2 GLU 18 HG2 GLU 18 -17.272 8.552 -9.533 449 HG3 GLU 18 HG3 GLU 18 -17.066 6.839 -9.131 450 HA PRO 19 HA PRO 19 -16.361 10.040 -3.096 451 HB2 PRO 19 HB2 PRO 19 -19.157 11.087 -3.276 452 HB3 PRO 19 HB3 PRO 19 -17.699 11.871 -2.609 453 HG2 PRO 19 HG2 PRO 19 -18.717 12.612 -5.039 454 HG3 PRO 19 HG3 PRO 19 -16.956 12.567 -4.719 455 HD2 PRO 19 HD2 PRO 19 -18.639 10.536 -6.188 456 HD3 PRO 19 HD3 PRO 19 -16.995 11.144 -6.553 457 H SER 20 H SER 20 -18.193 7.681 -4.620 458 HA SER 20 HA SER 20 -19.407 6.738 -2.084 459 HB2 SER 20 HB2 SER 20 -21.134 5.740 -3.614 460 HB3 SER 20 HB3 SER 20 -21.174 7.520 -3.526 461 HG SER 20 HG SER 20 -21.282 6.727 -5.683 462 H ASP 21 H ASP 21 -17.251 6.165 -4.721 463 HA ASP 21 HA ASP 21 -17.172 3.244 -4.425 464 HB2 ASP 21 HB2 ASP 21 -15.348 5.289 -5.673 465 HB3 ASP 21 HB3 ASP 21 -15.002 3.566 -5.688 466 H THR 22 H THR 22 -17.130 3.489 -2.092 467 HA THR 22 HA THR 22 -14.962 4.721 -0.663 468 HB THR 22 HB THR 22 -17.060 4.265 0.413 469 HG1 THR 22 HG1 THR 22 -16.161 3.412 2.280 470 HG21 THR 22 HG21 THR 22 -16.368 1.334 0.147 471 HG22 THR 22 HG22 THR 22 -17.704 2.028 1.120 472 HG23 THR 22 HG23 THR 22 -17.730 2.181 -0.647 473 H ILE 23 H ILE 23 -13.660 3.129 0.949 474 HA ILE 23 HA ILE 23 -11.514 2.433 -0.654 475 HB ILE 23 HB ILE 23 -12.030 1.251 2.082 476 HG12 ILE 23 HG12 ILE 23 -12.575 3.590 2.289 477 HG13 ILE 23 HG13 ILE 23 -10.972 3.329 2.966 478 HG21 ILE 23 HG21 ILE 23 -9.503 2.119 0.615 479 HG22 ILE 23 HG22 ILE 23 -9.578 1.483 2.276 480 HG23 ILE 23 HG23 ILE 23 -10.030 0.448 0.905 481 HD11 ILE 23 HD11 ILE 23 -11.121 5.395 1.610 482 HD12 ILE 23 HD12 ILE 23 -9.936 4.258 0.922 483 HD13 ILE 23 HD13 ILE 23 -11.545 4.446 0.179 484 H GLU 24 H GLU 24 -14.160 0.196 0.368 485 HA GLU 24 HA GLU 24 -12.677 -2.131 -0.438 486 HB2 GLU 24 HB2 GLU 24 -14.714 -3.335 -0.211 487 HB3 GLU 24 HB3 GLU 24 -14.666 -2.134 1.093 488 HG2 GLU 24 HG2 GLU 24 -16.164 -0.663 -0.250 489 HG3 GLU 24 HG3 GLU 24 -16.222 -1.892 -1.525 490 H ASN 25 H ASN 25 -14.448 0.296 -2.215 491 HA ASN 25 HA ASN 25 -14.691 -1.275 -4.650 492 HB2 ASN 25 HB2 ASN 25 -14.920 1.702 -4.133 493 HB3 ASN 25 HB3 ASN 25 -15.333 0.922 -5.635 494 HD21 ASN 25 HD21 ASN 25 -16.247 1.490 -2.392 495 HD22 ASN 25 HD22 ASN 25 -17.824 0.678 -2.412 496 H VAL 26 H VAL 26 -12.562 1.133 -3.162 497 HA VAL 26 HA VAL 26 -10.978 1.847 -5.445 498 HB VAL 26 HB VAL 26 -10.388 1.932 -2.471 499 HG11 VAL 26 HG11 VAL 26 -8.969 3.196 -4.842 500 HG12 VAL 26 HG12 VAL 26 -8.702 3.654 -3.146 501 HG13 VAL 26 HG13 VAL 26 -8.325 1.999 -3.681 502 HG21 VAL 26 HG21 VAL 26 -11.424 4.049 -4.409 503 HG22 VAL 26 HG22 VAL 26 -12.354 3.272 -3.108 504 HG23 VAL 26 HG23 VAL 26 -10.985 4.327 -2.703 505 H LYS 27 H LYS 27 -10.665 -0.599 -2.832 506 HA LYS 27 HA LYS 27 -8.068 -1.454 -3.501 507 HB2 LYS 27 HB2 LYS 27 -10.445 -2.806 -2.186 508 HB3 LYS 27 HB3 LYS 27 -8.848 -3.579 -2.377 509 HG2 LYS 27 HG2 LYS 27 -7.755 -1.854 -1.108 510 HG3 LYS 27 HG3 LYS 27 -9.240 -0.892 -1.004 511 HD2 LYS 27 HD2 LYS 27 -10.332 -2.659 0.315 512 HD3 LYS 27 HD3 LYS 27 -8.907 -3.709 0.124 513 HE2 LYS 27 HE2 LYS 27 -7.521 -1.963 1.232 514 HE3 LYS 27 HE3 LYS 27 -8.981 -1.012 1.539 515 HZ1 LYS 27 HZ1 LYS 27 -9.836 -2.801 2.853 516 HZ2 LYS 27 HZ2 LYS 27 -8.530 -3.750 2.519 517 HZ3 LYS 27 HZ3 LYS 27 -8.360 -2.384 3.424 518 H ALA 28 H ALA 28 -11.146 -2.080 -5.139 519 HA ALA 28 HA ALA 28 -10.085 -4.310 -6.685 520 HB1 ALA 28 HB1 ALA 28 -12.114 -3.988 -8.039 521 HB2 ALA 28 HB2 ALA 28 -12.508 -4.015 -6.301 522 HB3 ALA 28 HB3 ALA 28 -12.466 -2.473 -7.189 523 H LYS 29 H LYS 29 -9.921 -0.824 -6.827 524 HA LYS 29 HA LYS 29 -9.436 -0.549 -9.663 525 HB2 LYS 29 HB2 LYS 29 -8.519 1.311 -7.413 526 HB3 LYS 29 HB3 LYS 29 -8.933 1.759 -9.076 527 HG2 LYS 29 HG2 LYS 29 -10.899 0.688 -7.021 528 HG3 LYS 29 HG3 LYS 29 -10.552 2.411 -7.297 529 HD2 LYS 29 HD2 LYS 29 -11.214 2.159 -9.615 530 HD3 LYS 29 HD3 LYS 29 -11.742 0.475 -9.307 531 HE2 LYS 29 HE2 LYS 29 -13.272 1.245 -7.534 532 HE3 LYS 29 HE3 LYS 29 -12.730 2.906 -7.737 533 HZ1 LYS 29 HZ1 LYS 29 -13.604 2.890 -9.959 534 HZ2 LYS 29 HZ2 LYS 29 -14.155 1.349 -9.783 535 HZ3 LYS 29 HZ3 LYS 29 -14.784 2.571 -8.868 536 H ILE 30 H ILE 30 -7.412 -0.480 -6.737 537 HA ILE 30 HA ILE 30 -4.895 -0.306 -8.136 538 HB ILE 30 HB ILE 30 -5.632 -1.178 -5.314 539 HG12 ILE 30 HG12 ILE 30 -4.529 1.430 -6.412 540 HG13 ILE 30 HG13 ILE 30 -6.225 1.155 -5.977 541 HG21 ILE 30 HG21 ILE 30 -2.899 -0.443 -6.461 542 HG22 ILE 30 HG22 ILE 30 -3.245 -0.795 -4.751 543 HG23 ILE 30 HG23 ILE 30 -3.402 -2.073 -5.956 544 HD11 ILE 30 HD11 ILE 30 -5.054 2.378 -4.216 545 HD12 ILE 30 HD12 ILE 30 -5.583 0.794 -3.619 546 HD13 ILE 30 HD13 ILE 30 -3.874 1.074 -4.040 547 H GLN 31 H GLN 31 -6.971 -2.988 -7.052 548 HA GLN 31 HA GLN 31 -5.049 -5.072 -7.486 549 HB2 GLN 31 HB2 GLN 31 -7.047 -5.461 -6.136 550 HB3 GLN 31 HB3 GLN 31 -8.098 -5.002 -7.486 551 HG2 GLN 31 HG2 GLN 31 -7.347 -6.894 -8.811 552 HG3 GLN 31 HG3 GLN 31 -6.142 -7.326 -7.608 553 HE21 GLN 31 HE21 GLN 31 -6.875 -9.340 -6.927 554 HE22 GLN 31 HE22 GLN 31 -8.447 -9.603 -6.204 555 H ASP 32 H ASP 32 -7.463 -3.427 -9.566 556 HA ASP 32 HA ASP 32 -7.275 -5.352 -11.671 557 HB2 ASP 32 HB2 ASP 32 -9.166 -3.772 -11.257 558 HB3 ASP 32 HB3 ASP 32 -8.118 -2.423 -11.596 559 H LYS 33 H LYS 33 -5.498 -2.510 -10.767 560 HA LYS 33 HA LYS 33 -4.273 -2.013 -13.351 561 HB2 LYS 33 HB2 LYS 33 -3.981 -1.002 -10.513 562 HB3 LYS 33 HB3 LYS 33 -2.924 -0.411 -11.813 563 HG2 LYS 33 HG2 LYS 33 -5.969 -0.340 -11.994 564 HG3 LYS 33 HG3 LYS 33 -5.002 0.990 -11.320 565 HD2 LYS 33 HD2 LYS 33 -3.727 1.130 -13.456 566 HD3 LYS 33 HD3 LYS 33 -4.789 -0.124 -14.144 567 HE2 LYS 33 HE2 LYS 33 -6.760 1.327 -13.675 568 HE3 LYS 33 HE3 LYS 33 -5.676 2.579 -13.052 569 HZ1 LYS 33 HZ1 LYS 33 -6.267 2.973 -15.334 570 HZ2 LYS 33 HZ2 LYS 33 -4.650 2.684 -15.215 571 HZ3 LYS 33 HZ3 LYS 33 -5.657 1.518 -15.797 572 H GLU 34 H GLU 34 -3.401 -3.934 -10.499 573 HA GLU 34 HA GLU 34 -0.832 -4.563 -11.870 574 HB2 GLU 34 HB2 GLU 34 -1.222 -3.847 -8.940 575 HB3 GLU 34 HB3 GLU 34 0.267 -4.527 -9.592 576 HG2 GLU 34 HG2 GLU 34 -0.996 -1.899 -10.495 577 HG3 GLU 34 HG3 GLU 34 0.320 -2.048 -9.332 578 H GLY 35 H GLY 35 -3.357 -5.566 -9.538 579 HA2 GLY 35 HA2 GLY 35 -4.154 -7.849 -9.739 580 HA3 GLY 35 HA3 GLY 35 -2.474 -8.397 -9.921 581 H ILE 36 H ILE 36 -2.848 -5.814 -7.697 582 HA ILE 36 HA ILE 36 -1.899 -7.471 -5.523 583 HB ILE 36 HB ILE 36 -2.720 -4.545 -5.707 584 HG12 ILE 36 HG12 ILE 36 0.053 -5.818 -5.672 585 HG13 ILE 36 HG13 ILE 36 -0.785 -5.351 -7.156 586 HG21 ILE 36 HG21 ILE 36 -1.109 -5.986 -3.559 587 HG22 ILE 36 HG22 ILE 36 -1.499 -4.249 -3.610 588 HG23 ILE 36 HG23 ILE 36 -2.793 -5.446 -3.383 589 HD11 ILE 36 HD11 ILE 36 -0.903 -3.001 -6.349 590 HD12 ILE 36 HD12 ILE 36 0.008 -3.470 -4.894 591 HD13 ILE 36 HD13 ILE 36 0.765 -3.589 -6.494 592 HA PRO 37 HA PRO 37 -6.021 -8.439 -4.199 593 HB2 PRO 37 HB2 PRO 37 -5.465 -9.638 -1.784 594 HB3 PRO 37 HB3 PRO 37 -5.115 -10.403 -3.363 595 HG2 PRO 37 HG2 PRO 37 -3.235 -8.852 -1.570 596 HG3 PRO 37 HG3 PRO 37 -2.942 -10.434 -2.372 597 HD2 PRO 37 HD2 PRO 37 -2.037 -8.074 -3.400 598 HD3 PRO 37 HD3 PRO 37 -2.602 -9.396 -4.468 599 HA PRO 38 HA PRO 38 -7.295 -5.106 -1.627 600 HB2 PRO 38 HB2 PRO 38 -9.586 -6.121 -0.473 601 HB3 PRO 38 HB3 PRO 38 -9.454 -5.659 -2.200 602 HG2 PRO 38 HG2 PRO 38 -9.184 -8.421 -0.975 603 HG3 PRO 38 HG3 PRO 38 -10.145 -7.931 -2.409 604 HD2 PRO 38 HD2 PRO 38 -7.672 -9.042 -2.644 605 HD3 PRO 38 HD3 PRO 38 -8.213 -7.740 -3.750 606 H ASP 39 H ASP 39 -6.446 -8.197 -0.301 607 HA ASP 39 HA ASP 39 -6.860 -7.389 2.467 608 HB2 ASP 39 HB2 ASP 39 -7.217 -9.705 1.689 609 HB3 ASP 39 HB3 ASP 39 -5.508 -9.820 1.245 610 H GLN 40 H GLN 40 -4.366 -6.905 0.123 611 HA GLN 40 HA GLN 40 -2.326 -6.664 2.291 612 HB2 GLN 40 HB2 GLN 40 -2.040 -7.335 -0.648 613 HB3 GLN 40 HB3 GLN 40 -0.679 -6.964 0.427 614 HG2 GLN 40 HG2 GLN 40 -1.249 -8.830 1.896 615 HG3 GLN 40 HG3 GLN 40 -2.710 -9.174 0.952 616 HE21 GLN 40 HE21 GLN 40 0.664 -8.421 -0.149 617 HE22 GLN 40 HE22 GLN 40 0.857 -9.920 -1.028 618 H GLN 41 H GLN 41 -4.125 -4.797 -0.076 619 HA GLN 41 HA GLN 41 -2.201 -2.693 -0.403 620 HB2 GLN 41 HB2 GLN 41 -5.238 -2.742 -0.487 621 HB3 GLN 41 HB3 GLN 41 -4.252 -1.358 -0.984 622 HG2 GLN 41 HG2 GLN 41 -3.208 -2.656 -2.764 623 HG3 GLN 41 HG3 GLN 41 -4.007 -4.138 -2.190 624 HE21 GLN 41 HE21 GLN 41 -5.148 -4.471 -4.201 625 HE22 GLN 41 HE22 GLN 41 -6.543 -3.481 -4.563 626 H ARG 42 H ARG 42 -2.209 -0.603 0.549 627 HA ARG 42 HA ARG 42 -3.697 -0.115 3.054 628 HB2 ARG 42 HB2 ARG 42 -0.652 -0.162 2.844 629 HB3 ARG 42 HB3 ARG 42 -1.545 0.591 4.159 630 HG2 ARG 42 HG2 ARG 42 -1.621 -2.376 3.445 631 HG3 ARG 42 HG3 ARG 42 -0.709 -1.629 4.765 632 HD2 ARG 42 HD2 ARG 42 -2.855 -0.769 5.720 633 HD3 ARG 42 HD3 ARG 42 -3.744 -1.690 4.503 634 HE ARG 42 HE ARG 42 -2.372 -2.708 6.878 635 HH11 ARG 42 HH11 ARG 42 -3.704 -3.604 3.717 636 HH12 ARG 42 HH12 ARG 42 -3.893 -5.284 4.159 637 HH21 ARG 42 HH21 ARG 42 -2.651 -4.892 7.411 638 HH22 ARG 42 HH22 ARG 42 -3.294 -6.007 6.229 639 H LEU 43 H LEU 43 -4.772 1.511 1.861 640 HA LEU 43 HA LEU 43 -3.172 3.620 0.582 641 HB2 LEU 43 HB2 LEU 43 -6.108 2.957 0.879 642 HB3 LEU 43 HB3 LEU 43 -5.632 4.605 0.447 643 HG LEU 43 HG LEU 43 -4.814 2.108 -1.091 644 HD11 LEU 43 HD11 LEU 43 -6.493 2.908 -2.724 645 HD12 LEU 43 HD12 LEU 43 -7.238 2.498 -1.164 646 HD13 LEU 43 HD13 LEU 43 -6.968 4.203 -1.594 647 HD21 LEU 43 HD21 LEU 43 -4.226 3.800 -2.855 648 HD22 LEU 43 HD22 LEU 43 -4.606 5.098 -1.706 649 HD23 LEU 43 HD23 LEU 43 -3.236 4.003 -1.401 650 H ILE 44 H ILE 44 -2.825 5.626 1.283 651 HA ILE 44 HA ILE 44 -3.908 6.484 3.916 652 HB ILE 44 HB ILE 44 -1.021 6.518 2.947 653 HG12 ILE 44 HG12 ILE 44 -0.723 5.732 5.410 654 HG13 ILE 44 HG13 ILE 44 -2.456 5.398 5.381 655 HG21 ILE 44 HG21 ILE 44 -1.591 8.783 3.868 656 HG22 ILE 44 HG22 ILE 44 -2.149 7.984 5.366 657 HG23 ILE 44 HG23 ILE 44 -0.454 7.905 4.883 658 HD11 ILE 44 HD11 ILE 44 -2.147 3.720 3.640 659 HD12 ILE 44 HD12 ILE 44 -0.442 4.211 3.425 660 HD13 ILE 44 HD13 ILE 44 -0.986 3.418 4.925 661 H PHE 45 H PHE 45 -4.242 8.725 4.070 662 HA PHE 45 HA PHE 45 -3.723 10.464 1.741 663 HB2 PHE 45 HB2 PHE 45 -5.929 9.328 1.369 664 HB3 PHE 45 HB3 PHE 45 -6.487 9.952 2.919 665 HD1 PHE 45 HD1 PHE 45 -4.762 11.433 -0.102 666 HD2 PHE 45 HD2 PHE 45 -7.959 11.723 2.762 667 HE1 PHE 45 HE1 PHE 45 -5.593 13.444 -1.250 668 HE2 PHE 45 HE2 PHE 45 -8.773 13.779 1.642 669 HZ PHE 45 HZ PHE 45 -7.587 14.657 -0.358 670 H ALA 46 H ALA 46 -3.603 12.619 2.341 671 HA ALA 46 HA ALA 46 -2.877 14.225 3.733 672 HB1 ALA 46 HB1 ALA 46 -5.341 13.411 5.319 673 HB2 ALA 46 HB2 ALA 46 -4.497 14.972 5.423 674 HB3 ALA 46 HB3 ALA 46 -5.310 14.506 3.917 675 H GLY 47 H GLY 47 -2.212 11.217 4.464 676 HA2 GLY 47 HA2 GLY 47 -0.361 10.601 5.763 677 HA3 GLY 47 HA3 GLY 47 -0.650 11.945 6.863 678 H LYS 48 H LYS 48 -3.529 10.108 6.080 679 HA LYS 48 HA LYS 48 -3.020 8.256 8.340 680 HB2 LYS 48 HB2 LYS 48 -5.284 8.561 9.206 681 HB3 LYS 48 HB3 LYS 48 -4.329 10.043 9.296 682 HG2 LYS 48 HG2 LYS 48 -6.403 10.760 8.609 683 HG3 LYS 48 HG3 LYS 48 -5.424 10.757 7.131 684 HD2 LYS 48 HD2 LYS 48 -6.540 8.611 6.443 685 HD3 LYS 48 HD3 LYS 48 -7.544 8.677 7.903 686 HE2 LYS 48 HE2 LYS 48 -7.419 10.768 5.695 687 HE3 LYS 48 HE3 LYS 48 -8.714 9.581 5.943 688 HZ1 LYS 48 HZ1 LYS 48 -9.270 11.722 6.860 689 HZ2 LYS 48 HZ2 LYS 48 -9.155 10.602 8.058 690 HZ3 LYS 48 HZ3 LYS 48 -7.952 11.703 7.840 691 H GLN 49 H GLN 49 -4.563 6.474 8.367 692 HA GLN 49 HA GLN 49 -4.715 5.430 5.598 693 HB2 GLN 49 HB2 GLN 49 -3.344 4.200 7.183 694 HB3 GLN 49 HB3 GLN 49 -4.678 4.129 8.341 695 HG2 GLN 49 HG2 GLN 49 -5.985 2.747 6.751 696 HG3 GLN 49 HG3 GLN 49 -4.668 2.841 5.564 697 HE21 GLN 49 HE21 GLN 49 -5.741 0.411 6.555 698 HE22 GLN 49 HE22 GLN 49 -4.503 -0.399 7.496 699 H LEU 50 H LEU 50 -6.529 4.469 4.799 700 HA LEU 50 HA LEU 50 -9.044 5.541 5.973 701 HB2 LEU 50 HB2 LEU 50 -8.415 4.551 3.161 702 HB3 LEU 50 HB3 LEU 50 -9.959 5.220 3.719 703 HG LEU 50 HG LEU 50 -8.689 7.350 4.347 704 HD11 LEU 50 HD11 LEU 50 -6.644 7.747 2.892 705 HD12 LEU 50 HD12 LEU 50 -6.348 6.683 4.263 706 HD13 LEU 50 HD13 LEU 50 -6.565 5.992 2.629 707 HD21 LEU 50 HD21 LEU 50 -8.747 8.210 2.078 708 HD22 LEU 50 HD22 LEU 50 -8.704 6.555 1.410 709 HD23 LEU 50 HD23 LEU 50 -10.125 7.122 2.325 710 H GLU 51 H GLU 51 -11.059 4.096 5.462 711 HA GLU 51 HA GLU 51 -10.371 1.244 6.002 712 HB2 GLU 51 HB2 GLU 51 -11.977 3.160 7.694 713 HB3 GLU 51 HB3 GLU 51 -12.321 1.422 7.723 714 HG2 GLU 51 HG2 GLU 51 -9.997 0.940 8.337 715 HG3 GLU 51 HG3 GLU 51 -9.601 2.665 8.268 716 H ASP 52 H ASP 52 -12.010 -0.247 5.662 717 HA ASP 52 HA ASP 52 -13.526 0.268 3.273 718 HB2 ASP 52 HB2 ASP 52 -13.428 -2.106 5.179 719 HB3 ASP 52 HB3 ASP 52 -14.193 -2.112 3.589 720 H GLY 53 H GLY 53 -14.194 1.181 6.371 721 HA2 GLY 53 HA2 GLY 53 -17.112 0.610 6.168 722 HA3 GLY 53 HA3 GLY 53 -16.223 0.941 7.667 723 H ARG 54 H ARG 54 -15.093 2.933 5.153 724 HA ARG 54 HA ARG 54 -16.719 5.232 6.118 725 HB2 ARG 54 HB2 ARG 54 -14.026 5.318 4.727 726 HB3 ARG 54 HB3 ARG 54 -14.796 6.579 5.690 727 HG2 ARG 54 HG2 ARG 54 -13.778 3.927 6.806 728 HG3 ARG 54 HG3 ARG 54 -12.889 5.451 6.850 729 HD2 ARG 54 HD2 ARG 54 -14.640 6.494 8.181 730 HD3 ARG 54 HD3 ARG 54 -15.615 5.007 8.123 731 HE ARG 54 HE ARG 54 -13.245 4.120 9.157 732 HH11 ARG 54 HH11 ARG 54 -15.365 6.806 10.047 733 HH12 ARG 54 HH12 ARG 54 -14.926 6.745 11.737 734 HH21 ARG 54 HH21 ARG 54 -12.673 4.074 11.317 735 HH22 ARG 54 HH22 ARG 54 -13.387 5.190 12.469 736 H THR 55 H THR 55 -15.748 6.917 4.026 737 HA THR 55 HA THR 55 -16.333 5.718 1.419 738 HB THR 55 HB THR 55 -17.815 7.791 0.927 739 HG1 THR 55 HG1 THR 55 -18.786 8.699 2.658 740 HG21 THR 55 HG21 THR 55 -18.949 5.708 2.841 741 HG22 THR 55 HG22 THR 55 -19.835 6.617 1.595 742 HG23 THR 55 HG23 THR 55 -18.634 5.392 1.122 743 H LEU 56 H LEU 56 -15.523 7.157 -0.316 744 HA LEU 56 HA LEU 56 -13.128 8.541 0.451 745 HB2 LEU 56 HB2 LEU 56 -14.827 8.608 -2.079 746 HB3 LEU 56 HB3 LEU 56 -13.269 9.418 -1.928 747 HG LEU 56 HG LEU 56 -13.775 6.417 -1.711 748 HD11 LEU 56 HD11 LEU 56 -13.828 7.326 -4.010 749 HD12 LEU 56 HD12 LEU 56 -12.249 8.114 -3.735 750 HD13 LEU 56 HD13 LEU 56 -12.375 6.341 -3.754 751 HD21 LEU 56 HD21 LEU 56 -11.925 7.074 -0.194 752 HD22 LEU 56 HD22 LEU 56 -11.314 6.188 -1.594 753 HD23 LEU 56 HD23 LEU 56 -11.151 7.955 -1.542 754 H SER 57 H SER 57 -16.490 9.451 0.224 755 HA SER 57 HA SER 57 -16.134 12.295 0.266 756 HB2 SER 57 HB2 SER 57 -18.569 12.214 0.718 757 HB3 SER 57 HB3 SER 57 -18.119 11.101 -0.591 758 HG SER 57 HG SER 57 -19.517 10.143 0.923 759 H ASP 58 H ASP 58 -16.134 9.750 2.705 760 HA ASP 58 HA ASP 58 -16.665 11.442 4.980 761 HB2 ASP 58 HB2 ASP 58 -16.849 8.876 4.819 762 HB3 ASP 58 HB3 ASP 58 -15.090 8.843 4.964 763 H TYR 59 H TYR 59 -13.930 10.980 2.946 764 HA TYR 59 HA TYR 59 -12.182 12.364 4.913 765 HB2 TYR 59 HB2 TYR 59 -11.473 10.129 2.979 766 HB3 TYR 59 HB3 TYR 59 -10.284 11.108 3.850 767 HD1 TYR 59 HD1 TYR 59 -11.552 11.339 6.540 768 HD2 TYR 59 HD2 TYR 59 -11.199 7.984 3.882 769 HE1 TYR 59 HE1 TYR 59 -11.611 9.804 8.483 770 HE2 TYR 59 HE2 TYR 59 -11.221 6.431 5.837 771 HH TYR 59 HH TYR 59 -11.334 6.253 8.123 772 H ASN 60 H ASN 60 -14.021 13.268 2.779 773 HA ASN 60 HA ASN 60 -14.156 14.783 1.184 774 HB2 ASN 60 HB2 ASN 60 -13.107 16.801 1.717 775 HB3 ASN 60 HB3 ASN 60 -13.349 15.934 3.235 776 HD21 ASN 60 HD21 ASN 60 -11.634 15.412 4.535 777 HD22 ASN 60 HD22 ASN 60 -9.971 15.819 4.150 778 H ILE 61 H ILE 61 -12.243 12.490 0.427 779 HA ILE 61 HA ILE 61 -10.200 13.550 -1.235 780 HB ILE 61 HB ILE 61 -11.777 10.964 -1.237 781 HG12 ILE 61 HG12 ILE 61 -8.896 11.694 -0.564 782 HG13 ILE 61 HG13 ILE 61 -10.190 11.494 0.633 783 HG21 ILE 61 HG21 ILE 61 -10.129 10.086 -2.868 784 HG22 ILE 61 HG22 ILE 61 -11.061 11.405 -3.572 785 HG23 ILE 61 HG23 ILE 61 -9.404 11.707 -3.009 786 HD11 ILE 61 HD11 ILE 61 -8.732 9.519 0.472 787 HD12 ILE 61 HD12 ILE 61 -10.429 9.154 0.092 788 HD13 ILE 61 HD13 ILE 61 -9.214 9.284 -1.214 789 H GLN 62 H GLN 62 -10.101 14.328 -3.225 790 HA GLN 62 HA GLN 62 -12.505 14.393 -5.002 791 HB2 GLN 62 HB2 GLN 62 -10.498 16.633 -4.631 792 HB3 GLN 62 HB3 GLN 62 -12.051 16.704 -5.471 793 HG2 GLN 62 HG2 GLN 62 -11.663 16.337 -2.471 794 HG3 GLN 62 HG3 GLN 62 -12.008 17.860 -3.247 795 HE21 GLN 62 HE21 GLN 62 -13.586 16.368 -1.216 796 HE22 GLN 62 HE22 GLN 62 -15.174 16.137 -1.931 797 H LYS 63 H LYS 63 -11.522 15.563 -7.125 798 HA LYS 63 HA LYS 63 -9.885 13.587 -8.348 799 HB2 LYS 63 HB2 LYS 63 -11.426 15.816 -9.119 800 HB3 LYS 63 HB3 LYS 63 -9.747 16.238 -9.562 801 HG2 LYS 63 HG2 LYS 63 -9.524 14.074 -10.721 802 HG3 LYS 63 HG3 LYS 63 -11.180 13.649 -10.196 803 HD2 LYS 63 HD2 LYS 63 -11.138 14.431 -12.570 804 HD3 LYS 63 HD3 LYS 63 -12.080 15.530 -11.532 805 HE2 LYS 63 HE2 LYS 63 -10.129 17.037 -11.359 806 HE3 LYS 63 HE3 LYS 63 -9.173 15.930 -12.362 807 HZ1 LYS 63 HZ1 LYS 63 -10.074 17.738 -13.642 808 HZ2 LYS 63 HZ2 LYS 63 -10.724 16.325 -14.158 809 HZ3 LYS 63 HZ3 LYS 63 -11.610 17.347 -13.215 810 H GLU 64 H GLU 64 -7.824 13.456 -8.890 811 HA GLU 64 HA GLU 64 -5.581 13.743 -8.779 812 HB2 GLU 64 HB2 GLU 64 -6.315 16.686 -8.969 813 HB3 GLU 64 HB3 GLU 64 -4.813 15.903 -9.502 814 HG2 GLU 64 HG2 GLU 64 -6.134 14.548 -11.141 815 HG3 GLU 64 HG3 GLU 64 -7.592 15.421 -10.649 816 H SER 65 H SER 65 -6.998 13.717 -6.164 817 HA SER 65 HA SER 65 -6.028 15.750 -4.428 818 HB2 SER 65 HB2 SER 65 -6.935 14.211 -2.701 819 HB3 SER 65 HB3 SER 65 -8.068 14.457 -4.046 820 HG SER 65 HG SER 65 -7.816 12.233 -3.488 821 H THR 66 H THR 66 -4.606 12.870 -5.633 822 HA THR 66 HA THR 66 -2.769 11.652 -5.275 823 HB THR 66 HB THR 66 -1.833 14.130 -3.844 824 HG1 THR 66 HG1 THR 66 -1.371 13.148 -6.462 825 HG21 THR 66 HG21 THR 66 -0.424 12.194 -3.191 826 HG22 THR 66 HG22 THR 66 -0.286 11.709 -4.901 827 HG23 THR 66 HG23 THR 66 0.460 13.219 -4.335 828 H LEU 67 H LEU 67 -2.500 9.955 -4.073 829 HA LEU 67 HA LEU 67 -2.843 10.042 -1.102 830 HB2 LEU 67 HB2 LEU 67 -4.053 8.192 -3.176 831 HB3 LEU 67 HB3 LEU 67 -3.698 7.603 -1.552 832 HG LEU 67 HG LEU 67 -5.113 9.458 -0.618 833 HD11 LEU 67 HD11 LEU 67 -5.310 10.952 -2.582 834 HD12 LEU 67 HD12 LEU 67 -6.016 9.624 -3.534 835 HD13 LEU 67 HD13 LEU 67 -6.901 10.310 -2.151 836 HD21 LEU 67 HD21 LEU 67 -5.824 7.110 -0.782 837 HD22 LEU 67 HD22 LEU 67 -7.186 8.214 -1.054 838 HD23 LEU 67 HD23 LEU 67 -6.409 7.395 -2.438 839 H HIS 68 H HIS 68 -2.059 7.600 -0.406 840 HA HIS 68 HA HIS 68 0.442 6.987 -1.894 841 HB2 HIS 68 HB2 HIS 68 0.261 7.310 1.119 842 HB3 HIS 68 HB3 HIS 68 1.714 6.973 0.162 843 HD2 HIS 68 HD2 HIS 68 2.553 9.067 -1.500 844 HE1 HIS 68 HE1 HIS 68 0.492 12.110 0.632 845 HE2 HIS 68 HE2 HIS 68 2.277 11.645 -1.114 846 H LEU 69 H LEU 69 1.056 4.812 -1.796 847 HA LEU 69 HA LEU 69 -0.824 2.960 -0.426 848 HB2 LEU 69 HB2 LEU 69 -1.433 3.352 -2.794 849 HB3 LEU 69 HB3 LEU 69 0.176 2.861 -3.304 850 HG LEU 69 HG LEU 69 -1.711 1.190 -3.566 851 HD11 LEU 69 HD11 LEU 69 0.672 0.560 -3.702 852 HD12 LEU 69 HD12 LEU 69 0.671 0.187 -1.959 853 HD13 LEU 69 HD13 LEU 69 -0.356 -0.736 -3.064 854 HD21 LEU 69 HD21 LEU 69 -1.331 0.788 -0.571 855 HD22 LEU 69 HD22 LEU 69 -2.745 1.548 -1.327 856 HD23 LEU 69 HD23 LEU 69 -2.369 -0.158 -1.657 857 H VAL 70 H VAL 70 0.108 1.311 0.563 858 HA VAL 70 HA VAL 70 2.854 0.433 -0.136 859 HB VAL 70 HB VAL 70 1.832 1.021 2.676 860 HG11 VAL 70 HG11 VAL 70 3.342 -0.912 2.709 861 HG12 VAL 70 HG12 VAL 70 4.519 -0.040 1.687 862 HG13 VAL 70 HG13 VAL 70 4.179 0.504 3.342 863 HG21 VAL 70 HG21 VAL 70 2.438 3.086 1.494 864 HG22 VAL 70 HG22 VAL 70 3.698 2.694 2.675 865 HG23 VAL 70 HG23 VAL 70 3.965 2.358 0.947 866 H LEU 71 H LEU 71 3.154 -1.893 0.937 867 HA LEU 71 HA LEU 71 0.542 -3.211 1.254 868 HB2 LEU 71 HB2 LEU 71 1.125 -4.867 -0.569 869 HB3 LEU 71 HB3 LEU 71 0.658 -3.250 -1.076 870 HG LEU 71 HG LEU 71 3.011 -2.645 -1.493 871 HD11 LEU 71 HD11 LEU 71 3.593 -5.540 -0.736 872 HD12 LEU 71 HD12 LEU 71 4.724 -4.453 -1.578 873 HD13 LEU 71 HD13 LEU 71 4.223 -4.081 0.075 874 HD21 LEU 71 HD21 LEU 71 2.124 -5.255 -2.786 875 HD22 LEU 71 HD22 LEU 71 1.611 -3.619 -3.266 876 HD23 LEU 71 HD23 LEU 71 3.311 -4.107 -3.453 877 H ARG 72 H ARG 72 0.766 -5.617 1.503 878 HA ARG 72 HA ARG 72 3.040 -6.271 3.320 879 HB2 ARG 72 HB2 ARG 72 0.143 -7.100 3.069 880 HB3 ARG 72 HB3 ARG 72 1.302 -8.196 3.826 881 HG2 ARG 72 HG2 ARG 72 0.041 -6.685 5.400 882 HG3 ARG 72 HG3 ARG 72 1.808 -6.688 5.569 883 HD2 ARG 72 HD2 ARG 72 2.001 -4.602 4.380 884 HD3 ARG 72 HD3 ARG 72 0.256 -4.591 4.017 885 HE ARG 72 HE ARG 72 0.274 -4.731 6.738 886 HH11 ARG 72 HH11 ARG 72 1.989 -2.598 4.500 887 HH12 ARG 72 HH12 ARG 72 2.011 -1.254 5.620 888 HH21 ARG 72 HH21 ARG 72 0.304 -2.964 8.164 889 HH22 ARG 72 HH22 ARG 72 1.039 -1.455 7.683 890 H LEU 73 H LEU 73 3.271 -8.854 3.256 891 HA LEU 73 HA LEU 73 3.747 -9.479 0.396 892 HB2 LEU 73 HB2 LEU 73 5.664 -8.750 2.222 893 HB3 LEU 73 HB3 LEU 73 5.631 -10.495 2.490 894 HG LEU 73 HG LEU 73 5.949 -10.755 -0.043 895 HD11 LEU 73 HD11 LEU 73 5.162 -8.484 -0.686 896 HD12 LEU 73 HD12 LEU 73 6.485 -7.759 0.233 897 HD13 LEU 73 HD13 LEU 73 6.842 -8.731 -1.215 898 HD21 LEU 73 HD21 LEU 73 7.792 -10.974 1.588 899 HD22 LEU 73 HD22 LEU 73 8.365 -10.207 0.091 900 HD23 LEU 73 HD23 LEU 73 8.054 -9.214 1.537 901 H ARG 74 H ARG 74 1.667 -10.218 2.324 902 HA ARG 74 HA ARG 74 0.392 -11.950 3.044 903 HB2 ARG 74 HB2 ARG 74 0.691 -12.551 0.613 904 HB3 ARG 74 HB3 ARG 74 1.989 -13.649 1.084 905 HG2 ARG 74 HG2 ARG 74 -0.087 -14.889 0.777 906 HG3 ARG 74 HG3 ARG 74 0.403 -14.953 2.476 907 HD2 ARG 74 HD2 ARG 74 -1.218 -13.186 3.034 908 HD3 ARG 74 HD3 ARG 74 -1.658 -13.033 1.319 909 HE ARG 74 HE ARG 74 -2.005 -15.742 2.085 910 HH11 ARG 74 HH11 ARG 74 -3.409 -12.566 2.768 911 HH12 ARG 74 HH12 ARG 74 -4.992 -13.210 3.119 912 HH21 ARG 74 HH21 ARG 74 -4.083 -16.557 2.545 913 HH22 ARG 74 HH22 ARG 74 -5.373 -15.465 2.988 914 H GLY 75 H GLY 75 3.834 -12.468 3.113 915 HA2 GLY 75 HA2 GLY 75 4.371 -13.174 5.590 916 HA3 GLY 75 HA3 GLY 75 3.586 -14.685 5.033 917 H GLY 76 H GLY 76 4.779 -13.733 2.248 918 HA2 GLY 76 HA2 GLY 76 7.570 -13.874 2.267 919 HA3 GLY 76 HA3 GLY 76 7.002 -15.553 2.261 Start of MODEL 5 1 H LEU 491 H LEU 491 14.948 7.439 10.421 2 HA LEU 491 HA LEU 491 17.528 6.833 10.633 3 HB2 LEU 491 HB2 LEU 491 15.937 4.687 9.378 4 HB3 LEU 491 HB3 LEU 491 16.833 4.790 10.898 5 HG LEU 491 HG LEU 491 14.870 6.219 11.790 6 HD11 LEU 491 HD11 LEU 491 13.725 6.523 9.550 7 HD12 LEU 491 HD12 LEU 491 13.485 4.763 9.495 8 HD13 LEU 491 HD13 LEU 491 12.696 5.723 10.759 9 HD21 LEU 491 HD21 LEU 491 15.431 3.915 12.476 10 HD22 LEU 491 HD22 LEU 491 13.671 4.177 12.418 11 HD23 LEU 491 HD23 LEU 491 14.479 3.281 11.112 12 HA PRO 492 HA PRO 492 19.467 6.829 6.548 13 HB2 PRO 492 HB2 PRO 492 21.065 4.601 7.727 14 HB3 PRO 492 HB3 PRO 492 21.640 6.129 6.991 15 HG2 PRO 492 HG2 PRO 492 21.736 5.748 9.679 16 HG3 PRO 492 HG3 PRO 492 21.221 7.331 8.996 17 HD2 PRO 492 HD2 PRO 492 19.468 5.073 10.005 18 HD3 PRO 492 HD3 PRO 492 19.368 6.830 10.350 19 H LEU 493 H LEU 493 20.575 4.749 5.312 20 HA LEU 493 HA LEU 493 18.416 2.848 4.825 21 HB2 LEU 493 HB2 LEU 493 20.401 4.212 3.339 22 HB3 LEU 493 HB3 LEU 493 21.102 2.609 3.465 23 HG LEU 493 HG LEU 493 18.287 3.259 2.531 24 HD11 LEU 493 HD11 LEU 493 20.782 2.651 0.878 25 HD12 LEU 493 HD12 LEU 493 19.145 2.855 0.216 26 HD13 LEU 493 HD13 LEU 493 19.959 4.224 1.002 27 HD21 LEU 493 HD21 LEU 493 19.938 0.708 2.194 28 HD22 LEU 493 HD22 LEU 493 18.589 0.907 3.331 29 HD23 LEU 493 HD23 LEU 493 18.284 0.964 1.583 30 H GLN 494 H GLN 494 19.567 2.845 7.344 31 HA GLN 494 HA GLN 494 21.569 0.863 7.647 32 HB2 GLN 494 HB2 GLN 494 21.376 1.396 9.832 33 HB3 GLN 494 HB3 GLN 494 20.630 2.850 9.151 34 HG2 GLN 494 HG2 GLN 494 19.160 0.419 10.238 35 HG3 GLN 494 HG3 GLN 494 19.427 1.939 11.109 36 HE21 GLN 494 HE21 GLN 494 17.080 1.877 11.406 37 HE22 GLN 494 HE22 GLN 494 16.034 2.386 10.083 38 H ALA 495 H ALA 495 18.085 0.732 7.369 39 HA ALA 495 HA ALA 495 18.117 -2.209 7.623 40 HB1 ALA 495 HB1 ALA 495 16.401 -0.359 9.319 41 HB2 ALA 495 HB2 ALA 495 16.196 -2.124 9.220 42 HB3 ALA 495 HB3 ALA 495 17.687 -1.440 9.906 43 H LEU 496 H LEU 496 17.195 0.427 5.826 44 HA LEU 496 HA LEU 496 14.553 -0.430 5.028 45 HB2 LEU 496 HB2 LEU 496 16.662 1.505 4.050 46 HB3 LEU 496 HB3 LEU 496 15.311 1.080 2.994 47 HG LEU 496 HG LEU 496 13.697 1.809 4.696 48 HD11 LEU 496 HD11 LEU 496 14.933 1.404 6.766 49 HD12 LEU 496 HD12 LEU 496 16.166 2.600 6.295 50 HD13 LEU 496 HD13 LEU 496 14.509 3.125 6.659 51 HD21 LEU 496 HD21 LEU 496 14.212 4.226 4.551 52 HD22 LEU 496 HD22 LEU 496 15.887 3.829 4.085 53 HD23 LEU 496 HD23 LEU 496 14.535 3.398 3.012 54 HA PRO 497 HA PRO 497 15.351 -3.618 2.061 55 HB2 PRO 497 HB2 PRO 497 13.992 -1.830 0.057 56 HB3 PRO 497 HB3 PRO 497 13.692 -3.566 0.402 57 HG2 PRO 497 HG2 PRO 497 12.003 -1.689 1.380 58 HG3 PRO 497 HG3 PRO 497 12.547 -3.038 2.430 59 HD2 PRO 497 HD2 PRO 497 13.570 -0.202 2.366 60 HD3 PRO 497 HD3 PRO 497 13.198 -1.248 3.774 61 H GLU 498 H GLU 498 16.543 -4.137 0.101 62 HA GLU 498 HA GLU 498 18.846 -2.404 -0.138 63 HB2 GLU 498 HB2 GLU 498 18.901 -4.902 0.043 64 HB3 GLU 498 HB3 GLU 498 18.255 -4.993 -1.613 65 HG2 GLU 498 HG2 GLU 498 20.228 -3.755 -2.453 66 HG3 GLU 498 HG3 GLU 498 20.808 -3.533 -0.800 67 H GLY 499 H GLY 499 17.440 -0.673 -0.976 68 HA2 GLY 499 HA2 GLY 499 18.307 0.207 -3.398 69 HA3 GLY 499 HA3 GLY 499 16.868 -0.748 -3.837 70 H VAL 500 H VAL 500 15.539 -0.084 -1.239 71 HA VAL 500 HA VAL 500 14.104 2.256 -2.055 72 HB VAL 500 HB VAL 500 14.216 0.600 0.479 73 HG11 VAL 500 HG11 VAL 500 13.356 2.791 1.187 74 HG12 VAL 500 HG12 VAL 500 12.262 2.847 -0.220 75 HG13 VAL 500 HG13 VAL 500 12.015 1.648 1.066 76 HG21 VAL 500 HG21 VAL 500 12.188 0.876 -1.785 77 HG22 VAL 500 HG22 VAL 500 13.330 -0.473 -1.584 78 HG23 VAL 500 HG23 VAL 500 12.040 -0.211 -0.391 79 H ASP 501 H ASP 501 13.787 4.138 -0.502 80 HA ASP 501 HA ASP 501 16.318 5.114 0.730 81 HB2 ASP 501 HB2 ASP 501 16.066 5.763 -1.769 82 HB3 ASP 501 HB3 ASP 501 14.674 6.721 -1.260 83 H GLN 502 H GLN 502 16.001 6.640 2.264 84 HA GLN 502 HA GLN 502 13.571 6.414 3.728 85 HB2 GLN 502 HB2 GLN 502 14.703 8.387 5.011 86 HB3 GLN 502 HB3 GLN 502 15.384 6.763 5.074 87 HG2 GLN 502 HG2 GLN 502 16.359 8.889 3.123 88 HG3 GLN 502 HG3 GLN 502 17.016 8.649 4.753 89 HE21 GLN 502 HE21 GLN 502 16.452 5.559 4.203 90 HE22 GLN 502 HE22 GLN 502 17.938 5.112 3.393 91 H GLU 503 H GLU 503 14.688 8.796 1.312 92 HA GLU 503 HA GLU 503 12.478 10.580 1.928 93 HB2 GLU 503 HB2 GLU 503 14.544 10.448 -0.289 94 HB3 GLU 503 HB3 GLU 503 13.218 11.642 -0.298 95 HG2 GLU 503 HG2 GLU 503 13.819 12.420 1.922 96 HG3 GLU 503 HG3 GLU 503 15.099 11.219 2.048 97 H VAL 504 H VAL 504 12.398 7.585 0.867 98 HA VAL 504 HA VAL 504 9.887 8.041 -0.654 99 HB VAL 504 HB VAL 504 12.027 5.923 -1.186 100 HG11 VAL 504 HG11 VAL 504 9.923 4.858 -1.649 101 HG12 VAL 504 HG12 VAL 504 9.288 6.321 -2.452 102 HG13 VAL 504 HG13 VAL 504 10.601 5.378 -3.197 103 HG21 VAL 504 HG21 VAL 504 11.003 8.240 -2.876 104 HG22 VAL 504 HG22 VAL 504 12.596 8.146 -2.084 105 HG23 VAL 504 HG23 VAL 504 12.191 7.021 -3.394 106 H PHE 505 H PHE 505 10.990 7.268 2.273 107 HA PHE 505 HA PHE 505 8.829 5.272 2.665 108 HB2 PHE 505 HB2 PHE 505 10.481 3.738 2.682 109 HB3 PHE 505 HB3 PHE 505 11.740 4.933 2.947 110 HD1 PHE 505 HD1 PHE 505 12.274 5.812 5.156 111 HD2 PHE 505 HD2 PHE 505 9.587 2.507 4.626 112 HE1 PHE 505 HE1 PHE 505 12.644 5.140 7.520 113 HE2 PHE 505 HE2 PHE 505 9.961 1.827 7.002 114 HZ PHE 505 HZ PHE 505 11.494 3.143 8.431 115 H LYS 506 H LYS 506 10.635 8.019 3.866 116 HA LYS 506 HA LYS 506 9.619 7.905 6.572 117 HB2 LYS 506 HB2 LYS 506 10.724 10.135 4.835 118 HB3 LYS 506 HB3 LYS 506 10.219 10.382 6.516 119 HG2 LYS 506 HG2 LYS 506 11.782 8.665 7.292 120 HG3 LYS 506 HG3 LYS 506 12.331 8.366 5.639 121 HD2 LYS 506 HD2 LYS 506 12.551 10.999 7.160 122 HD3 LYS 506 HD3 LYS 506 13.883 9.871 6.810 123 HE2 LYS 506 HE2 LYS 506 13.652 10.278 4.418 124 HE3 LYS 506 HE3 LYS 506 12.254 11.332 4.696 125 HZ1 LYS 506 HZ1 LYS 506 13.645 12.833 5.875 126 HZ2 LYS 506 HZ2 LYS 506 14.934 11.829 5.798 127 HZ3 LYS 506 HZ3 LYS 506 14.355 12.533 4.421 128 H GLN 507 H GLN 507 8.043 8.535 3.588 129 HA GLN 507 HA GLN 507 6.164 10.491 4.653 130 HB2 GLN 507 HB2 GLN 507 5.828 8.824 2.137 131 HB3 GLN 507 HB3 GLN 507 5.112 10.396 2.517 132 HG2 GLN 507 HG2 GLN 507 6.838 10.927 1.006 133 HG3 GLN 507 HG3 GLN 507 7.555 11.292 2.583 134 HE21 GLN 507 HE21 GLN 507 9.722 10.736 2.506 135 HE22 GLN 507 HE22 GLN 507 10.307 9.230 1.849 136 H LEU 508 H LEU 508 6.582 7.162 4.989 137 HA LEU 508 HA LEU 508 3.772 6.351 5.114 138 HB2 LEU 508 HB2 LEU 508 6.296 4.953 6.083 139 HB3 LEU 508 HB3 LEU 508 4.739 4.200 5.707 140 HG LEU 508 HG LEU 508 6.529 5.601 3.671 141 HD11 LEU 508 HD11 LEU 508 6.059 2.629 4.050 142 HD12 LEU 508 HD12 LEU 508 7.198 3.430 2.941 143 HD13 LEU 508 HD13 LEU 508 7.479 3.495 4.690 144 HD21 LEU 508 HD21 LEU 508 5.059 4.489 2.020 145 HD22 LEU 508 HD22 LEU 508 4.053 3.858 3.340 146 HD23 LEU 508 HD23 LEU 508 4.138 5.611 3.044 147 HA PRO 509 HA PRO 509 3.211 7.423 9.393 148 HB2 PRO 509 HB2 PRO 509 1.498 5.385 10.193 149 HB3 PRO 509 HB3 PRO 509 1.011 6.856 9.314 150 HG2 PRO 509 HG2 PRO 509 1.577 4.092 8.245 151 HG3 PRO 509 HG3 PRO 509 0.257 5.212 7.770 152 HD2 PRO 509 HD2 PRO 509 2.538 4.902 6.273 153 HD3 PRO 509 HD3 PRO 509 1.716 6.485 6.417 154 H ALA 510 H ALA 510 3.518 6.549 11.579 155 HA ALA 510 HA ALA 510 5.920 5.092 11.829 156 HB1 ALA 510 HB1 ALA 510 3.686 5.653 13.820 157 HB2 ALA 510 HB2 ALA 510 5.345 5.152 14.246 158 HB3 ALA 510 HB3 ALA 510 5.055 6.723 13.455 159 H ASP 511 H ASP 511 2.613 3.984 11.500 160 HA ASP 511 HA ASP 511 3.226 1.303 12.561 161 HB2 ASP 511 HB2 ASP 511 0.740 2.444 11.197 162 HB3 ASP 511 HB3 ASP 511 0.852 0.856 11.968 163 H ILE 512 H ILE 512 3.927 2.899 9.739 164 HA ILE 512 HA ILE 512 4.119 0.264 8.365 165 HB ILE 512 HB ILE 512 3.767 3.027 7.166 166 HG12 ILE 512 HG12 ILE 512 2.080 0.496 7.305 167 HG13 ILE 512 HG13 ILE 512 1.726 2.067 8.041 168 HG21 ILE 512 HG21 ILE 512 4.177 0.340 5.777 169 HG22 ILE 512 HG22 ILE 512 3.812 1.885 4.975 170 HG23 ILE 512 HG23 ILE 512 5.350 1.686 5.813 171 HD11 ILE 512 HD11 ILE 512 1.549 3.061 5.748 172 HD12 ILE 512 HD12 ILE 512 1.752 1.423 5.066 173 HD13 ILE 512 HD13 ILE 512 0.355 1.783 6.091 174 H GLN 513 H GLN 513 5.817 2.998 9.738 175 HA GLN 513 HA GLN 513 8.341 2.664 8.497 176 HB2 GLN 513 HB2 GLN 513 7.633 3.113 11.439 177 HB3 GLN 513 HB3 GLN 513 9.266 3.254 10.780 178 HG2 GLN 513 HG2 GLN 513 6.903 4.947 9.879 179 HG3 GLN 513 HG3 GLN 513 8.129 5.452 11.049 180 HE21 GLN 513 HE21 GLN 513 7.246 5.525 7.814 181 HE22 GLN 513 HE22 GLN 513 8.809 5.816 7.087 182 H GLU 514 H GLU 514 6.669 0.790 11.020 183 HA GLU 514 HA GLU 514 8.862 -1.048 11.429 184 HB2 GLU 514 HB2 GLU 514 7.294 -2.174 12.926 185 HB3 GLU 514 HB3 GLU 514 7.241 -0.426 13.199 186 HG2 GLU 514 HG2 GLU 514 5.199 -0.259 11.811 187 HG3 GLU 514 HG3 GLU 514 5.252 -2.008 11.524 188 H GLU 515 H GLU 515 6.827 -0.756 8.781 189 HA GLU 515 HA GLU 515 6.577 -3.710 8.442 190 HB2 GLU 515 HB2 GLU 515 5.279 -1.415 6.937 191 HB3 GLU 515 HB3 GLU 515 4.991 -3.132 6.653 192 HG2 GLU 515 HG2 GLU 515 4.429 -1.750 9.310 193 HG3 GLU 515 HG3 GLU 515 3.241 -1.906 8.017 194 H ILE 516 H ILE 516 8.363 -0.935 7.320 195 HA ILE 516 HA ILE 516 9.272 -2.462 4.912 196 HB ILE 516 HB ILE 516 9.220 0.478 5.633 197 HG12 ILE 516 HG12 ILE 516 8.122 0.783 3.556 198 HG13 ILE 516 HG13 ILE 516 8.394 -0.906 3.059 199 HG21 ILE 516 HG21 ILE 516 10.818 -0.879 3.420 200 HG22 ILE 516 HG22 ILE 516 10.507 0.865 3.498 201 HG23 ILE 516 HG23 ILE 516 11.470 0.094 4.767 202 HD11 ILE 516 HD11 ILE 516 6.793 -1.696 4.683 203 HD12 ILE 516 HD12 ILE 516 6.671 -0.064 5.412 204 HD13 ILE 516 HD13 ILE 516 6.050 -0.371 3.771 205 H LEU 517 H LEU 517 10.231 -1.071 8.024 206 HA LEU 517 HA LEU 517 13.053 -1.548 7.742 207 HB2 LEU 517 HB2 LEU 517 11.145 -1.386 10.107 208 HB3 LEU 517 HB3 LEU 517 12.875 -1.657 10.316 209 HG LEU 517 HG LEU 517 11.712 0.734 8.822 210 HD11 LEU 517 HD11 LEU 517 12.788 0.528 11.670 211 HD12 LEU 517 HD12 LEU 517 12.272 2.024 10.853 212 HD13 LEU 517 HD13 LEU 517 11.083 0.756 11.229 213 HD21 LEU 517 HD21 LEU 517 13.969 1.668 9.093 214 HD22 LEU 517 HD22 LEU 517 14.485 0.217 9.972 215 HD23 LEU 517 HD23 LEU 517 14.070 0.112 8.240 216 H SER 518 H SER 518 10.453 -3.701 7.655 217 HA SER 518 HA SER 518 12.344 -5.933 8.007 218 HB2 SER 518 HB2 SER 518 10.803 -7.188 9.419 219 HB3 SER 518 HB3 SER 518 11.324 -5.672 10.197 220 HG SER 518 HG SER 518 9.061 -5.990 10.367 221 H GLY 519 H GLY 519 10.544 -4.478 5.902 222 HA2 GLY 519 HA2 GLY 519 9.456 -6.966 4.642 223 HA3 GLY 519 HA3 GLY 519 8.743 -5.338 4.423 224 H LYS 520 H LYS 520 11.421 -7.478 3.661 225 HA LYS 520 HA LYS 520 12.919 -5.236 2.398 226 HB2 LYS 520 HB2 LYS 520 14.098 -7.888 3.192 227 HB3 LYS 520 HB3 LYS 520 14.871 -6.315 3.019 228 HG2 LYS 520 HG2 LYS 520 13.008 -7.233 5.261 229 HG3 LYS 520 HG3 LYS 520 14.750 -7.020 5.371 230 HD2 LYS 520 HD2 LYS 520 12.675 -4.823 4.967 231 HD3 LYS 520 HD3 LYS 520 13.621 -5.141 6.427 232 HE2 LYS 520 HE2 LYS 520 14.722 -4.277 3.736 233 HE3 LYS 520 HE3 LYS 520 14.498 -3.253 5.167 234 HZ1 LYS 520 HZ1 LYS 520 16.067 -4.616 6.333 235 HZ2 LYS 520 HZ2 LYS 520 16.282 -5.597 5.027 236 HZ3 LYS 520 HZ3 LYS 520 16.765 -4.027 4.966 237 H SER 521 H SER 521 10.940 -7.450 1.131 238 HA SER 521 HA SER 521 12.840 -8.097 -1.057 239 HB2 SER 521 HB2 SER 521 12.785 -9.932 0.695 240 HB3 SER 521 HB3 SER 521 11.088 -10.213 0.267 241 HG SER 521 HG SER 521 12.581 -11.569 -0.872 242 H ARG 522 H ARG 522 10.319 -6.371 -0.797 243 HA ARG 522 HA ARG 522 9.062 -7.478 -3.248 244 HB2 ARG 522 HB2 ARG 522 7.944 -7.320 -0.728 245 HB3 ARG 522 HB3 ARG 522 7.400 -5.792 -1.460 246 HG2 ARG 522 HG2 ARG 522 5.735 -7.080 -2.337 247 HG3 ARG 522 HG3 ARG 522 6.982 -7.543 -3.529 248 HD2 ARG 522 HD2 ARG 522 6.323 -8.962 -0.924 249 HD3 ARG 522 HD3 ARG 522 5.845 -9.526 -2.546 250 HE ARG 522 HE ARG 522 8.666 -9.242 -2.502 251 HH11 ARG 522 HH11 ARG 522 6.143 -11.256 -1.067 252 HH12 ARG 522 HH12 ARG 522 7.223 -12.608 -0.799 253 HH21 ARG 522 HH21 ARG 522 10.047 -11.003 -2.102 254 HH22 ARG 522 HH22 ARG 522 9.424 -12.456 -1.347 255 H GLU 523 H GLU 523 11.102 -5.146 -2.287 256 HA GLU 523 HA GLU 523 10.097 -3.218 -4.268 257 HB2 GLU 523 HB2 GLU 523 10.322 -1.363 -2.640 258 HB3 GLU 523 HB3 GLU 523 8.924 -2.413 -2.342 259 HG2 GLU 523 HG2 GLU 523 11.587 -2.726 -0.898 260 HG3 GLU 523 HG3 GLU 523 10.278 -1.698 -0.294 261 H ASN 524 H ASN 524 11.620 -1.752 -5.003 262 HA ASN 524 HA ASN 524 14.373 -1.843 -3.939 263 HB2 ASN 524 HB2 ASN 524 14.041 -1.951 -6.920 264 HB3 ASN 524 HB3 ASN 524 15.368 -2.546 -5.943 265 HD21 ASN 524 HD21 ASN 524 13.775 -4.369 -4.261 266 HD22 ASN 524 HD22 ASN 524 13.003 -5.554 -5.293 267 H LEU 525 H LEU 525 12.011 -0.043 -4.177 268 HA LEU 525 HA LEU 525 11.390 2.012 -4.742 269 HB2 LEU 525 HB2 LEU 525 12.997 3.482 -4.232 270 HB3 LEU 525 HB3 LEU 525 14.176 2.195 -4.367 271 HG LEU 525 HG LEU 525 14.018 2.842 -6.985 272 HD11 LEU 525 HD11 LEU 525 12.342 4.698 -6.460 273 HD12 LEU 525 HD12 LEU 525 13.590 5.469 -5.469 274 HD13 LEU 525 HD13 LEU 525 13.843 5.281 -7.219 275 HD21 LEU 525 HD21 LEU 525 16.065 2.760 -5.668 276 HD22 LEU 525 HD22 LEU 525 16.005 4.262 -6.610 277 HD23 LEU 525 HD23 LEU 525 15.643 4.300 -4.871 278 H LYS 526 H LYS 526 11.924 -0.341 -6.728 279 HA LYS 526 HA LYS 526 11.292 1.130 -9.226 280 HB2 LYS 526 HB2 LYS 526 13.258 -1.096 -8.639 281 HB3 LYS 526 HB3 LYS 526 12.748 -0.705 -10.307 282 HG2 LYS 526 HG2 LYS 526 13.660 1.533 -10.108 283 HG3 LYS 526 HG3 LYS 526 14.053 1.281 -8.392 284 HD2 LYS 526 HD2 LYS 526 15.134 -0.518 -10.570 285 HD3 LYS 526 HD3 LYS 526 15.966 0.977 -10.081 286 HE2 LYS 526 HE2 LYS 526 16.083 0.155 -7.753 287 HE3 LYS 526 HE3 LYS 526 15.283 -1.350 -8.223 288 HZ1 LYS 526 HZ1 LYS 526 17.860 -0.393 -9.281 289 HZ2 LYS 526 HZ2 LYS 526 17.670 -1.585 -8.162 290 HZ3 LYS 526 HZ3 LYS 526 17.115 -1.797 -9.698 291 H1 MET 1 H1 MET 1 -13.184 13.971 -13.011 292 H2 MET 1 H2 MET 1 -13.233 12.335 -13.182 293 H3 MET 1 H3 MET 1 -11.860 13.154 -13.563 294 HA MET 1 HA MET 1 -11.533 13.788 -11.290 295 HB2 MET 1 HB2 MET 1 -13.844 13.872 -10.546 296 HB3 MET 1 HB3 MET 1 -14.071 12.148 -10.896 297 HG2 MET 1 HG2 MET 1 -12.461 11.535 -9.168 298 HG3 MET 1 HG3 MET 1 -12.100 13.240 -8.865 299 HE1 MET 1 HE1 MET 1 -12.465 12.960 -6.280 300 HE2 MET 1 HE2 MET 1 -13.900 12.193 -5.565 301 HE3 MET 1 HE3 MET 1 -12.773 11.227 -6.548 302 H GLN 2 H GLN 2 -9.838 12.766 -10.550 303 HA GLN 2 HA GLN 2 -9.808 9.869 -10.326 304 HB2 GLN 2 HB2 GLN 2 -7.933 9.500 -11.824 305 HB3 GLN 2 HB3 GLN 2 -9.151 10.415 -12.735 306 HG2 GLN 2 HG2 GLN 2 -7.818 12.498 -11.830 307 HG3 GLN 2 HG3 GLN 2 -6.534 11.356 -11.513 308 HE21 GLN 2 HE21 GLN 2 -5.091 12.196 -13.067 309 HE22 GLN 2 HE22 GLN 2 -5.390 12.095 -14.791 310 H ILE 3 H ILE 3 -7.540 9.222 -9.472 311 HA ILE 3 HA ILE 3 -6.252 11.392 -7.917 312 HB ILE 3 HB ILE 3 -6.283 10.202 -5.871 313 HG12 ILE 3 HG12 ILE 3 -7.250 7.822 -7.472 314 HG13 ILE 3 HG13 ILE 3 -5.878 7.986 -6.389 315 HG21 ILE 3 HG21 ILE 3 -9.082 10.024 -7.025 316 HG22 ILE 3 HG22 ILE 3 -8.627 10.181 -5.311 317 HG23 ILE 3 HG23 ILE 3 -8.289 11.506 -6.428 318 HD11 ILE 3 HD11 ILE 3 -8.808 7.932 -5.568 319 HD12 ILE 3 HD12 ILE 3 -7.608 6.651 -5.322 320 HD13 ILE 3 HD13 ILE 3 -7.444 8.187 -4.451 321 H PHE 4 H PHE 4 -4.260 10.171 -6.666 322 HA PHE 4 HA PHE 4 -2.953 8.432 -8.690 323 HB2 PHE 4 HB2 PHE 4 -1.602 10.794 -7.345 324 HB3 PHE 4 HB3 PHE 4 -0.942 9.753 -8.545 325 HD1 PHE 4 HD1 PHE 4 -2.265 9.631 -10.872 326 HD2 PHE 4 HD2 PHE 4 -2.628 12.840 -8.019 327 HE1 PHE 4 HE1 PHE 4 -2.999 11.157 -12.677 328 HE2 PHE 4 HE2 PHE 4 -3.315 14.369 -9.835 329 HZ PHE 4 HZ PHE 4 -3.505 13.532 -12.164 330 H VAL 5 H VAL 5 -3.048 6.635 -7.488 331 HA VAL 5 HA VAL 5 -2.517 6.651 -4.621 332 HB VAL 5 HB VAL 5 -3.076 4.258 -4.765 333 HG11 VAL 5 HG11 VAL 5 -5.059 6.068 -6.240 334 HG12 VAL 5 HG12 VAL 5 -5.437 4.596 -5.331 335 HG13 VAL 5 HG13 VAL 5 -4.820 6.020 -4.477 336 HG21 VAL 5 HG21 VAL 5 -3.552 4.787 -7.725 337 HG22 VAL 5 HG22 VAL 5 -2.262 3.752 -7.055 338 HG23 VAL 5 HG23 VAL 5 -3.957 3.303 -6.829 339 H LYS 6 H LYS 6 -0.265 7.546 -5.150 340 HA LYS 6 HA LYS 6 1.712 6.103 -6.480 341 HB2 LYS 6 HB2 LYS 6 1.907 8.441 -5.779 342 HB3 LYS 6 HB3 LYS 6 1.965 7.933 -4.075 343 HG2 LYS 6 HG2 LYS 6 4.061 6.838 -4.352 344 HG3 LYS 6 HG3 LYS 6 3.960 6.907 -6.128 345 HD2 LYS 6 HD2 LYS 6 3.975 9.428 -4.452 346 HD3 LYS 6 HD3 LYS 6 5.493 8.619 -4.930 347 HE2 LYS 6 HE2 LYS 6 4.891 8.775 -7.282 348 HE3 LYS 6 HE3 LYS 6 3.330 9.514 -6.876 349 HZ1 LYS 6 HZ1 LYS 6 4.521 11.362 -5.926 350 HZ2 LYS 6 HZ2 LYS 6 5.970 10.687 -6.307 351 HZ3 LYS 6 HZ3 LYS 6 4.941 11.158 -7.501 352 H THR 7 H THR 7 3.015 4.490 -6.102 353 HA THR 7 HA THR 7 2.203 2.637 -4.057 354 HB THR 7 HB THR 7 4.007 1.210 -5.095 355 HG1 THR 7 HG1 THR 7 5.184 2.087 -6.758 356 HG21 THR 7 HG21 THR 7 3.015 1.058 -7.349 357 HG22 THR 7 HG22 THR 7 1.762 1.196 -6.098 358 HG23 THR 7 HG23 THR 7 2.173 2.606 -7.092 359 H LEU 8 H LEU 8 4.006 1.343 -2.943 360 HA LEU 8 HA LEU 8 5.373 2.908 -1.029 361 HB2 LEU 8 HB2 LEU 8 4.487 0.572 -0.884 362 HB3 LEU 8 HB3 LEU 8 5.798 0.011 -1.911 363 HG LEU 8 HG LEU 8 5.851 -0.275 0.674 364 HD11 LEU 8 HD11 LEU 8 7.673 -0.927 -0.823 365 HD12 LEU 8 HD12 LEU 8 8.352 0.712 -0.737 366 HD13 LEU 8 HD13 LEU 8 8.263 -0.279 0.724 367 HD21 LEU 8 HD21 LEU 8 7.011 2.531 0.491 368 HD22 LEU 8 HD22 LEU 8 5.441 2.108 1.215 369 HD23 LEU 8 HD23 LEU 8 6.946 1.482 1.922 370 H THR 9 H THR 9 6.127 2.420 -4.316 371 HA THR 9 HA THR 9 9.056 2.655 -3.823 372 HB THR 9 HB THR 9 9.265 1.724 -6.140 373 HG1 THR 9 HG1 THR 9 7.407 0.751 -6.994 374 HG21 THR 9 HG21 THR 9 9.451 0.297 -4.116 375 HG22 THR 9 HG22 THR 9 7.696 0.013 -4.159 376 HG23 THR 9 HG23 THR 9 8.719 -0.592 -5.478 377 H GLY 10 H GLY 10 6.399 4.542 -4.634 378 HA2 GLY 10 HA2 GLY 10 6.667 6.838 -4.983 379 HA3 GLY 10 HA3 GLY 10 8.287 6.569 -5.664 380 H LYS 11 H LYS 11 5.566 4.630 -6.806 381 HA LYS 11 HA LYS 11 5.582 6.234 -9.324 382 HB2 LYS 11 HB2 LYS 11 6.715 4.087 -9.411 383 HB3 LYS 11 HB3 LYS 11 5.258 3.238 -8.890 384 HG2 LYS 11 HG2 LYS 11 5.103 5.036 -11.311 385 HG3 LYS 11 HG3 LYS 11 5.888 3.447 -11.456 386 HD2 LYS 11 HD2 LYS 11 3.866 2.316 -10.650 387 HD3 LYS 11 HD3 LYS 11 3.062 3.870 -10.394 388 HE2 LYS 11 HE2 LYS 11 2.300 2.916 -12.488 389 HE3 LYS 11 HE3 LYS 11 3.251 4.372 -12.811 390 HZ1 LYS 11 HZ1 LYS 11 5.123 2.952 -13.326 391 HZ2 LYS 11 HZ2 LYS 11 4.236 1.602 -13.021 392 HZ3 LYS 11 HZ3 LYS 11 3.841 2.578 -14.283 393 H THR 12 H THR 12 3.727 7.178 -9.841 394 HA THR 12 HA THR 12 1.345 6.643 -8.221 395 HB THR 12 HB THR 12 2.381 8.822 -9.908 396 HG1 THR 12 HG1 THR 12 1.246 9.947 -8.350 397 HG21 THR 12 HG21 THR 12 0.472 8.281 -11.357 398 HG22 THR 12 HG22 THR 12 -0.607 8.262 -9.942 399 HG23 THR 12 HG23 THR 12 0.191 9.774 -10.441 400 H ILE 13 H ILE 13 -0.678 6.048 -8.953 401 HA ILE 13 HA ILE 13 -0.886 4.991 -11.734 402 HB ILE 13 HB ILE 13 -1.973 3.703 -9.198 403 HG12 ILE 13 HG12 ILE 13 0.247 2.772 -11.073 404 HG13 ILE 13 HG13 ILE 13 0.477 3.413 -9.435 405 HG21 ILE 13 HG21 ILE 13 -3.417 3.488 -11.215 406 HG22 ILE 13 HG22 ILE 13 -2.040 2.797 -12.107 407 HG23 ILE 13 HG23 ILE 13 -2.742 1.929 -10.716 408 HD11 ILE 13 HD11 ILE 13 -0.924 1.552 -8.535 409 HD12 ILE 13 HD12 ILE 13 -0.999 0.852 -10.171 410 HD13 ILE 13 HD13 ILE 13 0.559 0.994 -9.335 411 H THR 14 H THR 14 -2.455 6.085 -12.781 412 HA THR 14 HA THR 14 -4.146 7.909 -11.281 413 HB THR 14 HB THR 14 -4.192 7.199 -14.246 414 HG1 THR 14 HG1 THR 14 -2.174 7.993 -13.608 415 HG21 THR 14 HG21 THR 14 -5.193 9.596 -12.651 416 HG22 THR 14 HG22 THR 14 -5.195 9.456 -14.427 417 HG23 THR 14 HG23 THR 14 -6.210 8.374 -13.454 418 H LEU 15 H LEU 15 -6.322 7.705 -10.859 419 HA LEU 15 HA LEU 15 -7.777 5.307 -11.806 420 HB2 LEU 15 HB2 LEU 15 -7.055 5.946 -8.915 421 HB3 LEU 15 HB3 LEU 15 -8.375 4.864 -9.357 422 HG LEU 15 HG LEU 15 -5.463 4.424 -10.158 423 HD11 LEU 15 HD11 LEU 15 -7.221 3.140 -8.022 424 HD12 LEU 15 HD12 LEU 15 -5.579 2.615 -8.480 425 HD13 LEU 15 HD13 LEU 15 -5.837 4.214 -7.742 426 HD21 LEU 15 HD21 LEU 15 -8.084 2.949 -10.606 427 HD22 LEU 15 HD22 LEU 15 -6.841 3.370 -11.792 428 HD23 LEU 15 HD23 LEU 15 -6.532 2.086 -10.591 429 H GLU 16 H GLU 16 -9.912 5.638 -11.933 430 HA GLU 16 HA GLU 16 -10.978 8.288 -11.133 431 HB2 GLU 16 HB2 GLU 16 -11.321 7.675 -13.443 432 HB3 GLU 16 HB3 GLU 16 -11.888 6.055 -12.997 433 HG2 GLU 16 HG2 GLU 16 -13.858 6.984 -11.924 434 HG3 GLU 16 HG3 GLU 16 -13.310 8.639 -12.251 435 H VAL 17 H VAL 17 -12.269 8.509 -9.470 436 HA VAL 17 HA VAL 17 -13.809 6.235 -8.382 437 HB VAL 17 HB VAL 17 -13.029 6.752 -6.093 438 HG11 VAL 17 HG11 VAL 17 -11.994 4.900 -7.370 439 HG12 VAL 17 HG12 VAL 17 -10.740 6.016 -7.959 440 HG13 VAL 17 HG13 VAL 17 -10.858 5.655 -6.228 441 HG21 VAL 17 HG21 VAL 17 -10.925 8.469 -7.495 442 HG22 VAL 17 HG22 VAL 17 -12.259 9.080 -6.484 443 HG23 VAL 17 HG23 VAL 17 -10.978 8.088 -5.763 444 H GLU 18 H GLU 18 -15.042 7.277 -6.306 445 HA GLU 18 HA GLU 18 -15.943 10.026 -6.945 446 HB2 GLU 18 HB2 GLU 18 -17.829 7.658 -6.569 447 HB3 GLU 18 HB3 GLU 18 -18.286 9.342 -6.872 448 HG2 GLU 18 HG2 GLU 18 -17.063 9.196 -9.077 449 HG3 GLU 18 HG3 GLU 18 -16.827 7.465 -8.740 450 HA PRO 19 HA PRO 19 -16.255 10.541 -2.528 451 HB2 PRO 19 HB2 PRO 19 -19.099 11.382 -2.928 452 HB3 PRO 19 HB3 PRO 19 -17.771 12.260 -2.106 453 HG2 PRO 19 HG2 PRO 19 -18.570 13.042 -4.558 454 HG3 PRO 19 HG3 PRO 19 -16.830 12.993 -4.126 455 HD2 PRO 19 HD2 PRO 19 -18.426 10.986 -5.710 456 HD3 PRO 19 HD3 PRO 19 -16.788 11.632 -6.027 457 H SER 20 H SER 20 -17.930 8.076 -4.134 458 HA SER 20 HA SER 20 -18.935 7.005 -1.554 459 HB2 SER 20 HB2 SER 20 -20.294 6.952 -4.268 460 HB3 SER 20 HB3 SER 20 -20.828 6.051 -2.838 461 HG SER 20 HG SER 20 -21.913 8.065 -3.068 462 H ASP 21 H ASP 21 -16.946 6.608 -4.313 463 HA ASP 21 HA ASP 21 -16.908 3.670 -4.261 464 HB2 ASP 21 HB2 ASP 21 -15.067 5.744 -5.443 465 HB3 ASP 21 HB3 ASP 21 -14.895 4.004 -5.691 466 H THR 22 H THR 22 -16.770 3.833 -1.923 467 HA THR 22 HA THR 22 -14.532 4.948 -0.535 468 HB THR 22 HB THR 22 -16.655 4.538 0.545 469 HG1 THR 22 HG1 THR 22 -15.792 3.683 2.400 470 HG21 THR 22 HG21 THR 22 -17.343 2.314 1.244 471 HG22 THR 22 HG22 THR 22 -17.365 2.476 -0.523 472 HG23 THR 22 HG23 THR 22 -16.025 1.594 0.272 473 H ILE 23 H ILE 23 -13.349 3.247 1.081 474 HA ILE 23 HA ILE 23 -11.187 2.520 -0.494 475 HB ILE 23 HB ILE 23 -11.824 1.355 2.226 476 HG12 ILE 23 HG12 ILE 23 -12.272 3.708 2.419 477 HG13 ILE 23 HG13 ILE 23 -10.692 3.392 3.133 478 HG21 ILE 23 HG21 ILE 23 -9.218 2.095 0.828 479 HG22 ILE 23 HG22 ILE 23 -9.367 1.492 2.497 480 HG23 ILE 23 HG23 ILE 23 -9.831 0.456 1.133 481 HD11 ILE 23 HD11 ILE 23 -11.165 4.519 0.331 482 HD12 ILE 23 HD12 ILE 23 -10.763 5.464 1.768 483 HD13 ILE 23 HD13 ILE 23 -9.583 4.292 1.126 484 H GLU 24 H GLU 24 -13.934 0.384 0.454 485 HA GLU 24 HA GLU 24 -12.536 -1.997 -0.387 486 HB2 GLU 24 HB2 GLU 24 -14.614 -3.124 -0.159 487 HB3 GLU 24 HB3 GLU 24 -14.538 -1.927 1.144 488 HG2 GLU 24 HG2 GLU 24 -15.965 -0.398 -0.205 489 HG3 GLU 24 HG3 GLU 24 -16.060 -1.622 -1.482 490 H ASN 25 H ASN 25 -14.250 0.538 -2.110 491 HA ASN 25 HA ASN 25 -14.541 -0.981 -4.570 492 HB2 ASN 25 HB2 ASN 25 -14.699 1.989 -3.984 493 HB3 ASN 25 HB3 ASN 25 -15.085 1.269 -5.531 494 HD21 ASN 25 HD21 ASN 25 -16.099 1.829 -2.343 495 HD22 ASN 25 HD22 ASN 25 -17.682 1.030 -2.408 496 H VAL 26 H VAL 26 -12.342 1.410 -3.109 497 HA VAL 26 HA VAL 26 -10.748 2.055 -5.387 498 HB VAL 26 HB VAL 26 -10.169 2.075 -2.392 499 HG11 VAL 26 HG11 VAL 26 -8.630 3.298 -4.711 500 HG12 VAL 26 HG12 VAL 26 -8.376 3.705 -2.998 501 HG13 VAL 26 HG13 VAL 26 -8.070 2.049 -3.570 502 HG21 VAL 26 HG21 VAL 26 -10.651 4.474 -2.566 503 HG22 VAL 26 HG22 VAL 26 -11.026 4.288 -4.305 504 HG23 VAL 26 HG23 VAL 26 -12.048 3.512 -3.071 505 H LYS 27 H LYS 27 -10.386 -0.386 -2.770 506 HA LYS 27 HA LYS 27 -7.898 -1.383 -3.548 507 HB2 LYS 27 HB2 LYS 27 -10.352 -2.629 -2.272 508 HB3 LYS 27 HB3 LYS 27 -8.828 -3.513 -2.499 509 HG2 LYS 27 HG2 LYS 27 -7.598 -1.980 -1.134 510 HG3 LYS 27 HG3 LYS 27 -8.954 -0.846 -1.043 511 HD2 LYS 27 HD2 LYS 27 -10.295 -2.487 0.202 512 HD3 LYS 27 HD3 LYS 27 -9.001 -3.701 0.032 513 HE2 LYS 27 HE2 LYS 27 -7.465 -2.252 1.281 514 HE3 LYS 27 HE3 LYS 27 -8.709 -1.011 1.433 515 HZ1 LYS 27 HZ1 LYS 27 -10.048 -2.560 2.673 516 HZ2 LYS 27 HZ2 LYS 27 -8.901 -3.734 2.541 517 HZ3 LYS 27 HZ3 LYS 27 -8.590 -2.370 3.405 518 H ALA 28 H ALA 28 -11.075 -1.819 -5.113 519 HA ALA 28 HA ALA 28 -10.100 -4.015 -6.775 520 HB1 ALA 28 HB1 ALA 28 -12.583 -2.271 -7.067 521 HB2 ALA 28 HB2 ALA 28 -12.229 -3.770 -7.945 522 HB3 ALA 28 HB3 ALA 28 -12.492 -3.817 -6.186 523 H LYS 29 H LYS 29 -10.275 -0.462 -6.948 524 HA LYS 29 HA LYS 29 -9.765 -0.211 -9.770 525 HB2 LYS 29 HB2 LYS 29 -9.315 1.570 -7.359 526 HB3 LYS 29 HB3 LYS 29 -8.637 1.981 -8.926 527 HG2 LYS 29 HG2 LYS 29 -10.691 3.137 -8.645 528 HG3 LYS 29 HG3 LYS 29 -10.889 1.939 -9.942 529 HD2 LYS 29 HD2 LYS 29 -12.147 0.472 -8.511 530 HD3 LYS 29 HD3 LYS 29 -11.679 1.410 -7.072 531 HE2 LYS 29 HE2 LYS 29 -14.001 1.835 -7.712 532 HE3 LYS 29 HE3 LYS 29 -13.022 3.301 -7.789 533 HZ1 LYS 29 HZ1 LYS 29 -12.882 3.032 -10.162 534 HZ2 LYS 29 HZ2 LYS 29 -13.759 1.639 -10.111 535 HZ3 LYS 29 HZ3 LYS 29 -14.454 3.071 -9.702 536 H ILE 30 H ILE 30 -7.715 -0.833 -6.932 537 HA ILE 30 HA ILE 30 -5.240 -0.385 -8.449 538 HB ILE 30 HB ILE 30 -5.869 -1.308 -5.616 539 HG12 ILE 30 HG12 ILE 30 -4.865 1.335 -6.756 540 HG13 ILE 30 HG13 ILE 30 -6.517 1.030 -6.217 541 HG21 ILE 30 HG21 ILE 30 -3.487 -0.945 -5.133 542 HG22 ILE 30 HG22 ILE 30 -3.677 -2.193 -6.368 543 HG23 ILE 30 HG23 ILE 30 -3.184 -0.551 -6.845 544 HD11 ILE 30 HD11 ILE 30 -5.353 2.214 -4.469 545 HD12 ILE 30 HD12 ILE 30 -5.645 0.553 -3.911 546 HD13 ILE 30 HD13 ILE 30 -4.025 1.039 -4.480 547 H GLN 31 H GLN 31 -7.287 -3.067 -7.309 548 HA GLN 31 HA GLN 31 -5.486 -5.189 -7.971 549 HB2 GLN 31 HB2 GLN 31 -7.457 -5.604 -6.598 550 HB3 GLN 31 HB3 GLN 31 -8.527 -4.972 -7.867 551 HG2 GLN 31 HG2 GLN 31 -7.941 -6.769 -9.368 552 HG3 GLN 31 HG3 GLN 31 -6.704 -7.370 -8.280 553 HE21 GLN 31 HE21 GLN 31 -7.471 -9.378 -7.648 554 HE22 GLN 31 HE22 GLN 31 -9.030 -9.635 -6.896 555 H ASP 32 H ASP 32 -7.842 -3.251 -9.831 556 HA ASP 32 HA ASP 32 -7.868 -4.948 -12.118 557 HB2 ASP 32 HB2 ASP 32 -9.596 -3.270 -11.606 558 HB3 ASP 32 HB3 ASP 32 -8.414 -1.992 -11.612 559 H LYS 33 H LYS 33 -5.858 -2.286 -11.062 560 HA LYS 33 HA LYS 33 -4.590 -1.815 -13.625 561 HB2 LYS 33 HB2 LYS 33 -4.235 -0.911 -10.763 562 HB3 LYS 33 HB3 LYS 33 -3.104 -0.384 -12.024 563 HG2 LYS 33 HG2 LYS 33 -6.126 -0.034 -12.216 564 HG3 LYS 33 HG3 LYS 33 -5.015 1.201 -11.564 565 HD2 LYS 33 HD2 LYS 33 -3.777 1.254 -13.678 566 HD3 LYS 33 HD3 LYS 33 -4.877 0.049 -14.385 567 HE2 LYS 33 HE2 LYS 33 -5.717 2.771 -13.314 568 HE3 LYS 33 HE3 LYS 33 -5.422 2.410 -15.017 569 HZ1 LYS 33 HZ1 LYS 33 -7.751 2.240 -14.487 570 HZ2 LYS 33 HZ2 LYS 33 -7.176 0.757 -14.900 571 HZ3 LYS 33 HZ3 LYS 33 -7.463 1.112 -13.327 572 H GLU 34 H GLU 34 -3.850 -3.900 -10.858 573 HA GLU 34 HA GLU 34 -1.321 -4.607 -12.270 574 HB2 GLU 34 HB2 GLU 34 -1.648 -4.097 -9.292 575 HB3 GLU 34 HB3 GLU 34 -0.185 -4.739 -10.049 576 HG2 GLU 34 HG2 GLU 34 -1.424 -2.017 -10.646 577 HG3 GLU 34 HG3 GLU 34 -0.061 -2.300 -9.565 578 H GLY 35 H GLY 35 -3.921 -5.634 -10.057 579 HA2 GLY 35 HA2 GLY 35 -4.833 -7.848 -10.394 580 HA3 GLY 35 HA3 GLY 35 -3.197 -8.469 -10.669 581 H ILE 36 H ILE 36 -3.361 -6.071 -8.235 582 HA ILE 36 HA ILE 36 -2.493 -7.990 -6.229 583 HB ILE 36 HB ILE 36 -2.935 -4.979 -6.215 584 HG12 ILE 36 HG12 ILE 36 -0.372 -6.631 -6.329 585 HG13 ILE 36 HG13 ILE 36 -1.147 -5.894 -7.738 586 HG21 ILE 36 HG21 ILE 36 -1.517 -6.738 -4.173 587 HG22 ILE 36 HG22 ILE 36 -1.670 -4.963 -4.115 588 HG23 ILE 36 HG23 ILE 36 -3.112 -5.980 -3.941 589 HD11 ILE 36 HD11 ILE 36 0.653 -4.447 -6.971 590 HD12 ILE 36 HD12 ILE 36 -0.907 -3.647 -6.670 591 HD13 ILE 36 HD13 ILE 36 -0.013 -4.404 -5.329 592 HA PRO 37 HA PRO 37 -6.668 -8.572 -4.867 593 HB2 PRO 37 HB2 PRO 37 -6.216 -9.989 -2.550 594 HB3 PRO 37 HB3 PRO 37 -5.981 -10.674 -4.188 595 HG2 PRO 37 HG2 PRO 37 -3.900 -9.480 -2.347 596 HG3 PRO 37 HG3 PRO 37 -3.817 -11.029 -3.257 597 HD2 PRO 37 HD2 PRO 37 -2.658 -8.727 -4.163 598 HD3 PRO 37 HD3 PRO 37 -3.407 -9.890 -5.299 599 HA PRO 38 HA PRO 38 -7.478 -5.325 -1.958 600 HB2 PRO 38 HB2 PRO 38 -9.883 -6.155 -0.894 601 HB3 PRO 38 HB3 PRO 38 -9.701 -5.512 -2.558 602 HG2 PRO 38 HG2 PRO 38 -9.791 -8.413 -1.688 603 HG3 PRO 38 HG3 PRO 38 -10.685 -7.628 -3.033 604 HD2 PRO 38 HD2 PRO 38 -8.393 -9.014 -3.458 605 HD3 PRO 38 HD3 PRO 38 -8.750 -7.515 -4.373 606 H ASP 39 H ASP 39 -6.996 -8.619 -1.090 607 HA ASP 39 HA ASP 39 -7.317 -8.200 1.771 608 HB2 ASP 39 HB2 ASP 39 -7.953 -10.304 0.623 609 HB3 ASP 39 HB3 ASP 39 -6.254 -10.564 0.192 610 H GLN 40 H GLN 40 -4.770 -7.562 -0.466 611 HA GLN 40 HA GLN 40 -2.803 -7.747 1.772 612 HB2 GLN 40 HB2 GLN 40 -2.356 -8.207 -1.196 613 HB3 GLN 40 HB3 GLN 40 -1.091 -8.148 0.044 614 HG2 GLN 40 HG2 GLN 40 -2.273 -10.027 1.252 615 HG3 GLN 40 HG3 GLN 40 -3.366 -10.160 -0.140 616 HE21 GLN 40 HE21 GLN 40 -1.704 -9.876 -2.321 617 HE22 GLN 40 HE22 GLN 40 -0.505 -11.156 -2.331 618 H GLN 41 H GLN 41 -4.396 -5.551 -0.389 619 HA GLN 41 HA GLN 41 -2.275 -3.596 -0.507 620 HB2 GLN 41 HB2 GLN 41 -5.299 -3.386 -0.704 621 HB3 GLN 41 HB3 GLN 41 -4.179 -2.053 -1.031 622 HG2 GLN 41 HG2 GLN 41 -3.175 -3.268 -2.889 623 HG3 GLN 41 HG3 GLN 41 -4.140 -4.711 -2.509 624 HE21 GLN 41 HE21 GLN 41 -5.367 -4.807 -4.448 625 HE22 GLN 41 HE22 GLN 41 -6.582 -3.602 -4.789 626 H ARG 42 H ARG 42 -2.454 -1.474 0.486 627 HA ARG 42 HA ARG 42 -4.035 -1.083 2.916 628 HB2 ARG 42 HB2 ARG 42 -1.900 -2.256 3.622 629 HB3 ARG 42 HB3 ARG 42 -0.987 -0.888 2.958 630 HG2 ARG 42 HG2 ARG 42 -2.085 0.634 4.554 631 HG3 ARG 42 HG3 ARG 42 -3.107 -0.700 5.142 632 HD2 ARG 42 HD2 ARG 42 -1.065 -1.939 5.833 633 HD3 ARG 42 HD3 ARG 42 -0.068 -0.566 5.312 634 HE ARG 42 HE ARG 42 -1.966 0.472 7.103 635 HH11 ARG 42 HH11 ARG 42 0.672 -1.882 7.209 636 HH12 ARG 42 HH12 ARG 42 1.013 -1.586 8.897 637 HH21 ARG 42 HH21 ARG 42 -1.530 0.807 9.275 638 HH22 ARG 42 HH22 ARG 42 -0.231 -0.065 10.071 639 H LEU 43 H LEU 43 -4.430 1.237 3.116 640 HA LEU 43 HA LEU 43 -3.162 2.835 0.955 641 HB2 LEU 43 HB2 LEU 43 -5.268 1.755 0.199 642 HB3 LEU 43 HB3 LEU 43 -6.128 2.522 1.542 643 HG LEU 43 HG LEU 43 -5.561 4.737 0.629 644 HD11 LEU 43 HD11 LEU 43 -3.479 4.220 -0.589 645 HD12 LEU 43 HD12 LEU 43 -4.369 3.121 -1.676 646 HD13 LEU 43 HD13 LEU 43 -4.678 4.868 -1.724 647 HD21 LEU 43 HD21 LEU 43 -7.073 4.568 -1.354 648 HD22 LEU 43 HD22 LEU 43 -6.855 2.803 -1.356 649 HD23 LEU 43 HD23 LEU 43 -7.666 3.597 0.011 650 H ILE 44 H ILE 44 -2.777 4.921 1.419 651 HA ILE 44 HA ILE 44 -3.715 6.039 4.012 652 HB ILE 44 HB ILE 44 -0.864 5.830 2.946 653 HG12 ILE 44 HG12 ILE 44 -0.588 5.169 5.472 654 HG13 ILE 44 HG13 ILE 44 -2.324 4.891 5.436 655 HG21 ILE 44 HG21 ILE 44 -1.783 7.485 5.329 656 HG22 ILE 44 HG22 ILE 44 -0.126 7.260 4.769 657 HG23 ILE 44 HG23 ILE 44 -1.253 8.173 3.768 658 HD11 ILE 44 HD11 ILE 44 -1.960 3.201 3.589 659 HD12 ILE 44 HD12 ILE 44 -0.213 3.522 3.709 660 HD13 ILE 44 HD13 ILE 44 -1.115 2.811 5.077 661 H PHE 45 H PHE 45 -3.783 8.332 4.047 662 HA PHE 45 HA PHE 45 -3.319 9.861 1.564 663 HB2 PHE 45 HB2 PHE 45 -5.638 8.968 1.409 664 HB3 PHE 45 HB3 PHE 45 -6.008 9.629 2.993 665 HD1 PHE 45 HD1 PHE 45 -4.339 11.045 -0.077 666 HD2 PHE 45 HD2 PHE 45 -7.424 11.451 2.894 667 HE1 PHE 45 HE1 PHE 45 -5.068 13.154 -1.131 668 HE2 PHE 45 HE2 PHE 45 -8.134 13.590 1.863 669 HZ PHE 45 HZ PHE 45 -6.956 14.451 -0.148 670 H ALA 46 H ALA 46 -2.838 11.976 2.015 671 HA ALA 46 HA ALA 46 -1.876 13.593 3.239 672 HB1 ALA 46 HB1 ALA 46 -4.369 13.229 4.942 673 HB2 ALA 46 HB2 ALA 46 -3.345 14.678 4.879 674 HB3 ALA 46 HB3 ALA 46 -4.257 14.178 3.437 675 H GLY 47 H GLY 47 -1.567 10.604 4.249 676 HA2 GLY 47 HA2 GLY 47 0.278 9.939 5.547 677 HA3 GLY 47 HA3 GLY 47 0.114 11.373 6.568 678 H LYS 48 H LYS 48 -2.940 9.794 5.955 679 HA LYS 48 HA LYS 48 -2.563 8.056 8.331 680 HB2 LYS 48 HB2 LYS 48 -4.766 8.611 9.187 681 HB3 LYS 48 HB3 LYS 48 -3.729 10.034 9.107 682 HG2 LYS 48 HG2 LYS 48 -5.766 10.801 8.372 683 HG3 LYS 48 HG3 LYS 48 -4.841 10.562 6.877 684 HD2 LYS 48 HD2 LYS 48 -6.105 8.426 6.475 685 HD3 LYS 48 HD3 LYS 48 -7.047 8.714 7.946 686 HE2 LYS 48 HE2 LYS 48 -6.880 10.536 5.520 687 HE3 LYS 48 HE3 LYS 48 -8.232 9.470 5.927 688 HZ1 LYS 48 HZ1 LYS 48 -7.290 11.732 7.564 689 HZ2 LYS 48 HZ2 LYS 48 -8.638 11.726 6.625 690 HZ3 LYS 48 HZ3 LYS 48 -8.544 10.741 7.938 691 H GLN 49 H GLN 49 -4.194 6.383 8.479 692 HA GLN 49 HA GLN 49 -4.411 5.158 5.795 693 HB2 GLN 49 HB2 GLN 49 -3.151 3.978 7.518 694 HB3 GLN 49 HB3 GLN 49 -4.527 4.046 8.622 695 HG2 GLN 49 HG2 GLN 49 -5.843 2.624 7.071 696 HG3 GLN 49 HG3 GLN 49 -4.488 2.604 5.925 697 HE21 GLN 49 HE21 GLN 49 -5.737 0.288 7.104 698 HE22 GLN 49 HE22 GLN 49 -4.529 -0.514 8.088 699 H LEU 50 H LEU 50 -6.307 4.111 5.140 700 HA LEU 50 HA LEU 50 -8.750 5.449 6.215 701 HB2 LEU 50 HB2 LEU 50 -8.199 4.411 3.404 702 HB3 LEU 50 HB3 LEU 50 -9.672 5.209 3.966 703 HG LEU 50 HG LEU 50 -8.205 7.233 4.564 704 HD11 LEU 50 HD11 LEU 50 -5.950 6.321 4.418 705 HD12 LEU 50 HD12 LEU 50 -6.274 5.694 2.777 706 HD13 LEU 50 HD13 LEU 50 -6.178 7.442 3.080 707 HD21 LEU 50 HD21 LEU 50 -8.374 6.410 1.636 708 HD22 LEU 50 HD22 LEU 50 -9.708 7.129 2.576 709 HD23 LEU 50 HD23 LEU 50 -8.237 8.067 2.272 710 H GLU 51 H GLU 51 -10.830 4.114 5.638 711 HA GLU 51 HA GLU 51 -10.320 1.236 6.219 712 HB2 GLU 51 HB2 GLU 51 -11.874 3.251 7.846 713 HB3 GLU 51 HB3 GLU 51 -12.308 1.533 7.881 714 HG2 GLU 51 HG2 GLU 51 -10.022 0.941 8.566 715 HG3 GLU 51 HG3 GLU 51 -9.545 2.643 8.494 716 H ASP 52 H ASP 52 -12.047 -0.145 5.837 717 HA ASP 52 HA ASP 52 -13.402 0.437 3.374 718 HB2 ASP 52 HB2 ASP 52 -13.621 -1.910 5.299 719 HB3 ASP 52 HB3 ASP 52 -14.202 -1.876 3.626 720 H GLY 53 H GLY 53 -14.201 1.375 6.461 721 HA2 GLY 53 HA2 GLY 53 -17.125 1.004 6.050 722 HA3 GLY 53 HA3 GLY 53 -16.325 1.248 7.613 723 H ARG 54 H ARG 54 -14.883 3.207 5.241 724 HA ARG 54 HA ARG 54 -16.401 5.604 6.139 725 HB2 ARG 54 HB2 ARG 54 -13.693 5.491 4.772 726 HB3 ARG 54 HB3 ARG 54 -14.382 6.819 5.705 727 HG2 ARG 54 HG2 ARG 54 -13.563 4.120 6.866 728 HG3 ARG 54 HG3 ARG 54 -12.586 5.596 6.921 729 HD2 ARG 54 HD2 ARG 54 -14.359 6.739 8.178 730 HD3 ARG 54 HD3 ARG 54 -15.345 5.262 8.161 731 HE ARG 54 HE ARG 54 -13.109 4.302 9.282 732 HH11 ARG 54 HH11 ARG 54 -14.765 7.354 9.932 733 HH12 ARG 54 HH12 ARG 54 -14.250 7.405 11.604 734 HH21 ARG 54 HH21 ARG 54 -12.416 4.413 11.404 735 HH22 ARG 54 HH22 ARG 54 -12.908 5.733 12.448 736 H THR 55 H THR 55 -15.377 7.248 4.060 737 HA THR 55 HA THR 55 -15.879 6.033 1.447 738 HB THR 55 HB THR 55 -17.377 7.916 0.762 739 HG1 THR 55 HG1 THR 55 -18.475 8.976 2.465 740 HG21 THR 55 HG21 THR 55 -18.263 5.623 1.336 741 HG22 THR 55 HG22 THR 55 -18.624 6.238 2.968 742 HG23 THR 55 HG23 THR 55 -19.426 6.944 1.548 743 H LEU 56 H LEU 56 -15.256 7.664 -0.295 744 HA LEU 56 HA LEU 56 -12.742 8.837 0.397 745 HB2 LEU 56 HB2 LEU 56 -14.592 9.304 -1.984 746 HB3 LEU 56 HB3 LEU 56 -12.930 9.866 -1.886 747 HG LEU 56 HG LEU 56 -13.993 7.036 -2.111 748 HD11 LEU 56 HD11 LEU 56 -12.347 6.929 -3.932 749 HD12 LEU 56 HD12 LEU 56 -13.396 8.352 -4.150 750 HD13 LEU 56 HD13 LEU 56 -11.751 8.551 -3.514 751 HD21 LEU 56 HD21 LEU 56 -11.731 6.151 -1.740 752 HD22 LEU 56 HD22 LEU 56 -11.152 7.761 -1.273 753 HD23 LEU 56 HD23 LEU 56 -12.351 6.906 -0.264 754 H SER 57 H SER 57 -16.034 10.019 0.365 755 HA SER 57 HA SER 57 -15.439 12.830 0.641 756 HB2 SER 57 HB2 SER 57 -17.521 12.169 -0.243 757 HB3 SER 57 HB3 SER 57 -17.830 11.005 1.026 758 HG SER 57 HG SER 57 -19.014 12.964 1.324 759 H ASP 58 H ASP 58 -15.848 10.097 2.861 760 HA ASP 58 HA ASP 58 -16.153 11.591 5.269 761 HB2 ASP 58 HB2 ASP 58 -16.493 9.063 4.841 762 HB3 ASP 58 HB3 ASP 58 -14.746 8.917 5.069 763 H TYR 59 H TYR 59 -13.451 11.180 3.195 764 HA TYR 59 HA TYR 59 -11.668 12.409 5.234 765 HB2 TYR 59 HB2 TYR 59 -11.020 10.205 3.247 766 HB3 TYR 59 HB3 TYR 59 -9.797 11.133 4.108 767 HD1 TYR 59 HD1 TYR 59 -11.013 11.339 6.841 768 HD2 TYR 59 HD2 TYR 59 -10.793 8.038 4.098 769 HE1 TYR 59 HE1 TYR 59 -11.066 9.765 8.748 770 HE2 TYR 59 HE2 TYR 59 -10.808 6.445 6.019 771 HH TYR 59 HH TYR 59 -10.876 6.222 8.308 772 H ASN 60 H ASN 60 -13.455 13.394 3.069 773 HA ASN 60 HA ASN 60 -13.527 14.928 1.477 774 HB2 ASN 60 HB2 ASN 60 -12.903 16.896 2.300 775 HB3 ASN 60 HB3 ASN 60 -12.491 15.920 3.715 776 HD21 ASN 60 HD21 ASN 60 -10.064 14.932 3.421 777 HD22 ASN 60 HD22 ASN 60 -8.887 16.183 3.078 778 H ILE 61 H ILE 61 -11.714 12.654 0.667 779 HA ILE 61 HA ILE 61 -9.574 13.683 -0.901 780 HB ILE 61 HB ILE 61 -11.362 11.241 -1.196 781 HG12 ILE 61 HG12 ILE 61 -8.465 11.505 -0.297 782 HG13 ILE 61 HG13 ILE 61 -9.832 11.481 0.833 783 HG21 ILE 61 HG21 ILE 61 -9.653 10.364 -2.771 784 HG22 ILE 61 HG22 ILE 61 -10.420 11.820 -3.409 785 HG23 ILE 61 HG23 ILE 61 -8.798 11.923 -2.700 786 HD11 ILE 61 HD11 ILE 61 -10.483 9.264 0.083 787 HD12 ILE 61 HD12 ILE 61 -9.144 9.234 -1.102 788 HD13 ILE 61 HD13 ILE 61 -8.794 9.273 0.636 789 H GLN 62 H GLN 62 -9.444 14.574 -2.887 790 HA GLN 62 HA GLN 62 -11.919 14.958 -4.521 791 HB2 GLN 62 HB2 GLN 62 -9.651 16.941 -4.162 792 HB3 GLN 62 HB3 GLN 62 -11.210 17.218 -4.951 793 HG2 GLN 62 HG2 GLN 62 -10.789 16.660 -1.985 794 HG3 GLN 62 HG3 GLN 62 -10.989 18.250 -2.675 795 HE21 GLN 62 HE21 GLN 62 -12.663 16.808 -0.682 796 HE22 GLN 62 HE22 GLN 62 -14.282 16.765 -1.359 797 H LYS 63 H LYS 63 -11.011 16.003 -6.725 798 HA LYS 63 HA LYS 63 -9.510 14.002 -8.063 799 HB2 LYS 63 HB2 LYS 63 -9.562 15.512 -9.891 800 HB3 LYS 63 HB3 LYS 63 -11.119 15.624 -9.056 801 HG2 LYS 63 HG2 LYS 63 -10.359 17.700 -7.911 802 HG3 LYS 63 HG3 LYS 63 -8.801 17.589 -8.758 803 HD2 LYS 63 HD2 LYS 63 -10.209 19.163 -9.926 804 HD3 LYS 63 HD3 LYS 63 -9.987 17.714 -10.931 805 HE2 LYS 63 HE2 LYS 63 -12.197 16.873 -10.220 806 HE3 LYS 63 HE3 LYS 63 -12.408 18.280 -9.166 807 HZ1 LYS 63 HZ1 LYS 63 -13.531 18.565 -11.258 808 HZ2 LYS 63 HZ2 LYS 63 -12.329 19.676 -11.112 809 HZ3 LYS 63 HZ3 LYS 63 -12.126 18.380 -12.097 810 H GLU 64 H GLU 64 -7.466 13.790 -8.663 811 HA GLU 64 HA GLU 64 -5.228 13.929 -8.606 812 HB2 GLU 64 HB2 GLU 64 -5.845 16.910 -8.645 813 HB3 GLU 64 HB3 GLU 64 -4.310 16.153 -9.109 814 HG2 GLU 64 HG2 GLU 64 -5.505 14.875 -10.886 815 HG3 GLU 64 HG3 GLU 64 -7.011 15.705 -10.454 816 H SER 65 H SER 65 -6.578 13.864 -5.916 817 HA SER 65 HA SER 65 -5.172 15.719 -4.226 818 HB2 SER 65 HB2 SER 65 -6.916 13.298 -3.677 819 HB3 SER 65 HB3 SER 65 -6.202 14.307 -2.398 820 HG SER 65 HG SER 65 -7.872 15.220 -4.493 821 H THR 66 H THR 66 -4.340 12.674 -5.547 822 HA THR 66 HA THR 66 -2.650 11.193 -5.300 823 HB THR 66 HB THR 66 -1.374 13.512 -3.843 824 HG1 THR 66 HG1 THR 66 -1.929 13.964 -5.952 825 HG21 THR 66 HG21 THR 66 0.769 12.399 -4.480 826 HG22 THR 66 HG22 THR 66 -0.168 11.415 -3.338 827 HG23 THR 66 HG23 THR 66 -0.149 10.992 -5.064 828 H LEU 67 H LEU 67 -2.395 9.438 -4.137 829 HA LEU 67 HA LEU 67 -2.716 9.508 -1.170 830 HB2 LEU 67 HB2 LEU 67 -4.087 7.773 -3.242 831 HB3 LEU 67 HB3 LEU 67 -3.717 7.129 -1.640 832 HG LEU 67 HG LEU 67 -4.941 9.103 -0.637 833 HD11 LEU 67 HD11 LEU 67 -5.108 10.634 -2.531 834 HD12 LEU 67 HD12 LEU 67 -5.901 9.382 -3.518 835 HD13 LEU 67 HD13 LEU 67 -6.733 10.083 -2.108 836 HD21 LEU 67 HD21 LEU 67 -6.488 7.143 -2.378 837 HD22 LEU 67 HD22 LEU 67 -5.853 6.832 -0.745 838 HD23 LEU 67 HD23 LEU 67 -7.128 8.038 -0.977 839 H HIS 68 H HIS 68 -2.031 7.078 -0.431 840 HA HIS 68 HA HIS 68 0.493 6.426 -1.855 841 HB2 HIS 68 HB2 HIS 68 0.215 6.931 1.128 842 HB3 HIS 68 HB3 HIS 68 1.669 6.346 0.305 843 HD2 HIS 68 HD2 HIS 68 2.604 8.139 -1.743 844 HE1 HIS 68 HE1 HIS 68 1.221 11.579 0.341 845 HE2 HIS 68 HE2 HIS 68 2.738 10.744 -1.528 846 H LEU 69 H LEU 69 -0.201 4.507 -2.635 847 HA LEU 69 HA LEU 69 -1.489 2.457 -1.055 848 HB2 LEU 69 HB2 LEU 69 -1.784 2.597 -3.468 849 HB3 LEU 69 HB3 LEU 69 -0.038 2.544 -3.732 850 HG LEU 69 HG LEU 69 0.041 0.226 -2.850 851 HD11 LEU 69 HD11 LEU 69 -2.998 0.506 -2.750 852 HD12 LEU 69 HD12 LEU 69 -2.096 -1.024 -2.600 853 HD13 LEU 69 HD13 LEU 69 -1.922 0.237 -1.366 854 HD21 LEU 69 HD21 LEU 69 -1.936 0.743 -5.103 855 HD22 LEU 69 HD22 LEU 69 -0.173 0.644 -5.240 856 HD23 LEU 69 HD23 LEU 69 -1.102 -0.803 -4.794 857 H VAL 70 H VAL 70 -0.616 0.694 -0.091 858 HA VAL 70 HA VAL 70 2.256 0.063 -0.322 859 HB VAL 70 HB VAL 70 0.819 0.444 2.347 860 HG11 VAL 70 HG11 VAL 70 2.481 -1.337 2.521 861 HG12 VAL 70 HG12 VAL 70 3.686 -0.340 1.658 862 HG13 VAL 70 HG13 VAL 70 3.130 0.122 3.278 863 HG21 VAL 70 HG21 VAL 70 3.048 2.067 1.041 864 HG22 VAL 70 HG22 VAL 70 1.387 2.626 1.369 865 HG23 VAL 70 HG23 VAL 70 2.472 2.260 2.715 866 H LEU 71 H LEU 71 2.575 -2.229 0.702 867 HA LEU 71 HA LEU 71 0.080 -3.777 0.785 868 HB2 LEU 71 HB2 LEU 71 0.525 -5.170 -1.046 869 HB3 LEU 71 HB3 LEU 71 0.781 -3.527 -1.639 870 HG LEU 71 HG LEU 71 2.904 -5.579 -0.881 871 HD11 LEU 71 HD11 LEU 71 1.767 -5.914 -3.046 872 HD12 LEU 71 HD12 LEU 71 2.171 -4.249 -3.520 873 HD13 LEU 71 HD13 LEU 71 3.468 -5.445 -3.265 874 HD21 LEU 71 HD21 LEU 71 3.786 -3.407 -0.247 875 HD22 LEU 71 HD22 LEU 71 4.551 -3.921 -1.756 876 HD23 LEU 71 HD23 LEU 71 3.260 -2.694 -1.797 877 H ARG 72 H ARG 72 0.546 -6.149 1.177 878 HA ARG 72 HA ARG 72 2.457 -6.344 3.374 879 HB2 ARG 72 HB2 ARG 72 0.262 -8.044 2.203 880 HB3 ARG 72 HB3 ARG 72 1.480 -8.827 3.214 881 HG2 ARG 72 HG2 ARG 72 -0.518 -8.089 4.494 882 HG3 ARG 72 HG3 ARG 72 1.011 -7.419 5.085 883 HD2 ARG 72 HD2 ARG 72 0.542 -5.291 3.906 884 HD3 ARG 72 HD3 ARG 72 -0.995 -5.958 3.324 885 HE ARG 72 HE ARG 72 -1.931 -5.606 5.410 886 HH11 ARG 72 HH11 ARG 72 1.582 -5.284 5.633 887 HH12 ARG 72 HH12 ARG 72 1.547 -4.714 7.282 888 HH21 ARG 72 HH21 ARG 72 -1.950 -4.829 7.563 889 HH22 ARG 72 HH22 ARG 72 -0.443 -4.449 8.366 890 H LEU 73 H LEU 73 3.602 -8.634 3.508 891 HA LEU 73 HA LEU 73 5.437 -8.571 1.194 892 HB2 LEU 73 HB2 LEU 73 5.831 -8.206 3.952 893 HB3 LEU 73 HB3 LEU 73 6.335 -9.872 3.706 894 HG LEU 73 HG LEU 73 8.231 -8.355 3.550 895 HD11 LEU 73 HD11 LEU 73 7.488 -9.363 0.776 896 HD12 LEU 73 HD12 LEU 73 9.121 -8.919 1.334 897 HD13 LEU 73 HD13 LEU 73 8.283 -10.309 2.058 898 HD21 LEU 73 HD21 LEU 73 6.959 -6.331 2.895 899 HD22 LEU 73 HD22 LEU 73 8.371 -6.599 1.852 900 HD23 LEU 73 HD23 LEU 73 6.740 -6.988 1.264 901 H ARG 74 H ARG 74 2.948 -10.117 1.723 902 HA ARG 74 HA ARG 74 1.963 -12.107 1.337 903 HB2 ARG 74 HB2 ARG 74 3.278 -11.881 -0.740 904 HB3 ARG 74 HB3 ARG 74 4.598 -12.802 -0.005 905 HG2 ARG 74 HG2 ARG 74 3.247 -14.232 -1.471 906 HG3 ARG 74 HG3 ARG 74 3.135 -14.779 0.207 907 HD2 ARG 74 HD2 ARG 74 0.959 -13.640 0.450 908 HD3 ARG 74 HD3 ARG 74 1.097 -13.009 -1.204 909 HE ARG 74 HE ARG 74 1.337 -15.795 -1.400 910 HH11 ARG 74 HH11 ARG 74 -1.074 -13.459 -0.312 911 HH12 ARG 74 HH12 ARG 74 -2.434 -14.492 -0.699 912 HH21 ARG 74 HH21 ARG 74 -0.452 -17.127 -1.908 913 HH22 ARG 74 HH22 ARG 74 -2.079 -16.558 -1.620 914 H GLY 75 H GLY 75 5.202 -12.442 2.733 915 HA2 GLY 75 HA2 GLY 75 4.959 -13.783 4.938 916 HA3 GLY 75 HA3 GLY 75 4.459 -15.087 3.824 917 H GLY 76 H GLY 76 6.423 -13.643 1.840 918 HA2 GLY 76 HA2 GLY 76 9.086 -13.815 2.655 919 HA3 GLY 76 HA3 GLY 76 8.621 -15.461 2.194 Start of MODEL 6 1 H LEU 491 H LEU 491 15.632 7.051 11.625 2 HA LEU 491 HA LEU 491 18.075 6.053 10.884 3 HB2 LEU 491 HB2 LEU 491 16.420 4.041 10.055 4 HB3 LEU 491 HB3 LEU 491 17.013 4.315 11.678 5 HG LEU 491 HG LEU 491 14.908 5.584 12.211 6 HD11 LEU 491 HD11 LEU 491 13.004 5.338 10.615 7 HD12 LEU 491 HD12 LEU 491 14.318 6.303 9.902 8 HD13 LEU 491 HD13 LEU 491 14.110 4.609 9.423 9 HD21 LEU 491 HD21 LEU 491 14.631 2.781 11.098 10 HD22 LEU 491 HD22 LEU 491 15.214 3.226 12.717 11 HD23 LEU 491 HD23 LEU 491 13.524 3.563 12.267 12 HA PRO 492 HA PRO 492 18.168 6.703 6.415 13 HB2 PRO 492 HB2 PRO 492 20.706 5.842 6.035 14 HB3 PRO 492 HB3 PRO 492 20.362 7.356 6.925 15 HG2 PRO 492 HG2 PRO 492 20.945 4.616 8.072 16 HG3 PRO 492 HG3 PRO 492 21.671 6.189 8.532 17 HD2 PRO 492 HD2 PRO 492 19.538 5.030 9.869 18 HD3 PRO 492 HD3 PRO 492 19.748 6.800 9.774 19 H LEU 493 H LEU 493 19.518 4.864 4.807 20 HA LEU 493 HA LEU 493 17.692 2.678 4.789 21 HB2 LEU 493 HB2 LEU 493 18.746 2.029 2.766 22 HB3 LEU 493 HB3 LEU 493 18.732 3.799 2.780 23 HG LEU 493 HG LEU 493 21.126 1.987 3.335 24 HD11 LEU 493 HD11 LEU 493 21.986 3.008 1.271 25 HD12 LEU 493 HD12 LEU 493 20.433 2.192 0.975 26 HD13 LEU 493 HD13 LEU 493 20.492 3.965 1.113 27 HD21 LEU 493 HD21 LEU 493 21.326 3.949 4.752 28 HD22 LEU 493 HD22 LEU 493 22.428 4.117 3.374 29 HD23 LEU 493 HD23 LEU 493 20.897 5.020 3.389 30 H GLN 494 H GLN 494 19.250 2.838 7.145 31 HA GLN 494 HA GLN 494 21.185 0.757 7.303 32 HB2 GLN 494 HB2 GLN 494 20.957 1.057 9.692 33 HB3 GLN 494 HB3 GLN 494 21.029 2.607 8.807 34 HG2 GLN 494 HG2 GLN 494 19.442 3.007 10.433 35 HG3 GLN 494 HG3 GLN 494 18.523 2.711 8.951 36 HE21 GLN 494 HE21 GLN 494 16.649 2.218 10.109 37 HE22 GLN 494 HE22 GLN 494 16.467 0.726 11.015 38 H ALA 495 H ALA 495 17.682 0.712 7.388 39 HA ALA 495 HA ALA 495 17.880 -2.247 7.454 40 HB1 ALA 495 HB1 ALA 495 15.993 -0.654 9.227 41 HB2 ALA 495 HB2 ALA 495 16.003 -2.426 9.052 42 HB3 ALA 495 HB3 ALA 495 17.403 -1.593 9.766 43 H LEU 496 H LEU 496 16.894 0.350 5.711 44 HA LEU 496 HA LEU 496 14.325 -0.444 4.783 45 HB2 LEU 496 HB2 LEU 496 16.627 1.237 3.816 46 HB3 LEU 496 HB3 LEU 496 15.448 0.702 2.622 47 HG LEU 496 HG LEU 496 13.610 1.625 3.983 48 HD11 LEU 496 HD11 LEU 496 14.662 1.632 6.204 49 HD12 LEU 496 HD12 LEU 496 15.830 2.864 5.663 50 HD13 LEU 496 HD13 LEU 496 14.096 3.251 5.760 51 HD21 LEU 496 HD21 LEU 496 15.828 3.593 3.254 52 HD22 LEU 496 HD22 LEU 496 14.672 2.882 2.116 53 HD23 LEU 496 HD23 LEU 496 14.085 3.977 3.381 54 HA PRO 497 HA PRO 497 15.013 -4.004 2.220 55 HB2 PRO 497 HB2 PRO 497 13.646 -2.397 0.075 56 HB3 PRO 497 HB3 PRO 497 13.286 -4.069 0.608 57 HG2 PRO 497 HG2 PRO 497 11.692 -2.046 1.415 58 HG3 PRO 497 HG3 PRO 497 12.200 -3.309 2.579 59 HD2 PRO 497 HD2 PRO 497 13.315 -0.524 2.248 60 HD3 PRO 497 HD3 PRO 497 12.948 -1.438 3.743 61 H GLU 498 H GLU 498 16.152 -4.733 0.294 62 HA GLU 498 HA GLU 498 18.487 -3.081 -0.136 63 HB2 GLU 498 HB2 GLU 498 18.492 -5.562 0.267 64 HB3 GLU 498 HB3 GLU 498 17.813 -5.775 -1.368 65 HG2 GLU 498 HG2 GLU 498 19.803 -4.680 -2.345 66 HG3 GLU 498 HG3 GLU 498 20.412 -4.319 -0.725 67 H GLY 499 H GLY 499 17.086 -1.409 -1.097 68 HA2 GLY 499 HA2 GLY 499 17.939 -0.766 -3.601 69 HA3 GLY 499 HA3 GLY 499 16.472 -1.714 -3.936 70 H VAL 500 H VAL 500 15.162 -0.818 -1.425 71 HA VAL 500 HA VAL 500 13.772 1.474 -2.375 72 HB VAL 500 HB VAL 500 13.968 0.109 0.318 73 HG11 VAL 500 HG11 VAL 500 11.974 2.224 -0.614 74 HG12 VAL 500 HG12 VAL 500 11.798 1.224 0.845 75 HG13 VAL 500 HG13 VAL 500 13.124 2.389 0.739 76 HG21 VAL 500 HG21 VAL 500 11.878 0.113 -1.911 77 HG22 VAL 500 HG22 VAL 500 13.029 -1.199 -1.595 78 HG23 VAL 500 HG23 VAL 500 11.777 -0.815 -0.396 79 H ASP 501 H ASP 501 13.585 3.550 -1.077 80 HA ASP 501 HA ASP 501 16.212 4.516 -0.087 81 HB2 ASP 501 HB2 ASP 501 15.061 4.998 -2.732 82 HB3 ASP 501 HB3 ASP 501 15.204 6.501 -1.834 83 H GLN 502 H GLN 502 16.096 6.594 0.926 84 HA GLN 502 HA GLN 502 13.935 6.819 2.745 85 HB2 GLN 502 HB2 GLN 502 16.012 8.851 1.816 86 HB3 GLN 502 HB3 GLN 502 15.035 9.002 3.294 87 HG2 GLN 502 HG2 GLN 502 16.849 6.625 2.756 88 HG3 GLN 502 HG3 GLN 502 17.407 8.095 3.563 89 HE21 GLN 502 HE21 GLN 502 15.471 5.188 3.876 90 HE22 GLN 502 HE22 GLN 502 15.109 5.374 5.580 91 H GLU 503 H GLU 503 14.743 8.647 -0.213 92 HA GLU 503 HA GLU 503 12.557 10.481 0.065 93 HB2 GLU 503 HB2 GLU 503 13.167 11.257 -2.136 94 HB3 GLU 503 HB3 GLU 503 14.642 10.939 -1.199 95 HG2 GLU 503 HG2 GLU 503 14.660 8.623 -2.310 96 HG3 GLU 503 HG3 GLU 503 13.414 9.239 -3.404 97 H VAL 504 H VAL 504 12.295 7.265 -0.370 98 HA VAL 504 HA VAL 504 9.662 7.633 -1.658 99 HB VAL 504 HB VAL 504 9.827 5.690 -2.961 100 HG11 VAL 504 HG11 VAL 504 11.358 6.415 -4.702 101 HG12 VAL 504 HG12 VAL 504 10.554 7.821 -3.975 102 HG13 VAL 504 HG13 VAL 504 12.238 7.435 -3.548 103 HG21 VAL 504 HG21 VAL 504 11.923 4.438 -3.310 104 HG22 VAL 504 HG22 VAL 504 12.757 5.472 -2.130 105 HG23 VAL 504 HG23 VAL 504 11.457 4.377 -1.595 106 H PHE 505 H PHE 505 11.110 6.943 1.133 107 HA PHE 505 HA PHE 505 9.082 4.881 1.862 108 HB2 PHE 505 HB2 PHE 505 11.021 3.679 2.110 109 HB3 PHE 505 HB3 PHE 505 12.006 5.114 2.330 110 HD1 PHE 505 HD1 PHE 505 12.254 6.233 4.419 111 HD2 PHE 505 HD2 PHE 505 10.003 2.599 4.100 112 HE1 PHE 505 HE1 PHE 505 12.510 5.857 6.884 113 HE2 PHE 505 HE2 PHE 505 10.277 2.199 6.542 114 HZ PHE 505 HZ PHE 505 11.568 3.798 7.913 115 H LYS 506 H LYS 506 10.479 8.040 2.393 116 HA LYS 506 HA LYS 506 9.305 8.430 5.008 117 HB2 LYS 506 HB2 LYS 506 10.418 10.335 2.917 118 HB3 LYS 506 HB3 LYS 506 9.840 10.843 4.514 119 HG2 LYS 506 HG2 LYS 506 11.453 9.325 5.616 120 HG3 LYS 506 HG3 LYS 506 12.058 8.801 4.043 121 HD2 LYS 506 HD2 LYS 506 12.147 11.669 5.074 122 HD3 LYS 506 HD3 LYS 506 13.511 10.530 5.065 123 HE2 LYS 506 HE2 LYS 506 13.381 10.367 2.614 124 HE3 LYS 506 HE3 LYS 506 12.016 11.500 2.600 125 HZ1 LYS 506 HZ1 LYS 506 13.467 13.154 3.567 126 HZ2 LYS 506 HZ2 LYS 506 14.732 12.108 3.569 127 HZ3 LYS 506 HZ3 LYS 506 14.084 12.614 2.145 128 H GLN 507 H GLN 507 7.804 7.778 2.217 129 HA GLN 507 HA GLN 507 5.738 9.837 2.191 130 HB2 GLN 507 HB2 GLN 507 5.338 7.166 0.904 131 HB3 GLN 507 HB3 GLN 507 4.968 8.775 0.286 132 HG2 GLN 507 HG2 GLN 507 7.676 7.389 0.420 133 HG3 GLN 507 HG3 GLN 507 6.742 7.755 -1.027 134 HE21 GLN 507 HE21 GLN 507 9.544 8.544 -0.109 135 HE22 GLN 507 HE22 GLN 507 9.567 10.266 -0.277 136 H LEU 508 H LEU 508 6.383 7.727 4.508 137 HA LEU 508 HA LEU 508 3.648 6.537 4.762 138 HB2 LEU 508 HB2 LEU 508 6.297 5.409 5.723 139 HB3 LEU 508 HB3 LEU 508 4.744 4.576 5.666 140 HG LEU 508 HG LEU 508 6.319 5.537 3.227 141 HD11 LEU 508 HD11 LEU 508 7.411 3.687 4.502 142 HD12 LEU 508 HD12 LEU 508 5.936 2.715 4.286 143 HD13 LEU 508 HD13 LEU 508 6.884 3.220 2.871 144 HD21 LEU 508 HD21 LEU 508 4.716 4.100 1.980 145 HD22 LEU 508 HD22 LEU 508 3.822 3.813 3.493 146 HD23 LEU 508 HD23 LEU 508 3.898 5.446 2.794 147 HA PRO 509 HA PRO 509 3.636 8.282 8.887 148 HB2 PRO 509 HB2 PRO 509 1.951 6.570 10.175 149 HB3 PRO 509 HB3 PRO 509 1.388 7.735 8.949 150 HG2 PRO 509 HG2 PRO 509 2.063 4.796 8.585 151 HG3 PRO 509 HG3 PRO 509 0.596 5.652 8.002 152 HD2 PRO 509 HD2 PRO 509 2.746 5.178 6.376 153 HD3 PRO 509 HD3 PRO 509 1.799 6.693 6.260 154 H ALA 510 H ALA 510 4.046 7.686 11.132 155 HA ALA 510 HA ALA 510 6.412 6.210 11.487 156 HB1 ALA 510 HB1 ALA 510 4.276 7.124 13.446 157 HB2 ALA 510 HB2 ALA 510 5.931 6.634 13.900 158 HB3 ALA 510 HB3 ALA 510 5.662 8.081 12.886 159 H ASP 511 H ASP 511 3.154 5.036 11.265 160 HA ASP 511 HA ASP 511 3.891 2.566 12.729 161 HB2 ASP 511 HB2 ASP 511 1.512 2.059 12.760 162 HB3 ASP 511 HB3 ASP 511 1.805 3.667 13.426 163 H ILE 512 H ILE 512 4.157 3.712 9.659 164 HA ILE 512 HA ILE 512 4.139 0.888 8.699 165 HB ILE 512 HB ILE 512 3.737 3.420 7.083 166 HG12 ILE 512 HG12 ILE 512 1.941 1.068 7.822 167 HG13 ILE 512 HG13 ILE 512 1.759 2.750 8.354 168 HG21 ILE 512 HG21 ILE 512 3.788 0.499 6.187 169 HG22 ILE 512 HG22 ILE 512 3.469 1.915 5.150 170 HG23 ILE 512 HG23 ILE 512 5.068 1.691 5.848 171 HD11 ILE 512 HD11 ILE 512 1.417 1.697 5.519 172 HD12 ILE 512 HD12 ILE 512 0.165 2.312 6.617 173 HD13 ILE 512 HD13 ILE 512 1.397 3.421 5.967 174 H GLN 513 H GLN 513 6.043 3.728 9.452 175 HA GLN 513 HA GLN 513 8.428 3.152 8.061 176 HB2 GLN 513 HB2 GLN 513 7.610 4.486 10.555 177 HB3 GLN 513 HB3 GLN 513 9.160 3.651 10.735 178 HG2 GLN 513 HG2 GLN 513 9.492 5.974 10.056 179 HG3 GLN 513 HG3 GLN 513 10.107 4.831 8.857 180 HE21 GLN 513 HE21 GLN 513 9.383 4.941 6.767 181 HE22 GLN 513 HE22 GLN 513 8.100 6.000 6.229 182 H GLU 514 H GLU 514 6.997 1.665 10.981 183 HA GLU 514 HA GLU 514 9.154 -0.207 11.361 184 HB2 GLU 514 HB2 GLU 514 7.715 -1.123 13.114 185 HB3 GLU 514 HB3 GLU 514 7.796 0.644 13.216 186 HG2 GLU 514 HG2 GLU 514 5.610 0.822 12.074 187 HG3 GLU 514 HG3 GLU 514 5.532 -0.942 11.934 188 H GLU 515 H GLU 515 6.915 -0.161 8.890 189 HA GLU 515 HA GLU 515 6.545 -3.118 8.911 190 HB2 GLU 515 HB2 GLU 515 5.266 -0.930 7.241 191 HB3 GLU 515 HB3 GLU 515 4.915 -2.658 7.097 192 HG2 GLU 515 HG2 GLU 515 4.517 -1.107 9.685 193 HG3 GLU 515 HG3 GLU 515 3.272 -1.265 8.452 194 H ILE 516 H ILE 516 8.378 -0.555 7.401 195 HA ILE 516 HA ILE 516 9.123 -2.356 5.135 196 HB ILE 516 HB ILE 516 9.220 0.638 5.561 197 HG12 ILE 516 HG12 ILE 516 8.027 0.779 3.514 198 HG13 ILE 516 HG13 ILE 516 8.265 -0.942 3.150 199 HG21 ILE 516 HG21 ILE 516 10.677 -1.020 3.459 200 HG22 ILE 516 HG22 ILE 516 10.423 0.722 3.331 201 HG23 ILE 516 HG23 ILE 516 11.414 0.081 4.655 202 HD11 ILE 516 HD11 ILE 516 5.956 -0.338 3.859 203 HD12 ILE 516 HD12 ILE 516 6.698 -1.580 4.881 204 HD13 ILE 516 HD13 ILE 516 6.592 0.104 5.461 205 H LEU 517 H LEU 517 10.281 -0.627 8.014 206 HA LEU 517 HA LEU 517 13.059 -1.327 7.716 207 HB2 LEU 517 HB2 LEU 517 11.268 -0.657 10.081 208 HB3 LEU 517 HB3 LEU 517 13.008 -0.939 10.241 209 HG LEU 517 HG LEU 517 11.856 1.160 8.353 210 HD11 LEU 517 HD11 LEU 517 12.824 1.459 11.225 211 HD12 LEU 517 HD12 LEU 517 12.407 2.800 10.126 212 HD13 LEU 517 HD13 LEU 517 11.148 1.666 10.665 213 HD21 LEU 517 HD21 LEU 517 14.607 0.858 9.634 214 HD22 LEU 517 HD22 LEU 517 14.219 0.426 7.952 215 HD23 LEU 517 HD23 LEU 517 14.117 2.111 8.479 216 H SER 518 H SER 518 10.370 -3.222 7.968 217 HA SER 518 HA SER 518 11.948 -5.520 9.020 218 HB2 SER 518 HB2 SER 518 9.976 -6.351 10.184 219 HB3 SER 518 HB3 SER 518 10.368 -4.717 10.759 220 HG SER 518 HG SER 518 8.161 -4.891 10.309 221 H GLY 519 H GLY 519 10.904 -4.298 6.315 222 HA2 GLY 519 HA2 GLY 519 9.834 -6.849 5.201 223 HA3 GLY 519 HA3 GLY 519 9.249 -5.249 4.684 224 H LYS 520 H LYS 520 12.530 -6.288 5.514 225 HA LYS 520 HA LYS 520 13.824 -4.792 3.577 226 HB2 LYS 520 HB2 LYS 520 15.795 -5.801 4.377 227 HB3 LYS 520 HB3 LYS 520 14.696 -5.666 5.754 228 HG2 LYS 520 HG2 LYS 520 15.171 -8.213 4.130 229 HG3 LYS 520 HG3 LYS 520 16.001 -7.817 5.628 230 HD2 LYS 520 HD2 LYS 520 12.994 -8.255 5.336 231 HD3 LYS 520 HD3 LYS 520 14.153 -9.400 6.003 232 HE2 LYS 520 HE2 LYS 520 13.612 -6.631 7.156 233 HE3 LYS 520 HE3 LYS 520 12.913 -8.142 7.756 234 HZ1 LYS 520 HZ1 LYS 520 15.127 -8.922 8.224 235 HZ2 LYS 520 HZ2 LYS 520 15.788 -7.517 7.679 236 HZ3 LYS 520 HZ3 LYS 520 14.835 -7.514 9.017 237 H SER 521 H SER 521 11.988 -7.330 2.694 238 HA SER 521 HA SER 521 13.630 -7.910 0.293 239 HB2 SER 521 HB2 SER 521 14.061 -9.663 2.032 240 HB3 SER 521 HB3 SER 521 12.330 -10.054 2.008 241 HG SER 521 HG SER 521 13.602 -11.373 0.610 242 H ARG 522 H ARG 522 12.093 -9.606 -0.988 243 HA ARG 522 HA ARG 522 10.314 -9.811 -2.348 244 HB2 ARG 522 HB2 ARG 522 9.244 -9.892 0.128 245 HB3 ARG 522 HB3 ARG 522 8.469 -8.411 -0.447 246 HG2 ARG 522 HG2 ARG 522 6.913 -9.895 -1.201 247 HG3 ARG 522 HG3 ARG 522 8.006 -9.986 -2.599 248 HD2 ARG 522 HD2 ARG 522 8.065 -11.835 -0.175 249 HD3 ARG 522 HD3 ARG 522 7.283 -12.214 -1.719 250 HE ARG 522 HE ARG 522 10.114 -11.512 -1.966 251 HH11 ARG 522 HH11 ARG 522 7.863 -14.140 -1.262 252 HH12 ARG 522 HH12 ARG 522 8.936 -15.381 -1.873 253 HH21 ARG 522 HH21 ARG 522 11.496 -13.146 -2.752 254 HH22 ARG 522 HH22 ARG 522 11.009 -14.809 -2.695 255 H GLU 523 H GLU 523 11.707 -6.933 -1.808 256 HA GLU 523 HA GLU 523 10.365 -5.801 -4.143 257 HB2 GLU 523 HB2 GLU 523 9.867 -3.655 -3.115 258 HB3 GLU 523 HB3 GLU 523 8.975 -4.944 -2.284 259 HG2 GLU 523 HG2 GLU 523 10.692 -4.967 -0.494 260 HG3 GLU 523 HG3 GLU 523 11.558 -3.655 -1.319 261 H ASN 524 H ASN 524 11.507 -3.837 -4.939 262 HA ASN 524 HA ASN 524 14.307 -3.560 -4.086 263 HB2 ASN 524 HB2 ASN 524 13.425 -4.685 -6.775 264 HB3 ASN 524 HB3 ASN 524 15.034 -4.018 -6.481 265 HD21 ASN 524 HD21 ASN 524 12.793 -6.645 -5.612 266 HD22 ASN 524 HD22 ASN 524 14.039 -7.744 -5.062 267 H LEU 525 H LEU 525 12.061 -1.764 -4.070 268 HA LEU 525 HA LEU 525 11.394 0.280 -4.703 269 HB2 LEU 525 HB2 LEU 525 13.082 1.719 -4.710 270 HB3 LEU 525 HB3 LEU 525 14.159 0.336 -4.778 271 HG LEU 525 HG LEU 525 13.655 0.633 -7.441 272 HD11 LEU 525 HD11 LEU 525 12.249 2.716 -6.903 273 HD12 LEU 525 HD12 LEU 525 13.717 3.458 -6.259 274 HD13 LEU 525 HD13 LEU 525 13.633 3.020 -7.982 275 HD21 LEU 525 HD21 LEU 525 15.699 2.199 -5.826 276 HD22 LEU 525 HD22 LEU 525 15.866 0.512 -6.375 277 HD23 LEU 525 HD23 LEU 525 15.784 1.831 -7.564 278 H LYS 526 H LYS 526 11.436 -2.223 -6.586 279 HA LYS 526 HA LYS 526 10.274 -0.850 -8.958 280 HB2 LYS 526 HB2 LYS 526 12.164 -3.191 -8.661 281 HB3 LYS 526 HB3 LYS 526 11.260 -2.914 -10.177 282 HG2 LYS 526 HG2 LYS 526 12.300 -0.717 -10.433 283 HG3 LYS 526 HG3 LYS 526 13.139 -0.884 -8.879 284 HD2 LYS 526 HD2 LYS 526 13.484 -2.826 -11.180 285 HD3 LYS 526 HD3 LYS 526 14.547 -1.421 -10.909 286 HE2 LYS 526 HE2 LYS 526 15.079 -2.296 -8.639 287 HE3 LYS 526 HE3 LYS 526 14.083 -3.725 -8.968 288 HZ1 LYS 526 HZ1 LYS 526 16.405 -4.146 -9.397 289 HZ2 LYS 526 HZ2 LYS 526 15.553 -4.242 -10.797 290 HZ3 LYS 526 HZ3 LYS 526 16.479 -2.921 -10.485 291 H1 MET 1 H1 MET 1 -11.922 13.281 -13.360 292 H2 MET 1 H2 MET 1 -13.316 14.006 -12.870 293 H3 MET 1 H3 MET 1 -13.266 12.375 -13.081 294 HA MET 1 HA MET 1 -11.741 13.879 -11.069 295 HB2 MET 1 HB2 MET 1 -14.080 13.831 -10.430 296 HB3 MET 1 HB3 MET 1 -14.206 12.104 -10.812 297 HG2 MET 1 HG2 MET 1 -12.658 11.534 -9.030 298 HG3 MET 1 HG3 MET 1 -12.332 13.243 -8.708 299 HE1 MET 1 HE1 MET 1 -12.726 12.895 -6.145 300 HE2 MET 1 HE2 MET 1 -14.175 12.123 -5.455 301 HE3 MET 1 HE3 MET 1 -13.036 11.169 -6.438 302 H GLN 2 H GLN 2 -10.025 12.945 -10.275 303 HA GLN 2 HA GLN 2 -9.849 10.058 -10.044 304 HB2 GLN 2 HB2 GLN 2 -7.915 9.786 -11.480 305 HB3 GLN 2 HB3 GLN 2 -9.176 10.607 -12.430 306 HG2 GLN 2 HG2 GLN 2 -7.990 12.786 -11.477 307 HG3 GLN 2 HG3 GLN 2 -6.633 11.709 -11.215 308 HE21 GLN 2 HE21 GLN 2 -5.286 12.731 -12.762 309 HE22 GLN 2 HE22 GLN 2 -5.601 12.644 -14.482 310 H ILE 3 H ILE 3 -7.576 9.531 -9.151 311 HA ILE 3 HA ILE 3 -6.483 11.745 -7.495 312 HB ILE 3 HB ILE 3 -6.527 10.509 -5.500 313 HG12 ILE 3 HG12 ILE 3 -7.115 8.105 -7.238 314 HG13 ILE 3 HG13 ILE 3 -5.861 8.366 -6.035 315 HG21 ILE 3 HG21 ILE 3 -9.222 10.021 -6.813 316 HG22 ILE 3 HG22 ILE 3 -8.886 10.196 -5.074 317 HG23 ILE 3 HG23 ILE 3 -8.654 11.576 -6.154 318 HD11 ILE 3 HD11 ILE 3 -7.501 6.804 -5.158 319 HD12 ILE 3 HD12 ILE 3 -7.632 8.323 -4.242 320 HD13 ILE 3 HD13 ILE 3 -8.826 7.925 -5.498 321 H PHE 4 H PHE 4 -4.384 10.771 -6.321 322 HA PHE 4 HA PHE 4 -2.923 9.179 -8.376 323 HB2 PHE 4 HB2 PHE 4 -1.783 11.568 -6.910 324 HB3 PHE 4 HB3 PHE 4 -1.003 10.623 -8.126 325 HD1 PHE 4 HD1 PHE 4 -2.298 10.458 -10.475 326 HD2 PHE 4 HD2 PHE 4 -2.865 13.581 -7.567 327 HE1 PHE 4 HE1 PHE 4 -3.092 11.972 -12.257 328 HE2 PHE 4 HE2 PHE 4 -3.641 15.103 -9.366 329 HZ PHE 4 HZ PHE 4 -3.769 14.297 -11.709 330 H VAL 5 H VAL 5 -3.102 7.349 -7.162 331 HA VAL 5 HA VAL 5 -2.208 7.289 -4.371 332 HB VAL 5 HB VAL 5 -2.958 5.021 -6.266 333 HG11 VAL 5 HG11 VAL 5 -3.309 3.786 -4.144 334 HG12 VAL 5 HG12 VAL 5 -1.625 4.311 -4.319 335 HG13 VAL 5 HG13 VAL 5 -2.716 5.200 -3.232 336 HG21 VAL 5 HG21 VAL 5 -4.628 6.577 -4.235 337 HG22 VAL 5 HG22 VAL 5 -4.852 6.582 -5.996 338 HG23 VAL 5 HG23 VAL 5 -5.150 5.103 -5.072 339 H LYS 6 H LYS 6 -0.045 7.628 -4.114 340 HA LYS 6 HA LYS 6 1.860 6.533 -6.062 341 HB2 LYS 6 HB2 LYS 6 2.164 8.785 -5.168 342 HB3 LYS 6 HB3 LYS 6 2.220 8.148 -3.511 343 HG2 LYS 6 HG2 LYS 6 4.276 6.998 -3.899 344 HG3 LYS 6 HG3 LYS 6 4.171 7.236 -5.655 345 HD2 LYS 6 HD2 LYS 6 4.279 9.581 -3.739 346 HD3 LYS 6 HD3 LYS 6 5.764 8.784 -4.326 347 HE2 LYS 6 HE2 LYS 6 5.124 9.204 -6.642 348 HE3 LYS 6 HE3 LYS 6 3.600 9.951 -6.124 349 HZ1 LYS 6 HZ1 LYS 6 4.890 11.645 -5.007 350 HZ2 LYS 6 HZ2 LYS 6 6.299 10.952 -5.490 351 HZ3 LYS 6 HZ3 LYS 6 5.285 11.595 -6.603 352 H THR 7 H THR 7 3.179 4.855 -5.805 353 HA THR 7 HA THR 7 2.433 2.887 -3.778 354 HB THR 7 HB THR 7 3.986 1.451 -5.118 355 HG1 THR 7 HG1 THR 7 4.975 2.373 -6.886 356 HG21 THR 7 HG21 THR 7 1.596 1.700 -5.748 357 HG22 THR 7 HG22 THR 7 2.017 3.075 -6.793 358 HG23 THR 7 HG23 THR 7 2.635 1.446 -7.167 359 H LEU 8 H LEU 8 4.254 1.485 -2.944 360 HA LEU 8 HA LEU 8 5.963 2.915 -1.183 361 HB2 LEU 8 HB2 LEU 8 4.960 0.715 -0.755 362 HB3 LEU 8 HB3 LEU 8 5.859 0.008 -2.092 363 HG LEU 8 HG LEU 8 7.948 0.256 -0.942 364 HD11 LEU 8 HD11 LEU 8 6.421 1.662 1.290 365 HD12 LEU 8 HD12 LEU 8 8.140 1.207 1.320 366 HD13 LEU 8 HD13 LEU 8 7.580 2.443 0.187 367 HD21 LEU 8 HD21 LEU 8 5.853 -0.752 1.015 368 HD22 LEU 8 HD22 LEU 8 6.531 -1.676 -0.347 369 HD23 LEU 8 HD23 LEU 8 7.582 -1.172 0.991 370 H THR 9 H THR 9 6.260 2.778 -4.439 371 HA THR 9 HA THR 9 9.243 2.631 -4.358 372 HB THR 9 HB THR 9 9.158 1.929 -6.704 373 HG1 THR 9 HG1 THR 9 7.159 1.344 -7.577 374 HG21 THR 9 HG21 THR 9 9.155 0.240 -4.853 375 HG22 THR 9 HG22 THR 9 7.382 0.191 -4.933 376 HG23 THR 9 HG23 THR 9 8.343 -0.348 -6.328 377 H GLY 10 H GLY 10 6.801 4.834 -4.400 378 HA2 GLY 10 HA2 GLY 10 7.059 7.096 -4.641 379 HA3 GLY 10 HA3 GLY 10 8.628 6.869 -5.436 380 H LYS 11 H LYS 11 5.727 5.191 -6.603 381 HA LYS 11 HA LYS 11 5.697 7.031 -8.949 382 HB2 LYS 11 HB2 LYS 11 6.842 4.907 -9.320 383 HB3 LYS 11 HB3 LYS 11 5.407 4.000 -8.826 384 HG2 LYS 11 HG2 LYS 11 5.118 6.025 -11.037 385 HG3 LYS 11 HG3 LYS 11 5.959 4.499 -11.379 386 HD2 LYS 11 HD2 LYS 11 4.028 3.195 -10.626 387 HD3 LYS 11 HD3 LYS 11 3.170 4.670 -10.158 388 HE2 LYS 11 HE2 LYS 11 2.340 3.923 -12.304 389 HE3 LYS 11 HE3 LYS 11 3.215 5.446 -12.515 390 HZ1 LYS 11 HZ1 LYS 11 5.110 4.180 -13.280 391 HZ2 LYS 11 HZ2 LYS 11 4.302 2.765 -13.064 392 HZ3 LYS 11 HZ3 LYS 11 3.791 3.838 -14.197 393 H THR 12 H THR 12 3.830 8.032 -9.229 394 HA THR 12 HA THR 12 1.484 7.262 -7.674 395 HB THR 12 HB THR 12 2.451 9.647 -9.040 396 HG1 THR 12 HG1 THR 12 1.086 10.516 -7.496 397 HG21 THR 12 HG21 THR 12 0.712 9.112 -10.737 398 HG22 THR 12 HG22 THR 12 -0.494 9.006 -9.424 399 HG23 THR 12 HG23 THR 12 0.330 10.544 -9.771 400 H ILE 13 H ILE 13 -0.547 6.735 -8.463 401 HA ILE 13 HA ILE 13 -0.693 5.778 -11.285 402 HB ILE 13 HB ILE 13 -1.806 4.381 -8.812 403 HG12 ILE 13 HG12 ILE 13 0.497 3.592 -10.647 404 HG13 ILE 13 HG13 ILE 13 0.653 4.146 -8.966 405 HG21 ILE 13 HG21 ILE 13 -1.756 3.546 -11.745 406 HG22 ILE 13 HG22 ILE 13 -2.485 2.631 -10.402 407 HG23 ILE 13 HG23 ILE 13 -3.180 4.181 -10.891 408 HD11 ILE 13 HD11 ILE 13 -0.712 2.205 -8.218 409 HD12 ILE 13 HD12 ILE 13 -0.717 1.588 -9.893 410 HD13 ILE 13 HD13 ILE 13 0.810 1.732 -9.007 411 H THR 14 H THR 14 -2.308 6.777 -12.335 412 HA THR 14 HA THR 14 -4.124 8.508 -10.869 413 HB THR 14 HB THR 14 -4.021 7.789 -13.831 414 HG1 THR 14 HG1 THR 14 -2.766 9.665 -13.968 415 HG21 THR 14 HG21 THR 14 -6.114 8.889 -13.112 416 HG22 THR 14 HG22 THR 14 -5.165 10.164 -12.307 417 HG23 THR 14 HG23 THR 14 -5.113 10.001 -14.079 418 H LEU 15 H LEU 15 -6.262 8.075 -10.365 419 HA LEU 15 HA LEU 15 -7.515 5.610 -11.459 420 HB2 LEU 15 HB2 LEU 15 -7.248 6.283 -8.503 421 HB3 LEU 15 HB3 LEU 15 -8.128 4.908 -9.188 422 HG LEU 15 HG LEU 15 -5.141 5.377 -9.470 423 HD11 LEU 15 HD11 LEU 15 -6.641 3.458 -7.631 424 HD12 LEU 15 HD12 LEU 15 -4.877 3.683 -7.727 425 HD13 LEU 15 HD13 LEU 15 -5.910 4.996 -7.117 426 HD21 LEU 15 HD21 LEU 15 -5.053 3.002 -10.079 427 HD22 LEU 15 HD22 LEU 15 -6.825 2.892 -10.002 428 HD23 LEU 15 HD23 LEU 15 -6.058 3.909 -11.238 429 H GLU 16 H GLU 16 -9.618 5.870 -11.800 430 HA GLU 16 HA GLU 16 -10.915 8.425 -11.055 431 HB2 GLU 16 HB2 GLU 16 -11.087 7.729 -13.361 432 HB3 GLU 16 HB3 GLU 16 -11.602 6.101 -12.898 433 HG2 GLU 16 HG2 GLU 16 -13.663 6.982 -11.933 434 HG3 GLU 16 HG3 GLU 16 -13.173 8.644 -12.317 435 H VAL 17 H VAL 17 -12.242 8.592 -9.404 436 HA VAL 17 HA VAL 17 -13.743 6.258 -8.377 437 HB VAL 17 HB VAL 17 -13.034 6.757 -6.065 438 HG11 VAL 17 HG11 VAL 17 -10.807 5.765 -6.151 439 HG12 VAL 17 HG12 VAL 17 -11.875 4.975 -7.328 440 HG13 VAL 17 HG13 VAL 17 -10.659 6.160 -7.873 441 HG21 VAL 17 HG21 VAL 17 -10.974 8.592 -7.374 442 HG22 VAL 17 HG22 VAL 17 -12.356 9.121 -6.382 443 HG23 VAL 17 HG23 VAL 17 -11.053 8.166 -5.653 444 H GLU 18 H GLU 18 -15.127 7.135 -6.410 445 HA GLU 18 HA GLU 18 -16.143 9.872 -6.976 446 HB2 GLU 18 HB2 GLU 18 -17.764 7.303 -6.710 447 HB3 GLU 18 HB3 GLU 18 -18.451 8.920 -6.865 448 HG2 GLU 18 HG2 GLU 18 -16.705 7.567 -8.969 449 HG3 GLU 18 HG3 GLU 18 -18.467 7.579 -8.949 450 HA PRO 19 HA PRO 19 -16.559 10.278 -2.546 451 HB2 PRO 19 HB2 PRO 19 -19.416 11.034 -3.038 452 HB3 PRO 19 HB3 PRO 19 -18.157 11.929 -2.136 453 HG2 PRO 19 HG2 PRO 19 -18.867 12.752 -4.603 454 HG3 PRO 19 HG3 PRO 19 -17.140 12.732 -4.106 455 HD2 PRO 19 HD2 PRO 19 -18.625 10.721 -5.788 456 HD3 PRO 19 HD3 PRO 19 -16.993 11.423 -6.029 457 H SER 20 H SER 20 -18.177 7.823 -4.256 458 HA SER 20 HA SER 20 -19.176 6.659 -1.710 459 HB2 SER 20 HB2 SER 20 -20.494 6.625 -4.448 460 HB3 SER 20 HB3 SER 20 -21.023 5.682 -3.040 461 HG SER 20 HG SER 20 -22.151 7.680 -3.272 462 H ASP 21 H ASP 21 -17.124 6.399 -4.440 463 HA ASP 21 HA ASP 21 -16.966 3.465 -4.431 464 HB2 ASP 21 HB2 ASP 21 -15.158 5.617 -5.530 465 HB3 ASP 21 HB3 ASP 21 -14.953 3.890 -5.821 466 H THR 22 H THR 22 -16.892 3.572 -2.094 467 HA THR 22 HA THR 22 -14.762 4.783 -0.620 468 HB THR 22 HB THR 22 -16.857 4.226 0.415 469 HG1 THR 22 HG1 THR 22 -15.984 3.330 2.248 470 HG21 THR 22 HG21 THR 22 -17.448 1.940 1.013 471 HG22 THR 22 HG22 THR 22 -17.482 2.192 -0.739 472 HG23 THR 22 HG23 THR 22 -16.102 1.328 0.007 473 H ILE 23 H ILE 23 -13.479 3.136 0.956 474 HA ILE 23 HA ILE 23 -11.251 2.585 -0.591 475 HB ILE 23 HB ILE 23 -11.865 1.291 2.074 476 HG12 ILE 23 HG12 ILE 23 -12.485 3.605 2.324 477 HG13 ILE 23 HG13 ILE 23 -10.916 3.353 3.089 478 HG21 ILE 23 HG21 ILE 23 -9.784 0.576 0.988 479 HG22 ILE 23 HG22 ILE 23 -9.290 2.266 0.770 480 HG23 ILE 23 HG23 ILE 23 -9.430 1.586 2.411 481 HD11 ILE 23 HD11 ILE 23 -11.015 5.472 1.820 482 HD12 ILE 23 HD12 ILE 23 -9.801 4.376 1.116 483 HD13 ILE 23 HD13 ILE 23 -11.384 4.582 0.331 484 H GLU 24 H GLU 24 -13.866 0.258 0.260 485 HA GLU 24 HA GLU 24 -12.313 -2.011 -0.606 486 HB2 GLU 24 HB2 GLU 24 -14.316 -3.276 -0.414 487 HB3 GLU 24 HB3 GLU 24 -14.320 -2.094 0.909 488 HG2 GLU 24 HG2 GLU 24 -15.843 -0.646 -0.420 489 HG3 GLU 24 HG3 GLU 24 -15.848 -1.851 -1.718 490 H ASN 25 H ASN 25 -14.131 0.444 -2.303 491 HA ASN 25 HA ASN 25 -14.337 -1.054 -4.784 492 HB2 ASN 25 HB2 ASN 25 -14.670 1.900 -4.162 493 HB3 ASN 25 HB3 ASN 25 -15.009 1.176 -5.714 494 HD21 ASN 25 HD21 ASN 25 -16.053 1.610 -2.515 495 HD22 ASN 25 HD22 ASN 25 -17.591 0.731 -2.603 496 H VAL 26 H VAL 26 -12.288 1.424 -3.265 497 HA VAL 26 HA VAL 26 -10.706 2.219 -5.502 498 HB VAL 26 HB VAL 26 -10.162 2.162 -2.499 499 HG11 VAL 26 HG11 VAL 26 -8.068 2.288 -3.653 500 HG12 VAL 26 HG12 VAL 26 -8.680 3.529 -4.774 501 HG13 VAL 26 HG13 VAL 26 -8.453 3.908 -3.046 502 HG21 VAL 26 HG21 VAL 26 -10.771 4.534 -2.595 503 HG22 VAL 26 HG22 VAL 26 -11.139 4.385 -4.337 504 HG23 VAL 26 HG23 VAL 26 -12.118 3.513 -3.141 505 H LYS 27 H LYS 27 -10.290 -0.310 -2.998 506 HA LYS 27 HA LYS 27 -7.725 -1.174 -3.749 507 HB2 LYS 27 HB2 LYS 27 -10.155 -2.560 -2.576 508 HB3 LYS 27 HB3 LYS 27 -8.587 -3.364 -2.794 509 HG2 LYS 27 HG2 LYS 27 -7.461 -1.795 -1.365 510 HG3 LYS 27 HG3 LYS 27 -8.900 -0.767 -1.238 511 HD2 LYS 27 HD2 LYS 27 -10.131 -2.585 -0.114 512 HD3 LYS 27 HD3 LYS 27 -8.720 -3.660 -0.276 513 HE2 LYS 27 HE2 LYS 27 -7.374 -2.091 1.070 514 HE3 LYS 27 HE3 LYS 27 -8.773 -1.015 1.234 515 HZ1 LYS 27 HZ1 LYS 27 -8.520 -2.444 3.147 516 HZ2 LYS 27 HZ2 LYS 27 -9.940 -2.731 2.381 517 HZ3 LYS 27 HZ3 LYS 27 -8.686 -3.789 2.215 518 H ALA 28 H ALA 28 -10.829 -1.636 -5.421 519 HA ALA 28 HA ALA 28 -9.726 -3.736 -7.136 520 HB1 ALA 28 HB1 ALA 28 -12.250 -2.066 -7.455 521 HB2 ALA 28 HB2 ALA 28 -11.828 -3.537 -8.345 522 HB3 ALA 28 HB3 ALA 28 -12.149 -3.626 -6.595 523 H LYS 29 H LYS 29 -10.004 -0.193 -7.155 524 HA LYS 29 HA LYS 29 -9.425 0.189 -9.946 525 HB2 LYS 29 HB2 LYS 29 -9.153 1.903 -7.456 526 HB3 LYS 29 HB3 LYS 29 -8.482 2.434 -8.992 527 HG2 LYS 29 HG2 LYS 29 -10.627 3.409 -8.706 528 HG3 LYS 29 HG3 LYS 29 -10.708 2.257 -10.057 529 HD2 LYS 29 HD2 LYS 29 -11.881 0.641 -8.724 530 HD3 LYS 29 HD3 LYS 29 -11.494 1.530 -7.235 531 HE2 LYS 29 HE2 LYS 29 -13.839 1.847 -7.875 532 HE3 LYS 29 HE3 LYS 29 -12.944 3.371 -7.877 533 HZ1 LYS 29 HZ1 LYS 29 -13.534 1.770 -10.277 534 HZ2 LYS 29 HZ2 LYS 29 -14.345 3.129 -9.821 535 HZ3 LYS 29 HZ3 LYS 29 -12.763 3.223 -10.246 536 H ILE 30 H ILE 30 -7.430 -0.415 -7.058 537 HA ILE 30 HA ILE 30 -4.938 0.164 -8.496 538 HB ILE 30 HB ILE 30 -5.608 -0.906 -5.725 539 HG12 ILE 30 HG12 ILE 30 -4.527 1.806 -6.604 540 HG13 ILE 30 HG13 ILE 30 -6.243 1.479 -6.298 541 HG21 ILE 30 HG21 ILE 30 -3.233 -0.503 -5.172 542 HG22 ILE 30 HG22 ILE 30 -3.383 -1.717 -6.446 543 HG23 ILE 30 HG23 ILE 30 -2.909 -0.055 -6.867 544 HD11 ILE 30 HD11 ILE 30 -5.729 0.875 -3.957 545 HD12 ILE 30 HD12 ILE 30 -4.012 1.242 -4.239 546 HD13 ILE 30 HD13 ILE 30 -5.225 2.528 -4.354 547 H GLN 31 H GLN 31 -6.932 -2.625 -7.540 548 HA GLN 31 HA GLN 31 -5.021 -4.655 -8.209 549 HB2 GLN 31 HB2 GLN 31 -7.007 -5.184 -6.893 550 HB3 GLN 31 HB3 GLN 31 -8.068 -4.581 -8.187 551 HG2 GLN 31 HG2 GLN 31 -7.329 -6.318 -9.709 552 HG3 GLN 31 HG3 GLN 31 -6.114 -6.874 -8.566 553 HE21 GLN 31 HE21 GLN 31 -6.898 -8.984 -8.261 554 HE22 GLN 31 HE22 GLN 31 -8.447 -9.320 -7.515 555 H ASP 32 H ASP 32 -7.473 -2.822 -10.070 556 HA ASP 32 HA ASP 32 -7.347 -4.470 -12.389 557 HB2 ASP 32 HB2 ASP 32 -9.176 -2.898 -11.799 558 HB3 ASP 32 HB3 ASP 32 -8.073 -1.551 -11.920 559 H LYS 33 H LYS 33 -5.495 -1.771 -11.209 560 HA LYS 33 HA LYS 33 -4.236 -1.121 -13.752 561 HB2 LYS 33 HB2 LYS 33 -4.100 -0.207 -10.882 562 HB3 LYS 33 HB3 LYS 33 -2.932 0.407 -12.072 563 HG2 LYS 33 HG2 LYS 33 -5.935 0.493 -12.566 564 HG3 LYS 33 HG3 LYS 33 -5.084 1.783 -11.698 565 HD2 LYS 33 HD2 LYS 33 -3.542 2.071 -13.605 566 HD3 LYS 33 HD3 LYS 33 -4.453 0.858 -14.528 567 HE2 LYS 33 HE2 LYS 33 -5.641 3.416 -13.368 568 HE3 LYS 33 HE3 LYS 33 -5.078 3.247 -15.033 569 HZ1 LYS 33 HZ1 LYS 33 -7.214 1.640 -13.790 570 HZ2 LYS 33 HZ2 LYS 33 -7.437 2.868 -14.863 571 HZ3 LYS 33 HZ3 LYS 33 -6.684 1.492 -15.340 572 H GLU 34 H GLU 34 -3.411 -3.199 -11.010 573 HA GLU 34 HA GLU 34 -0.770 -3.647 -12.324 574 HB2 GLU 34 HB2 GLU 34 -1.287 -3.288 -9.347 575 HB3 GLU 34 HB3 GLU 34 0.254 -3.785 -10.047 576 HG2 GLU 34 HG2 GLU 34 -1.145 -1.141 -10.622 577 HG3 GLU 34 HG3 GLU 34 0.166 -1.371 -9.468 578 H GLY 35 H GLY 35 -3.360 -4.934 -10.227 579 HA2 GLY 35 HA2 GLY 35 -4.122 -7.186 -10.712 580 HA3 GLY 35 HA3 GLY 35 -2.437 -7.688 -10.935 581 H ILE 36 H ILE 36 -2.832 -5.415 -8.418 582 HA ILE 36 HA ILE 36 -1.933 -7.362 -6.460 583 HB ILE 36 HB ILE 36 -2.621 -4.396 -6.315 584 HG12 ILE 36 HG12 ILE 36 0.093 -5.792 -6.378 585 HG13 ILE 36 HG13 ILE 36 -0.695 -5.126 -7.814 586 HG21 ILE 36 HG21 ILE 36 -1.414 -4.396 -4.174 587 HG22 ILE 36 HG22 ILE 36 -2.786 -5.513 -4.104 588 HG23 ILE 36 HG23 ILE 36 -1.137 -6.152 -4.313 589 HD11 ILE 36 HD11 ILE 36 -0.725 -2.876 -6.744 590 HD12 ILE 36 HD12 ILE 36 0.148 -3.547 -5.346 591 HD13 ILE 36 HD13 ILE 36 0.920 -3.521 -6.944 592 HA PRO 37 HA PRO 37 -6.082 -8.323 -5.270 593 HB2 PRO 37 HB2 PRO 37 -5.595 -9.716 -2.932 594 HB3 PRO 37 HB3 PRO 37 -5.261 -10.373 -4.565 595 HG2 PRO 37 HG2 PRO 37 -3.338 -9.039 -2.659 596 HG3 PRO 37 HG3 PRO 37 -3.099 -10.562 -3.586 597 HD2 PRO 37 HD2 PRO 37 -2.094 -8.171 -4.426 598 HD3 PRO 37 HD3 PRO 37 -2.723 -9.366 -5.599 599 HA PRO 38 HA PRO 38 -7.177 -5.130 -2.402 600 HB2 PRO 38 HB2 PRO 38 -9.642 -6.007 -1.551 601 HB3 PRO 38 HB3 PRO 38 -9.345 -5.384 -3.204 602 HG2 PRO 38 HG2 PRO 38 -9.418 -8.272 -2.297 603 HG3 PRO 38 HG3 PRO 38 -10.240 -7.535 -3.714 604 HD2 PRO 38 HD2 PRO 38 -7.875 -8.847 -3.958 605 HD3 PRO 38 HD3 PRO 38 -8.226 -7.372 -4.917 606 H ASP 39 H ASP 39 -6.696 -8.425 -1.540 607 HA ASP 39 HA ASP 39 -7.288 -8.072 1.283 608 HB2 ASP 39 HB2 ASP 39 -7.742 -10.168 0.031 609 HB3 ASP 39 HB3 ASP 39 -6.003 -10.376 -0.216 610 H GLN 40 H GLN 40 -4.565 -7.282 -0.679 611 HA GLN 40 HA GLN 40 -2.798 -7.521 1.714 612 HB2 GLN 40 HB2 GLN 40 -2.026 -7.801 -1.208 613 HB3 GLN 40 HB3 GLN 40 -0.945 -7.911 0.199 614 HG2 GLN 40 HG2 GLN 40 -2.400 -9.820 1.043 615 HG3 GLN 40 HG3 GLN 40 -3.225 -9.782 -0.532 616 HE21 GLN 40 HE21 GLN 40 -1.105 -9.353 -2.314 617 HE22 GLN 40 HE22 GLN 40 -0.020 -10.725 -2.241 618 H GLN 41 H GLN 41 -4.219 -5.268 -0.524 619 HA GLN 41 HA GLN 41 -2.126 -3.310 -0.519 620 HB2 GLN 41 HB2 GLN 41 -5.149 -3.104 -0.760 621 HB3 GLN 41 HB3 GLN 41 -4.040 -1.749 -1.016 622 HG2 GLN 41 HG2 GLN 41 -2.973 -2.899 -2.891 623 HG3 GLN 41 HG3 GLN 41 -3.930 -4.355 -2.580 624 HE21 GLN 41 HE21 GLN 41 -5.086 -4.393 -4.564 625 HE22 GLN 41 HE22 GLN 41 -6.304 -3.192 -4.910 626 H ARG 42 H ARG 42 -2.275 -1.202 0.531 627 HA ARG 42 HA ARG 42 -3.797 -0.934 3.014 628 HB2 ARG 42 HB2 ARG 42 -1.703 -2.193 3.636 629 HB3 ARG 42 HB3 ARG 42 -0.747 -0.824 3.042 630 HG2 ARG 42 HG2 ARG 42 -1.852 0.659 4.692 631 HG3 ARG 42 HG3 ARG 42 -2.857 -0.703 5.242 632 HD2 ARG 42 HD2 ARG 42 -0.794 -1.950 5.851 633 HD3 ARG 42 HD3 ARG 42 0.181 -0.545 5.380 634 HE ARG 42 HE ARG 42 -1.712 0.397 7.228 635 HH11 ARG 42 HH11 ARG 42 0.912 -1.965 7.207 636 HH12 ARG 42 HH12 ARG 42 1.259 -1.762 8.908 637 HH21 ARG 42 HH21 ARG 42 -1.227 0.669 9.417 638 HH22 ARG 42 HH22 ARG 42 0.064 -0.247 10.159 639 H LEU 43 H LEU 43 -4.752 0.966 2.417 640 HA LEU 43 HA LEU 43 -3.207 2.874 0.758 641 HB2 LEU 43 HB2 LEU 43 -5.368 1.827 -0.018 642 HB3 LEU 43 HB3 LEU 43 -6.184 2.603 1.347 643 HG LEU 43 HG LEU 43 -5.416 4.827 0.429 644 HD11 LEU 43 HD11 LEU 43 -3.553 4.014 -1.002 645 HD12 LEU 43 HD12 LEU 43 -4.716 3.116 -2.000 646 HD13 LEU 43 HD13 LEU 43 -4.759 4.895 -1.961 647 HD21 LEU 43 HD21 LEU 43 -7.129 4.837 -1.369 648 HD22 LEU 43 HD22 LEU 43 -7.138 3.055 -1.362 649 HD23 LEU 43 HD23 LEU 43 -7.692 3.951 0.068 650 H ILE 44 H ILE 44 -2.804 4.929 1.397 651 HA ILE 44 HA ILE 44 -3.915 5.924 3.983 652 HB ILE 44 HB ILE 44 -1.019 5.942 3.018 653 HG12 ILE 44 HG12 ILE 44 -0.671 5.109 5.429 654 HG13 ILE 44 HG13 ILE 44 -2.410 4.816 5.485 655 HG21 ILE 44 HG21 ILE 44 -2.201 7.423 5.410 656 HG22 ILE 44 HG22 ILE 44 -0.489 7.296 5.025 657 HG23 ILE 44 HG23 ILE 44 -1.542 8.185 3.936 658 HD11 ILE 44 HD11 ILE 44 -0.541 3.607 3.398 659 HD12 ILE 44 HD12 ILE 44 -0.979 2.810 4.927 660 HD13 ILE 44 HD13 ILE 44 -2.233 3.131 3.744 661 H PHE 45 H PHE 45 -4.024 8.239 4.083 662 HA PHE 45 HA PHE 45 -3.954 9.615 1.401 663 HB2 PHE 45 HB2 PHE 45 -6.236 9.088 2.058 664 HB3 PHE 45 HB3 PHE 45 -6.002 9.864 3.614 665 HD1 PHE 45 HD1 PHE 45 -4.606 11.342 0.496 666 HD2 PHE 45 HD2 PHE 45 -7.857 11.389 3.313 667 HE1 PHE 45 HE1 PHE 45 -5.443 13.414 -0.523 668 HE2 PHE 45 HE2 PHE 45 -8.682 13.507 2.317 669 HZ PHE 45 HZ PHE 45 -7.475 14.524 0.396 670 H ALA 46 H ALA 46 -4.907 11.530 3.944 671 HA ALA 46 HA ALA 46 -2.753 13.300 3.466 672 HB1 ALA 46 HB1 ALA 46 -4.780 13.144 5.729 673 HB2 ALA 46 HB2 ALA 46 -3.865 14.611 5.254 674 HB3 ALA 46 HB3 ALA 46 -5.050 13.872 4.130 675 H GLY 47 H GLY 47 -2.724 10.456 5.141 676 HA2 GLY 47 HA2 GLY 47 -0.332 10.035 5.898 677 HA3 GLY 47 HA3 GLY 47 -0.661 11.273 7.129 678 H LYS 48 H LYS 48 -3.554 9.686 6.497 679 HA LYS 48 HA LYS 48 -3.032 7.593 8.543 680 HB2 LYS 48 HB2 LYS 48 -5.225 7.960 9.471 681 HB3 LYS 48 HB3 LYS 48 -4.332 9.489 9.431 682 HG2 LYS 48 HG2 LYS 48 -6.354 10.188 8.667 683 HG3 LYS 48 HG3 LYS 48 -5.529 9.832 7.134 684 HD2 LYS 48 HD2 LYS 48 -6.741 7.651 7.020 685 HD3 LYS 48 HD3 LYS 48 -7.557 8.013 8.547 686 HE2 LYS 48 HE2 LYS 48 -7.724 9.680 6.006 687 HE3 LYS 48 HE3 LYS 48 -8.964 8.564 6.594 688 HZ1 LYS 48 HZ1 LYS 48 -8.021 10.965 8.015 689 HZ2 LYS 48 HZ2 LYS 48 -9.444 10.820 7.212 690 HZ3 LYS 48 HZ3 LYS 48 -9.167 9.919 8.561 691 H GLN 49 H GLN 49 -4.336 5.784 8.404 692 HA GLN 49 HA GLN 49 -4.630 4.852 5.623 693 HB2 GLN 49 HB2 GLN 49 -3.304 3.541 7.191 694 HB3 GLN 49 HB3 GLN 49 -4.643 3.499 8.344 695 HG2 GLN 49 HG2 GLN 49 -5.997 2.200 6.708 696 HG3 GLN 49 HG3 GLN 49 -4.644 2.236 5.564 697 HE21 GLN 49 HE21 GLN 49 -5.845 -0.155 6.537 698 HE22 GLN 49 HE22 GLN 49 -4.651 -1.003 7.501 699 H LEU 50 H LEU 50 -6.510 4.576 4.653 700 HA LEU 50 HA LEU 50 -8.941 5.481 5.958 701 HB2 LEU 50 HB2 LEU 50 -8.681 4.128 3.255 702 HB3 LEU 50 HB3 LEU 50 -9.980 5.168 3.840 703 HG LEU 50 HG LEU 50 -8.846 6.522 2.360 704 HD11 LEU 50 HD11 LEU 50 -7.777 8.296 3.596 705 HD12 LEU 50 HD12 LEU 50 -9.088 7.641 4.593 706 HD13 LEU 50 HD13 LEU 50 -7.400 7.199 4.947 707 HD21 LEU 50 HD21 LEU 50 -6.139 5.785 3.517 708 HD22 LEU 50 HD22 LEU 50 -6.869 4.992 2.094 709 HD23 LEU 50 HD23 LEU 50 -6.492 6.727 2.062 710 H GLU 51 H GLU 51 -11.046 4.030 5.603 711 HA GLU 51 HA GLU 51 -10.367 1.170 6.101 712 HB2 GLU 51 HB2 GLU 51 -12.133 2.981 7.763 713 HB3 GLU 51 HB3 GLU 51 -12.297 1.208 7.781 714 HG2 GLU 51 HG2 GLU 51 -9.960 0.955 8.446 715 HG3 GLU 51 HG3 GLU 51 -9.732 2.706 8.379 716 H ASP 52 H ASP 52 -12.000 -0.310 5.695 717 HA ASP 52 HA ASP 52 -13.375 0.234 3.228 718 HB2 ASP 52 HB2 ASP 52 -13.400 -2.178 5.082 719 HB3 ASP 52 HB3 ASP 52 -14.000 -2.145 3.415 720 H GLY 53 H GLY 53 -14.246 1.089 6.292 721 HA2 GLY 53 HA2 GLY 53 -17.140 0.493 5.893 722 HA3 GLY 53 HA3 GLY 53 -16.348 0.734 7.461 723 H ARG 54 H ARG 54 -15.196 2.836 4.988 724 HA ARG 54 HA ARG 54 -16.822 5.105 6.036 725 HB2 ARG 54 HB2 ARG 54 -14.073 5.227 4.770 726 HB3 ARG 54 HB3 ARG 54 -14.871 6.460 5.746 727 HG2 ARG 54 HG2 ARG 54 -13.953 3.747 6.805 728 HG3 ARG 54 HG3 ARG 54 -13.030 5.244 6.942 729 HD2 ARG 54 HD2 ARG 54 -14.804 6.288 8.230 730 HD3 ARG 54 HD3 ARG 54 -15.818 4.829 8.082 731 HE ARG 54 HE ARG 54 -13.488 3.874 9.179 732 HH11 ARG 54 HH11 ARG 54 -15.696 6.472 10.079 733 HH12 ARG 54 HH12 ARG 54 -15.358 6.324 11.791 734 HH21 ARG 54 HH21 ARG 54 -13.029 3.730 11.370 735 HH22 ARG 54 HH22 ARG 54 -13.844 4.764 12.531 736 H THR 55 H THR 55 -15.795 6.890 4.036 737 HA THR 55 HA THR 55 -16.140 5.718 1.380 738 HB THR 55 HB THR 55 -17.684 7.559 0.677 739 HG1 THR 55 HG1 THR 55 -18.901 8.536 2.361 740 HG21 THR 55 HG21 THR 55 -18.527 5.230 1.141 741 HG22 THR 55 HG22 THR 55 -18.933 5.763 2.788 742 HG23 THR 55 HG23 THR 55 -19.734 6.503 1.384 743 H LEU 56 H LEU 56 -15.515 7.406 -0.305 744 HA LEU 56 HA LEU 56 -13.083 8.677 0.509 745 HB2 LEU 56 HB2 LEU 56 -14.856 9.069 -1.947 746 HB3 LEU 56 HB3 LEU 56 -13.254 9.770 -1.763 747 HG LEU 56 HG LEU 56 -14.014 6.834 -1.996 748 HD11 LEU 56 HD11 LEU 56 -13.621 8.161 -4.082 749 HD12 LEU 56 HD12 LEU 56 -12.004 8.589 -3.481 750 HD13 LEU 56 HD13 LEU 56 -12.401 6.895 -3.847 751 HD21 LEU 56 HD21 LEU 56 -11.618 6.285 -1.678 752 HD22 LEU 56 HD22 LEU 56 -11.300 7.965 -1.199 753 HD23 LEU 56 HD23 LEU 56 -12.345 6.922 -0.195 754 H SER 57 H SER 57 -16.433 9.720 0.378 755 HA SER 57 HA SER 57 -15.950 12.546 0.704 756 HB2 SER 57 HB2 SER 57 -17.974 11.830 -0.258 757 HB3 SER 57 HB3 SER 57 -18.280 10.628 0.968 758 HG SER 57 HG SER 57 -19.554 12.521 1.273 759 H ASP 58 H ASP 58 -16.320 9.773 2.875 760 HA ASP 58 HA ASP 58 -16.762 11.225 5.292 761 HB2 ASP 58 HB2 ASP 58 -17.013 8.697 4.761 762 HB3 ASP 58 HB3 ASP 58 -15.281 8.594 5.105 763 H TYR 59 H TYR 59 -13.981 10.901 3.328 764 HA TYR 59 HA TYR 59 -12.250 12.047 5.462 765 HB2 TYR 59 HB2 TYR 59 -11.593 9.846 3.474 766 HB3 TYR 59 HB3 TYR 59 -10.371 10.736 4.382 767 HD1 TYR 59 HD1 TYR 59 -11.837 10.901 7.071 768 HD2 TYR 59 HD2 TYR 59 -11.230 7.676 4.290 769 HE1 TYR 59 HE1 TYR 59 -11.908 9.286 8.941 770 HE2 TYR 59 HE2 TYR 59 -11.210 6.059 6.168 771 HH TYR 59 HH TYR 59 -11.413 5.771 8.445 772 H ASN 60 H ASN 60 -13.912 13.166 3.250 773 HA ASN 60 HA ASN 60 -13.765 14.699 1.625 774 HB2 ASN 60 HB2 ASN 60 -12.435 16.609 2.290 775 HB3 ASN 60 HB3 ASN 60 -13.265 15.891 3.675 776 HD21 ASN 60 HD21 ASN 60 -10.113 16.083 2.077 777 HD22 ASN 60 HD22 ASN 60 -9.167 15.761 3.532 778 H ILE 61 H ILE 61 -12.165 12.301 0.913 779 HA ILE 61 HA ILE 61 -9.910 13.271 -0.624 780 HB ILE 61 HB ILE 61 -11.611 10.752 -0.692 781 HG12 ILE 61 HG12 ILE 61 -8.712 11.281 0.092 782 HG13 ILE 61 HG13 ILE 61 -10.057 11.201 1.243 783 HG21 ILE 61 HG21 ILE 61 -9.124 11.385 -2.344 784 HG22 ILE 61 HG22 ILE 61 -9.950 9.814 -2.279 785 HG23 ILE 61 HG23 ILE 61 -10.770 11.206 -2.990 786 HD11 ILE 61 HD11 ILE 61 -9.155 8.917 -0.547 787 HD12 ILE 61 HD12 ILE 61 -8.822 9.089 1.183 788 HD13 ILE 61 HD13 ILE 61 -10.497 8.874 0.630 789 H GLN 62 H GLN 62 -9.878 14.160 -2.596 790 HA GLN 62 HA GLN 62 -12.331 14.281 -4.281 791 HB2 GLN 62 HB2 GLN 62 -10.663 16.700 -3.509 792 HB3 GLN 62 HB3 GLN 62 -12.122 16.659 -4.525 793 HG2 GLN 62 HG2 GLN 62 -13.315 15.645 -2.503 794 HG3 GLN 62 HG3 GLN 62 -11.891 16.080 -1.558 795 HE21 GLN 62 HE21 GLN 62 -14.013 17.171 -0.565 796 HE22 GLN 62 HE22 GLN 62 -14.200 18.859 -0.997 797 H LYS 63 H LYS 63 -11.505 15.772 -6.314 798 HA LYS 63 HA LYS 63 -9.690 14.138 -7.731 799 HB2 LYS 63 HB2 LYS 63 -9.841 15.788 -9.420 800 HB3 LYS 63 HB3 LYS 63 -11.431 15.663 -8.662 801 HG2 LYS 63 HG2 LYS 63 -10.955 17.703 -7.310 802 HG3 LYS 63 HG3 LYS 63 -9.354 17.820 -8.069 803 HD2 LYS 63 HD2 LYS 63 -10.854 19.339 -9.209 804 HD3 LYS 63 HD3 LYS 63 -10.429 17.996 -10.295 805 HE2 LYS 63 HE2 LYS 63 -12.572 16.888 -9.784 806 HE3 LYS 63 HE3 LYS 63 -12.989 18.190 -8.654 807 HZ1 LYS 63 HZ1 LYS 63 -12.951 19.726 -10.481 808 HZ2 LYS 63 HZ2 LYS 63 -12.554 18.531 -11.545 809 HZ3 LYS 63 HZ3 LYS 63 -14.011 18.514 -10.791 810 H GLU 64 H GLU 64 -7.626 14.183 -8.220 811 HA GLU 64 HA GLU 64 -5.411 14.510 -7.977 812 HB2 GLU 64 HB2 GLU 64 -6.249 17.422 -7.746 813 HB3 GLU 64 HB3 GLU 64 -4.654 16.807 -8.226 814 HG2 GLU 64 HG2 GLU 64 -5.715 15.673 -10.187 815 HG3 GLU 64 HG3 GLU 64 -7.269 16.382 -9.739 816 H SER 65 H SER 65 -6.894 13.991 -5.457 817 HA SER 65 HA SER 65 -5.977 15.716 -3.381 818 HB2 SER 65 HB2 SER 65 -6.844 13.871 -1.945 819 HB3 SER 65 HB3 SER 65 -7.990 14.347 -3.207 820 HG SER 65 HG SER 65 -7.747 12.083 -3.106 821 H THR 66 H THR 66 -4.592 12.948 -4.959 822 HA THR 66 HA THR 66 -2.736 11.696 -4.760 823 HB THR 66 HB THR 66 -1.799 14.057 -3.134 824 HG1 THR 66 HG1 THR 66 -0.780 14.539 -5.096 825 HG21 THR 66 HG21 THR 66 -0.412 12.090 -2.566 826 HG22 THR 66 HG22 THR 66 -0.225 11.704 -4.289 827 HG23 THR 66 HG23 THR 66 0.504 13.183 -3.616 828 H LEU 67 H LEU 67 -2.242 9.913 -3.678 829 HA LEU 67 HA LEU 67 -2.647 9.752 -0.734 830 HB2 LEU 67 HB2 LEU 67 -3.984 8.071 -2.889 831 HB3 LEU 67 HB3 LEU 67 -3.656 7.429 -1.284 832 HG LEU 67 HG LEU 67 -4.888 9.573 -0.420 833 HD11 LEU 67 HD11 LEU 67 -5.267 10.699 -2.572 834 HD12 LEU 67 HD12 LEU 67 -6.030 9.232 -3.228 835 HD13 LEU 67 HD13 LEU 67 -6.812 10.150 -1.915 836 HD21 LEU 67 HD21 LEU 67 -6.361 7.237 -1.684 837 HD22 LEU 67 HD22 LEU 67 -5.589 7.240 -0.084 838 HD23 LEU 67 HD23 LEU 67 -6.965 8.308 -0.383 839 H HIS 68 H HIS 68 -1.948 7.290 -0.170 840 HA HIS 68 HA HIS 68 0.519 6.662 -1.703 841 HB2 HIS 68 HB2 HIS 68 0.364 6.901 1.316 842 HB3 HIS 68 HB3 HIS 68 1.797 6.508 0.351 843 HD2 HIS 68 HD2 HIS 68 2.564 8.612 -1.439 844 HE1 HIS 68 HE1 HIS 68 1.005 11.662 1.084 845 HE2 HIS 68 HE2 HIS 68 2.530 11.175 -0.900 846 H LEU 69 H LEU 69 1.231 4.474 -1.440 847 HA LEU 69 HA LEU 69 -0.740 2.597 -0.245 848 HB2 LEU 69 HB2 LEU 69 -1.370 2.880 -2.583 849 HB3 LEU 69 HB3 LEU 69 0.308 2.687 -3.101 850 HG LEU 69 HG LEU 69 0.272 0.330 -2.253 851 HD11 LEU 69 HD11 LEU 69 -2.716 0.876 -1.931 852 HD12 LEU 69 HD12 LEU 69 -1.922 -0.717 -1.811 853 HD13 LEU 69 HD13 LEU 69 -1.570 0.535 -0.609 854 HD21 LEU 69 HD21 LEU 69 -1.843 1.086 -4.302 855 HD22 LEU 69 HD22 LEU 69 -0.112 0.829 -4.609 856 HD23 LEU 69 HD23 LEU 69 -1.128 -0.536 -4.091 857 H VAL 70 H VAL 70 0.070 0.782 0.523 858 HA VAL 70 HA VAL 70 2.823 -0.144 -0.034 859 HB VAL 70 HB VAL 70 1.684 0.607 2.683 860 HG11 VAL 70 HG11 VAL 70 4.058 -1.206 2.086 861 HG12 VAL 70 HG12 VAL 70 3.697 -0.474 3.668 862 HG13 VAL 70 HG13 VAL 70 2.576 -1.646 2.983 863 HG21 VAL 70 HG21 VAL 70 4.272 1.216 1.184 864 HG22 VAL 70 HG22 VAL 70 2.954 2.355 1.528 865 HG23 VAL 70 HG23 VAL 70 3.929 1.700 2.858 866 H LEU 71 H LEU 71 2.951 -2.505 0.814 867 HA LEU 71 HA LEU 71 0.307 -3.729 1.203 868 HB2 LEU 71 HB2 LEU 71 0.737 -5.374 -0.652 869 HB3 LEU 71 HB3 LEU 71 0.336 -3.728 -1.131 870 HG LEU 71 HG LEU 71 2.771 -3.268 -1.534 871 HD11 LEU 71 HD11 LEU 71 3.012 -6.283 -1.165 872 HD12 LEU 71 HD12 LEU 71 4.249 -5.237 -1.896 873 HD13 LEU 71 HD13 LEU 71 3.834 -5.037 -0.187 874 HD21 LEU 71 HD21 LEU 71 1.501 -5.575 -3.059 875 HD22 LEU 71 HD22 LEU 71 1.187 -3.843 -3.321 876 HD23 LEU 71 HD23 LEU 71 2.798 -4.518 -3.660 877 H ARG 72 H ARG 72 0.480 -6.112 1.599 878 HA ARG 72 HA ARG 72 2.428 -6.490 3.718 879 HB2 ARG 72 HB2 ARG 72 0.068 -7.964 2.593 880 HB3 ARG 72 HB3 ARG 72 1.246 -8.896 3.529 881 HG2 ARG 72 HG2 ARG 72 -0.631 -7.978 4.911 882 HG3 ARG 72 HG3 ARG 72 0.990 -7.516 5.461 883 HD2 ARG 72 HD2 ARG 72 0.750 -5.310 4.372 884 HD3 ARG 72 HD3 ARG 72 -0.859 -5.769 3.796 885 HE ARG 72 HE ARG 72 -1.715 -5.523 5.970 886 HH11 ARG 72 HH11 ARG 72 1.805 -5.119 5.990 887 HH12 ARG 72 HH12 ARG 72 1.828 -4.485 7.621 888 HH21 ARG 72 HH21 ARG 72 -1.635 -4.680 8.088 889 HH22 ARG 72 HH22 ARG 72 -0.098 -4.247 8.794 890 H LEU 73 H LEU 73 3.447 -8.802 3.847 891 HA LEU 73 HA LEU 73 5.191 -8.927 1.452 892 HB2 LEU 73 HB2 LEU 73 5.809 -8.367 4.098 893 HB3 LEU 73 HB3 LEU 73 6.090 -10.112 4.041 894 HG LEU 73 HG LEU 73 7.566 -9.685 1.993 895 HD11 LEU 73 HD11 LEU 73 7.166 -6.807 2.942 896 HD12 LEU 73 HD12 LEU 73 8.375 -7.328 1.751 897 HD13 LEU 73 HD13 LEU 73 6.641 -7.468 1.379 898 HD21 LEU 73 HD21 LEU 73 8.306 -8.302 4.606 899 HD22 LEU 73 HD22 LEU 73 8.474 -10.037 4.266 900 HD23 LEU 73 HD23 LEU 73 9.451 -8.852 3.359 901 H ARG 74 H ARG 74 2.657 -10.301 2.052 902 HA ARG 74 HA ARG 74 1.585 -12.290 1.858 903 HB2 ARG 74 HB2 ARG 74 3.086 -12.371 -0.163 904 HB3 ARG 74 HB3 ARG 74 4.220 -13.347 0.770 905 HG2 ARG 74 HG2 ARG 74 2.809 -14.775 -0.642 906 HG3 ARG 74 HG3 ARG 74 2.470 -15.093 1.074 907 HD2 ARG 74 HD2 ARG 74 0.469 -13.652 0.949 908 HD3 ARG 74 HD3 ARG 74 0.843 -13.274 -0.747 909 HE ARG 74 HE ARG 74 0.672 -16.087 -0.492 910 HH11 ARG 74 HH11 ARG 74 -1.382 -13.230 -0.248 911 HH12 ARG 74 HH12 ARG 74 -2.837 -14.073 -0.726 912 HH21 ARG 74 HH21 ARG 74 -1.241 -17.179 -1.137 913 HH22 ARG 74 HH22 ARG 74 -2.751 -16.310 -1.231 914 H GLY 75 H GLY 75 4.651 -12.363 3.529 915 HA2 GLY 75 HA2 GLY 75 4.165 -13.402 5.872 916 HA3 GLY 75 HA3 GLY 75 3.962 -14.884 4.885 917 H GLY 76 H GLY 76 6.084 -13.399 3.054 918 HA2 GLY 76 HA2 GLY 76 8.566 -13.249 4.352 919 HA3 GLY 76 HA3 GLY 76 8.345 -14.945 3.870 Start of MODEL 7 1 H LEU 491 H LEU 491 15.034 6.266 10.114 2 HA LEU 491 HA LEU 491 17.647 6.152 10.967 3 HB2 LEU 491 HB2 LEU 491 15.939 3.918 9.802 4 HB3 LEU 491 HB3 LEU 491 17.257 3.803 10.980 5 HG LEU 491 HG LEU 491 15.226 3.613 12.313 6 HD11 LEU 491 HD11 LEU 491 16.103 6.485 12.542 7 HD12 LEU 491 HD12 LEU 491 15.510 5.366 13.808 8 HD13 LEU 491 HD13 LEU 491 17.091 5.111 13.077 9 HD21 LEU 491 HD21 LEU 491 13.291 4.577 11.889 10 HD22 LEU 491 HD22 LEU 491 14.038 6.139 11.466 11 HD23 LEU 491 HD23 LEU 491 13.947 4.811 10.269 12 HA PRO 492 HA PRO 492 19.701 6.431 7.138 13 HB2 PRO 492 HB2 PRO 492 22.234 5.960 7.911 14 HB3 PRO 492 HB3 PRO 492 21.276 7.362 8.497 15 HG2 PRO 492 HG2 PRO 492 21.824 4.732 9.917 16 HG3 PRO 492 HG3 PRO 492 21.858 6.381 10.611 17 HD2 PRO 492 HD2 PRO 492 19.676 4.612 10.733 18 HD3 PRO 492 HD3 PRO 492 19.510 6.381 10.886 19 H LEU 493 H LEU 493 18.840 4.844 5.958 20 HA LEU 493 HA LEU 493 18.307 2.660 5.330 21 HB2 LEU 493 HB2 LEU 493 19.815 4.289 3.981 22 HB3 LEU 493 HB3 LEU 493 21.078 3.124 4.235 23 HG LEU 493 HG LEU 493 18.351 2.690 2.899 24 HD11 LEU 493 HD11 LEU 493 21.148 2.821 1.695 25 HD12 LEU 493 HD12 LEU 493 19.656 2.508 0.786 26 HD13 LEU 493 HD13 LEU 493 19.896 4.083 1.580 27 HD21 LEU 493 HD21 LEU 493 20.693 0.740 3.067 28 HD22 LEU 493 HD22 LEU 493 19.105 0.549 3.854 29 HD23 LEU 493 HD23 LEU 493 19.226 0.498 2.090 30 H GLN 494 H GLN 494 18.904 2.165 7.820 31 HA GLN 494 HA GLN 494 21.201 0.368 7.915 32 HB2 GLN 494 HB2 GLN 494 20.897 0.536 10.341 33 HB3 GLN 494 HB3 GLN 494 20.951 2.124 9.542 34 HG2 GLN 494 HG2 GLN 494 19.250 2.465 11.020 35 HG3 GLN 494 HG3 GLN 494 18.372 2.017 9.553 36 HE21 GLN 494 HE21 GLN 494 16.646 1.647 11.227 37 HE22 GLN 494 HE22 GLN 494 16.585 0.083 12.017 38 H ALA 495 H ALA 495 17.776 0.300 7.770 39 HA ALA 495 HA ALA 495 17.838 -2.657 7.741 40 HB1 ALA 495 HB1 ALA 495 15.859 -2.808 9.228 41 HB2 ALA 495 HB2 ALA 495 17.249 -2.084 10.061 42 HB3 ALA 495 HB3 ALA 495 15.925 -1.051 9.486 43 H LEU 496 H LEU 496 17.095 0.086 6.102 44 HA LEU 496 HA LEU 496 14.502 -0.476 5.060 45 HB2 LEU 496 HB2 LEU 496 16.913 1.131 4.210 46 HB3 LEU 496 HB3 LEU 496 15.677 0.763 3.014 47 HG LEU 496 HG LEU 496 13.939 1.721 4.561 48 HD11 LEU 496 HD11 LEU 496 16.385 2.785 6.050 49 HD12 LEU 496 HD12 LEU 496 14.693 3.242 6.347 50 HD13 LEU 496 HD13 LEU 496 15.233 1.586 6.683 51 HD21 LEU 496 HD21 LEU 496 16.219 3.533 3.655 52 HD22 LEU 496 HD22 LEU 496 14.863 2.974 2.657 53 HD23 LEU 496 HD23 LEU 496 14.557 4.070 4.018 54 HA PRO 497 HA PRO 497 15.200 -3.977 2.433 55 HB2 PRO 497 HB2 PRO 497 13.673 -2.433 0.353 56 HB3 PRO 497 HB3 PRO 497 13.365 -4.088 0.951 57 HG2 PRO 497 HG2 PRO 497 11.802 -2.046 1.771 58 HG3 PRO 497 HG3 PRO 497 12.365 -3.282 2.950 59 HD2 PRO 497 HD2 PRO 497 13.488 -0.519 2.437 60 HD3 PRO 497 HD3 PRO 497 13.128 -1.326 3.997 61 H GLU 498 H GLU 498 16.166 -4.594 0.283 62 HA GLU 498 HA GLU 498 18.519 -3.109 -0.249 63 HB2 GLU 498 HB2 GLU 498 18.196 -5.544 -0.665 64 HB3 GLU 498 HB3 GLU 498 17.100 -5.150 -2.003 65 HG2 GLU 498 HG2 GLU 498 18.935 -3.947 -3.150 66 HG3 GLU 498 HG3 GLU 498 20.019 -4.281 -1.792 67 H GLY 499 H GLY 499 18.958 -1.447 -1.546 68 HA2 GLY 499 HA2 GLY 499 18.871 -0.040 -3.361 69 HA3 GLY 499 HA3 GLY 499 17.488 -0.954 -3.988 70 H VAL 500 H VAL 500 16.033 -0.489 -1.283 71 HA VAL 500 HA VAL 500 14.570 1.815 -2.109 72 HB VAL 500 HB VAL 500 14.682 0.385 0.575 73 HG11 VAL 500 HG11 VAL 500 12.624 2.359 -0.526 74 HG12 VAL 500 HG12 VAL 500 12.391 1.350 0.913 75 HG13 VAL 500 HG13 VAL 500 13.635 2.601 0.919 76 HG21 VAL 500 HG21 VAL 500 13.975 -1.021 -1.345 77 HG22 VAL 500 HG22 VAL 500 12.594 -0.655 -0.289 78 HG23 VAL 500 HG23 VAL 500 12.792 0.221 -1.822 79 H ASP 501 H ASP 501 14.232 3.768 -0.689 80 HA ASP 501 HA ASP 501 16.790 4.810 0.407 81 HB2 ASP 501 HB2 ASP 501 15.674 5.383 -2.209 82 HB3 ASP 501 HB3 ASP 501 15.584 6.831 -1.208 83 H GLN 502 H GLN 502 16.484 6.963 1.408 84 HA GLN 502 HA GLN 502 14.333 6.828 3.292 85 HB2 GLN 502 HB2 GLN 502 16.143 9.159 2.514 86 HB3 GLN 502 HB3 GLN 502 15.243 8.988 4.041 87 HG2 GLN 502 HG2 GLN 502 17.364 7.000 3.148 88 HG3 GLN 502 HG3 GLN 502 17.728 8.440 4.096 89 HE21 GLN 502 HE21 GLN 502 16.493 5.218 4.171 90 HE22 GLN 502 HE22 GLN 502 16.206 5.155 5.904 91 H GLU 503 H GLU 503 14.942 8.801 0.364 92 HA GLU 503 HA GLU 503 12.625 10.448 0.769 93 HB2 GLU 503 HB2 GLU 503 14.512 10.024 -1.580 94 HB3 GLU 503 HB3 GLU 503 13.163 11.188 -1.621 95 HG2 GLU 503 HG2 GLU 503 13.979 12.267 0.410 96 HG3 GLU 503 HG3 GLU 503 15.322 11.128 0.519 97 H VAL 504 H VAL 504 12.589 7.317 0.279 98 HA VAL 504 HA VAL 504 9.944 7.478 -1.045 99 HB VAL 504 HB VAL 504 10.386 5.281 -2.174 100 HG11 VAL 504 HG11 VAL 504 12.185 7.577 -3.032 101 HG12 VAL 504 HG12 VAL 504 11.600 6.252 -4.060 102 HG13 VAL 504 HG13 VAL 504 10.445 7.425 -3.390 103 HG21 VAL 504 HG21 VAL 504 12.685 4.576 -2.574 104 HG22 VAL 504 HG22 VAL 504 13.295 5.893 -1.544 105 HG23 VAL 504 HG23 VAL 504 12.333 4.567 -0.836 106 H PHE 505 H PHE 505 11.368 7.039 1.826 107 HA PHE 505 HA PHE 505 9.363 4.991 2.582 108 HB2 PHE 505 HB2 PHE 505 11.317 3.716 2.704 109 HB3 PHE 505 HB3 PHE 505 12.325 5.124 2.969 110 HD1 PHE 505 HD1 PHE 505 10.156 2.678 4.685 111 HD2 PHE 505 HD2 PHE 505 12.766 6.052 5.061 112 HE1 PHE 505 HE1 PHE 505 10.419 2.170 7.094 113 HE2 PHE 505 HE2 PHE 505 13.027 5.568 7.522 114 HZ PHE 505 HZ PHE 505 11.852 3.613 8.515 115 H LYS 506 H LYS 506 11.095 7.988 3.303 116 HA LYS 506 HA LYS 506 10.244 8.251 6.028 117 HB2 LYS 506 HB2 LYS 506 11.107 10.266 3.920 118 HB3 LYS 506 HB3 LYS 506 10.772 10.691 5.608 119 HG2 LYS 506 HG2 LYS 506 12.509 9.151 6.394 120 HG3 LYS 506 HG3 LYS 506 12.874 8.669 4.732 121 HD2 LYS 506 HD2 LYS 506 13.090 11.511 5.822 122 HD3 LYS 506 HD3 LYS 506 14.455 10.388 5.601 123 HE2 LYS 506 HE2 LYS 506 14.022 10.320 3.186 124 HE3 LYS 506 HE3 LYS 506 12.634 11.408 3.388 125 HZ1 LYS 506 HZ1 LYS 506 14.595 12.605 2.719 126 HZ2 LYS 506 HZ2 LYS 506 14.148 13.072 4.229 127 HZ3 LYS 506 HZ3 LYS 506 15.433 12.071 4.026 128 H GLN 507 H GLN 507 8.420 8.471 3.108 129 HA GLN 507 HA GLN 507 6.657 10.589 4.060 130 HB2 GLN 507 HB2 GLN 507 6.131 8.708 1.732 131 HB3 GLN 507 HB3 GLN 507 5.492 10.329 2.008 132 HG2 GLN 507 HG2 GLN 507 7.166 10.647 0.366 133 HG3 GLN 507 HG3 GLN 507 7.959 11.129 1.870 134 HE21 GLN 507 HE21 GLN 507 10.107 10.467 1.740 135 HE22 GLN 507 HE22 GLN 507 10.600 8.884 1.191 136 H LEU 508 H LEU 508 6.988 7.264 4.621 137 HA LEU 508 HA LEU 508 4.203 6.508 4.936 138 HB2 LEU 508 HB2 LEU 508 6.779 5.282 6.001 139 HB3 LEU 508 HB3 LEU 508 5.215 4.465 5.856 140 HG LEU 508 HG LEU 508 6.833 5.561 3.508 141 HD11 LEU 508 HD11 LEU 508 7.352 3.242 3.002 142 HD12 LEU 508 HD12 LEU 508 7.932 3.643 4.630 143 HD13 LEU 508 HD13 LEU 508 6.440 2.690 4.425 144 HD21 LEU 508 HD21 LEU 508 4.328 3.834 3.634 145 HD22 LEU 508 HD22 LEU 508 4.427 5.505 3.026 146 HD23 LEU 508 HD23 LEU 508 5.248 4.200 2.156 147 HA PRO 509 HA PRO 509 3.770 7.940 9.174 148 HB2 PRO 509 HB2 PRO 509 1.919 6.171 10.133 149 HB3 PRO 509 HB3 PRO 509 1.513 7.487 8.995 150 HG2 PRO 509 HG2 PRO 509 2.097 4.575 8.410 151 HG3 PRO 509 HG3 PRO 509 0.740 5.565 7.770 152 HD2 PRO 509 HD2 PRO 509 3.023 5.103 6.322 153 HD3 PRO 509 HD3 PRO 509 2.167 6.671 6.242 154 H ALA 510 H ALA 510 3.969 7.149 11.400 155 HA ALA 510 HA ALA 510 6.272 5.606 11.818 156 HB1 ALA 510 HB1 ALA 510 3.960 6.330 13.655 157 HB2 ALA 510 HB2 ALA 510 5.570 5.772 14.198 158 HB3 ALA 510 HB3 ALA 510 5.396 7.325 13.337 159 H ASP 511 H ASP 511 2.938 4.543 11.401 160 HA ASP 511 HA ASP 511 3.574 1.913 12.584 161 HB2 ASP 511 HB2 ASP 511 1.186 1.446 12.319 162 HB3 ASP 511 HB3 ASP 511 1.443 2.946 13.209 163 H ILE 512 H ILE 512 4.114 3.344 9.647 164 HA ILE 512 HA ILE 512 4.115 0.620 8.436 165 HB ILE 512 HB ILE 512 3.888 3.284 7.012 166 HG12 ILE 512 HG12 ILE 512 1.972 0.951 7.433 167 HG13 ILE 512 HG13 ILE 512 1.811 2.583 8.105 168 HG21 ILE 512 HG21 ILE 512 3.923 0.442 5.889 169 HG22 ILE 512 HG22 ILE 512 3.669 1.929 4.951 170 HG23 ILE 512 HG23 ILE 512 5.234 1.634 5.717 171 HD11 ILE 512 HD11 ILE 512 1.590 1.793 5.175 172 HD12 ILE 512 HD12 ILE 512 0.311 2.399 6.248 173 HD13 ILE 512 HD13 ILE 512 1.639 3.476 5.759 174 H GLN 513 H GLN 513 6.036 3.308 9.572 175 HA GLN 513 HA GLN 513 8.486 2.811 8.276 176 HB2 GLN 513 HB2 GLN 513 7.562 3.892 10.863 177 HB3 GLN 513 HB3 GLN 513 9.091 2.998 11.009 178 HG2 GLN 513 HG2 GLN 513 9.508 5.351 10.644 179 HG3 GLN 513 HG3 GLN 513 10.158 4.334 9.351 180 HE21 GLN 513 HE21 GLN 513 9.760 4.921 7.296 181 HE22 GLN 513 HE22 GLN 513 8.500 6.010 6.784 182 H GLU 514 H GLU 514 6.872 1.080 10.955 183 HA GLU 514 HA GLU 514 8.970 -0.838 11.341 184 HB2 GLU 514 HB2 GLU 514 7.347 -1.935 12.810 185 HB3 GLU 514 HB3 GLU 514 7.391 -0.185 13.097 186 HG2 GLU 514 HG2 GLU 514 5.357 0.104 11.739 187 HG3 GLU 514 HG3 GLU 514 5.312 -1.636 11.411 188 H GLU 515 H GLU 515 6.794 -0.549 8.743 189 HA GLU 515 HA GLU 515 6.551 -3.497 8.407 190 HB2 GLU 515 HB2 GLU 515 5.345 -1.190 6.840 191 HB3 GLU 515 HB3 GLU 515 4.982 -2.905 6.600 192 HG2 GLU 515 HG2 GLU 515 4.474 -1.446 9.231 193 HG3 GLU 515 HG3 GLU 515 3.299 -1.519 7.924 194 H ILE 516 H ILE 516 8.352 -0.734 7.257 195 HA ILE 516 HA ILE 516 9.294 -2.265 4.874 196 HB ILE 516 HB ILE 516 9.306 0.671 5.639 197 HG12 ILE 516 HG12 ILE 516 8.198 1.013 3.569 198 HG13 ILE 516 HG13 ILE 516 8.533 -0.633 3.010 199 HG21 ILE 516 HG21 ILE 516 10.899 -0.722 3.444 200 HG22 ILE 516 HG22 ILE 516 10.624 1.025 3.509 201 HG23 ILE 516 HG23 ILE 516 11.560 0.236 4.795 202 HD11 ILE 516 HD11 ILE 516 6.914 -1.557 4.543 203 HD12 ILE 516 HD12 ILE 516 6.703 0.030 5.340 204 HD13 ILE 516 HD13 ILE 516 6.154 -0.217 3.668 205 H LEU 517 H LEU 517 10.292 -0.782 7.959 206 HA LEU 517 HA LEU 517 13.083 -1.422 7.705 207 HB2 LEU 517 HB2 LEU 517 11.218 -0.983 10.074 208 HB3 LEU 517 HB3 LEU 517 12.951 -1.263 10.258 209 HG LEU 517 HG LEU 517 11.808 0.992 8.557 210 HD11 LEU 517 HD11 LEU 517 12.824 1.055 11.424 211 HD12 LEU 517 HD12 LEU 517 12.355 2.473 10.459 212 HD13 LEU 517 HD13 LEU 517 11.129 1.267 10.922 213 HD21 LEU 517 HD21 LEU 517 14.565 0.583 9.786 214 HD22 LEU 517 HD22 LEU 517 14.160 0.297 8.072 215 HD23 LEU 517 HD23 LEU 517 14.059 1.934 8.756 216 H SER 518 H SER 518 10.416 -3.389 7.718 217 HA SER 518 HA SER 518 12.050 -5.735 8.533 218 HB2 SER 518 HB2 SER 518 9.145 -5.231 9.323 219 HB3 SER 518 HB3 SER 518 10.056 -6.726 9.613 220 HG SER 518 HG SER 518 10.635 -4.140 10.628 221 H GLY 519 H GLY 519 10.996 -4.345 5.922 222 HA2 GLY 519 HA2 GLY 519 9.516 -6.683 4.812 223 HA3 GLY 519 HA3 GLY 519 9.315 -5.005 4.271 224 H LYS 520 H LYS 520 12.459 -6.380 5.036 225 HA LYS 520 HA LYS 520 13.693 -5.455 2.716 226 HB2 LYS 520 HB2 LYS 520 15.621 -6.406 3.577 227 HB3 LYS 520 HB3 LYS 520 14.655 -6.040 5.012 228 HG2 LYS 520 HG2 LYS 520 14.986 -8.772 3.684 229 HG3 LYS 520 HG3 LYS 520 15.816 -8.230 5.137 230 HD2 LYS 520 HD2 LYS 520 12.790 -8.574 4.916 231 HD3 LYS 520 HD3 LYS 520 13.922 -9.759 5.587 232 HE2 LYS 520 HE2 LYS 520 14.683 -8.098 7.260 233 HE3 LYS 520 HE3 LYS 520 13.484 -6.944 6.654 234 HZ1 LYS 520 HZ1 LYS 520 12.881 -9.597 7.794 235 HZ2 LYS 520 HZ2 LYS 520 12.705 -8.173 8.580 236 HZ3 LYS 520 HZ3 LYS 520 11.764 -8.509 7.275 237 H SER 521 H SER 521 11.528 -7.864 2.562 238 HA SER 521 HA SER 521 12.973 -9.283 0.375 239 HB2 SER 521 HB2 SER 521 13.154 -10.496 2.603 240 HB3 SER 521 HB3 SER 521 11.396 -10.736 2.522 241 HG SER 521 HG SER 521 12.586 -12.489 1.626 242 H ARG 522 H ARG 522 10.855 -7.218 0.266 243 HA ARG 522 HA ARG 522 9.021 -8.786 -1.402 244 HB2 ARG 522 HB2 ARG 522 8.280 -8.160 1.109 245 HB3 ARG 522 HB3 ARG 522 7.938 -6.592 0.361 246 HG2 ARG 522 HG2 ARG 522 5.912 -7.695 0.072 247 HG3 ARG 522 HG3 ARG 522 6.733 -8.057 -1.474 248 HD2 ARG 522 HD2 ARG 522 6.978 -9.838 0.971 249 HD3 ARG 522 HD3 ARG 522 5.606 -10.020 -0.148 250 HE ARG 522 HE ARG 522 7.897 -10.134 -1.743 251 HH11 ARG 522 HH11 ARG 522 6.591 -11.929 1.014 252 HH12 ARG 522 HH12 ARG 522 7.366 -13.426 0.536 253 HH21 ARG 522 HH21 ARG 522 8.837 -12.099 -2.351 254 HH22 ARG 522 HH22 ARG 522 8.610 -13.530 -1.361 255 H GLU 523 H GLU 523 11.173 -6.236 -1.163 256 HA GLU 523 HA GLU 523 10.041 -4.913 -3.511 257 HB2 GLU 523 HB2 GLU 523 10.025 -2.699 -2.441 258 HB3 GLU 523 HB3 GLU 523 8.816 -3.796 -1.725 259 HG2 GLU 523 HG2 GLU 523 10.439 -4.310 0.121 260 HG3 GLU 523 HG3 GLU 523 11.543 -3.103 -0.563 261 H ASN 524 H ASN 524 11.467 -3.259 -4.366 262 HA ASN 524 HA ASN 524 14.313 -3.451 -3.591 263 HB2 ASN 524 HB2 ASN 524 13.197 -4.246 -6.334 264 HB3 ASN 524 HB3 ASN 524 14.903 -4.184 -5.888 265 HD21 ASN 524 HD21 ASN 524 11.766 -5.749 -5.054 266 HD22 ASN 524 HD22 ASN 524 12.451 -7.263 -4.538 267 H LEU 525 H LEU 525 12.303 -1.365 -3.576 268 HA LEU 525 HA LEU 525 11.808 0.692 -4.317 269 HB2 LEU 525 HB2 LEU 525 13.624 1.964 -4.325 270 HB3 LEU 525 HB3 LEU 525 14.586 0.507 -4.384 271 HG LEU 525 HG LEU 525 14.095 0.793 -7.050 272 HD11 LEU 525 HD11 LEU 525 14.221 3.160 -7.647 273 HD12 LEU 525 HD12 LEU 525 12.824 2.973 -6.561 274 HD13 LEU 525 HD13 LEU 525 14.343 3.627 -5.934 275 HD21 LEU 525 HD21 LEU 525 16.249 2.282 -5.511 276 HD22 LEU 525 HD22 LEU 525 16.301 0.558 -5.962 277 HD23 LEU 525 HD23 LEU 525 16.298 1.816 -7.223 278 H LYS 526 H LYS 526 11.639 -1.913 -6.067 279 HA LYS 526 HA LYS 526 10.710 -0.567 -8.557 280 HB2 LYS 526 HB2 LYS 526 12.421 -3.016 -8.083 281 HB3 LYS 526 HB3 LYS 526 11.591 -2.748 -9.645 282 HG2 LYS 526 HG2 LYS 526 12.785 -0.626 -9.928 283 HG3 LYS 526 HG3 LYS 526 13.612 -0.847 -8.368 284 HD2 LYS 526 HD2 LYS 526 13.719 -2.917 -10.572 285 HD3 LYS 526 HD3 LYS 526 14.890 -1.575 -10.497 286 HE2 LYS 526 HE2 LYS 526 14.439 -3.596 -8.248 287 HE3 LYS 526 HE3 LYS 526 15.713 -3.713 -9.463 288 HZ1 LYS 526 HZ1 LYS 526 16.517 -1.558 -8.716 289 HZ2 LYS 526 HZ2 LYS 526 15.382 -1.535 -7.520 290 HZ3 LYS 526 HZ3 LYS 526 16.553 -2.679 -7.514 291 H1 MET 1 H1 MET 1 -14.767 10.332 -10.164 292 H2 MET 1 H2 MET 1 -14.743 10.463 -11.802 293 H3 MET 1 H3 MET 1 -15.631 11.519 -10.904 294 HA MET 1 HA MET 1 -13.655 12.577 -11.691 295 HB2 MET 1 HB2 MET 1 -12.845 13.448 -9.603 296 HB3 MET 1 HB3 MET 1 -14.594 13.224 -9.484 297 HG2 MET 1 HG2 MET 1 -14.295 11.171 -8.207 298 HG3 MET 1 HG3 MET 1 -12.545 11.222 -8.445 299 HE1 MET 1 HE1 MET 1 -12.920 11.933 -4.600 300 HE2 MET 1 HE2 MET 1 -13.845 10.805 -5.616 301 HE3 MET 1 HE3 MET 1 -12.085 10.971 -5.841 302 H GLN 2 H GLN 2 -11.180 12.633 -10.209 303 HA GLN 2 HA GLN 2 -10.011 9.953 -10.751 304 HB2 GLN 2 HB2 GLN 2 -9.141 12.779 -11.453 305 HB3 GLN 2 HB3 GLN 2 -7.939 11.526 -11.151 306 HG2 GLN 2 HG2 GLN 2 -8.649 10.236 -13.004 307 HG3 GLN 2 HG3 GLN 2 -10.159 11.174 -13.147 308 HE21 GLN 2 HE21 GLN 2 -6.582 11.820 -13.090 309 HE22 GLN 2 HE22 GLN 2 -6.622 12.973 -14.408 310 H ILE 3 H ILE 3 -8.078 9.573 -9.553 311 HA ILE 3 HA ILE 3 -7.085 11.578 -7.691 312 HB ILE 3 HB ILE 3 -7.032 10.366 -5.733 313 HG12 ILE 3 HG12 ILE 3 -7.500 7.891 -7.364 314 HG13 ILE 3 HG13 ILE 3 -6.264 8.291 -6.199 315 HG21 ILE 3 HG21 ILE 3 -9.788 9.813 -6.862 316 HG22 ILE 3 HG22 ILE 3 -9.347 9.885 -5.137 317 HG23 ILE 3 HG23 ILE 3 -9.215 11.332 -6.133 318 HD11 ILE 3 HD11 ILE 3 -7.745 6.629 -5.249 319 HD12 ILE 3 HD12 ILE 3 -7.924 8.150 -4.351 320 HD13 ILE 3 HD13 ILE 3 -9.162 7.655 -5.536 321 H PHE 4 H PHE 4 -4.917 10.808 -6.860 322 HA PHE 4 HA PHE 4 -3.605 8.870 -8.746 323 HB2 PHE 4 HB2 PHE 4 -2.509 11.530 -7.701 324 HB3 PHE 4 HB3 PHE 4 -1.639 10.334 -8.580 325 HD1 PHE 4 HD1 PHE 4 -4.899 12.200 -9.095 326 HD2 PHE 4 HD2 PHE 4 -1.226 10.714 -10.773 327 HE1 PHE 4 HE1 PHE 4 -5.494 13.196 -11.281 328 HE2 PHE 4 HE2 PHE 4 -1.786 11.753 -12.927 329 HZ PHE 4 HZ PHE 4 -3.926 13.008 -13.197 330 H VAL 5 H VAL 5 -2.423 7.327 -7.756 331 HA VAL 5 HA VAL 5 -2.112 7.616 -4.799 332 HB VAL 5 HB VAL 5 -2.886 5.087 -6.294 333 HG11 VAL 5 HG11 VAL 5 -3.354 4.268 -4.022 334 HG12 VAL 5 HG12 VAL 5 -1.660 4.801 -4.154 335 HG13 VAL 5 HG13 VAL 5 -2.856 5.831 -3.334 336 HG21 VAL 5 HG21 VAL 5 -4.637 7.024 -4.711 337 HG22 VAL 5 HG22 VAL 5 -4.785 6.666 -6.438 338 HG23 VAL 5 HG23 VAL 5 -5.129 5.407 -5.247 339 H LYS 6 H LYS 6 0.010 7.780 -4.396 340 HA LYS 6 HA LYS 6 1.935 6.719 -6.321 341 HB2 LYS 6 HB2 LYS 6 2.070 8.987 -5.222 342 HB3 LYS 6 HB3 LYS 6 2.493 8.157 -3.705 343 HG2 LYS 6 HG2 LYS 6 4.488 7.181 -4.786 344 HG3 LYS 6 HG3 LYS 6 3.972 7.820 -6.355 345 HD2 LYS 6 HD2 LYS 6 5.686 9.280 -5.541 346 HD3 LYS 6 HD3 LYS 6 4.147 10.149 -5.398 347 HE2 LYS 6 HE2 LYS 6 4.030 9.507 -2.997 348 HE3 LYS 6 HE3 LYS 6 5.581 8.655 -3.165 349 HZ1 LYS 6 HZ1 LYS 6 5.870 10.858 -2.272 350 HZ2 LYS 6 HZ2 LYS 6 6.595 10.753 -3.742 351 HZ3 LYS 6 HZ3 LYS 6 5.163 11.540 -3.588 352 H THR 7 H THR 7 3.388 5.089 -6.008 353 HA THR 7 HA THR 7 2.673 3.062 -4.026 354 HB THR 7 HB THR 7 4.340 1.732 -5.313 355 HG1 THR 7 HG1 THR 7 5.388 2.713 -7.007 356 HG21 THR 7 HG21 THR 7 2.396 3.270 -7.092 357 HG22 THR 7 HG22 THR 7 3.115 1.680 -7.440 358 HG23 THR 7 HG23 THR 7 1.985 1.868 -6.081 359 H LEU 8 H LEU 8 4.614 1.760 -3.190 360 HA LEU 8 HA LEU 8 6.204 3.311 -1.395 361 HB2 LEU 8 HB2 LEU 8 5.297 0.748 -1.555 362 HB3 LEU 8 HB3 LEU 8 6.954 0.501 -2.095 363 HG LEU 8 HG LEU 8 6.044 1.740 0.547 364 HD11 LEU 8 HD11 LEU 8 7.424 -0.889 -0.133 365 HD12 LEU 8 HD12 LEU 8 6.936 -0.343 1.488 366 HD13 LEU 8 HD13 LEU 8 5.703 -0.711 0.255 367 HD21 LEU 8 HD21 LEU 8 8.856 1.145 -0.443 368 HD22 LEU 8 HD22 LEU 8 8.180 2.755 -0.077 369 HD23 LEU 8 HD23 LEU 8 8.418 1.575 1.226 370 H THR 9 H THR 9 6.503 3.288 -4.628 371 HA THR 9 HA THR 9 9.486 3.212 -4.575 372 HB THR 9 HB THR 9 9.455 2.320 -6.849 373 HG1 THR 9 HG1 THR 9 7.499 1.602 -7.710 374 HG21 THR 9 HG21 THR 9 7.723 0.643 -4.979 375 HG22 THR 9 HG22 THR 9 8.736 0.050 -6.316 376 HG23 THR 9 HG23 THR 9 9.498 0.767 -4.880 377 H GLY 10 H GLY 10 6.974 5.301 -4.752 378 HA2 GLY 10 HA2 GLY 10 7.098 7.547 -5.199 379 HA3 GLY 10 HA3 GLY 10 8.698 7.331 -5.930 380 H LYS 11 H LYS 11 5.893 5.440 -6.989 381 HA LYS 11 HA LYS 11 5.639 7.149 -9.427 382 HB2 LYS 11 HB2 LYS 11 6.914 5.049 -9.726 383 HB3 LYS 11 HB3 LYS 11 5.527 4.108 -9.177 384 HG2 LYS 11 HG2 LYS 11 5.113 6.056 -11.442 385 HG3 LYS 11 HG3 LYS 11 5.992 4.542 -11.759 386 HD2 LYS 11 HD2 LYS 11 4.105 3.211 -10.946 387 HD3 LYS 11 HD3 LYS 11 3.214 4.674 -10.502 388 HE2 LYS 11 HE2 LYS 11 2.379 3.859 -12.626 389 HE3 LYS 11 HE3 LYS 11 3.217 5.395 -12.880 390 HZ1 LYS 11 HZ1 LYS 11 3.818 3.758 -14.527 391 HZ2 LYS 11 HZ2 LYS 11 5.134 4.160 -13.623 392 HZ3 LYS 11 HZ3 LYS 11 4.365 2.727 -13.375 393 H THR 12 H THR 12 3.562 7.341 -10.307 394 HA THR 12 HA THR 12 1.419 6.770 -8.282 395 HB THR 12 HB THR 12 1.679 9.301 -9.928 396 HG1 THR 12 HG1 THR 12 2.556 10.184 -8.045 397 HG21 THR 12 HG21 THR 12 0.197 8.533 -7.393 398 HG22 THR 12 HG22 THR 12 0.254 10.151 -8.136 399 HG23 THR 12 HG23 THR 12 -0.509 8.791 -9.016 400 H ILE 13 H ILE 13 -0.602 6.386 -8.998 401 HA ILE 13 HA ILE 13 -0.907 5.771 -11.914 402 HB ILE 13 HB ILE 13 -1.980 4.208 -9.534 403 HG12 ILE 13 HG12 ILE 13 0.300 3.552 -11.451 404 HG13 ILE 13 HG13 ILE 13 0.464 3.962 -9.731 405 HG21 ILE 13 HG21 ILE 13 -1.992 3.603 -12.525 406 HG22 ILE 13 HG22 ILE 13 -2.705 2.594 -11.243 407 HG23 ILE 13 HG23 ILE 13 -3.389 4.189 -11.596 408 HD11 ILE 13 HD11 ILE 13 0.613 1.557 -9.989 409 HD12 ILE 13 HD12 ILE 13 -0.908 1.950 -9.151 410 HD13 ILE 13 HD13 ILE 13 -0.918 1.504 -10.876 411 H THR 14 H THR 14 -2.489 6.919 -12.824 412 HA THR 14 HA THR 14 -4.315 8.445 -11.161 413 HB THR 14 HB THR 14 -4.579 7.996 -14.148 414 HG1 THR 14 HG1 THR 14 -3.180 9.748 -14.369 415 HG21 THR 14 HG21 THR 14 -6.398 9.215 -13.001 416 HG22 THR 14 HG22 THR 14 -5.210 10.279 -12.220 417 HG23 THR 14 HG23 THR 14 -5.447 10.336 -13.986 418 H LEU 15 H LEU 15 -6.339 7.900 -10.596 419 HA LEU 15 HA LEU 15 -7.526 5.397 -11.713 420 HB2 LEU 15 HB2 LEU 15 -7.530 6.347 -8.826 421 HB3 LEU 15 HB3 LEU 15 -8.254 4.854 -9.431 422 HG LEU 15 HG LEU 15 -5.260 5.484 -9.523 423 HD11 LEU 15 HD11 LEU 15 -5.093 3.945 -7.646 424 HD12 LEU 15 HD12 LEU 15 -6.262 5.220 -7.223 425 HD13 LEU 15 HD13 LEU 15 -6.845 3.620 -7.710 426 HD21 LEU 15 HD21 LEU 15 -5.964 3.907 -11.266 427 HD22 LEU 15 HD22 LEU 15 -5.053 3.076 -9.985 428 HD23 LEU 15 HD23 LEU 15 -6.826 2.934 -10.054 429 H GLU 16 H GLU 16 -9.968 5.356 -10.853 430 HA GLU 16 HA GLU 16 -11.147 8.073 -10.961 431 HB2 GLU 16 HB2 GLU 16 -11.182 7.366 -13.262 432 HB3 GLU 16 HB3 GLU 16 -11.602 5.706 -12.817 433 HG2 GLU 16 HG2 GLU 16 -13.798 6.412 -12.032 434 HG3 GLU 16 HG3 GLU 16 -13.441 8.103 -12.426 435 H VAL 17 H VAL 17 -12.664 8.287 -9.511 436 HA VAL 17 HA VAL 17 -14.120 5.993 -8.356 437 HB VAL 17 HB VAL 17 -13.428 6.652 -6.069 438 HG11 VAL 17 HG11 VAL 17 -12.215 4.806 -7.184 439 HG12 VAL 17 HG12 VAL 17 -11.020 5.975 -7.803 440 HG13 VAL 17 HG13 VAL 17 -11.183 5.712 -6.058 441 HG21 VAL 17 HG21 VAL 17 -12.796 8.994 -6.547 442 HG22 VAL 17 HG22 VAL 17 -11.463 8.119 -5.757 443 HG23 VAL 17 HG23 VAL 17 -11.402 8.427 -7.499 444 H GLU 18 H GLU 18 -15.500 6.981 -6.457 445 HA GLU 18 HA GLU 18 -16.373 9.770 -7.036 446 HB2 GLU 18 HB2 GLU 18 -18.122 7.313 -6.581 447 HB3 GLU 18 HB3 GLU 18 -18.728 8.964 -6.717 448 HG2 GLU 18 HG2 GLU 18 -17.236 7.453 -8.907 449 HG3 GLU 18 HG3 GLU 18 -18.986 7.641 -8.768 450 HA PRO 19 HA PRO 19 -16.294 10.185 -2.636 451 HB2 PRO 19 HB2 PRO 19 -19.094 11.245 -2.636 452 HB3 PRO 19 HB3 PRO 19 -17.603 12.001 -2.016 453 HG2 PRO 19 HG2 PRO 19 -18.722 12.841 -4.357 454 HG3 PRO 19 HG3 PRO 19 -16.944 12.736 -4.144 455 HD2 PRO 19 HD2 PRO 19 -18.784 10.788 -5.526 456 HD3 PRO 19 HD3 PRO 19 -17.174 11.388 -6.036 457 H SER 20 H SER 20 -18.248 7.878 -4.101 458 HA SER 20 HA SER 20 -19.204 6.868 -1.469 459 HB2 SER 20 HB2 SER 20 -20.555 6.718 -4.192 460 HB3 SER 20 HB3 SER 20 -21.113 5.903 -2.722 461 HG SER 20 HG SER 20 -22.149 7.916 -3.063 462 H ASP 21 H ASP 21 -17.173 6.421 -4.141 463 HA ASP 21 HA ASP 21 -17.155 3.479 -4.065 464 HB2 ASP 21 HB2 ASP 21 -15.328 5.532 -5.311 465 HB3 ASP 21 HB3 ASP 21 -15.175 3.782 -5.539 466 H THR 22 H THR 22 -16.942 3.472 -1.792 467 HA THR 22 HA THR 22 -14.745 4.662 -0.368 468 HB THR 22 HB THR 22 -16.749 4.154 0.814 469 HG1 THR 22 HG1 THR 22 -15.875 3.034 2.513 470 HG21 THR 22 HG21 THR 22 -17.678 2.359 -0.429 471 HG22 THR 22 HG22 THR 22 -16.325 1.274 0.014 472 HG23 THR 22 HG23 THR 22 -17.485 1.850 1.255 473 H ILE 23 H ILE 23 -13.353 2.986 1.098 474 HA ILE 23 HA ILE 23 -11.263 2.435 -0.618 475 HB ILE 23 HB ILE 23 -11.696 1.047 2.038 476 HG12 ILE 23 HG12 ILE 23 -12.206 3.336 2.464 477 HG13 ILE 23 HG13 ILE 23 -10.556 3.054 3.020 478 HG21 ILE 23 HG21 ILE 23 -9.755 0.310 0.752 479 HG22 ILE 23 HG22 ILE 23 -9.206 1.990 0.562 480 HG23 ILE 23 HG23 ILE 23 -9.244 1.239 2.179 481 HD11 ILE 23 HD11 ILE 23 -10.694 5.193 1.879 482 HD12 ILE 23 HD12 ILE 23 -9.716 4.093 0.881 483 HD13 ILE 23 HD13 ILE 23 -11.410 4.454 0.445 484 H GLU 24 H GLU 24 -13.822 0.074 0.368 485 HA GLU 24 HA GLU 24 -12.343 -2.172 -0.641 486 HB2 GLU 24 HB2 GLU 24 -14.396 -3.400 -0.443 487 HB3 GLU 24 HB3 GLU 24 -14.250 -2.315 0.958 488 HG2 GLU 24 HG2 GLU 24 -15.779 -0.713 -0.143 489 HG3 GLU 24 HG3 GLU 24 -15.941 -1.809 -1.530 490 H ASN 25 H ASN 25 -14.193 0.338 -2.205 491 HA ASN 25 HA ASN 25 -14.504 -1.090 -4.720 492 HB2 ASN 25 HB2 ASN 25 -14.787 1.848 -4.014 493 HB3 ASN 25 HB3 ASN 25 -15.220 1.149 -5.554 494 HD21 ASN 25 HD21 ASN 25 -16.068 1.513 -2.278 495 HD22 ASN 25 HD22 ASN 25 -17.633 0.676 -2.307 496 H VAL 26 H VAL 26 -12.405 1.358 -3.213 497 HA VAL 26 HA VAL 26 -10.892 2.206 -5.497 498 HB VAL 26 HB VAL 26 -10.249 2.114 -2.515 499 HG11 VAL 26 HG11 VAL 26 -8.896 3.578 -4.808 500 HG12 VAL 26 HG12 VAL 26 -8.590 3.906 -3.087 501 HG13 VAL 26 HG13 VAL 26 -8.205 2.309 -3.764 502 HG21 VAL 26 HG21 VAL 26 -10.931 4.470 -2.515 503 HG22 VAL 26 HG22 VAL 26 -11.359 4.360 -4.246 504 HG23 VAL 26 HG23 VAL 26 -12.260 3.423 -3.035 505 H LYS 27 H LYS 27 -10.353 -0.323 -3.003 506 HA LYS 27 HA LYS 27 -7.810 -1.115 -3.837 507 HB2 LYS 27 HB2 LYS 27 -10.176 -2.580 -2.629 508 HB3 LYS 27 HB3 LYS 27 -8.598 -3.353 -2.912 509 HG2 LYS 27 HG2 LYS 27 -7.463 -1.794 -1.476 510 HG3 LYS 27 HG3 LYS 27 -8.918 -0.793 -1.297 511 HD2 LYS 27 HD2 LYS 27 -10.080 -2.631 -0.160 512 HD3 LYS 27 HD3 LYS 27 -8.677 -3.702 -0.413 513 HE2 LYS 27 HE2 LYS 27 -7.269 -2.193 0.912 514 HE3 LYS 27 HE3 LYS 27 -8.625 -1.093 1.167 515 HZ1 LYS 27 HZ1 LYS 27 -9.786 -2.824 2.308 516 HZ2 LYS 27 HZ2 LYS 27 -8.550 -3.890 2.076 517 HZ3 LYS 27 HZ3 LYS 27 -8.344 -2.562 3.037 518 H ALA 28 H ALA 28 -10.950 -1.661 -5.431 519 HA ALA 28 HA ALA 28 -9.880 -3.720 -7.192 520 HB1 ALA 28 HB1 ALA 28 -11.992 -3.486 -8.374 521 HB2 ALA 28 HB2 ALA 28 -12.286 -3.585 -6.620 522 HB3 ALA 28 HB3 ALA 28 -12.384 -2.014 -7.467 523 H LYS 29 H LYS 29 -10.086 -0.173 -7.183 524 HA LYS 29 HA LYS 29 -9.608 0.203 -10.004 525 HB2 LYS 29 HB2 LYS 29 -9.285 1.930 -7.523 526 HB3 LYS 29 HB3 LYS 29 -8.701 2.476 -9.083 527 HG2 LYS 29 HG2 LYS 29 -10.880 3.374 -8.688 528 HG3 LYS 29 HG3 LYS 29 -10.957 2.248 -10.055 529 HD2 LYS 29 HD2 LYS 29 -12.009 0.552 -8.691 530 HD3 LYS 29 HD3 LYS 29 -11.611 1.450 -7.210 531 HE2 LYS 29 HE2 LYS 29 -13.978 1.662 -7.747 532 HE3 LYS 29 HE3 LYS 29 -13.168 3.231 -7.814 533 HZ1 LYS 29 HZ1 LYS 29 -13.788 1.577 -10.171 534 HZ2 LYS 29 HZ2 LYS 29 -14.638 2.897 -9.690 535 HZ3 LYS 29 HZ3 LYS 29 -13.078 3.066 -10.180 536 H ILE 30 H ILE 30 -7.528 -0.356 -7.166 537 HA ILE 30 HA ILE 30 -5.088 0.214 -8.702 538 HB ILE 30 HB ILE 30 -5.652 -0.751 -5.872 539 HG12 ILE 30 HG12 ILE 30 -4.647 1.899 -7.013 540 HG13 ILE 30 HG13 ILE 30 -6.301 1.594 -6.467 541 HG21 ILE 30 HG21 ILE 30 -3.468 -1.630 -6.641 542 HG22 ILE 30 HG22 ILE 30 -2.984 0.005 -7.147 543 HG23 ILE 30 HG23 ILE 30 -3.256 -0.375 -5.425 544 HD11 ILE 30 HD11 ILE 30 -5.447 1.137 -4.171 545 HD12 ILE 30 HD12 ILE 30 -3.806 1.566 -4.724 546 HD13 ILE 30 HD13 ILE 30 -5.089 2.784 -4.751 547 H GLN 31 H GLN 31 -7.053 -2.555 -7.649 548 HA GLN 31 HA GLN 31 -5.158 -4.598 -8.341 549 HB2 GLN 31 HB2 GLN 31 -7.110 -5.110 -6.963 550 HB3 GLN 31 HB3 GLN 31 -8.205 -4.521 -8.227 551 HG2 GLN 31 HG2 GLN 31 -7.494 -6.269 -9.761 552 HG3 GLN 31 HG3 GLN 31 -6.264 -6.823 -8.637 553 HE21 GLN 31 HE21 GLN 31 -7.049 -8.922 -8.296 554 HE22 GLN 31 HE22 GLN 31 -8.584 -9.248 -7.516 555 H ASP 32 H ASP 32 -7.668 -2.795 -10.166 556 HA ASP 32 HA ASP 32 -7.574 -4.496 -12.449 557 HB2 ASP 32 HB2 ASP 32 -9.407 -2.911 -11.794 558 HB3 ASP 32 HB3 ASP 32 -8.337 -1.568 -12.094 559 H LYS 33 H LYS 33 -5.719 -1.755 -11.378 560 HA LYS 33 HA LYS 33 -4.567 -1.109 -13.969 561 HB2 LYS 33 HB2 LYS 33 -4.244 -0.233 -11.099 562 HB3 LYS 33 HB3 LYS 33 -3.179 0.413 -12.360 563 HG2 LYS 33 HG2 LYS 33 -6.223 0.502 -12.575 564 HG3 LYS 33 HG3 LYS 33 -5.278 1.786 -11.798 565 HD2 LYS 33 HD2 LYS 33 -4.001 2.147 -13.865 566 HD3 LYS 33 HD3 LYS 33 -4.924 0.853 -14.672 567 HE2 LYS 33 HE2 LYS 33 -7.015 2.116 -14.292 568 HE3 LYS 33 HE3 LYS 33 -6.102 3.396 -13.477 569 HZ1 LYS 33 HZ1 LYS 33 -6.534 3.942 -15.765 570 HZ2 LYS 33 HZ2 LYS 33 -4.919 3.777 -15.527 571 HZ3 LYS 33 HZ3 LYS 33 -5.766 2.587 -16.288 572 H GLU 34 H GLU 34 -3.656 -3.201 -11.273 573 HA GLU 34 HA GLU 34 -1.062 -3.681 -12.666 574 HB2 GLU 34 HB2 GLU 34 -1.483 -3.226 -9.689 575 HB3 GLU 34 HB3 GLU 34 0.026 -3.795 -10.407 576 HG2 GLU 34 HG2 GLU 34 -1.321 -1.133 -11.051 577 HG3 GLU 34 HG3 GLU 34 0.013 -1.358 -9.922 578 H GLY 35 H GLY 35 -3.522 -4.902 -10.364 579 HA2 GLY 35 HA2 GLY 35 -4.330 -7.172 -10.784 580 HA3 GLY 35 HA3 GLY 35 -2.648 -7.682 -11.047 581 H ILE 36 H ILE 36 -2.967 -5.340 -8.588 582 HA ILE 36 HA ILE 36 -2.007 -7.225 -6.601 583 HB ILE 36 HB ILE 36 -2.729 -4.268 -6.480 584 HG12 ILE 36 HG12 ILE 36 -0.010 -5.641 -6.663 585 HG13 ILE 36 HG13 ILE 36 -0.871 -4.978 -8.051 586 HG21 ILE 36 HG21 ILE 36 -1.135 -5.982 -4.525 587 HG22 ILE 36 HG22 ILE 36 -1.448 -4.233 -4.388 588 HG23 ILE 36 HG23 ILE 36 -2.787 -5.391 -4.249 589 HD11 ILE 36 HD11 ILE 36 0.087 -3.397 -5.629 590 HD12 ILE 36 HD12 ILE 36 0.754 -3.352 -7.272 591 HD13 ILE 36 HD13 ILE 36 -0.881 -2.728 -6.965 592 HA PRO 37 HA PRO 37 -6.141 -8.206 -5.332 593 HB2 PRO 37 HB2 PRO 37 -5.598 -9.651 -3.052 594 HB3 PRO 37 HB3 PRO 37 -5.305 -10.270 -4.702 595 HG2 PRO 37 HG2 PRO 37 -3.322 -9.006 -2.807 596 HG3 PRO 37 HG3 PRO 37 -3.127 -10.495 -3.787 597 HD2 PRO 37 HD2 PRO 37 -2.136 -8.067 -4.572 598 HD3 PRO 37 HD3 PRO 37 -2.770 -9.234 -5.766 599 HA PRO 38 HA PRO 38 -7.202 -5.133 -2.296 600 HB2 PRO 38 HB2 PRO 38 -9.592 -6.137 -1.366 601 HB3 PRO 38 HB3 PRO 38 -9.403 -5.401 -2.987 602 HG2 PRO 38 HG2 PRO 38 -9.363 -8.341 -2.255 603 HG3 PRO 38 HG3 PRO 38 -10.258 -7.545 -3.590 604 HD2 PRO 38 HD2 PRO 38 -7.875 -8.795 -3.993 605 HD3 PRO 38 HD3 PRO 38 -8.294 -7.286 -4.867 606 H ASP 39 H ASP 39 -6.658 -8.473 -1.614 607 HA ASP 39 HA ASP 39 -7.036 -8.271 1.245 608 HB2 ASP 39 HB2 ASP 39 -5.733 -10.418 -0.475 609 HB3 ASP 39 HB3 ASP 39 -6.141 -10.594 1.240 610 H GLN 40 H GLN 40 -4.550 -7.182 -0.832 611 HA GLN 40 HA GLN 40 -2.561 -7.454 1.383 612 HB2 GLN 40 HB2 GLN 40 -2.183 -7.532 -1.609 613 HB3 GLN 40 HB3 GLN 40 -0.858 -7.225 -0.467 614 HG2 GLN 40 HG2 GLN 40 -1.356 -9.336 0.712 615 HG3 GLN 40 HG3 GLN 40 -2.699 -9.641 -0.402 616 HE21 GLN 40 HE21 GLN 40 -2.110 -11.317 -1.561 617 HE22 GLN 40 HE22 GLN 40 -0.613 -11.485 -2.481 618 H GLN 41 H GLN 41 -4.226 -5.162 -0.767 619 HA GLN 41 HA GLN 41 -2.261 -3.107 -0.693 620 HB2 GLN 41 HB2 GLN 41 -5.280 -3.018 -0.969 621 HB3 GLN 41 HB3 GLN 41 -4.215 -1.616 -1.205 622 HG2 GLN 41 HG2 GLN 41 -3.049 -2.748 -3.038 623 HG3 GLN 41 HG3 GLN 41 -4.005 -4.217 -2.762 624 HE21 GLN 41 HE21 GLN 41 -5.127 -4.298 -4.732 625 HE22 GLN 41 HE22 GLN 41 -6.328 -3.099 -5.149 626 H ARG 42 H ARG 42 -2.406 -1.054 0.324 627 HA ARG 42 HA ARG 42 -3.898 -0.720 2.825 628 HB2 ARG 42 HB2 ARG 42 -1.713 -1.927 3.340 629 HB3 ARG 42 HB3 ARG 42 -0.855 -0.496 2.730 630 HG2 ARG 42 HG2 ARG 42 -1.920 0.886 4.487 631 HG3 ARG 42 HG3 ARG 42 -2.845 -0.529 5.042 632 HD2 ARG 42 HD2 ARG 42 -0.720 -1.742 5.456 633 HD3 ARG 42 HD3 ARG 42 0.188 -0.290 4.985 634 HE ARG 42 HE ARG 42 -1.481 0.599 6.999 635 HH11 ARG 42 HH11 ARG 42 0.818 -2.056 6.716 636 HH12 ARG 42 HH12 ARG 42 1.242 -2.040 8.409 637 HH21 ARG 42 HH21 ARG 42 -0.886 0.652 9.194 638 HH22 ARG 42 HH22 ARG 42 0.283 -0.487 9.815 639 H LEU 43 H LEU 43 -4.539 1.465 2.859 640 HA LEU 43 HA LEU 43 -3.273 3.188 0.782 641 HB2 LEU 43 HB2 LEU 43 -5.367 2.013 0.073 642 HB3 LEU 43 HB3 LEU 43 -6.215 2.764 1.426 643 HG LEU 43 HG LEU 43 -5.686 4.999 0.461 644 HD11 LEU 43 HD11 LEU 43 -4.694 3.338 -1.909 645 HD12 LEU 43 HD12 LEU 43 -4.961 5.097 -1.930 646 HD13 LEU 43 HD13 LEU 43 -3.694 4.406 -0.897 647 HD21 LEU 43 HD21 LEU 43 -7.329 4.800 -1.396 648 HD22 LEU 43 HD22 LEU 43 -7.104 3.031 -1.408 649 HD23 LEU 43 HD23 LEU 43 -7.832 3.829 0.000 650 H ILE 44 H ILE 44 -2.879 5.259 1.365 651 HA ILE 44 HA ILE 44 -3.839 6.203 4.025 652 HB ILE 44 HB ILE 44 -0.992 6.184 2.939 653 HG12 ILE 44 HG12 ILE 44 -0.657 5.245 5.363 654 HG13 ILE 44 HG13 ILE 44 -2.384 4.891 5.301 655 HG21 ILE 44 HG21 ILE 44 -1.980 7.521 5.491 656 HG22 ILE 44 HG22 ILE 44 -0.313 7.433 4.928 657 HG23 ILE 44 HG23 ILE 44 -1.475 8.394 4.019 658 HD11 ILE 44 HD11 ILE 44 -0.285 3.895 3.318 659 HD12 ILE 44 HD12 ILE 44 -0.965 2.952 4.667 660 HD13 ILE 44 HD13 ILE 44 -2.004 3.426 3.327 661 H PHE 45 H PHE 45 -4.071 8.437 4.210 662 HA PHE 45 HA PHE 45 -3.422 10.214 1.951 663 HB2 PHE 45 HB2 PHE 45 -5.665 9.291 1.432 664 HB3 PHE 45 HB3 PHE 45 -6.237 9.793 3.025 665 HD1 PHE 45 HD1 PHE 45 -4.300 11.529 0.293 666 HD2 PHE 45 HD2 PHE 45 -7.678 11.571 2.953 667 HE1 PHE 45 HE1 PHE 45 -4.936 13.775 -0.547 668 HE2 PHE 45 HE2 PHE 45 -8.317 13.810 2.110 669 HZ PHE 45 HZ PHE 45 -6.939 14.921 0.366 670 H ALA 46 H ALA 46 -3.253 12.363 2.608 671 HA ALA 46 HA ALA 46 -2.467 13.897 4.054 672 HB1 ALA 46 HB1 ALA 46 -4.952 13.122 5.624 673 HB2 ALA 46 HB2 ALA 46 -4.061 14.655 5.746 674 HB3 ALA 46 HB3 ALA 46 -4.911 14.234 4.239 675 H GLY 47 H GLY 47 -1.916 10.853 4.660 676 HA2 GLY 47 HA2 GLY 47 -0.131 10.073 5.937 677 HA3 GLY 47 HA3 GLY 47 -0.317 11.407 7.081 678 H LYS 48 H LYS 48 -3.315 9.766 6.261 679 HA LYS 48 HA LYS 48 -2.876 7.859 8.491 680 HB2 LYS 48 HB2 LYS 48 -5.157 8.156 9.301 681 HB3 LYS 48 HB3 LYS 48 -4.138 9.577 9.521 682 HG2 LYS 48 HG2 LYS 48 -6.279 10.313 8.910 683 HG3 LYS 48 HG3 LYS 48 -5.169 10.619 7.554 684 HD2 LYS 48 HD2 LYS 48 -6.173 8.780 6.287 685 HD3 LYS 48 HD3 LYS 48 -7.201 8.323 7.665 686 HE2 LYS 48 HE2 LYS 48 -8.439 9.653 6.027 687 HE3 LYS 48 HE3 LYS 48 -8.318 10.495 7.580 688 HZ1 LYS 48 HZ1 LYS 48 -6.579 10.992 5.247 689 HZ2 LYS 48 HZ2 LYS 48 -7.857 11.935 5.693 690 HZ3 LYS 48 HZ3 LYS 48 -6.545 11.808 6.673 691 H GLN 49 H GLN 49 -4.410 6.129 8.513 692 HA GLN 49 HA GLN 49 -4.483 5.063 5.740 693 HB2 GLN 49 HB2 GLN 49 -3.126 3.866 7.373 694 HB3 GLN 49 HB3 GLN 49 -4.515 3.704 8.458 695 HG2 GLN 49 HG2 GLN 49 -5.701 2.361 6.738 696 HG3 GLN 49 HG3 GLN 49 -4.318 2.527 5.647 697 HE21 GLN 49 HE21 GLN 49 -5.462 0.043 6.613 698 HE22 GLN 49 HE22 GLN 49 -4.225 -0.766 7.552 699 H LEU 50 H LEU 50 -6.285 4.582 4.738 700 HA LEU 50 HA LEU 50 -8.783 5.509 5.942 701 HB2 LEU 50 HB2 LEU 50 -8.425 4.292 3.190 702 HB3 LEU 50 HB3 LEU 50 -9.641 5.443 3.747 703 HG LEU 50 HG LEU 50 -6.659 5.986 3.375 704 HD11 LEU 50 HD11 LEU 50 -7.430 7.538 1.629 705 HD12 LEU 50 HD12 LEU 50 -7.966 5.878 1.278 706 HD13 LEU 50 HD13 LEU 50 -9.114 7.068 1.933 707 HD21 LEU 50 HD21 LEU 50 -8.858 7.906 4.221 708 HD22 LEU 50 HD22 LEU 50 -7.615 7.253 5.318 709 HD23 LEU 50 HD23 LEU 50 -7.144 8.297 3.967 710 H GLU 51 H GLU 51 -10.826 4.155 5.746 711 HA GLU 51 HA GLU 51 -10.199 1.269 6.215 712 HB2 GLU 51 HB2 GLU 51 -11.792 3.238 7.848 713 HB3 GLU 51 HB3 GLU 51 -12.194 1.509 7.886 714 HG2 GLU 51 HG2 GLU 51 -9.907 0.950 8.553 715 HG3 GLU 51 HG3 GLU 51 -9.428 2.645 8.425 716 H ASP 52 H ASP 52 -11.729 -0.222 5.686 717 HA ASP 52 HA ASP 52 -13.210 0.364 3.304 718 HB2 ASP 52 HB2 ASP 52 -13.172 -2.106 5.082 719 HB3 ASP 52 HB3 ASP 52 -13.790 -2.022 3.430 720 H GLY 53 H GLY 53 -14.000 1.089 6.435 721 HA2 GLY 53 HA2 GLY 53 -16.889 0.434 6.115 722 HA3 GLY 53 HA3 GLY 53 -16.047 0.685 7.662 723 H ARG 54 H ARG 54 -15.027 2.848 5.192 724 HA ARG 54 HA ARG 54 -16.741 5.038 6.260 725 HB2 ARG 54 HB2 ARG 54 -14.004 5.290 5.046 726 HB3 ARG 54 HB3 ARG 54 -14.846 6.471 6.051 727 HG2 ARG 54 HG2 ARG 54 -13.812 3.775 7.052 728 HG3 ARG 54 HG3 ARG 54 -12.922 5.300 7.166 729 HD2 ARG 54 HD2 ARG 54 -14.570 6.288 8.565 730 HD3 ARG 54 HD3 ARG 54 -15.695 4.916 8.343 731 HE ARG 54 HE ARG 54 -13.325 3.840 9.371 732 HH11 ARG 54 HH11 ARG 54 -15.773 6.140 10.446 733 HH12 ARG 54 HH12 ARG 54 -15.515 5.797 12.146 734 HH21 ARG 54 HH21 ARG 54 -12.994 3.422 11.542 735 HH22 ARG 54 HH22 ARG 54 -13.952 4.231 12.773 736 H THR 55 H THR 55 -15.516 6.808 4.227 737 HA THR 55 HA THR 55 -16.136 5.746 1.569 738 HB THR 55 HB THR 55 -17.589 7.912 1.236 739 HG1 THR 55 HG1 THR 55 -18.590 8.615 3.052 740 HG21 THR 55 HG21 THR 55 -18.384 5.482 1.183 741 HG22 THR 55 HG22 THR 55 -18.753 5.653 2.913 742 HG23 THR 55 HG23 THR 55 -19.609 6.657 1.716 743 H LEU 56 H LEU 56 -15.328 7.213 -0.109 744 HA LEU 56 HA LEU 56 -12.894 8.502 0.606 745 HB2 LEU 56 HB2 LEU 56 -14.672 8.675 -1.854 746 HB3 LEU 56 HB3 LEU 56 -13.134 9.534 -1.723 747 HG LEU 56 HG LEU 56 -13.448 6.510 -1.475 748 HD11 LEU 56 HD11 LEU 56 -12.416 8.294 -3.720 749 HD12 LEU 56 HD12 LEU 56 -12.295 6.517 -3.686 750 HD13 LEU 56 HD13 LEU 56 -13.889 7.293 -3.756 751 HD21 LEU 56 HD21 LEU 56 -10.976 8.287 -1.699 752 HD22 LEU 56 HD22 LEU 56 -11.459 7.378 -0.244 753 HD23 LEU 56 HD23 LEU 56 -10.973 6.516 -1.712 754 H SER 57 H SER 57 -16.215 9.561 0.580 755 HA SER 57 HA SER 57 -15.754 12.388 0.666 756 HB2 SER 57 HB2 SER 57 -18.156 12.370 1.292 757 HB3 SER 57 HB3 SER 57 -17.845 11.274 -0.066 758 HG SER 57 HG SER 57 -19.152 10.347 1.551 759 H ASP 58 H ASP 58 -15.668 9.786 3.025 760 HA ASP 58 HA ASP 58 -16.023 11.455 5.362 761 HB2 ASP 58 HB2 ASP 58 -16.522 8.989 5.221 762 HB3 ASP 58 HB3 ASP 58 -14.778 8.689 5.166 763 H TYR 59 H TYR 59 -13.351 10.858 3.229 764 HA TYR 59 HA TYR 59 -11.533 12.049 5.283 765 HB2 TYR 59 HB2 TYR 59 -10.287 10.907 2.875 766 HB3 TYR 59 HB3 TYR 59 -9.782 10.836 4.555 767 HD1 TYR 59 HD1 TYR 59 -10.768 8.997 6.036 768 HD2 TYR 59 HD2 TYR 59 -11.424 9.226 1.802 769 HE1 TYR 59 HE1 TYR 59 -11.379 6.555 5.988 770 HE2 TYR 59 HE2 TYR 59 -12.125 6.839 1.771 771 HH TYR 59 HH TYR 59 -12.153 4.821 4.697 772 H ASN 60 H ASN 60 -13.528 13.205 3.244 773 HA ASN 60 HA ASN 60 -13.704 14.849 1.776 774 HB2 ASN 60 HB2 ASN 60 -13.244 16.792 2.736 775 HB3 ASN 60 HB3 ASN 60 -12.776 15.763 4.085 776 HD21 ASN 60 HD21 ASN 60 -10.302 15.049 3.933 777 HD22 ASN 60 HD22 ASN 60 -9.215 16.391 3.649 778 H ILE 61 H ILE 61 -11.840 12.742 0.845 779 HA ILE 61 HA ILE 61 -9.746 13.933 -0.695 780 HB ILE 61 HB ILE 61 -11.415 11.414 -0.979 781 HG12 ILE 61 HG12 ILE 61 -8.469 11.878 -0.338 782 HG13 ILE 61 HG13 ILE 61 -9.734 11.707 0.895 783 HG21 ILE 61 HG21 ILE 61 -9.819 10.678 -2.735 784 HG22 ILE 61 HG22 ILE 61 -10.728 12.084 -3.258 785 HG23 ILE 61 HG23 ILE 61 -9.048 12.283 -2.698 786 HD11 ILE 61 HD11 ILE 61 -10.278 9.460 0.033 787 HD12 ILE 61 HD12 ILE 61 -8.974 9.605 -1.169 788 HD13 ILE 61 HD13 ILE 61 -8.586 9.582 0.566 789 H GLN 62 H GLN 62 -9.690 14.694 -2.820 790 HA GLN 62 HA GLN 62 -12.325 15.355 -4.061 791 HB2 GLN 62 HB2 GLN 62 -9.818 17.056 -4.032 792 HB3 GLN 62 HB3 GLN 62 -11.410 17.517 -4.640 793 HG2 GLN 62 HG2 GLN 62 -10.773 16.858 -1.727 794 HG3 GLN 62 HG3 GLN 62 -10.842 18.476 -2.391 795 HE21 GLN 62 HE21 GLN 62 -12.525 17.066 -0.273 796 HE22 GLN 62 HE22 GLN 62 -14.176 17.314 -0.812 797 H LYS 63 H LYS 63 -11.649 16.291 -6.441 798 HA LYS 63 HA LYS 63 -10.683 13.932 -7.783 799 HB2 LYS 63 HB2 LYS 63 -11.177 15.184 -9.771 800 HB3 LYS 63 HB3 LYS 63 -12.498 15.354 -8.601 801 HG2 LYS 63 HG2 LYS 63 -11.582 17.577 -7.920 802 HG3 LYS 63 HG3 LYS 63 -10.292 17.403 -9.137 803 HD2 LYS 63 HD2 LYS 63 -13.273 17.346 -9.744 804 HD3 LYS 63 HD3 LYS 63 -12.239 18.788 -9.917 805 HE2 LYS 63 HE2 LYS 63 -10.794 17.526 -11.501 806 HE3 LYS 63 HE3 LYS 63 -11.892 16.140 -11.377 807 HZ1 LYS 63 HZ1 LYS 63 -13.645 17.525 -12.263 808 HZ2 LYS 63 HZ2 LYS 63 -12.630 18.814 -12.369 809 HZ3 LYS 63 HZ3 LYS 63 -12.374 17.484 -13.300 810 H GLU 64 H GLU 64 -8.968 13.541 -8.909 811 HA GLU 64 HA GLU 64 -6.880 13.518 -9.593 812 HB2 GLU 64 HB2 GLU 64 -7.212 16.539 -9.657 813 HB3 GLU 64 HB3 GLU 64 -5.877 15.630 -10.395 814 HG2 GLU 64 HG2 GLU 64 -7.465 14.388 -11.803 815 HG3 GLU 64 HG3 GLU 64 -8.827 15.256 -11.069 816 H SER 65 H SER 65 -7.589 14.048 -6.549 817 HA SER 65 HA SER 65 -5.396 15.389 -5.386 818 HB2 SER 65 HB2 SER 65 -7.322 13.258 -4.381 819 HB3 SER 65 HB3 SER 65 -6.158 14.106 -3.347 820 HG SER 65 HG SER 65 -7.139 16.068 -3.950 821 H THR 66 H THR 66 -4.232 13.870 -3.591 822 HA THR 66 HA THR 66 -2.827 11.694 -5.093 823 HB THR 66 HB THR 66 -1.556 13.902 -3.443 824 HG1 THR 66 HG1 THR 66 -2.156 14.498 -5.548 825 HG21 THR 66 HG21 THR 66 -0.346 11.799 -3.121 826 HG22 THR 66 HG22 THR 66 -0.357 11.496 -4.876 827 HG23 THR 66 HG23 THR 66 0.581 12.851 -4.208 828 H LEU 67 H LEU 67 -2.492 9.897 -3.955 829 HA LEU 67 HA LEU 67 -2.721 9.871 -0.983 830 HB2 LEU 67 HB2 LEU 67 -4.018 7.985 -2.998 831 HB3 LEU 67 HB3 LEU 67 -3.796 7.602 -1.293 832 HG LEU 67 HG LEU 67 -5.160 9.703 -0.756 833 HD11 LEU 67 HD11 LEU 67 -6.874 10.249 -2.497 834 HD12 LEU 67 HD12 LEU 67 -5.249 10.775 -2.976 835 HD13 LEU 67 HD13 LEU 67 -5.949 9.297 -3.679 836 HD21 LEU 67 HD21 LEU 67 -5.897 7.366 -0.478 837 HD22 LEU 67 HD22 LEU 67 -7.237 8.385 -1.040 838 HD23 LEU 67 HD23 LEU 67 -6.398 7.314 -2.187 839 H HIS 68 H HIS 68 -2.038 7.366 -0.396 840 HA HIS 68 HA HIS 68 0.405 6.730 -1.968 841 HB2 HIS 68 HB2 HIS 68 0.288 6.967 1.059 842 HB3 HIS 68 HB3 HIS 68 1.709 6.586 0.076 843 HD2 HIS 68 HD2 HIS 68 2.625 8.652 -1.559 844 HE1 HIS 68 HE1 HIS 68 0.760 11.763 0.655 845 HE2 HIS 68 HE2 HIS 68 2.495 11.232 -1.127 846 H LEU 69 H LEU 69 1.092 4.572 -1.829 847 HA LEU 69 HA LEU 69 -0.897 2.644 -0.726 848 HB2 LEU 69 HB2 LEU 69 -1.445 2.938 -3.051 849 HB3 LEU 69 HB3 LEU 69 0.262 2.899 -3.517 850 HG LEU 69 HG LEU 69 0.370 0.495 -2.791 851 HD11 LEU 69 HD11 LEU 69 -2.659 0.803 -2.596 852 HD12 LEU 69 HD12 LEU 69 -1.754 -0.731 -2.533 853 HD13 LEU 69 HD13 LEU 69 -1.559 0.462 -1.237 854 HD21 LEU 69 HD21 LEU 69 -1.695 1.214 -4.899 855 HD22 LEU 69 HD22 LEU 69 0.061 1.115 -5.136 856 HD23 LEU 69 HD23 LEU 69 -0.850 -0.355 -4.752 857 H VAL 70 H VAL 70 -0.092 0.864 0.111 858 HA VAL 70 HA VAL 70 2.650 -0.077 -0.389 859 HB VAL 70 HB VAL 70 1.551 0.708 2.352 860 HG11 VAL 70 HG11 VAL 70 4.076 -0.832 1.621 861 HG12 VAL 70 HG12 VAL 70 3.757 -0.099 3.210 862 HG13 VAL 70 HG13 VAL 70 2.721 -1.405 2.624 863 HG21 VAL 70 HG21 VAL 70 2.525 2.603 1.196 864 HG22 VAL 70 HG22 VAL 70 3.706 2.038 2.396 865 HG23 VAL 70 HG23 VAL 70 3.918 1.638 0.675 866 H LEU 71 H LEU 71 2.793 -2.403 0.627 867 HA LEU 71 HA LEU 71 0.135 -3.532 1.157 868 HB2 LEU 71 HB2 LEU 71 0.423 -5.299 -0.581 869 HB3 LEU 71 HB3 LEU 71 0.112 -3.676 -1.174 870 HG LEU 71 HG LEU 71 2.527 -3.396 -1.721 871 HD11 LEU 71 HD11 LEU 71 3.916 -5.459 -1.889 872 HD12 LEU 71 HD12 LEU 71 3.571 -5.043 -0.207 873 HD13 LEU 71 HD13 LEU 71 2.666 -6.360 -1.006 874 HD21 LEU 71 HD21 LEU 71 0.855 -4.136 -3.373 875 HD22 LEU 71 HD22 LEU 71 2.428 -4.902 -3.679 876 HD23 LEU 71 HD23 LEU 71 1.128 -5.832 -2.903 877 H ARG 72 H ARG 72 0.246 -5.912 1.617 878 HA ARG 72 HA ARG 72 2.021 -6.277 3.847 879 HB2 ARG 72 HB2 ARG 72 -0.223 -7.755 2.520 880 HB3 ARG 72 HB3 ARG 72 0.877 -8.703 3.534 881 HG2 ARG 72 HG2 ARG 72 -1.086 -7.832 4.789 882 HG3 ARG 72 HG3 ARG 72 0.473 -7.327 5.451 883 HD2 ARG 72 HD2 ARG 72 0.238 -5.131 4.306 884 HD3 ARG 72 HD3 ARG 72 -1.341 -5.642 3.682 885 HE ARG 72 HE ARG 72 -2.272 -5.320 5.803 886 HH11 ARG 72 HH11 ARG 72 1.261 -5.111 6.006 887 HH12 ARG 72 HH12 ARG 72 1.247 -4.499 7.639 888 HH21 ARG 72 HH21 ARG 72 -2.251 -4.515 7.936 889 HH22 ARG 72 HH22 ARG 72 -0.730 -4.174 8.727 890 H LEU 73 H LEU 73 2.977 -8.615 4.114 891 HA LEU 73 HA LEU 73 5.114 -8.632 2.098 892 HB2 LEU 73 HB2 LEU 73 5.125 -8.520 4.879 893 HB3 LEU 73 HB3 LEU 73 5.397 -10.242 4.593 894 HG LEU 73 HG LEU 73 7.294 -9.576 3.034 895 HD11 LEU 73 HD11 LEU 73 6.774 -6.836 4.296 896 HD12 LEU 73 HD12 LEU 73 8.142 -7.257 3.238 897 HD13 LEU 73 HD13 LEU 73 6.487 -7.233 2.595 898 HD21 LEU 73 HD21 LEU 73 7.442 -8.577 5.911 899 HD22 LEU 73 HD22 LEU 73 7.676 -10.258 5.384 900 HD23 LEU 73 HD23 LEU 73 8.832 -8.998 4.887 901 H ARG 74 H ARG 74 2.459 -9.916 1.951 902 HA ARG 74 HA ARG 74 1.395 -11.737 1.153 903 HB2 ARG 74 HB2 ARG 74 3.135 -11.663 -0.553 904 HB3 ARG 74 HB3 ARG 74 4.206 -12.644 0.455 905 HG2 ARG 74 HG2 ARG 74 3.123 -14.008 -1.300 906 HG3 ARG 74 HG3 ARG 74 2.661 -14.550 0.319 907 HD2 ARG 74 HD2 ARG 74 0.528 -13.249 0.113 908 HD3 ARG 74 HD3 ARG 74 1.017 -12.761 -1.520 909 HE ARG 74 HE ARG 74 0.506 -14.880 -2.320 910 HH11 ARG 74 HH11 ARG 74 0.427 -14.899 1.222 911 HH12 ARG 74 HH12 ARG 74 -0.323 -16.476 1.305 912 HH21 ARG 74 HH21 ARG 74 -0.482 -16.921 -2.169 913 HH22 ARG 74 HH22 ARG 74 -0.832 -17.620 -0.606 914 H GLY 75 H GLY 75 4.201 -12.628 3.180 915 HA2 GLY 75 HA2 GLY 75 3.387 -13.776 5.289 916 HA3 GLY 75 HA3 GLY 75 2.619 -14.936 4.162 917 H GLY 76 H GLY 76 5.024 -14.524 2.300 918 HA2 GLY 76 HA2 GLY 76 7.460 -15.295 3.352 919 HA3 GLY 76 HA3 GLY 76 6.541 -16.808 3.239 Start of MODEL 8 1 H LEU 491 H LEU 491 15.325 6.989 11.612 2 HA LEU 491 HA LEU 491 17.774 6.238 11.023 3 HB2 LEU 491 HB2 LEU 491 16.637 4.035 10.104 4 HB3 LEU 491 HB3 LEU 491 16.902 4.425 11.758 5 HG LEU 491 HG LEU 491 14.569 5.385 11.914 6 HD11 LEU 491 HD11 LEU 491 14.196 5.877 9.521 7 HD12 LEU 491 HD12 LEU 491 14.319 4.145 9.141 8 HD13 LEU 491 HD13 LEU 491 12.966 4.755 10.134 9 HD21 LEU 491 HD21 LEU 491 14.776 2.508 10.966 10 HD22 LEU 491 HD22 LEU 491 15.256 3.081 12.573 11 HD23 LEU 491 HD23 LEU 491 13.555 3.202 12.078 12 HA PRO 492 HA PRO 492 18.436 6.385 6.529 13 HB2 PRO 492 HB2 PRO 492 20.953 5.419 6.547 14 HB3 PRO 492 HB3 PRO 492 20.573 7.025 7.242 15 HG2 PRO 492 HG2 PRO 492 20.971 4.408 8.690 16 HG3 PRO 492 HG3 PRO 492 21.631 6.019 9.112 17 HD2 PRO 492 HD2 PRO 492 19.328 4.898 10.219 18 HD3 PRO 492 HD3 PRO 492 19.591 6.655 10.128 19 H LEU 493 H LEU 493 19.740 4.532 5.165 20 HA LEU 493 HA LEU 493 17.982 2.306 5.041 21 HB2 LEU 493 HB2 LEU 493 19.743 3.728 3.433 22 HB3 LEU 493 HB3 LEU 493 20.665 2.264 3.688 23 HG LEU 493 HG LEU 493 17.778 2.404 2.714 24 HD11 LEU 493 HD11 LEU 493 20.346 2.026 1.116 25 HD12 LEU 493 HD12 LEU 493 18.694 1.933 0.458 26 HD13 LEU 493 HD13 LEU 493 19.301 3.470 1.112 27 HD21 LEU 493 HD21 LEU 493 18.354 0.202 3.703 28 HD22 LEU 493 HD22 LEU 493 18.148 0.067 1.943 29 HD23 LEU 493 HD23 LEU 493 19.782 0.101 2.650 30 H GLN 494 H GLN 494 19.167 2.451 7.590 31 HA GLN 494 HA GLN 494 21.280 0.538 7.801 32 HB2 GLN 494 HB2 GLN 494 21.000 0.895 10.182 33 HB3 GLN 494 HB3 GLN 494 20.920 2.428 9.293 34 HG2 GLN 494 HG2 GLN 494 19.195 2.789 10.695 35 HG3 GLN 494 HG3 GLN 494 18.322 2.050 9.354 36 HE21 GLN 494 HE21 GLN 494 16.900 1.976 11.484 37 HE22 GLN 494 HE22 GLN 494 16.952 0.438 12.329 38 H ALA 495 H ALA 495 17.761 0.362 7.935 39 HA ALA 495 HA ALA 495 18.028 -2.599 7.966 40 HB1 ALA 495 HB1 ALA 495 16.175 -1.016 9.793 41 HB2 ALA 495 HB2 ALA 495 16.144 -2.782 9.592 42 HB3 ALA 495 HB3 ALA 495 17.571 -2.000 10.293 43 H LEU 496 H LEU 496 16.976 0.002 6.280 44 HA LEU 496 HA LEU 496 14.324 -0.832 5.548 45 HB2 LEU 496 HB2 LEU 496 16.421 1.035 4.374 46 HB3 LEU 496 HB3 LEU 496 14.847 0.809 3.622 47 HG LEU 496 HG LEU 496 15.249 1.737 6.499 48 HD11 LEU 496 HD11 LEU 496 14.557 3.948 5.631 49 HD12 LEU 496 HD12 LEU 496 16.060 3.389 4.867 50 HD13 LEU 496 HD13 LEU 496 14.516 3.289 3.980 51 HD21 LEU 496 HD21 LEU 496 13.065 0.614 6.122 52 HD22 LEU 496 HD22 LEU 496 12.863 2.364 6.331 53 HD23 LEU 496 HD23 LEU 496 12.784 1.652 4.702 54 HA PRO 497 HA PRO 497 14.831 -3.961 2.530 55 HB2 PRO 497 HB2 PRO 497 13.469 -2.062 0.623 56 HB3 PRO 497 HB3 PRO 497 13.081 -3.782 0.929 57 HG2 PRO 497 HG2 PRO 497 11.549 -1.873 2.037 58 HG3 PRO 497 HG3 PRO 497 12.099 -3.254 3.050 59 HD2 PRO 497 HD2 PRO 497 13.254 -0.460 2.900 60 HD3 PRO 497 HD3 PRO 497 12.903 -1.458 4.342 61 H GLU 498 H GLU 498 16.119 -4.590 0.733 62 HA GLU 498 HA GLU 498 18.144 -2.648 -0.076 63 HB2 GLU 498 HB2 GLU 498 18.623 -5.049 0.549 64 HB3 GLU 498 HB3 GLU 498 17.815 -5.544 -0.956 65 HG2 GLU 498 HG2 GLU 498 19.474 -4.337 -2.285 66 HG3 GLU 498 HG3 GLU 498 20.099 -3.536 -0.837 67 H GLY 499 H GLY 499 16.088 -1.528 -0.829 68 HA2 GLY 499 HA2 GLY 499 16.196 -1.100 -3.588 69 HA3 GLY 499 HA3 GLY 499 14.923 -2.323 -3.317 70 H VAL 500 H VAL 500 15.650 0.196 -0.927 71 HA VAL 500 HA VAL 500 13.337 1.840 -1.756 72 HB VAL 500 HB VAL 500 13.606 0.347 0.881 73 HG11 VAL 500 HG11 VAL 500 11.692 2.614 0.173 74 HG12 VAL 500 HG12 VAL 500 11.513 1.533 1.568 75 HG13 VAL 500 HG13 VAL 500 12.909 2.607 1.487 76 HG21 VAL 500 HG21 VAL 500 11.412 0.499 -1.228 77 HG22 VAL 500 HG22 VAL 500 12.475 -0.891 -0.919 78 HG23 VAL 500 HG23 VAL 500 11.298 -0.387 0.309 79 H ASP 501 H ASP 501 13.244 3.852 -0.402 80 HA ASP 501 HA ASP 501 15.852 4.692 0.762 81 HB2 ASP 501 HB2 ASP 501 15.494 5.265 -1.786 82 HB3 ASP 501 HB3 ASP 501 14.317 6.426 -1.186 83 H GLN 502 H GLN 502 15.673 6.209 2.294 84 HA GLN 502 HA GLN 502 13.279 6.351 3.797 85 HB2 GLN 502 HB2 GLN 502 14.581 8.355 4.848 86 HB3 GLN 502 HB3 GLN 502 15.178 6.711 5.055 87 HG2 GLN 502 HG2 GLN 502 16.160 8.475 2.781 88 HG3 GLN 502 HG3 GLN 502 16.847 8.554 4.410 89 HE21 GLN 502 HE21 GLN 502 16.019 5.365 4.155 90 HE22 GLN 502 HE22 GLN 502 17.546 4.746 3.549 91 H GLU 503 H GLU 503 14.502 8.368 1.114 92 HA GLU 503 HA GLU 503 12.679 10.521 1.675 93 HB2 GLU 503 HB2 GLU 503 13.419 11.475 -0.378 94 HB3 GLU 503 HB3 GLU 503 14.830 10.651 0.315 95 HG2 GLU 503 HG2 GLU 503 14.297 8.671 -1.160 96 HG3 GLU 503 HG3 GLU 503 13.002 9.611 -1.896 97 H VAL 504 H VAL 504 11.978 7.402 0.780 98 HA VAL 504 HA VAL 504 9.359 8.289 -0.255 99 HB VAL 504 HB VAL 504 10.836 7.694 -2.117 100 HG11 VAL 504 HG11 VAL 504 10.668 4.867 -0.985 101 HG12 VAL 504 HG12 VAL 504 11.287 5.302 -2.596 102 HG13 VAL 504 HG13 VAL 504 12.134 5.868 -1.146 103 HG21 VAL 504 HG21 VAL 504 8.448 5.825 -1.831 104 HG22 VAL 504 HG22 VAL 504 8.366 7.547 -2.276 105 HG23 VAL 504 HG23 VAL 504 9.201 6.389 -3.334 106 H PHE 505 H PHE 505 10.733 7.154 2.294 107 HA PHE 505 HA PHE 505 8.623 5.115 2.876 108 HB2 PHE 505 HB2 PHE 505 10.476 3.772 2.959 109 HB3 PHE 505 HB3 PHE 505 11.579 5.123 3.200 110 HD1 PHE 505 HD1 PHE 505 11.934 6.131 5.409 111 HD2 PHE 505 HD2 PHE 505 9.662 2.534 4.869 112 HE1 PHE 505 HE1 PHE 505 12.224 5.588 7.817 113 HE2 PHE 505 HE2 PHE 505 9.940 1.987 7.281 114 HZ PHE 505 HZ PHE 505 11.226 3.515 8.753 115 H LYS 506 H LYS 506 10.166 8.144 3.649 116 HA LYS 506 HA LYS 506 9.044 8.288 6.334 117 HB2 LYS 506 HB2 LYS 506 10.271 10.332 4.448 118 HB3 LYS 506 HB3 LYS 506 9.657 10.734 6.068 119 HG2 LYS 506 HG2 LYS 506 11.139 9.051 7.082 120 HG3 LYS 506 HG3 LYS 506 11.787 8.624 5.497 121 HD2 LYS 506 HD2 LYS 506 11.990 11.366 6.815 122 HD3 LYS 506 HD3 LYS 506 13.298 10.167 6.683 123 HE2 LYS 506 HE2 LYS 506 13.214 10.308 4.238 124 HE3 LYS 506 HE3 LYS 506 11.895 11.494 4.335 125 HZ1 LYS 506 HZ1 LYS 506 14.600 11.864 5.441 126 HZ2 LYS 506 HZ2 LYS 506 14.037 12.545 4.054 127 HZ3 LYS 506 HZ3 LYS 506 13.381 12.961 5.502 128 H GLN 507 H GLN 507 7.524 8.124 3.407 129 HA GLN 507 HA GLN 507 5.519 10.206 3.885 130 HB2 GLN 507 HB2 GLN 507 5.046 7.997 1.926 131 HB3 GLN 507 HB3 GLN 507 4.742 9.729 1.772 132 HG2 GLN 507 HG2 GLN 507 7.376 8.243 1.487 133 HG3 GLN 507 HG3 GLN 507 6.479 9.058 0.212 134 HE21 GLN 507 HE21 GLN 507 9.286 9.426 1.107 135 HE22 GLN 507 HE22 GLN 507 9.435 11.098 1.548 136 H LEU 508 H LEU 508 6.179 7.473 5.471 137 HA LEU 508 HA LEU 508 3.456 6.249 5.478 138 HB2 LEU 508 HB2 LEU 508 6.256 5.292 6.174 139 HB3 LEU 508 HB3 LEU 508 4.814 4.352 6.522 140 HG LEU 508 HG LEU 508 4.374 3.948 4.212 141 HD11 LEU 508 HD11 LEU 508 6.572 5.933 3.547 142 HD12 LEU 508 HD12 LEU 508 5.847 4.790 2.393 143 HD13 LEU 508 HD13 LEU 508 4.836 6.042 3.117 144 HD21 LEU 508 HD21 LEU 508 6.194 2.685 5.368 145 HD22 LEU 508 HD22 LEU 508 6.398 2.763 3.604 146 HD23 LEU 508 HD23 LEU 508 7.376 3.806 4.668 147 HA PRO 509 HA PRO 509 3.156 7.465 9.799 148 HB2 PRO 509 HB2 PRO 509 1.460 5.482 10.699 149 HB3 PRO 509 HB3 PRO 509 0.933 6.921 9.790 150 HG2 PRO 509 HG2 PRO 509 1.486 4.119 8.790 151 HG3 PRO 509 HG3 PRO 509 0.118 5.188 8.342 152 HD2 PRO 509 HD2 PRO 509 2.339 4.866 6.760 153 HD3 PRO 509 HD3 PRO 509 1.470 6.428 6.861 154 H ALA 510 H ALA 510 3.640 6.602 11.912 155 HA ALA 510 HA ALA 510 6.034 5.124 11.964 156 HB1 ALA 510 HB1 ALA 510 3.976 5.762 14.113 157 HB2 ALA 510 HB2 ALA 510 5.655 5.250 14.434 158 HB3 ALA 510 HB3 ALA 510 5.320 6.806 13.621 159 H ASP 511 H ASP 511 2.704 4.001 11.973 160 HA ASP 511 HA ASP 511 3.408 1.402 13.137 161 HB2 ASP 511 HB2 ASP 511 1.217 2.562 13.541 162 HB3 ASP 511 HB3 ASP 511 0.829 2.374 11.825 163 H ILE 512 H ILE 512 3.706 2.857 10.072 164 HA ILE 512 HA ILE 512 3.845 0.134 8.852 165 HB ILE 512 HB ILE 512 3.565 2.836 7.503 166 HG12 ILE 512 HG12 ILE 512 1.671 0.483 7.910 167 HG13 ILE 512 HG13 ILE 512 1.506 2.098 8.607 168 HG21 ILE 512 HG21 ILE 512 4.906 1.209 6.159 169 HG22 ILE 512 HG22 ILE 512 3.595 0.024 6.316 170 HG23 ILE 512 HG23 ILE 512 3.348 1.544 5.414 171 HD11 ILE 512 HD11 ILE 512 1.318 3.030 6.267 172 HD12 ILE 512 HD12 ILE 512 1.270 1.362 5.656 173 HD13 ILE 512 HD13 ILE 512 -0.005 1.940 6.740 174 H GLN 513 H GLN 513 5.716 2.876 9.984 175 HA GLN 513 HA GLN 513 8.064 2.518 8.449 176 HB2 GLN 513 HB2 GLN 513 7.727 3.033 11.453 177 HB3 GLN 513 HB3 GLN 513 9.254 3.229 10.597 178 HG2 GLN 513 HG2 GLN 513 6.778 4.825 9.856 179 HG3 GLN 513 HG3 GLN 513 7.926 5.334 11.116 180 HE21 GLN 513 HE21 GLN 513 7.352 5.017 7.688 181 HE22 GLN 513 HE22 GLN 513 8.855 5.727 7.159 182 H GLU 514 H GLU 514 6.800 0.752 11.269 183 HA GLU 514 HA GLU 514 9.068 -0.975 11.572 184 HB2 GLU 514 HB2 GLU 514 7.620 -2.157 13.151 185 HB3 GLU 514 HB3 GLU 514 7.455 -0.401 13.367 186 HG2 GLU 514 HG2 GLU 514 5.376 -0.412 12.058 187 HG3 GLU 514 HG3 GLU 514 5.517 -2.162 11.826 188 H GLU 515 H GLU 515 6.560 -0.892 9.232 189 HA GLU 515 HA GLU 515 6.619 -3.809 8.756 190 HB2 GLU 515 HB2 GLU 515 5.116 -1.578 7.328 191 HB3 GLU 515 HB3 GLU 515 4.906 -3.311 7.062 192 HG2 GLU 515 HG2 GLU 515 4.382 -1.890 9.708 193 HG3 GLU 515 HG3 GLU 515 3.150 -2.275 8.510 194 H ILE 516 H ILE 516 8.283 -0.938 7.676 195 HA ILE 516 HA ILE 516 9.016 -2.320 5.137 196 HB ILE 516 HB ILE 516 9.946 0.443 5.904 197 HG12 ILE 516 HG12 ILE 516 7.666 0.865 6.163 198 HG13 ILE 516 HG13 ILE 516 8.040 1.331 4.504 199 HG21 ILE 516 HG21 ILE 516 10.944 -0.660 3.973 200 HG22 ILE 516 HG22 ILE 516 9.341 -0.956 3.265 201 HG23 ILE 516 HG23 ILE 516 9.944 0.709 3.437 202 HD11 ILE 516 HD11 ILE 516 6.581 -1.172 5.404 203 HD12 ILE 516 HD12 ILE 516 5.955 0.185 4.461 204 HD13 ILE 516 HD13 ILE 516 7.165 -0.908 3.735 205 H LEU 517 H LEU 517 10.304 -0.931 8.147 206 HA LEU 517 HA LEU 517 13.053 -1.570 7.736 207 HB2 LEU 517 HB2 LEU 517 11.307 -1.226 10.203 208 HB3 LEU 517 HB3 LEU 517 13.050 -1.480 10.303 209 HG LEU 517 HG LEU 517 11.796 0.763 8.661 210 HD11 LEU 517 HD11 LEU 517 12.292 2.246 10.546 211 HD12 LEU 517 HD12 LEU 517 11.155 0.977 11.045 212 HD13 LEU 517 HD13 LEU 517 12.873 0.866 11.507 213 HD21 LEU 517 HD21 LEU 517 14.601 0.411 9.820 214 HD22 LEU 517 HD22 LEU 517 14.171 0.142 8.120 215 HD23 LEU 517 HD23 LEU 517 14.039 1.764 8.820 216 H SER 518 H SER 518 10.356 -3.588 7.983 217 HA SER 518 HA SER 518 11.484 -5.825 9.379 218 HB2 SER 518 HB2 SER 518 9.344 -5.598 7.229 219 HB3 SER 518 HB3 SER 518 9.770 -7.127 8.027 220 HG SER 518 HG SER 518 8.916 -4.767 9.364 221 H GLY 519 H GLY 519 11.869 -4.627 6.025 222 HA2 GLY 519 HA2 GLY 519 13.954 -5.087 4.943 223 HA3 GLY 519 HA3 GLY 519 14.036 -6.654 5.763 224 H LYS 520 H LYS 520 11.236 -5.193 4.013 225 HA LYS 520 HA LYS 520 10.546 -7.586 2.695 226 HB2 LYS 520 HB2 LYS 520 9.790 -4.686 2.193 227 HB3 LYS 520 HB3 LYS 520 8.965 -6.109 1.517 228 HG2 LYS 520 HG2 LYS 520 8.645 -6.926 3.910 229 HG3 LYS 520 HG3 LYS 520 9.162 -5.317 4.446 230 HD2 LYS 520 HD2 LYS 520 6.788 -5.969 2.652 231 HD3 LYS 520 HD3 LYS 520 6.726 -5.456 4.350 232 HE2 LYS 520 HE2 LYS 520 7.806 -3.298 3.711 233 HE3 LYS 520 HE3 LYS 520 7.778 -3.809 2.014 234 HZ1 LYS 520 HZ1 LYS 520 5.364 -3.964 2.193 235 HZ2 LYS 520 HZ2 LYS 520 5.425 -3.432 3.743 236 HZ3 LYS 520 HZ3 LYS 520 5.886 -2.441 2.515 237 H SER 521 H SER 521 9.952 -7.223 0.330 238 HA SER 521 HA SER 521 12.294 -6.632 -1.377 239 HB2 SER 521 HB2 SER 521 12.660 -8.905 -0.370 240 HB3 SER 521 HB3 SER 521 11.143 -9.443 -1.110 241 HG SER 521 HG SER 521 13.009 -9.902 -2.385 242 H ARG 522 H ARG 522 11.477 -8.021 -3.602 243 HA ARG 522 HA ARG 522 10.179 -7.811 -5.430 244 HB2 ARG 522 HB2 ARG 522 8.529 -8.810 -3.533 245 HB3 ARG 522 HB3 ARG 522 7.682 -7.298 -3.866 246 HG2 ARG 522 HG2 ARG 522 6.695 -8.673 -5.444 247 HG3 ARG 522 HG3 ARG 522 8.045 -8.023 -6.400 248 HD2 ARG 522 HD2 ARG 522 7.987 -10.683 -4.899 249 HD3 ARG 522 HD3 ARG 522 7.806 -10.491 -6.644 250 HE ARG 522 HE ARG 522 10.283 -10.263 -5.055 251 HH11 ARG 522 HH11 ARG 522 8.718 -9.822 -8.198 252 HH12 ARG 522 HH12 ARG 522 10.240 -9.763 -9.061 253 HH21 ARG 522 HH21 ARG 522 12.239 -10.222 -6.227 254 HH22 ARG 522 HH22 ARG 522 12.214 -9.984 -7.957 255 H GLU 523 H GLU 523 11.245 -5.389 -3.937 256 HA GLU 523 HA GLU 523 9.859 -3.377 -5.603 257 HB2 GLU 523 HB2 GLU 523 9.824 -1.807 -3.703 258 HB3 GLU 523 HB3 GLU 523 8.742 -3.194 -3.478 259 HG2 GLU 523 HG2 GLU 523 10.483 -4.272 -2.012 260 HG3 GLU 523 HG3 GLU 523 11.478 -2.822 -2.179 261 H ASN 524 H ASN 524 11.229 -1.621 -6.223 262 HA ASN 524 HA ASN 524 14.092 -1.938 -5.492 263 HB2 ASN 524 HB2 ASN 524 13.410 -1.413 -8.359 264 HB3 ASN 524 HB3 ASN 524 14.748 -2.340 -7.689 265 HD21 ASN 524 HD21 ASN 524 13.490 -4.393 -6.314 266 HD22 ASN 524 HD22 ASN 524 12.314 -5.230 -7.321 267 H LEU 525 H LEU 525 11.906 0.019 -5.015 268 HA LEU 525 HA LEU 525 11.453 2.219 -5.125 269 HB2 LEU 525 HB2 LEU 525 13.195 3.462 -4.475 270 HB3 LEU 525 HB3 LEU 525 14.133 1.993 -4.635 271 HG LEU 525 HG LEU 525 14.279 2.924 -7.213 272 HD11 LEU 525 HD11 LEU 525 14.626 5.343 -7.127 273 HD12 LEU 525 HD12 LEU 525 13.019 5.009 -6.425 274 HD13 LEU 525 HD13 LEU 525 14.393 5.356 -5.361 275 HD21 LEU 525 HD21 LEU 525 16.513 3.731 -6.588 276 HD22 LEU 525 HD22 LEU 525 16.057 3.690 -4.866 277 HD23 LEU 525 HD23 LEU 525 16.139 2.179 -5.805 278 H LYS 526 H LYS 526 11.645 0.334 -7.587 279 HA LYS 526 HA LYS 526 10.984 2.404 -9.614 280 HB2 LYS 526 HB2 LYS 526 12.607 -0.150 -9.745 281 HB3 LYS 526 HB3 LYS 526 11.972 0.637 -11.218 282 HG2 LYS 526 HG2 LYS 526 13.261 2.640 -10.746 283 HG3 LYS 526 HG3 LYS 526 13.828 1.976 -9.195 284 HD2 LYS 526 HD2 LYS 526 14.260 0.522 -11.814 285 HD3 LYS 526 HD3 LYS 526 15.401 1.770 -11.257 286 HE2 LYS 526 HE2 LYS 526 14.671 -0.715 -9.633 287 HE3 LYS 526 HE3 LYS 526 16.076 -0.577 -10.695 288 HZ1 LYS 526 HZ1 LYS 526 16.796 1.311 -9.366 289 HZ2 LYS 526 HZ2 LYS 526 15.530 1.084 -8.334 290 HZ3 LYS 526 HZ3 LYS 526 16.692 -0.064 -8.477 291 H1 MET 1 H1 MET 1 -13.770 11.460 -13.593 292 H2 MET 1 H2 MET 1 -12.502 12.353 -14.136 293 H3 MET 1 H3 MET 1 -13.858 13.105 -13.585 294 HA MET 1 HA MET 1 -12.086 13.238 -11.968 295 HB2 MET 1 HB2 MET 1 -14.341 13.238 -11.070 296 HB3 MET 1 HB3 MET 1 -14.463 11.474 -11.236 297 HG2 MET 1 HG2 MET 1 -12.703 11.147 -9.581 298 HG3 MET 1 HG3 MET 1 -12.425 12.890 -9.477 299 HE1 MET 1 HE1 MET 1 -12.539 12.918 -6.908 300 HE2 MET 1 HE2 MET 1 -13.824 12.146 -5.949 301 HE3 MET 1 HE3 MET 1 -12.723 11.149 -6.929 302 H GLN 2 H GLN 2 -10.381 12.382 -10.973 303 HA GLN 2 HA GLN 2 -10.134 9.520 -10.606 304 HB2 GLN 2 HB2 GLN 2 -8.186 9.221 -12.018 305 HB3 GLN 2 HB3 GLN 2 -9.456 9.967 -13.012 306 HG2 GLN 2 HG2 GLN 2 -8.292 12.215 -12.121 307 HG3 GLN 2 HG3 GLN 2 -6.926 11.159 -11.859 308 HE21 GLN 2 HE21 GLN 2 -5.620 12.130 -13.473 309 HE22 GLN 2 HE22 GLN 2 -5.984 12.010 -15.186 310 H ILE 3 H ILE 3 -7.853 9.095 -9.661 311 HA ILE 3 HA ILE 3 -6.738 11.444 -8.242 312 HB ILE 3 HB ILE 3 -6.737 10.421 -6.126 313 HG12 ILE 3 HG12 ILE 3 -7.362 7.839 -7.564 314 HG13 ILE 3 HG13 ILE 3 -6.066 8.248 -6.448 315 HG21 ILE 3 HG21 ILE 3 -9.456 9.770 -7.330 316 HG22 ILE 3 HG22 ILE 3 -9.105 10.126 -5.619 317 HG23 ILE 3 HG23 ILE 3 -8.911 11.393 -6.838 318 HD11 ILE 3 HD11 ILE 3 -9.006 7.857 -5.741 319 HD12 ILE 3 HD12 ILE 3 -7.657 6.787 -5.332 320 HD13 ILE 3 HD13 ILE 3 -7.758 8.405 -4.598 321 H PHE 4 H PHE 4 -4.633 10.637 -7.071 322 HA PHE 4 HA PHE 4 -3.262 8.651 -8.835 323 HB2 PHE 4 HB2 PHE 4 -2.057 11.159 -7.603 324 HB3 PHE 4 HB3 PHE 4 -1.253 10.019 -8.627 325 HD1 PHE 4 HD1 PHE 4 -2.452 9.629 -11.035 326 HD2 PHE 4 HD2 PHE 4 -3.005 13.096 -8.541 327 HE1 PHE 4 HE1 PHE 4 -3.204 10.940 -13.005 328 HE2 PHE 4 HE2 PHE 4 -3.775 14.384 -10.510 329 HZ PHE 4 HZ PHE 4 -3.872 13.313 -12.740 330 H VAL 5 H VAL 5 -2.722 6.898 -7.693 331 HA VAL 5 HA VAL 5 -2.314 7.232 -4.753 332 HB VAL 5 HB VAL 5 -3.174 4.767 -6.314 333 HG11 VAL 5 HG11 VAL 5 -2.959 5.383 -3.337 334 HG12 VAL 5 HG12 VAL 5 -3.639 3.889 -4.030 335 HG13 VAL 5 HG13 VAL 5 -1.921 4.269 -4.257 336 HG21 VAL 5 HG21 VAL 5 -4.962 6.478 -6.315 337 HG22 VAL 5 HG22 VAL 5 -5.366 5.167 -5.197 338 HG23 VAL 5 HG23 VAL 5 -4.755 6.714 -4.567 339 H LYS 6 H LYS 6 -0.186 7.509 -4.440 340 HA LYS 6 HA LYS 6 1.745 6.301 -6.255 341 HB2 LYS 6 HB2 LYS 6 1.838 8.664 -5.293 342 HB3 LYS 6 HB3 LYS 6 2.291 7.931 -3.743 343 HG2 LYS 6 HG2 LYS 6 4.275 6.906 -4.805 344 HG3 LYS 6 HG3 LYS 6 3.731 7.485 -6.393 345 HD2 LYS 6 HD2 LYS 6 5.467 8.957 -5.626 346 HD3 LYS 6 HD3 LYS 6 3.924 9.833 -5.576 347 HE2 LYS 6 HE2 LYS 6 3.750 9.383 -3.145 348 HE3 LYS 6 HE3 LYS 6 5.287 8.495 -3.200 349 HZ1 LYS 6 HZ1 LYS 6 4.936 11.344 -3.853 350 HZ2 LYS 6 HZ2 LYS 6 5.593 10.752 -2.468 351 HZ3 LYS 6 HZ3 LYS 6 6.358 10.527 -3.901 352 H THR 7 H THR 7 3.063 4.613 -5.893 353 HA THR 7 HA THR 7 2.408 2.801 -3.714 354 HB THR 7 HB THR 7 4.001 1.323 -4.870 355 HG1 THR 7 HG1 THR 7 5.081 2.108 -6.664 356 HG21 THR 7 HG21 THR 7 1.658 1.536 -5.704 357 HG22 THR 7 HG22 THR 7 2.190 2.794 -6.836 358 HG23 THR 7 HG23 THR 7 2.810 1.137 -7.001 359 H LEU 8 H LEU 8 4.325 1.602 -2.708 360 HA LEU 8 HA LEU 8 5.877 3.355 -1.094 361 HB2 LEU 8 HB2 LEU 8 5.021 1.152 -0.422 362 HB3 LEU 8 HB3 LEU 8 6.041 0.359 -1.623 363 HG LEU 8 HG LEU 8 8.045 0.935 -0.462 364 HD11 LEU 8 HD11 LEU 8 8.004 2.200 1.697 365 HD12 LEU 8 HD12 LEU 8 7.525 3.212 0.327 366 HD13 LEU 8 HD13 LEU 8 6.282 2.568 1.428 367 HD21 LEU 8 HD21 LEU 8 6.030 0.085 1.635 368 HD22 LEU 8 HD22 LEU 8 6.738 -0.988 0.392 369 HD23 LEU 8 HD23 LEU 8 7.781 -0.237 1.613 370 H THR 9 H THR 9 6.271 2.889 -4.299 371 HA THR 9 HA THR 9 9.251 2.962 -4.129 372 HB THR 9 HB THR 9 9.293 1.948 -6.380 373 HG1 THR 9 HG1 THR 9 7.213 2.501 -7.065 374 HG21 THR 9 HG21 THR 9 8.705 -0.330 -5.662 375 HG22 THR 9 HG22 THR 9 9.500 0.550 -4.335 376 HG23 THR 9 HG23 THR 9 7.739 0.318 -4.323 377 H GLY 10 H GLY 10 6.753 5.004 -4.437 378 HA2 GLY 10 HA2 GLY 10 6.909 7.227 -4.968 379 HA3 GLY 10 HA3 GLY 10 8.514 6.952 -5.673 380 H LYS 11 H LYS 11 5.723 5.055 -6.714 381 HA LYS 11 HA LYS 11 5.546 6.648 -9.252 382 HB2 LYS 11 HB2 LYS 11 6.831 4.545 -9.377 383 HB3 LYS 11 HB3 LYS 11 5.386 3.637 -8.894 384 HG2 LYS 11 HG2 LYS 11 5.127 5.633 -11.128 385 HG3 LYS 11 HG3 LYS 11 5.976 4.100 -11.464 386 HD2 LYS 11 HD2 LYS 11 4.004 2.840 -10.637 387 HD3 LYS 11 HD3 LYS 11 3.128 4.351 -10.369 388 HE2 LYS 11 HE2 LYS 11 4.218 3.328 -13.004 389 HE3 LYS 11 HE3 LYS 11 2.501 3.372 -12.498 390 HZ1 LYS 11 HZ1 LYS 11 2.648 5.755 -12.460 391 HZ2 LYS 11 HZ2 LYS 11 4.228 5.720 -12.927 392 HZ3 LYS 11 HZ3 LYS 11 3.058 5.191 -13.947 393 H THR 12 H THR 12 3.468 7.020 -10.024 394 HA THR 12 HA THR 12 1.324 6.100 -8.166 395 HB THR 12 HB THR 12 2.185 8.627 -8.334 396 HG1 THR 12 HG1 THR 12 0.639 7.960 -6.907 397 HG21 THR 12 HG21 THR 12 1.568 8.909 -10.725 398 HG22 THR 12 HG22 THR 12 -0.128 8.528 -10.310 399 HG23 THR 12 HG23 THR 12 0.626 9.981 -9.650 400 H ILE 13 H ILE 13 -0.814 6.000 -9.015 401 HA ILE 13 HA ILE 13 -0.912 5.325 -11.919 402 HB ILE 13 HB ILE 13 -2.086 3.742 -9.602 403 HG12 ILE 13 HG12 ILE 13 0.257 3.111 -11.454 404 HG13 ILE 13 HG13 ILE 13 0.374 3.504 -9.738 405 HG21 ILE 13 HG21 ILE 13 -3.447 3.684 -11.697 406 HG22 ILE 13 HG22 ILE 13 -2.016 3.124 -12.591 407 HG23 ILE 13 HG23 ILE 13 -2.742 2.108 -11.322 408 HD11 ILE 13 HD11 ILE 13 -0.960 1.036 -10.909 409 HD12 ILE 13 HD12 ILE 13 0.552 1.120 -9.986 410 HD13 ILE 13 HD13 ILE 13 -0.990 1.500 -9.187 411 H THR 14 H THR 14 -2.630 6.190 -12.947 412 HA THR 14 HA THR 14 -4.355 8.011 -11.480 413 HB THR 14 HB THR 14 -4.520 7.121 -14.392 414 HG1 THR 14 HG1 THR 14 -3.145 8.865 -14.770 415 HG21 THR 14 HG21 THR 14 -6.436 8.419 -13.538 416 HG22 THR 14 HG22 THR 14 -5.316 9.651 -12.898 417 HG23 THR 14 HG23 THR 14 -5.468 9.398 -14.660 418 H LEU 15 H LEU 15 -6.432 7.588 -10.768 419 HA LEU 15 HA LEU 15 -7.721 5.060 -11.683 420 HB2 LEU 15 HB2 LEU 15 -7.383 5.939 -8.795 421 HB3 LEU 15 HB3 LEU 15 -8.219 4.485 -9.350 422 HG LEU 15 HG LEU 15 -5.264 5.047 -9.798 423 HD11 LEU 15 HD11 LEU 15 -4.861 3.477 -7.960 424 HD12 LEU 15 HD12 LEU 15 -5.884 4.815 -7.389 425 HD13 LEU 15 HD13 LEU 15 -6.613 3.232 -7.748 426 HD21 LEU 15 HD21 LEU 15 -6.856 2.464 -10.053 427 HD22 LEU 15 HD22 LEU 15 -6.212 3.415 -11.404 428 HD23 LEU 15 HD23 LEU 15 -5.097 2.654 -10.237 429 H GLU 16 H GLU 16 -9.792 5.297 -12.064 430 HA GLU 16 HA GLU 16 -11.145 7.855 -11.468 431 HB2 GLU 16 HB2 GLU 16 -11.350 6.960 -13.710 432 HB3 GLU 16 HB3 GLU 16 -11.812 5.361 -13.088 433 HG2 GLU 16 HG2 GLU 16 -13.871 6.259 -12.171 434 HG3 GLU 16 HG3 GLU 16 -13.443 7.901 -12.688 435 H VAL 17 H VAL 17 -12.506 8.147 -9.879 436 HA VAL 17 HA VAL 17 -13.862 5.886 -8.547 437 HB VAL 17 HB VAL 17 -13.072 6.601 -6.329 438 HG11 VAL 17 HG11 VAL 17 -10.781 5.772 -6.434 439 HG12 VAL 17 HG12 VAL 17 -11.838 4.796 -7.481 440 HG13 VAL 17 HG13 VAL 17 -10.731 6.004 -8.188 441 HG21 VAL 17 HG21 VAL 17 -11.193 8.446 -7.859 442 HG22 VAL 17 HG22 VAL 17 -12.574 8.963 -6.857 443 HG23 VAL 17 HG23 VAL 17 -11.183 8.155 -6.108 444 H GLU 18 H GLU 18 -15.152 6.896 -6.600 445 HA GLU 18 HA GLU 18 -16.188 9.614 -7.251 446 HB2 GLU 18 HB2 GLU 18 -17.766 7.139 -6.424 447 HB3 GLU 18 HB3 GLU 18 -18.442 8.753 -6.644 448 HG2 GLU 18 HG2 GLU 18 -17.117 7.091 -8.831 449 HG3 GLU 18 HG3 GLU 18 -18.851 7.211 -8.538 450 HA PRO 19 HA PRO 19 -15.605 10.337 -2.931 451 HB2 PRO 19 HB2 PRO 19 -18.395 11.397 -2.724 452 HB3 PRO 19 HB3 PRO 19 -16.853 12.187 -2.296 453 HG2 PRO 19 HG2 PRO 19 -18.198 12.876 -4.572 454 HG3 PRO 19 HG3 PRO 19 -16.409 12.780 -4.531 455 HD2 PRO 19 HD2 PRO 19 -18.371 10.749 -5.595 456 HD3 PRO 19 HD3 PRO 19 -16.817 11.302 -6.295 457 H SER 20 H SER 20 -17.702 7.943 -4.034 458 HA SER 20 HA SER 20 -18.493 7.137 -1.291 459 HB2 SER 20 HB2 SER 20 -20.452 6.106 -2.473 460 HB3 SER 20 HB3 SER 20 -20.449 7.887 -2.491 461 HG SER 20 HG SER 20 -20.905 6.967 -4.549 462 H ASP 21 H ASP 21 -16.551 6.483 -3.966 463 HA ASP 21 HA ASP 21 -16.650 3.562 -3.843 464 HB2 ASP 21 HB2 ASP 21 -14.762 5.571 -5.064 465 HB3 ASP 21 HB3 ASP 21 -14.538 3.822 -5.211 466 H THR 22 H THR 22 -16.541 3.735 -1.506 467 HA THR 22 HA THR 22 -14.317 4.699 -0.017 468 HB THR 22 HB THR 22 -16.332 4.363 1.122 469 HG1 THR 22 HG1 THR 22 -15.688 3.071 2.795 470 HG21 THR 22 HG21 THR 22 -17.389 2.174 1.468 471 HG22 THR 22 HG22 THR 22 -17.470 2.751 -0.201 472 HG23 THR 22 HG23 THR 22 -16.295 1.477 0.237 473 H ILE 23 H ILE 23 -13.066 2.987 1.495 474 HA ILE 23 HA ILE 23 -10.941 2.260 -0.118 475 HB ILE 23 HB ILE 23 -11.571 1.029 2.565 476 HG12 ILE 23 HG12 ILE 23 -11.898 3.378 2.843 477 HG13 ILE 23 HG13 ILE 23 -10.284 2.997 3.458 478 HG21 ILE 23 HG21 ILE 23 -8.970 1.675 1.116 479 HG22 ILE 23 HG22 ILE 23 -9.103 1.067 2.788 480 HG23 ILE 23 HG23 ILE 23 -9.651 0.062 1.432 481 HD11 ILE 23 HD11 ILE 23 -10.944 4.269 0.759 482 HD12 ILE 23 HD12 ILE 23 -10.249 5.077 2.162 483 HD13 ILE 23 HD13 ILE 23 -9.304 3.835 1.302 484 H GLU 24 H GLU 24 -13.743 0.153 0.681 485 HA GLU 24 HA GLU 24 -12.375 -2.233 -0.211 486 HB2 GLU 24 HB2 GLU 24 -14.534 -3.292 -0.124 487 HB3 GLU 24 HB3 GLU 24 -14.353 -2.237 1.297 488 HG2 GLU 24 HG2 GLU 24 -15.696 -0.499 0.174 489 HG3 GLU 24 HG3 GLU 24 -15.886 -1.547 -1.242 490 H ASN 25 H ASN 25 -13.862 0.421 -1.865 491 HA ASN 25 HA ASN 25 -14.294 -1.019 -4.358 492 HB2 ASN 25 HB2 ASN 25 -14.417 1.929 -3.677 493 HB3 ASN 25 HB3 ASN 25 -14.890 1.249 -5.218 494 HD21 ASN 25 HD21 ASN 25 -15.729 1.681 -1.951 495 HD22 ASN 25 HD22 ASN 25 -17.325 0.914 -1.979 496 H VAL 26 H VAL 26 -11.989 1.452 -3.017 497 HA VAL 26 HA VAL 26 -10.573 1.856 -5.478 498 HB VAL 26 HB VAL 26 -8.775 2.705 -3.728 499 HG11 VAL 26 HG11 VAL 26 -10.014 4.843 -3.615 500 HG12 VAL 26 HG12 VAL 26 -10.130 4.115 -5.232 501 HG13 VAL 26 HG13 VAL 26 -11.508 4.010 -4.110 502 HG21 VAL 26 HG21 VAL 26 -11.252 2.651 -2.030 503 HG22 VAL 26 HG22 VAL 26 -9.782 1.643 -1.797 504 HG23 VAL 26 HG23 VAL 26 -9.694 3.413 -1.645 505 H LYS 27 H LYS 27 -10.212 -0.487 -2.804 506 HA LYS 27 HA LYS 27 -7.730 -1.571 -3.545 507 HB2 LYS 27 HB2 LYS 27 -10.286 -2.684 -2.355 508 HB3 LYS 27 HB3 LYS 27 -8.863 -3.713 -2.635 509 HG2 LYS 27 HG2 LYS 27 -7.475 -2.360 -1.220 510 HG3 LYS 27 HG3 LYS 27 -8.712 -1.098 -1.089 511 HD2 LYS 27 HD2 LYS 27 -10.209 -2.633 0.106 512 HD3 LYS 27 HD3 LYS 27 -9.027 -3.954 -0.072 513 HE2 LYS 27 HE2 LYS 27 -7.370 -2.669 1.192 514 HE3 LYS 27 HE3 LYS 27 -8.473 -1.302 1.322 515 HZ1 LYS 27 HZ1 LYS 27 -9.980 -2.680 2.573 516 HZ2 LYS 27 HZ2 LYS 27 -8.962 -3.973 2.463 517 HZ3 LYS 27 HZ3 LYS 27 -8.515 -2.636 3.311 518 H ALA 28 H ALA 28 -10.899 -1.833 -5.164 519 HA ALA 28 HA ALA 28 -9.974 -3.981 -6.904 520 HB1 ALA 28 HB1 ALA 28 -12.381 -2.127 -7.160 521 HB2 ALA 28 HB2 ALA 28 -12.096 -3.625 -8.062 522 HB3 ALA 28 HB3 ALA 28 -12.371 -3.687 -6.304 523 H LYS 29 H LYS 29 -10.002 -0.423 -6.966 524 HA LYS 29 HA LYS 29 -9.516 -0.166 -9.805 525 HB2 LYS 29 HB2 LYS 29 -9.109 1.658 -7.417 526 HB3 LYS 29 HB3 LYS 29 -8.532 2.096 -9.020 527 HG2 LYS 29 HG2 LYS 29 -10.665 3.103 -8.622 528 HG3 LYS 29 HG3 LYS 29 -10.792 1.937 -9.951 529 HD2 LYS 29 HD2 LYS 29 -11.993 0.385 -8.628 530 HD3 LYS 29 HD3 LYS 29 -11.417 1.127 -7.115 531 HE2 LYS 29 HE2 LYS 29 -13.768 1.625 -7.466 532 HE3 LYS 29 HE3 LYS 29 -12.797 3.098 -7.483 533 HZ1 LYS 29 HZ1 LYS 29 -12.901 3.117 -9.861 534 HZ2 LYS 29 HZ2 LYS 29 -13.742 1.707 -9.900 535 HZ3 LYS 29 HZ3 LYS 29 -14.423 3.058 -9.255 536 H ILE 30 H ILE 30 -7.457 -0.655 -6.926 537 HA ILE 30 HA ILE 30 -5.003 -0.174 -8.460 538 HB ILE 30 HB ILE 30 -5.572 -1.048 -5.598 539 HG12 ILE 30 HG12 ILE 30 -4.592 1.627 -6.688 540 HG13 ILE 30 HG13 ILE 30 -6.285 1.282 -6.321 541 HG21 ILE 30 HG21 ILE 30 -2.939 -0.211 -6.896 542 HG22 ILE 30 HG22 ILE 30 -3.185 -0.511 -5.158 543 HG23 ILE 30 HG23 ILE 30 -3.342 -1.840 -6.310 544 HD11 ILE 30 HD11 ILE 30 -5.290 2.485 -4.476 545 HD12 ILE 30 HD12 ILE 30 -5.700 0.844 -3.952 546 HD13 ILE 30 HD13 ILE 30 -4.004 1.275 -4.307 547 H GLN 31 H GLN 31 -7.021 -2.855 -7.334 548 HA GLN 31 HA GLN 31 -5.145 -4.962 -7.902 549 HB2 GLN 31 HB2 GLN 31 -7.124 -5.379 -6.521 550 HB3 GLN 31 HB3 GLN 31 -8.191 -4.824 -7.823 551 HG2 GLN 31 HG2 GLN 31 -7.527 -6.663 -9.259 552 HG3 GLN 31 HG3 GLN 31 -6.289 -7.177 -8.125 553 HE21 GLN 31 HE21 GLN 31 -7.050 -9.223 -7.589 554 HE22 GLN 31 HE22 GLN 31 -8.592 -9.503 -6.796 555 H ASP 32 H ASP 32 -7.622 -3.199 -9.812 556 HA ASP 32 HA ASP 32 -7.572 -4.975 -12.031 557 HB2 ASP 32 HB2 ASP 32 -9.354 -3.342 -11.506 558 HB3 ASP 32 HB3 ASP 32 -8.229 -2.021 -11.706 559 H LYS 33 H LYS 33 -5.641 -2.254 -11.053 560 HA LYS 33 HA LYS 33 -4.436 -1.764 -13.655 561 HB2 LYS 33 HB2 LYS 33 -4.168 -0.717 -10.832 562 HB3 LYS 33 HB3 LYS 33 -3.053 -0.176 -12.105 563 HG2 LYS 33 HG2 LYS 33 -6.084 -0.063 -12.405 564 HG3 LYS 33 HG3 LYS 33 -5.131 1.268 -11.720 565 HD2 LYS 33 HD2 LYS 33 -3.779 1.401 -13.757 566 HD3 LYS 33 HD3 LYS 33 -4.733 0.104 -14.504 567 HE2 LYS 33 HE2 LYS 33 -5.857 2.755 -13.505 568 HE3 LYS 33 HE3 LYS 33 -5.457 2.406 -15.192 569 HZ1 LYS 33 HZ1 LYS 33 -7.069 0.617 -15.144 570 HZ2 LYS 33 HZ2 LYS 33 -7.444 0.945 -13.580 571 HZ3 LYS 33 HZ3 LYS 33 -7.785 2.044 -14.749 572 H GLU 34 H GLU 34 -3.581 -3.736 -10.858 573 HA GLU 34 HA GLU 34 -1.039 -4.373 -12.283 574 HB2 GLU 34 HB2 GLU 34 -1.277 -3.753 -9.313 575 HB3 GLU 34 HB3 GLU 34 0.162 -4.409 -10.113 576 HG2 GLU 34 HG2 GLU 34 0.224 -2.396 -11.588 577 HG3 GLU 34 HG3 GLU 34 -1.128 -1.709 -10.671 578 H GLY 35 H GLY 35 -3.540 -5.407 -9.950 579 HA2 GLY 35 HA2 GLY 35 -4.379 -7.674 -10.263 580 HA3 GLY 35 HA3 GLY 35 -2.706 -8.234 -10.469 581 H ILE 36 H ILE 36 -2.990 -5.770 -8.132 582 HA ILE 36 HA ILE 36 -2.080 -7.574 -6.057 583 HB ILE 36 HB ILE 36 -2.746 -4.600 -6.094 584 HG12 ILE 36 HG12 ILE 36 -0.059 -6.046 -6.179 585 HG13 ILE 36 HG13 ILE 36 -0.894 -5.447 -7.616 586 HG21 ILE 36 HG21 ILE 36 -1.192 -6.236 -4.046 587 HG22 ILE 36 HG22 ILE 36 -1.471 -4.479 -3.992 588 HG23 ILE 36 HG23 ILE 36 -2.835 -5.600 -3.808 589 HD11 ILE 36 HD11 ILE 36 -0.852 -3.145 -6.673 590 HD12 ILE 36 HD12 ILE 36 0.070 -3.749 -5.276 591 HD13 ILE 36 HD13 ILE 36 0.778 -3.825 -6.901 592 HA PRO 37 HA PRO 37 -6.236 -8.423 -4.747 593 HB2 PRO 37 HB2 PRO 37 -5.725 -9.770 -2.410 594 HB3 PRO 37 HB3 PRO 37 -5.413 -10.464 -4.029 595 HG2 PRO 37 HG2 PRO 37 -3.450 -9.102 -2.171 596 HG3 PRO 37 HG3 PRO 37 -3.246 -10.651 -3.055 597 HD2 PRO 37 HD2 PRO 37 -2.233 -8.285 -3.976 598 HD3 PRO 37 HD3 PRO 37 -2.876 -9.520 -5.106 599 HA PRO 38 HA PRO 38 -7.358 -5.290 -1.802 600 HB2 PRO 38 HB2 PRO 38 -9.655 -6.368 -0.734 601 HB3 PRO 38 HB3 PRO 38 -9.565 -5.715 -2.396 602 HG2 PRO 38 HG2 PRO 38 -9.326 -8.610 -1.522 603 HG3 PRO 38 HG3 PRO 38 -10.323 -7.926 -2.853 604 HD2 PRO 38 HD2 PRO 38 -7.893 -9.058 -3.306 605 HD3 PRO 38 HD3 PRO 38 -8.425 -7.617 -4.225 606 H ASP 39 H ASP 39 -6.532 -8.530 -1.016 607 HA ASP 39 HA ASP 39 -6.893 -8.239 1.850 608 HB2 ASP 39 HB2 ASP 39 -7.316 -10.355 0.610 609 HB3 ASP 39 HB3 ASP 39 -5.601 -10.434 0.199 610 H GLN 40 H GLN 40 -4.423 -7.240 -0.330 611 HA GLN 40 HA GLN 40 -2.444 -7.350 1.904 612 HB2 GLN 40 HB2 GLN 40 -1.985 -7.757 -1.064 613 HB3 GLN 40 HB3 GLN 40 -0.714 -7.547 0.148 614 HG2 GLN 40 HG2 GLN 40 -1.731 -9.501 1.424 615 HG3 GLN 40 HG3 GLN 40 -2.761 -9.791 0.004 616 HE21 GLN 40 HE21 GLN 40 -1.278 -9.591 -2.161 617 HE22 GLN 40 HE22 GLN 40 0.131 -10.634 -2.118 618 H GLN 41 H GLN 41 -4.129 -5.220 -0.300 619 HA GLN 41 HA GLN 41 -2.116 -3.162 -0.374 620 HB2 GLN 41 HB2 GLN 41 -5.146 -3.101 -0.594 621 HB3 GLN 41 HB3 GLN 41 -4.090 -1.712 -0.911 622 HG2 GLN 41 HG2 GLN 41 -2.988 -2.915 -2.742 623 HG3 GLN 41 HG3 GLN 41 -3.936 -4.371 -2.380 624 HE21 GLN 41 HE21 GLN 41 -5.194 -4.549 -4.258 625 HE22 GLN 41 HE22 GLN 41 -6.368 -3.338 -4.699 626 H ARG 42 H ARG 42 -2.253 -1.092 0.682 627 HA ARG 42 HA ARG 42 -3.913 -0.744 3.062 628 HB2 ARG 42 HB2 ARG 42 -1.857 -2.021 3.818 629 HB3 ARG 42 HB3 ARG 42 -0.869 -0.651 3.289 630 HG2 ARG 42 HG2 ARG 42 -1.988 0.813 4.909 631 HG3 ARG 42 HG3 ARG 42 -3.142 -0.480 5.321 632 HD2 ARG 42 HD2 ARG 42 -1.281 -1.889 6.118 633 HD3 ARG 42 HD3 ARG 42 -0.129 -0.585 5.744 634 HE ARG 42 HE ARG 42 -2.105 0.520 7.415 635 HH11 ARG 42 HH11 ARG 42 0.376 -2.002 7.663 636 HH12 ARG 42 HH12 ARG 42 0.594 -1.755 9.380 637 HH21 ARG 42 HH21 ARG 42 -1.803 0.797 9.618 638 HH22 ARG 42 HH22 ARG 42 -0.620 -0.149 10.486 639 H LEU 43 H LEU 43 -4.523 1.417 3.064 640 HA LEU 43 HA LEU 43 -3.047 3.154 1.133 641 HB2 LEU 43 HB2 LEU 43 -5.533 1.973 0.833 642 HB3 LEU 43 HB3 LEU 43 -5.958 3.584 1.417 643 HG LEU 43 HG LEU 43 -4.137 2.967 -0.954 644 HD11 LEU 43 HD11 LEU 43 -7.049 3.866 -0.865 645 HD12 LEU 43 HD12 LEU 43 -6.063 3.661 -2.331 646 HD13 LEU 43 HD13 LEU 43 -6.479 2.253 -1.326 647 HD21 LEU 43 HD21 LEU 43 -3.658 5.184 -0.002 648 HD22 LEU 43 HD22 LEU 43 -4.532 5.359 -1.532 649 HD23 LEU 43 HD23 LEU 43 -5.397 5.573 0.007 650 H ILE 44 H ILE 44 -2.771 5.283 1.628 651 HA ILE 44 HA ILE 44 -3.737 6.304 4.252 652 HB ILE 44 HB ILE 44 -0.876 6.189 3.220 653 HG12 ILE 44 HG12 ILE 44 -0.641 5.414 5.742 654 HG13 ILE 44 HG13 ILE 44 -2.355 5.051 5.608 655 HG21 ILE 44 HG21 ILE 44 -1.871 7.694 5.676 656 HG22 ILE 44 HG22 ILE 44 -0.200 7.546 5.134 657 HG23 ILE 44 HG23 ILE 44 -1.339 8.476 4.164 658 HD11 ILE 44 HD11 ILE 44 -1.832 3.504 3.690 659 HD12 ILE 44 HD12 ILE 44 -0.113 3.909 3.884 660 HD13 ILE 44 HD13 ILE 44 -1.002 3.067 5.180 661 H PHE 45 H PHE 45 -3.857 8.581 4.345 662 HA PHE 45 HA PHE 45 -3.405 10.211 1.921 663 HB2 PHE 45 HB2 PHE 45 -5.650 9.384 1.578 664 HB3 PHE 45 HB3 PHE 45 -6.070 9.639 3.266 665 HD1 PHE 45 HD1 PHE 45 -6.457 11.871 4.206 666 HD2 PHE 45 HD2 PHE 45 -5.784 11.275 0.003 667 HE1 PHE 45 HE1 PHE 45 -7.435 14.097 3.736 668 HE2 PHE 45 HE2 PHE 45 -6.788 13.490 -0.468 669 HZ PHE 45 HZ PHE 45 -7.562 14.928 1.399 670 H ALA 46 H ALA 46 -2.985 12.319 2.444 671 HA ALA 46 HA ALA 46 -2.073 13.920 3.739 672 HB1 ALA 46 HB1 ALA 46 -4.594 13.446 5.370 673 HB2 ALA 46 HB2 ALA 46 -3.596 14.917 5.388 674 HB3 ALA 46 HB3 ALA 46 -4.464 14.452 3.907 675 H GLY 47 H GLY 47 -1.668 10.930 4.619 676 HA2 GLY 47 HA2 GLY 47 0.115 10.222 5.967 677 HA3 GLY 47 HA3 GLY 47 -0.062 11.633 7.006 678 H LYS 48 H LYS 48 -3.111 10.030 6.288 679 HA LYS 48 HA LYS 48 -2.728 8.265 8.642 680 HB2 LYS 48 HB2 LYS 48 -4.960 8.695 9.467 681 HB3 LYS 48 HB3 LYS 48 -3.960 10.147 9.464 682 HG2 LYS 48 HG2 LYS 48 -6.054 10.847 8.783 683 HG3 LYS 48 HG3 LYS 48 -5.055 10.814 7.317 684 HD2 LYS 48 HD2 LYS 48 -6.185 8.728 6.603 685 HD3 LYS 48 HD3 LYS 48 -7.183 8.718 8.067 686 HE2 LYS 48 HE2 LYS 48 -7.111 10.948 6.005 687 HE3 LYS 48 HE3 LYS 48 -8.338 9.673 6.090 688 HZ1 LYS 48 HZ1 LYS 48 -9.082 11.670 7.176 689 HZ2 LYS 48 HZ2 LYS 48 -8.917 10.467 8.287 690 HZ3 LYS 48 HZ3 LYS 48 -7.792 11.661 8.195 691 H GLN 49 H GLN 49 -4.203 6.523 8.741 692 HA GLN 49 HA GLN 49 -4.346 5.294 6.061 693 HB2 GLN 49 HB2 GLN 49 -3.122 4.166 7.870 694 HB3 GLN 49 HB3 GLN 49 -4.575 4.167 8.876 695 HG2 GLN 49 HG2 GLN 49 -5.730 2.745 7.182 696 HG3 GLN 49 HG3 GLN 49 -4.262 2.747 6.187 697 HE21 GLN 49 HE21 GLN 49 -5.528 0.389 7.137 698 HE22 GLN 49 HE22 GLN 49 -4.456 -0.391 8.278 699 H LEU 50 H LEU 50 -6.201 4.117 5.420 700 HA LEU 50 HA LEU 50 -8.664 5.559 6.285 701 HB2 LEU 50 HB2 LEU 50 -8.205 4.251 3.591 702 HB3 LEU 50 HB3 LEU 50 -9.381 5.497 4.041 703 HG LEU 50 HG LEU 50 -6.353 5.849 3.902 704 HD11 LEU 50 HD11 LEU 50 -8.567 6.923 2.117 705 HD12 LEU 50 HD12 LEU 50 -6.835 7.281 1.968 706 HD13 LEU 50 HD13 LEU 50 -7.430 5.626 1.693 707 HD21 LEU 50 HD21 LEU 50 -7.617 7.291 5.628 708 HD22 LEU 50 HD22 LEU 50 -6.679 8.147 4.399 709 HD23 LEU 50 HD23 LEU 50 -8.447 8.017 4.231 710 H GLU 51 H GLU 51 -10.748 4.334 5.969 711 HA GLU 51 HA GLU 51 -10.355 1.454 6.660 712 HB2 GLU 51 HB2 GLU 51 -11.770 3.685 8.084 713 HB3 GLU 51 HB3 GLU 51 -12.464 2.057 8.165 714 HG2 GLU 51 HG2 GLU 51 -10.338 1.157 9.003 715 HG3 GLU 51 HG3 GLU 51 -9.590 2.755 8.872 716 H ASP 52 H ASP 52 -11.901 0.032 6.034 717 HA ASP 52 HA ASP 52 -13.272 0.639 3.593 718 HB2 ASP 52 HB2 ASP 52 -13.414 -1.784 5.430 719 HB3 ASP 52 HB3 ASP 52 -13.978 -1.711 3.759 720 H GLY 53 H GLY 53 -14.130 1.476 6.672 721 HA2 GLY 53 HA2 GLY 53 -17.033 1.008 6.226 722 HA3 GLY 53 HA3 GLY 53 -16.260 1.249 7.807 723 H ARG 54 H ARG 54 -14.914 3.265 5.388 724 HA ARG 54 HA ARG 54 -16.522 5.615 6.266 725 HB2 ARG 54 HB2 ARG 54 -13.725 5.543 5.155 726 HB3 ARG 54 HB3 ARG 54 -14.505 6.888 5.997 727 HG2 ARG 54 HG2 ARG 54 -13.770 4.217 7.281 728 HG3 ARG 54 HG3 ARG 54 -12.753 5.665 7.326 729 HD2 ARG 54 HD2 ARG 54 -14.404 6.904 8.522 730 HD3 ARG 54 HD3 ARG 54 -15.601 5.586 8.372 731 HE ARG 54 HE ARG 54 -13.339 4.481 9.614 732 HH11 ARG 54 HH11 ARG 54 -15.710 6.995 10.369 733 HH12 ARG 54 HH12 ARG 54 -15.558 6.770 12.096 734 HH21 ARG 54 HH21 ARG 54 -13.146 4.224 11.812 735 HH22 ARG 54 HH22 ARG 54 -14.101 5.189 12.926 736 H THR 55 H THR 55 -15.075 7.161 4.166 737 HA THR 55 HA THR 55 -15.814 6.075 1.553 738 HB THR 55 HB THR 55 -17.129 8.315 1.161 739 HG1 THR 55 HG1 THR 55 -18.065 9.148 2.955 740 HG21 THR 55 HG21 THR 55 -19.209 7.184 1.664 741 HG22 THR 55 HG22 THR 55 -18.041 5.905 1.241 742 HG23 THR 55 HG23 THR 55 -18.435 6.221 2.946 743 H LEU 56 H LEU 56 -14.966 7.463 -0.186 744 HA LEU 56 HA LEU 56 -12.436 8.595 0.454 745 HB2 LEU 56 HB2 LEU 56 -14.225 9.129 -1.955 746 HB3 LEU 56 HB3 LEU 56 -12.522 9.553 -1.821 747 HG LEU 56 HG LEU 56 -13.796 6.819 -2.044 748 HD11 LEU 56 HD11 LEU 56 -13.177 8.119 -4.091 749 HD12 LEU 56 HD12 LEU 56 -11.497 8.176 -3.518 750 HD13 LEU 56 HD13 LEU 56 -12.238 6.617 -3.935 751 HD21 LEU 56 HD21 LEU 56 -10.922 7.410 -1.215 752 HD22 LEU 56 HD22 LEU 56 -12.162 6.545 -0.262 753 HD23 LEU 56 HD23 LEU 56 -11.530 5.822 -1.746 754 H SER 57 H SER 57 -15.692 9.899 0.361 755 HA SER 57 HA SER 57 -15.067 12.679 0.496 756 HB2 SER 57 HB2 SER 57 -17.463 12.807 1.108 757 HB3 SER 57 HB3 SER 57 -17.212 11.681 -0.246 758 HG SER 57 HG SER 57 -18.585 10.850 1.388 759 H ASP 58 H ASP 58 -15.181 10.089 2.890 760 HA ASP 58 HA ASP 58 -15.345 11.836 5.190 761 HB2 ASP 58 HB2 ASP 58 -16.003 9.406 5.141 762 HB3 ASP 58 HB3 ASP 58 -14.279 8.991 5.028 763 H TYR 59 H TYR 59 -12.835 11.136 2.948 764 HA TYR 59 HA TYR 59 -10.872 12.254 4.885 765 HB2 TYR 59 HB2 TYR 59 -9.824 10.942 2.454 766 HB3 TYR 59 HB3 TYR 59 -9.189 10.961 4.088 767 HD1 TYR 59 HD1 TYR 59 -10.473 9.350 5.828 768 HD2 TYR 59 HD2 TYR 59 -10.753 9.124 1.539 769 HE1 TYR 59 HE1 TYR 59 -11.207 6.959 5.989 770 HE2 TYR 59 HE2 TYR 59 -11.569 6.789 1.713 771 HH TYR 59 HH TYR 59 -11.992 5.131 4.830 772 H ASN 60 H ASN 60 -12.938 13.408 2.869 773 HA ASN 60 HA ASN 60 -13.131 15.288 1.681 774 HB2 ASN 60 HB2 ASN 60 -10.301 16.019 2.380 775 HB3 ASN 60 HB3 ASN 60 -11.702 17.092 2.270 776 HD21 ASN 60 HD21 ASN 60 -9.571 15.513 4.285 777 HD22 ASN 60 HD22 ASN 60 -10.468 15.549 5.783 778 H ILE 61 H ILE 61 -11.451 12.872 0.426 779 HA ILE 61 HA ILE 61 -9.517 13.955 -1.311 780 HB ILE 61 HB ILE 61 -11.337 11.546 -1.573 781 HG12 ILE 61 HG12 ILE 61 -8.412 11.762 -0.765 782 HG13 ILE 61 HG13 ILE 61 -9.760 11.673 0.389 783 HG21 ILE 61 HG21 ILE 61 -9.704 10.698 -3.243 784 HG22 ILE 61 HG22 ILE 61 -10.485 12.171 -3.810 785 HG23 ILE 61 HG23 ILE 61 -8.826 12.240 -3.160 786 HD11 ILE 61 HD11 ILE 61 -9.023 9.555 -1.665 787 HD12 ILE 61 HD12 ILE 61 -8.811 9.461 0.096 788 HD13 ILE 61 HD13 ILE 61 -10.448 9.503 -0.604 789 H GLN 62 H GLN 62 -9.509 14.735 -3.359 790 HA GLN 62 HA GLN 62 -12.095 15.211 -4.780 791 HB2 GLN 62 HB2 GLN 62 -9.711 17.080 -4.672 792 HB3 GLN 62 HB3 GLN 62 -11.299 17.415 -5.368 793 HG2 GLN 62 HG2 GLN 62 -10.771 16.915 -2.403 794 HG3 GLN 62 HG3 GLN 62 -10.857 18.502 -3.138 795 HE21 GLN 62 HE21 GLN 62 -12.578 17.075 -1.067 796 HE22 GLN 62 HE22 GLN 62 -14.217 17.250 -1.671 797 H LYS 63 H LYS 63 -11.417 16.065 -7.088 798 HA LYS 63 HA LYS 63 -10.062 13.933 -8.441 799 HB2 LYS 63 HB2 LYS 63 -10.426 15.261 -10.385 800 HB3 LYS 63 HB3 LYS 63 -11.871 15.369 -9.368 801 HG2 LYS 63 HG2 LYS 63 -11.095 17.583 -8.508 802 HG3 LYS 63 HG3 LYS 63 -9.653 17.462 -9.544 803 HD2 LYS 63 HD2 LYS 63 -11.280 18.859 -10.649 804 HD3 LYS 63 HD3 LYS 63 -11.116 17.331 -11.543 805 HE2 LYS 63 HE2 LYS 63 -13.172 16.477 -10.469 806 HE3 LYS 63 HE3 LYS 63 -13.312 17.966 -9.522 807 HZ1 LYS 63 HZ1 LYS 63 -14.712 18.015 -11.464 808 HZ2 LYS 63 HZ2 LYS 63 -13.561 19.177 -11.581 809 HZ3 LYS 63 HZ3 LYS 63 -13.423 17.797 -12.462 810 H GLU 64 H GLU 64 -8.134 13.776 -9.420 811 HA GLU 64 HA GLU 64 -5.943 14.029 -9.747 812 HB2 GLU 64 HB2 GLU 64 -6.585 16.991 -9.481 813 HB3 GLU 64 HB3 GLU 64 -5.101 16.294 -10.159 814 HG2 GLU 64 HG2 GLU 64 -6.436 15.133 -11.899 815 HG3 GLU 64 HG3 GLU 64 -7.912 15.854 -11.240 816 H SER 65 H SER 65 -7.131 13.987 -6.865 817 HA SER 65 HA SER 65 -5.145 15.250 -5.233 818 HB2 SER 65 HB2 SER 65 -7.466 14.609 -4.507 819 HB3 SER 65 HB3 SER 65 -6.987 12.901 -4.626 820 HG SER 65 HG SER 65 -5.924 14.914 -2.924 821 H THR 66 H THR 66 -3.996 13.682 -3.637 822 HA THR 66 HA THR 66 -2.574 11.535 -5.169 823 HB THR 66 HB THR 66 -1.295 13.745 -3.515 824 HG1 THR 66 HG1 THR 66 -1.884 14.329 -5.632 825 HG21 THR 66 HG21 THR 66 0.839 12.669 -4.272 826 HG22 THR 66 HG22 THR 66 -0.095 11.631 -3.181 827 HG23 THR 66 HG23 THR 66 -0.110 11.319 -4.935 828 H LEU 67 H LEU 67 -2.286 9.720 -4.011 829 HA LEU 67 HA LEU 67 -2.575 9.805 -1.036 830 HB2 LEU 67 HB2 LEU 67 -3.754 7.733 -2.941 831 HB3 LEU 67 HB3 LEU 67 -3.719 7.629 -1.178 832 HG LEU 67 HG LEU 67 -4.962 9.930 -1.236 833 HD11 LEU 67 HD11 LEU 67 -6.545 10.063 -3.164 834 HD12 LEU 67 HD12 LEU 67 -4.876 10.334 -3.681 835 HD13 LEU 67 HD13 LEU 67 -5.650 8.757 -3.972 836 HD21 LEU 67 HD21 LEU 67 -5.863 7.814 -0.369 837 HD22 LEU 67 HD22 LEU 67 -7.101 8.686 -1.293 838 HD23 LEU 67 HD23 LEU 67 -6.273 7.294 -2.024 839 H HIS 68 H HIS 68 -1.922 7.425 -0.229 840 HA HIS 68 HA HIS 68 0.574 6.634 -1.645 841 HB2 HIS 68 HB2 HIS 68 0.315 7.132 1.339 842 HB3 HIS 68 HB3 HIS 68 1.770 6.610 0.483 843 HD2 HIS 68 HD2 HIS 68 2.714 8.471 -1.441 844 HE1 HIS 68 HE1 HIS 68 1.072 11.836 0.579 845 HE2 HIS 68 HE2 HIS 68 2.721 11.086 -1.205 846 H LEU 69 H LEU 69 1.063 4.494 -1.586 847 HA LEU 69 HA LEU 69 -0.840 2.650 -0.235 848 HB2 LEU 69 HB2 LEU 69 -1.553 3.090 -2.503 849 HB3 LEU 69 HB3 LEU 69 0.057 2.789 -3.140 850 HG LEU 69 HG LEU 69 -1.652 1.045 -3.594 851 HD11 LEU 69 HD11 LEU 69 -0.214 -0.846 -3.299 852 HD12 LEU 69 HD12 LEU 69 0.788 0.567 -3.681 853 HD13 LEU 69 HD13 LEU 69 0.704 -0.050 -2.015 854 HD21 LEU 69 HD21 LEU 69 -1.346 0.306 -0.671 855 HD22 LEU 69 HD22 LEU 69 -2.784 1.086 -1.385 856 HD23 LEU 69 HD23 LEU 69 -2.296 -0.546 -1.907 857 H VAL 70 H VAL 70 0.034 0.879 0.593 858 HA VAL 70 HA VAL 70 2.846 0.081 0.005 859 HB VAL 70 HB VAL 70 1.583 0.573 2.727 860 HG11 VAL 70 HG11 VAL 70 4.180 -0.809 1.951 861 HG12 VAL 70 HG12 VAL 70 3.814 -0.217 3.593 862 HG13 VAL 70 HG13 VAL 70 2.826 -1.498 2.882 863 HG21 VAL 70 HG21 VAL 70 3.555 2.066 3.006 864 HG22 VAL 70 HG22 VAL 70 4.046 1.714 1.337 865 HG23 VAL 70 HG23 VAL 70 2.528 2.581 1.651 866 H LEU 71 H LEU 71 3.125 -2.296 0.654 867 HA LEU 71 HA LEU 71 0.553 -3.722 0.893 868 HB2 LEU 71 HB2 LEU 71 1.196 -5.159 -1.095 869 HB3 LEU 71 HB3 LEU 71 0.624 -3.526 -1.422 870 HG LEU 71 HG LEU 71 2.954 -2.748 -1.768 871 HD11 LEU 71 HD11 LEU 71 3.653 -5.702 -1.486 872 HD12 LEU 71 HD12 LEU 71 4.730 -4.452 -2.136 873 HD13 LEU 71 HD13 LEU 71 4.236 -4.381 -0.438 874 HD21 LEU 71 HD21 LEU 71 2.113 -5.162 -3.422 875 HD22 LEU 71 HD22 LEU 71 1.550 -3.485 -3.636 876 HD23 LEU 71 HD23 LEU 71 3.249 -3.891 -3.937 877 H ARG 72 H ARG 72 0.874 -6.138 0.933 878 HA ARG 72 HA ARG 72 3.039 -6.741 2.860 879 HB2 ARG 72 HB2 ARG 72 0.342 -7.893 2.130 880 HB3 ARG 72 HB3 ARG 72 1.538 -8.951 2.884 881 HG2 ARG 72 HG2 ARG 72 -0.044 -7.835 4.489 882 HG3 ARG 72 HG3 ARG 72 1.677 -7.617 4.842 883 HD2 ARG 72 HD2 ARG 72 1.643 -5.371 3.877 884 HD3 ARG 72 HD3 ARG 72 -0.047 -5.578 3.393 885 HE ARG 72 HE ARG 72 -0.735 -5.171 5.569 886 HH11 ARG 72 HH11 ARG 72 2.773 -5.711 5.541 887 HH12 ARG 72 HH12 ARG 72 2.939 -5.271 7.234 888 HH21 ARG 72 HH21 ARG 72 -0.429 -4.609 7.776 889 HH22 ARG 72 HH22 ARG 72 1.191 -4.651 8.449 890 H LEU 73 H LEU 73 3.595 -9.266 2.640 891 HA LEU 73 HA LEU 73 4.492 -9.653 -0.159 892 HB2 LEU 73 HB2 LEU 73 6.087 -8.803 1.934 893 HB3 LEU 73 HB3 LEU 73 6.257 -10.555 2.082 894 HG LEU 73 HG LEU 73 6.904 -10.587 -0.390 895 HD11 LEU 73 HD11 LEU 73 5.839 -8.438 -1.032 896 HD12 LEU 73 HD12 LEU 73 6.903 -7.564 0.082 897 HD13 LEU 73 HD13 LEU 73 7.585 -8.376 -1.351 898 HD21 LEU 73 HD21 LEU 73 8.547 -8.833 1.492 899 HD22 LEU 73 HD22 LEU 73 8.571 -10.608 1.440 900 HD23 LEU 73 HD23 LEU 73 9.166 -9.676 0.047 901 H ARG 74 H ARG 74 2.335 -10.681 1.531 902 HA ARG 74 HA ARG 74 1.204 -12.517 2.148 903 HB2 ARG 74 HB2 ARG 74 1.753 -12.971 -0.308 904 HB3 ARG 74 HB3 ARG 74 2.993 -14.089 0.265 905 HG2 ARG 74 HG2 ARG 74 0.953 -15.318 -0.257 906 HG3 ARG 74 HG3 ARG 74 1.246 -15.387 1.489 907 HD2 ARG 74 HD2 ARG 74 -0.397 -13.591 1.855 908 HD3 ARG 74 HD3 ARG 74 -0.634 -13.430 0.101 909 HE ARG 74 HE ARG 74 -1.170 -16.113 0.747 910 HH11 ARG 74 HH11 ARG 74 -2.437 -12.908 1.501 911 HH12 ARG 74 HH12 ARG 74 -4.072 -13.461 1.754 912 HH21 ARG 74 HH21 ARG 74 -3.324 -16.836 1.071 913 HH22 ARG 74 HH22 ARG 74 -4.574 -15.696 1.505 914 H GLY 75 H GLY 75 4.660 -12.783 2.424 915 HA2 GLY 75 HA2 GLY 75 5.098 -13.515 4.887 916 HA3 GLY 75 HA3 GLY 75 4.444 -15.067 4.271 917 H GLY 76 H GLY 76 5.752 -13.928 1.589 918 HA2 GLY 76 HA2 GLY 76 8.551 -13.935 1.823 919 HA3 GLY 76 HA3 GLY 76 8.054 -15.629 1.634 Start of MODEL 9 1 H LEU 491 H LEU 491 13.578 5.819 11.008 2 HA LEU 491 HA LEU 491 16.225 5.779 11.235 3 HB2 LEU 491 HB2 LEU 491 15.223 3.280 10.079 4 HB3 LEU 491 HB3 LEU 491 15.884 3.670 11.670 5 HG LEU 491 HG LEU 491 13.580 4.600 12.285 6 HD11 LEU 491 HD11 LEU 491 12.602 4.766 9.990 7 HD12 LEU 491 HD12 LEU 491 12.858 3.026 9.770 8 HD13 LEU 491 HD13 LEU 491 11.694 3.615 10.985 9 HD21 LEU 491 HD21 LEU 491 13.886 1.668 11.580 10 HD22 LEU 491 HD22 LEU 491 14.499 2.471 13.050 11 HD23 LEU 491 HD23 LEU 491 12.743 2.352 12.765 12 HA PRO 492 HA PRO 492 18.252 5.993 7.219 13 HB2 PRO 492 HB2 PRO 492 20.103 4.027 8.515 14 HB3 PRO 492 HB3 PRO 492 20.493 5.582 7.710 15 HG2 PRO 492 HG2 PRO 492 20.569 5.373 10.409 16 HG3 PRO 492 HG3 PRO 492 19.840 6.819 9.628 17 HD2 PRO 492 HD2 PRO 492 18.429 4.378 10.737 18 HD3 PRO 492 HD3 PRO 492 18.043 6.110 10.974 19 H LEU 493 H LEU 493 19.577 4.222 5.917 20 HA LEU 493 HA LEU 493 17.779 2.106 5.166 21 HB2 LEU 493 HB2 LEU 493 19.850 3.633 4.057 22 HB3 LEU 493 HB3 LEU 493 20.642 2.085 4.266 23 HG LEU 493 HG LEU 493 17.947 2.535 2.906 24 HD11 LEU 493 HD11 LEU 493 19.155 2.266 0.764 25 HD12 LEU 493 HD12 LEU 493 19.746 3.670 1.678 26 HD13 LEU 493 HD13 LEU 493 20.697 2.164 1.647 27 HD21 LEU 493 HD21 LEU 493 19.828 0.133 2.838 28 HD22 LEU 493 HD22 LEU 493 18.273 0.210 3.706 29 HD23 LEU 493 HD23 LEU 493 18.301 0.279 1.932 30 H GLN 494 H GLN 494 18.604 2.054 7.889 31 HA GLN 494 HA GLN 494 20.713 0.200 8.359 32 HB2 GLN 494 HB2 GLN 494 19.346 0.005 10.615 33 HB3 GLN 494 HB3 GLN 494 20.304 1.431 10.182 34 HG2 GLN 494 HG2 GLN 494 18.307 2.216 11.136 35 HG3 GLN 494 HG3 GLN 494 18.248 2.589 9.419 36 HE21 GLN 494 HE21 GLN 494 16.898 0.762 12.071 37 HE22 GLN 494 HE22 GLN 494 15.499 0.110 11.226 38 H ALA 495 H ALA 495 17.262 -0.181 7.887 39 HA ALA 495 HA ALA 495 17.608 -3.120 7.686 40 HB1 ALA 495 HB1 ALA 495 15.634 -1.741 9.556 41 HB2 ALA 495 HB2 ALA 495 15.679 -3.488 9.225 42 HB3 ALA 495 HB3 ALA 495 17.045 -2.699 10.045 43 H LEU 496 H LEU 496 16.652 -0.449 6.098 44 HA LEU 496 HA LEU 496 14.061 -1.304 5.134 45 HB2 LEU 496 HB2 LEU 496 16.148 0.661 4.094 46 HB3 LEU 496 HB3 LEU 496 14.489 0.528 3.501 47 HG LEU 496 HG LEU 496 15.305 1.296 6.335 48 HD11 LEU 496 HD11 LEU 496 14.041 2.931 4.098 49 HD12 LEU 496 HD12 LEU 496 14.479 3.508 5.726 50 HD13 LEU 496 HD13 LEU 496 15.753 2.990 4.591 51 HD21 LEU 496 HD21 LEU 496 12.560 1.198 5.022 52 HD22 LEU 496 HD22 LEU 496 13.129 0.100 6.303 53 HD23 LEU 496 HD23 LEU 496 12.927 1.828 6.648 54 HA PRO 497 HA PRO 497 15.046 -4.166 1.941 55 HB2 PRO 497 HB2 PRO 497 13.823 -2.195 0.018 56 HB3 PRO 497 HB3 PRO 497 13.505 -3.954 0.167 57 HG2 PRO 497 HG2 PRO 497 11.755 -2.173 1.199 58 HG3 PRO 497 HG3 PRO 497 12.200 -3.635 2.140 59 HD2 PRO 497 HD2 PRO 497 13.215 -0.805 2.447 60 HD3 PRO 497 HD3 PRO 497 12.781 -2.003 3.711 61 H GLU 498 H GLU 498 16.410 -4.555 0.092 62 HA GLU 498 HA GLU 498 18.682 -2.752 0.092 63 HB2 GLU 498 HB2 GLU 498 18.795 -5.263 0.212 64 HB3 GLU 498 HB3 GLU 498 18.285 -5.314 -1.495 65 HG2 GLU 498 HG2 GLU 498 20.286 -4.036 -2.143 66 HG3 GLU 498 HG3 GLU 498 20.704 -3.783 -0.444 67 H GLY 499 H GLY 499 17.194 -1.082 -0.800 68 HA2 GLY 499 HA2 GLY 499 18.204 -0.096 -3.149 69 HA3 GLY 499 HA3 GLY 499 16.822 -1.082 -3.681 70 H VAL 500 H VAL 500 15.293 -0.547 -1.187 71 HA VAL 500 HA VAL 500 13.925 1.866 -1.903 72 HB VAL 500 HB VAL 500 13.923 0.060 0.539 73 HG11 VAL 500 HG11 VAL 500 12.065 2.405 -0.057 74 HG12 VAL 500 HG12 VAL 500 11.775 1.154 1.169 75 HG13 VAL 500 HG13 VAL 500 13.152 2.245 1.344 76 HG21 VAL 500 HG21 VAL 500 13.053 -0.856 -1.601 77 HG22 VAL 500 HG22 VAL 500 11.734 -0.617 -0.426 78 HG23 VAL 500 HG23 VAL 500 11.961 0.542 -1.749 79 H ASP 501 H ASP 501 13.651 3.740 -0.330 80 HA ASP 501 HA ASP 501 16.210 4.381 1.046 81 HB2 ASP 501 HB2 ASP 501 15.994 5.183 -1.448 82 HB3 ASP 501 HB3 ASP 501 14.899 6.391 -0.788 83 H GLN 502 H GLN 502 16.050 6.285 2.409 84 HA GLN 502 HA GLN 502 13.849 6.221 4.199 85 HB2 GLN 502 HB2 GLN 502 15.850 8.452 3.568 86 HB3 GLN 502 HB3 GLN 502 14.831 8.376 5.013 87 HG2 GLN 502 HG2 GLN 502 17.078 7.841 5.489 88 HG3 GLN 502 HG3 GLN 502 16.028 6.423 5.802 89 HE21 GLN 502 HE21 GLN 502 16.195 4.612 4.426 90 HE22 GLN 502 HE22 GLN 502 17.621 4.320 3.444 91 H GLU 503 H GLU 503 14.878 8.541 1.785 92 HA GLU 503 HA GLU 503 12.733 10.360 1.993 93 HB2 GLU 503 HB2 GLU 503 13.573 11.377 -0.011 94 HB3 GLU 503 HB3 GLU 503 14.964 10.774 0.907 95 HG2 GLU 503 HG2 GLU 503 14.930 8.708 -0.532 96 HG3 GLU 503 HG3 GLU 503 13.638 9.437 -1.491 97 H VAL 504 H VAL 504 12.343 7.204 1.036 98 HA VAL 504 HA VAL 504 9.788 8.022 -0.159 99 HB VAL 504 HB VAL 504 11.389 7.583 -1.955 100 HG11 VAL 504 HG11 VAL 504 12.015 5.266 -2.518 101 HG12 VAL 504 HG12 VAL 504 12.673 5.735 -0.938 102 HG13 VAL 504 HG13 VAL 504 11.237 4.682 -1.028 103 HG21 VAL 504 HG21 VAL 504 8.945 7.351 -2.288 104 HG22 VAL 504 HG22 VAL 504 9.888 6.290 -3.354 105 HG23 VAL 504 HG23 VAL 504 9.069 5.612 -1.936 106 H PHE 505 H PHE 505 11.029 6.727 2.419 107 HA PHE 505 HA PHE 505 8.840 4.716 2.751 108 HB2 PHE 505 HB2 PHE 505 10.783 3.403 2.825 109 HB3 PHE 505 HB3 PHE 505 11.758 4.728 3.421 110 HD1 PHE 505 HD1 PHE 505 11.687 5.483 5.695 111 HD2 PHE 505 HD2 PHE 505 9.710 1.890 4.459 112 HE1 PHE 505 HE1 PHE 505 11.659 4.692 8.066 113 HE2 PHE 505 HE2 PHE 505 9.716 1.063 6.815 114 HZ PHE 505 HZ PHE 505 10.692 2.459 8.608 115 H LYS 506 H LYS 506 10.444 7.653 3.786 116 HA LYS 506 HA LYS 506 9.221 7.732 6.413 117 HB2 LYS 506 HB2 LYS 506 10.560 9.818 4.650 118 HB3 LYS 506 HB3 LYS 506 9.943 10.151 6.284 119 HG2 LYS 506 HG2 LYS 506 11.382 8.384 7.220 120 HG3 LYS 506 HG3 LYS 506 12.050 8.046 5.616 121 HD2 LYS 506 HD2 LYS 506 12.230 10.719 7.065 122 HD3 LYS 506 HD3 LYS 506 13.533 9.511 6.970 123 HE2 LYS 506 HE2 LYS 506 13.551 9.711 4.517 124 HE3 LYS 506 HE3 LYS 506 12.252 10.911 4.590 125 HZ1 LYS 506 HZ1 LYS 506 13.706 12.339 5.853 126 HZ2 LYS 506 HZ2 LYS 506 14.916 11.231 5.806 127 HZ3 LYS 506 HZ3 LYS 506 14.411 11.952 4.421 128 H GLN 507 H GLN 507 7.775 7.777 3.423 129 HA GLN 507 HA GLN 507 5.900 9.971 3.965 130 HB2 GLN 507 HB2 GLN 507 5.374 7.913 1.856 131 HB3 GLN 507 HB3 GLN 507 5.148 9.662 1.807 132 HG2 GLN 507 HG2 GLN 507 7.717 8.074 1.484 133 HG3 GLN 507 HG3 GLN 507 6.905 9.041 0.256 134 HE21 GLN 507 HE21 GLN 507 9.697 9.175 1.250 135 HE22 GLN 507 HE22 GLN 507 9.925 10.790 1.843 136 H LEU 508 H LEU 508 6.358 6.848 5.031 137 HA LEU 508 HA LEU 508 3.595 5.862 4.930 138 HB2 LEU 508 HB2 LEU 508 6.269 4.848 5.946 139 HB3 LEU 508 HB3 LEU 508 4.778 3.942 6.164 140 HG LEU 508 HG LEU 508 4.542 3.531 3.836 141 HD11 LEU 508 HD11 LEU 508 6.808 5.490 3.321 142 HD12 LEU 508 HD12 LEU 508 6.111 4.388 2.117 143 HD13 LEU 508 HD13 LEU 508 5.102 5.660 2.817 144 HD21 LEU 508 HD21 LEU 508 7.511 3.372 4.485 145 HD22 LEU 508 HD22 LEU 508 6.286 2.237 5.085 146 HD23 LEU 508 HD23 LEU 508 6.611 2.351 3.338 147 HA PRO 509 HA PRO 509 2.821 6.919 9.262 148 HB2 PRO 509 HB2 PRO 509 0.983 5.018 9.907 149 HB3 PRO 509 HB3 PRO 509 0.599 6.390 8.835 150 HG2 PRO 509 HG2 PRO 509 1.383 3.560 8.081 151 HG3 PRO 509 HG3 PRO 509 0.030 4.543 7.412 152 HD2 PRO 509 HD2 PRO 509 2.459 4.297 6.147 153 HD3 PRO 509 HD3 PRO 509 1.502 5.809 6.085 154 H ALA 510 H ALA 510 2.860 5.865 11.389 155 HA ALA 510 HA ALA 510 5.215 4.375 11.795 156 HB1 ALA 510 HB1 ALA 510 2.783 4.888 13.549 157 HB2 ALA 510 HB2 ALA 510 4.380 4.343 14.144 158 HB3 ALA 510 HB3 ALA 510 4.198 5.947 13.391 159 H ASP 511 H ASP 511 2.026 3.238 10.926 160 HA ASP 511 HA ASP 511 2.619 0.554 12.035 161 HB2 ASP 511 HB2 ASP 511 0.312 0.030 11.633 162 HB3 ASP 511 HB3 ASP 511 0.377 1.597 12.449 163 H ILE 512 H ILE 512 3.210 2.238 9.185 164 HA ILE 512 HA ILE 512 3.422 -0.393 7.787 165 HB ILE 512 HB ILE 512 3.332 2.388 6.582 166 HG12 ILE 512 HG12 ILE 512 1.301 0.104 6.572 167 HG13 ILE 512 HG13 ILE 512 1.147 1.611 7.480 168 HG21 ILE 512 HG21 ILE 512 3.220 1.177 4.416 169 HG22 ILE 512 HG22 ILE 512 4.727 0.820 5.255 170 HG23 ILE 512 HG23 ILE 512 3.406 -0.371 5.276 171 HD11 ILE 512 HD11 ILE 512 1.237 2.866 5.275 172 HD12 ILE 512 HD12 ILE 512 1.118 1.289 4.455 173 HD13 ILE 512 HD13 ILE 512 -0.193 1.850 5.508 174 H GLN 513 H GLN 513 5.143 2.231 9.322 175 HA GLN 513 HA GLN 513 7.717 1.939 8.240 176 HB2 GLN 513 HB2 GLN 513 6.450 2.849 10.727 177 HB3 GLN 513 HB3 GLN 513 7.942 1.958 11.075 178 HG2 GLN 513 HG2 GLN 513 8.375 4.349 10.877 179 HG3 GLN 513 HG3 GLN 513 9.234 3.402 9.656 180 HE21 GLN 513 HE21 GLN 513 8.895 3.811 7.497 181 HE22 GLN 513 HE22 GLN 513 7.763 4.995 6.897 182 H GLU 514 H GLU 514 5.961 -0.049 10.637 183 HA GLU 514 HA GLU 514 8.177 -1.842 11.076 184 HB2 GLU 514 HB2 GLU 514 6.575 -3.057 12.476 185 HB3 GLU 514 HB3 GLU 514 6.502 -1.315 12.803 186 HG2 GLU 514 HG2 GLU 514 4.496 -1.115 11.380 187 HG3 GLU 514 HG3 GLU 514 4.575 -2.844 11.008 188 H GLU 515 H GLU 515 6.252 -1.554 8.348 189 HA GLU 515 HA GLU 515 6.086 -4.509 7.982 190 HB2 GLU 515 HB2 GLU 515 4.820 -2.275 6.366 191 HB3 GLU 515 HB3 GLU 515 4.525 -4.014 6.184 192 HG2 GLU 515 HG2 GLU 515 3.900 -2.421 8.711 193 HG3 GLU 515 HG3 GLU 515 2.748 -2.698 7.410 194 H ILE 516 H ILE 516 7.870 -1.702 6.971 195 HA ILE 516 HA ILE 516 8.908 -3.173 4.594 196 HB ILE 516 HB ILE 516 8.878 -0.252 5.412 197 HG12 ILE 516 HG12 ILE 516 7.871 0.132 3.280 198 HG13 ILE 516 HG13 ILE 516 8.175 -1.534 2.750 199 HG21 ILE 516 HG21 ILE 516 10.544 -1.572 3.231 200 HG22 ILE 516 HG22 ILE 516 10.281 0.173 3.364 201 HG23 ILE 516 HG23 ILE 516 11.163 -0.679 4.644 202 HD11 ILE 516 HD11 ILE 516 6.493 -2.385 4.254 203 HD12 ILE 516 HD12 ILE 516 6.305 -0.781 5.020 204 HD13 ILE 516 HD13 ILE 516 5.791 -1.040 3.339 205 H LEU 517 H LEU 517 9.694 -1.899 7.794 206 HA LEU 517 HA LEU 517 12.531 -2.486 7.665 207 HB2 LEU 517 HB2 LEU 517 10.493 -2.059 9.885 208 HB3 LEU 517 HB3 LEU 517 12.188 -2.414 10.224 209 HG LEU 517 HG LEU 517 11.289 -0.039 8.541 210 HD11 LEU 517 HD11 LEU 517 10.413 0.098 10.860 211 HD12 LEU 517 HD12 LEU 517 12.054 -0.186 11.489 212 HD13 LEU 517 HD13 LEU 517 11.693 1.297 10.582 213 HD21 LEU 517 HD21 LEU 517 13.910 -0.640 9.992 214 HD22 LEU 517 HD22 LEU 517 13.673 -0.815 8.237 215 HD23 LEU 517 HD23 LEU 517 13.568 0.783 8.994 216 H SER 518 H SER 518 9.936 -4.531 7.399 217 HA SER 518 HA SER 518 11.368 -6.716 8.837 218 HB2 SER 518 HB2 SER 518 8.396 -6.135 9.037 219 HB3 SER 518 HB3 SER 518 9.249 -7.510 9.768 220 HG SER 518 HG SER 518 8.939 -5.703 11.187 221 H GLY 519 H GLY 519 10.932 -6.052 5.839 222 HA2 GLY 519 HA2 GLY 519 10.298 -8.899 5.237 223 HA3 GLY 519 HA3 GLY 519 9.435 -7.647 4.338 224 H LYS 520 H LYS 520 11.706 -5.782 4.235 225 HA LYS 520 HA LYS 520 13.444 -5.243 2.915 226 HB2 LYS 520 HB2 LYS 520 14.402 -7.783 4.288 227 HB3 LYS 520 HB3 LYS 520 15.463 -6.557 3.549 228 HG2 LYS 520 HG2 LYS 520 15.102 -5.026 5.214 229 HG3 LYS 520 HG3 LYS 520 13.455 -5.589 5.568 230 HD2 LYS 520 HD2 LYS 520 14.278 -7.599 6.631 231 HD3 LYS 520 HD3 LYS 520 15.970 -7.148 6.274 232 HE2 LYS 520 HE2 LYS 520 15.716 -5.108 7.636 233 HE3 LYS 520 HE3 LYS 520 14.021 -5.521 7.944 234 HZ1 LYS 520 HZ1 LYS 520 14.776 -7.509 9.067 235 HZ2 LYS 520 HZ2 LYS 520 16.349 -7.114 8.778 236 HZ3 LYS 520 HZ3 LYS 520 15.431 -6.178 9.766 237 H SER 521 H SER 521 11.574 -7.064 1.446 238 HA SER 521 HA SER 521 13.426 -7.678 -0.750 239 HB2 SER 521 HB2 SER 521 13.301 -9.756 0.633 240 HB3 SER 521 HB3 SER 521 11.537 -9.766 0.410 241 HG SER 521 HG SER 521 12.668 -11.069 -1.125 242 H ARG 522 H ARG 522 12.033 -8.512 -2.617 243 HA ARG 522 HA ARG 522 10.555 -7.980 -4.251 244 HB2 ARG 522 HB2 ARG 522 9.050 -8.893 -2.153 245 HB3 ARG 522 HB3 ARG 522 8.330 -7.299 -2.396 246 HG2 ARG 522 HG2 ARG 522 7.077 -8.439 -3.942 247 HG3 ARG 522 HG3 ARG 522 8.461 -8.104 -4.988 248 HD2 ARG 522 HD2 ARG 522 7.848 -10.636 -3.415 249 HD3 ARG 522 HD3 ARG 522 7.901 -10.456 -5.177 250 HE ARG 522 HE ARG 522 10.455 -9.763 -4.308 251 HH11 ARG 522 HH11 ARG 522 8.360 -12.599 -4.093 252 HH12 ARG 522 HH12 ARG 522 9.696 -13.724 -3.952 253 HH21 ARG 522 HH21 ARG 522 12.180 -11.250 -4.085 254 HH22 ARG 522 HH22 ARG 522 11.840 -12.961 -3.977 255 H GLU 523 H GLU 523 11.945 -5.704 -2.536 256 HA GLU 523 HA GLU 523 10.630 -3.532 -4.077 257 HB2 GLU 523 HB2 GLU 523 11.450 -3.271 -1.168 258 HB3 GLU 523 HB3 GLU 523 10.669 -2.049 -2.188 259 HG2 GLU 523 HG2 GLU 523 8.718 -3.722 -2.406 260 HG3 GLU 523 HG3 GLU 523 9.485 -4.583 -1.048 261 H ASN 524 H ASN 524 12.041 -2.091 -4.912 262 HA ASN 524 HA ASN 524 14.819 -1.936 -3.970 263 HB2 ASN 524 HB2 ASN 524 14.089 -2.730 -6.833 264 HB3 ASN 524 HB3 ASN 524 15.727 -2.454 -6.202 265 HD21 ASN 524 HD21 ASN 524 12.968 -4.598 -6.406 266 HD22 ASN 524 HD22 ASN 524 13.649 -5.957 -5.539 267 H LEU 525 H LEU 525 12.405 -0.249 -4.132 268 HA LEU 525 HA LEU 525 11.637 1.712 -4.833 269 HB2 LEU 525 HB2 LEU 525 13.145 3.295 -4.430 270 HB3 LEU 525 HB3 LEU 525 14.358 2.035 -4.402 271 HG LEU 525 HG LEU 525 14.308 2.472 -7.082 272 HD11 LEU 525 HD11 LEU 525 12.585 4.330 -6.736 273 HD12 LEU 525 HD12 LEU 525 13.799 5.186 -5.771 274 HD13 LEU 525 HD13 LEU 525 14.099 4.880 -7.496 275 HD21 LEU 525 HD21 LEU 525 16.282 2.498 -5.619 276 HD22 LEU 525 HD22 LEU 525 16.281 3.901 -6.710 277 HD23 LEU 525 HD23 LEU 525 15.814 4.107 -5.007 278 H LYS 526 H LYS 526 12.226 -0.682 -6.728 279 HA LYS 526 HA LYS 526 11.455 0.668 -9.269 280 HB2 LYS 526 HB2 LYS 526 13.535 -1.445 -8.647 281 HB3 LYS 526 HB3 LYS 526 12.916 -1.193 -10.304 282 HG2 LYS 526 HG2 LYS 526 13.681 1.125 -10.258 283 HG3 LYS 526 HG3 LYS 526 14.296 0.933 -8.600 284 HD2 LYS 526 HD2 LYS 526 15.123 -0.873 -10.885 285 HD3 LYS 526 HD3 LYS 526 15.987 0.645 -10.524 286 HE2 LYS 526 HE2 LYS 526 15.583 -1.632 -8.534 287 HE3 LYS 526 HE3 LYS 526 17.025 -1.422 -9.536 288 HZ1 LYS 526 HZ1 LYS 526 17.331 0.744 -8.493 289 HZ2 LYS 526 HZ2 LYS 526 16.021 0.488 -7.524 290 HZ3 LYS 526 HZ3 LYS 526 17.342 -0.467 -7.387 291 H1 MET 1 H1 MET 1 -12.740 12.228 -13.770 292 H2 MET 1 H2 MET 1 -14.160 12.897 -13.266 293 H3 MET 1 H3 MET 1 -14.024 11.263 -13.425 294 HA MET 1 HA MET 1 -12.534 12.912 -11.519 295 HB2 MET 1 HB2 MET 1 -14.878 12.789 -10.850 296 HB3 MET 1 HB3 MET 1 -14.873 11.018 -11.037 297 HG2 MET 1 HG2 MET 1 -13.219 10.777 -9.284 298 HG3 MET 1 HG3 MET 1 -12.988 12.529 -9.190 299 HE1 MET 1 HE1 MET 1 -13.312 10.868 -6.635 300 HE2 MET 1 HE2 MET 1 -13.216 12.643 -6.641 301 HE3 MET 1 HE3 MET 1 -14.495 11.820 -5.711 302 H GLN 2 H GLN 2 -10.759 12.103 -10.764 303 HA GLN 2 HA GLN 2 -10.446 9.265 -10.277 304 HB2 GLN 2 HB2 GLN 2 -8.560 8.933 -11.772 305 HB3 GLN 2 HB3 GLN 2 -9.898 9.595 -12.741 306 HG2 GLN 2 HG2 GLN 2 -8.782 11.909 -12.074 307 HG3 GLN 2 HG3 GLN 2 -7.364 10.931 -11.763 308 HE21 GLN 2 HE21 GLN 2 -6.133 11.820 -13.481 309 HE22 GLN 2 HE22 GLN 2 -6.530 11.545 -15.167 310 H ILE 3 H ILE 3 -8.079 8.949 -9.450 311 HA ILE 3 HA ILE 3 -6.988 11.416 -8.215 312 HB ILE 3 HB ILE 3 -6.768 10.516 -6.072 313 HG12 ILE 3 HG12 ILE 3 -7.267 7.834 -7.333 314 HG13 ILE 3 HG13 ILE 3 -6.060 8.364 -6.185 315 HG21 ILE 3 HG21 ILE 3 -9.557 9.805 -7.036 316 HG22 ILE 3 HG22 ILE 3 -9.068 10.196 -5.367 317 HG23 ILE 3 HG23 ILE 3 -8.952 11.431 -6.626 318 HD11 ILE 3 HD11 ILE 3 -7.805 8.490 -4.398 319 HD12 ILE 3 HD12 ILE 3 -9.000 7.871 -5.566 320 HD13 ILE 3 HD13 ILE 3 -7.628 6.859 -5.087 321 H PHE 4 H PHE 4 -4.774 10.624 -7.051 322 HA PHE 4 HA PHE 4 -3.409 8.804 -8.976 323 HB2 PHE 4 HB2 PHE 4 -2.306 11.502 -8.091 324 HB3 PHE 4 HB3 PHE 4 -1.581 10.366 -9.140 325 HD1 PHE 4 HD1 PHE 4 -2.504 9.752 -11.342 326 HD2 PHE 4 HD2 PHE 4 -3.933 13.124 -9.083 327 HE1 PHE 4 HE1 PHE 4 -3.281 10.800 -13.421 328 HE2 PHE 4 HE2 PHE 4 -4.737 14.177 -11.179 329 HZ PHE 4 HZ PHE 4 -4.410 13.030 -13.356 330 H VAL 5 H VAL 5 -3.044 7.163 -7.567 331 HA VAL 5 HA VAL 5 -2.005 7.809 -4.879 332 HB VAL 5 HB VAL 5 -2.496 5.576 -4.315 333 HG11 VAL 5 HG11 VAL 5 -4.677 6.525 -6.257 334 HG12 VAL 5 HG12 VAL 5 -4.865 5.272 -5.011 335 HG13 VAL 5 HG13 VAL 5 -4.532 6.935 -4.542 336 HG21 VAL 5 HG21 VAL 5 -2.791 4.970 -7.276 337 HG22 VAL 5 HG22 VAL 5 -1.528 4.363 -6.163 338 HG23 VAL 5 HG23 VAL 5 -3.207 3.856 -5.951 339 H LYS 6 H LYS 6 0.168 7.532 -4.339 340 HA LYS 6 HA LYS 6 1.881 6.530 -6.570 341 HB2 LYS 6 HB2 LYS 6 2.226 8.879 -6.118 342 HB3 LYS 6 HB3 LYS 6 2.466 8.550 -4.386 343 HG2 LYS 6 HG2 LYS 6 4.461 7.228 -4.855 344 HG3 LYS 6 HG3 LYS 6 4.237 7.442 -6.608 345 HD2 LYS 6 HD2 LYS 6 4.493 9.791 -4.728 346 HD3 LYS 6 HD3 LYS 6 5.924 8.962 -5.417 347 HE2 LYS 6 HE2 LYS 6 5.143 9.403 -7.670 348 HE3 LYS 6 HE3 LYS 6 3.681 10.208 -7.034 349 HZ1 LYS 6 HZ1 LYS 6 6.460 11.100 -6.621 350 HZ2 LYS 6 HZ2 LYS 6 5.367 11.797 -7.628 351 HZ3 LYS 6 HZ3 LYS 6 5.124 11.835 -6.006 352 H THR 7 H THR 7 3.326 5.012 -6.316 353 HA THR 7 HA THR 7 2.944 3.155 -4.130 354 HB THR 7 HB THR 7 4.468 1.760 -5.508 355 HG1 THR 7 HG1 THR 7 5.416 2.643 -7.277 356 HG21 THR 7 HG21 THR 7 3.088 1.604 -7.517 357 HG22 THR 7 HG22 THR 7 2.056 1.850 -6.096 358 HG23 THR 7 HG23 THR 7 2.387 3.205 -7.203 359 H LEU 8 H LEU 8 4.982 1.906 -3.448 360 HA LEU 8 HA LEU 8 6.820 3.605 -2.026 361 HB2 LEU 8 HB2 LEU 8 5.761 1.225 -1.559 362 HB3 LEU 8 HB3 LEU 8 7.134 0.617 -2.467 363 HG LEU 8 HG LEU 8 7.385 0.510 -0.017 364 HD11 LEU 8 HD11 LEU 8 9.439 0.800 -1.438 365 HD12 LEU 8 HD12 LEU 8 9.386 2.544 -1.036 366 HD13 LEU 8 HD13 LEU 8 9.597 1.338 0.242 367 HD21 LEU 8 HD21 LEU 8 7.373 3.550 -0.075 368 HD22 LEU 8 HD22 LEU 8 6.083 2.514 0.574 369 HD23 LEU 8 HD23 LEU 8 7.688 2.518 1.334 370 H THR 9 H THR 9 6.724 3.419 -5.191 371 HA THR 9 HA THR 9 9.663 3.080 -5.526 372 HB THR 9 HB THR 9 9.285 1.936 -7.663 373 HG1 THR 9 HG1 THR 9 7.195 1.283 -8.188 374 HG21 THR 9 HG21 THR 9 8.453 -0.205 -6.795 375 HG22 THR 9 HG22 THR 9 9.502 0.577 -5.588 376 HG23 THR 9 HG23 THR 9 7.733 0.616 -5.394 377 H GLY 10 H GLY 10 7.420 5.343 -5.465 378 HA2 GLY 10 HA2 GLY 10 7.380 7.458 -6.285 379 HA3 GLY 10 HA3 GLY 10 8.912 7.167 -7.132 380 H LYS 11 H LYS 11 5.940 5.268 -7.582 381 HA LYS 11 HA LYS 11 5.490 6.579 -10.239 382 HB2 LYS 11 HB2 LYS 11 6.415 4.252 -10.313 383 HB3 LYS 11 HB3 LYS 11 5.036 3.701 -9.345 384 HG2 LYS 11 HG2 LYS 11 3.480 4.631 -11.124 385 HG3 LYS 11 HG3 LYS 11 4.907 4.936 -12.135 386 HD2 LYS 11 HD2 LYS 11 3.852 2.847 -12.772 387 HD3 LYS 11 HD3 LYS 11 5.446 2.510 -12.026 388 HE2 LYS 11 HE2 LYS 11 4.328 1.963 -9.899 389 HE3 LYS 11 HE3 LYS 11 2.755 2.388 -10.598 390 HZ1 LYS 11 HZ1 LYS 11 4.497 0.204 -11.535 391 HZ2 LYS 11 HZ2 LYS 11 3.145 0.024 -10.616 392 HZ3 LYS 11 HZ3 LYS 11 3.014 0.587 -12.146 393 H THR 12 H THR 12 3.433 7.046 -10.771 394 HA THR 12 HA THR 12 1.523 6.924 -8.476 395 HB THR 12 HB THR 12 1.676 9.052 -10.633 396 HG1 THR 12 HG1 THR 12 2.676 10.253 -9.029 397 HG21 THR 12 HG21 THR 12 0.217 8.811 -7.998 398 HG22 THR 12 HG22 THR 12 0.361 10.285 -8.993 399 HG23 THR 12 HG23 THR 12 -0.473 8.847 -9.653 400 H ILE 13 H ILE 13 -0.664 6.366 -9.001 401 HA ILE 13 HA ILE 13 -1.078 5.339 -11.779 402 HB ILE 13 HB ILE 13 -1.892 3.977 -9.185 403 HG12 ILE 13 HG12 ILE 13 0.339 3.284 -11.161 404 HG13 ILE 13 HG13 ILE 13 0.550 3.857 -9.501 405 HG21 ILE 13 HG21 ILE 13 -2.034 3.084 -12.092 406 HG22 ILE 13 HG22 ILE 13 -2.575 2.142 -10.679 407 HG23 ILE 13 HG23 ILE 13 -3.415 3.637 -11.114 408 HD11 ILE 13 HD11 ILE 13 -0.707 1.216 -10.343 409 HD12 ILE 13 HD12 ILE 13 0.848 1.466 -9.530 410 HD13 ILE 13 HD13 ILE 13 -0.662 1.838 -8.671 411 H THR 14 H THR 14 -2.838 6.086 -12.719 412 HA THR 14 HA THR 14 -4.615 7.866 -11.282 413 HB THR 14 HB THR 14 -4.933 6.784 -14.105 414 HG1 THR 14 HG1 THR 14 -3.614 8.506 -14.720 415 HG21 THR 14 HG21 THR 14 -6.788 8.122 -13.180 416 HG22 THR 14 HG22 THR 14 -5.640 9.415 -12.746 417 HG23 THR 14 HG23 THR 14 -5.938 9.017 -14.458 418 H LEU 15 H LEU 15 -6.725 7.442 -10.630 419 HA LEU 15 HA LEU 15 -7.898 4.777 -11.220 420 HB2 LEU 15 HB2 LEU 15 -7.393 5.909 -8.438 421 HB3 LEU 15 HB3 LEU 15 -8.302 4.439 -8.792 422 HG LEU 15 HG LEU 15 -5.371 4.832 -9.519 423 HD11 LEU 15 HD11 LEU 15 -6.608 3.348 -7.160 424 HD12 LEU 15 HD12 LEU 15 -4.874 3.474 -7.543 425 HD13 LEU 15 HD13 LEU 15 -5.791 4.923 -7.058 426 HD21 LEU 15 HD21 LEU 15 -7.096 2.326 -9.302 427 HD22 LEU 15 HD22 LEU 15 -6.552 3.077 -10.822 428 HD23 LEU 15 HD23 LEU 15 -5.365 2.377 -9.689 429 H GLU 16 H GLU 16 -10.042 4.897 -11.424 430 HA GLU 16 HA GLU 16 -11.375 7.504 -10.948 431 HB2 GLU 16 HB2 GLU 16 -11.647 6.540 -13.149 432 HB3 GLU 16 HB3 GLU 16 -12.072 4.958 -12.466 433 HG2 GLU 16 HG2 GLU 16 -14.110 5.849 -11.511 434 HG3 GLU 16 HG3 GLU 16 -13.716 7.487 -12.075 435 H VAL 17 H VAL 17 -12.701 7.853 -9.356 436 HA VAL 17 HA VAL 17 -14.018 5.663 -7.877 437 HB VAL 17 HB VAL 17 -13.214 6.533 -5.723 438 HG11 VAL 17 HG11 VAL 17 -10.925 5.670 -5.786 439 HG12 VAL 17 HG12 VAL 17 -11.997 4.651 -6.770 440 HG13 VAL 17 HG13 VAL 17 -10.889 5.806 -7.554 441 HG21 VAL 17 HG21 VAL 17 -11.347 8.273 -7.399 442 HG22 VAL 17 HG22 VAL 17 -12.706 8.853 -6.402 443 HG23 VAL 17 HG23 VAL 17 -11.303 8.088 -5.634 444 H GLU 18 H GLU 18 -15.340 6.810 -6.019 445 HA GLU 18 HA GLU 18 -16.256 9.529 -6.733 446 HB2 GLU 18 HB2 GLU 18 -18.141 7.169 -6.289 447 HB3 GLU 18 HB3 GLU 18 -18.608 8.848 -6.610 448 HG2 GLU 18 HG2 GLU 18 -17.408 8.671 -8.822 449 HG3 GLU 18 HG3 GLU 18 -17.175 6.939 -8.466 450 HA PRO 19 HA PRO 19 -16.402 9.987 -2.341 451 HB2 PRO 19 HB2 PRO 19 -19.227 10.969 -2.494 452 HB3 PRO 19 HB3 PRO 19 -17.790 11.776 -1.805 453 HG2 PRO 19 HG2 PRO 19 -18.813 12.557 -4.203 454 HG3 PRO 19 HG3 PRO 19 -17.046 12.515 -3.897 455 HD2 PRO 19 HD2 PRO 19 -18.732 10.503 -5.385 456 HD3 PRO 19 HD3 PRO 19 -17.109 11.145 -5.782 457 H SER 20 H SER 20 -18.167 7.590 -3.876 458 HA SER 20 HA SER 20 -19.298 6.577 -1.330 459 HB2 SER 20 HB2 SER 20 -20.997 5.503 -2.857 460 HB3 SER 20 HB3 SER 20 -21.126 7.279 -2.724 461 HG SER 20 HG SER 20 -21.228 6.531 -4.896 462 H ASP 21 H ASP 21 -17.167 6.119 -4.005 463 HA ASP 21 HA ASP 21 -16.963 3.200 -3.713 464 HB2 ASP 21 HB2 ASP 21 -15.307 5.300 -5.105 465 HB3 ASP 21 HB3 ASP 21 -14.910 3.583 -5.129 466 H THR 22 H THR 22 -16.784 3.533 -1.374 467 HA THR 22 HA THR 22 -14.565 4.855 -0.129 468 HB THR 22 HB THR 22 -16.548 4.343 1.111 469 HG1 THR 22 HG1 THR 22 -15.493 3.535 2.903 470 HG21 THR 22 HG21 THR 22 -17.277 2.256 0.148 471 HG22 THR 22 HG22 THR 22 -15.815 1.428 0.768 472 HG23 THR 22 HG23 THR 22 -17.042 2.084 1.898 473 H ILE 23 H ILE 23 -13.061 3.376 1.387 474 HA ILE 23 HA ILE 23 -11.019 2.739 -0.347 475 HB ILE 23 HB ILE 23 -11.290 1.596 2.440 476 HG12 ILE 23 HG12 ILE 23 -11.924 3.904 2.647 477 HG13 ILE 23 HG13 ILE 23 -10.256 3.752 3.194 478 HG21 ILE 23 HG21 ILE 23 -9.329 0.854 1.169 479 HG22 ILE 23 HG22 ILE 23 -8.912 2.537 0.780 480 HG23 ILE 23 HG23 ILE 23 -8.834 1.961 2.461 481 HD11 ILE 23 HD11 ILE 23 -9.459 4.650 1.023 482 HD12 ILE 23 HD12 ILE 23 -11.141 4.777 0.454 483 HD13 ILE 23 HD13 ILE 23 -10.599 5.768 1.814 484 H GLU 24 H GLU 24 -13.461 0.386 0.912 485 HA GLU 24 HA GLU 24 -11.900 -1.866 0.014 486 HB2 GLU 24 HB2 GLU 24 -13.851 -3.186 0.439 487 HB3 GLU 24 HB3 GLU 24 -13.703 -1.982 1.738 488 HG2 GLU 24 HG2 GLU 24 -15.410 -0.582 0.611 489 HG3 GLU 24 HG3 GLU 24 -15.556 -1.789 -0.680 490 H ASN 25 H ASN 25 -13.985 0.402 -1.628 491 HA ASN 25 HA ASN 25 -14.372 -1.230 -4.000 492 HB2 ASN 25 HB2 ASN 25 -14.661 1.758 -3.545 493 HB3 ASN 25 HB3 ASN 25 -15.174 0.914 -4.978 494 HD21 ASN 25 HD21 ASN 25 -15.824 1.546 -1.683 495 HD22 ASN 25 HD22 ASN 25 -17.372 0.692 -1.547 496 H VAL 26 H VAL 26 -12.207 1.274 -2.753 497 HA VAL 26 HA VAL 26 -10.863 2.001 -5.173 498 HB VAL 26 HB VAL 26 -9.994 2.140 -2.263 499 HG11 VAL 26 HG11 VAL 26 -8.852 3.420 -4.773 500 HG12 VAL 26 HG12 VAL 26 -8.429 3.890 -3.111 501 HG13 VAL 26 HG13 VAL 26 -8.065 2.249 -3.685 502 HG21 VAL 26 HG21 VAL 26 -12.054 3.403 -2.723 503 HG22 VAL 26 HG22 VAL 26 -10.697 4.509 -2.446 504 HG23 VAL 26 HG23 VAL 26 -11.276 4.202 -4.106 505 H LYS 27 H LYS 27 -10.242 -0.416 -2.598 506 HA LYS 27 HA LYS 27 -7.691 -1.197 -3.511 507 HB2 LYS 27 HB2 LYS 27 -9.887 -2.650 -1.996 508 HB3 LYS 27 HB3 LYS 27 -8.276 -3.335 -2.309 509 HG2 LYS 27 HG2 LYS 27 -7.174 -1.547 -1.123 510 HG3 LYS 27 HG3 LYS 27 -8.697 -0.668 -0.905 511 HD2 LYS 27 HD2 LYS 27 -9.594 -2.511 0.468 512 HD3 LYS 27 HD3 LYS 27 -8.099 -3.442 0.205 513 HE2 LYS 27 HE2 LYS 27 -6.791 -1.621 1.254 514 HE3 LYS 27 HE3 LYS 27 -8.278 -0.713 1.546 515 HZ1 LYS 27 HZ1 LYS 27 -9.060 -2.487 2.924 516 HZ2 LYS 27 HZ2 LYS 27 -7.704 -3.382 2.653 517 HZ3 LYS 27 HZ3 LYS 27 -7.617 -1.960 3.487 518 H ALA 28 H ALA 28 -10.890 -1.935 -4.843 519 HA ALA 28 HA ALA 28 -9.908 -4.137 -6.474 520 HB1 ALA 28 HB1 ALA 28 -12.370 -2.361 -6.779 521 HB2 ALA 28 HB2 ALA 28 -12.060 -3.880 -7.638 522 HB3 ALA 28 HB3 ALA 28 -12.301 -3.889 -5.867 523 H LYS 29 H LYS 29 -9.886 -0.652 -6.647 524 HA LYS 29 HA LYS 29 -9.616 -0.377 -9.516 525 HB2 LYS 29 HB2 LYS 29 -8.587 1.521 -7.357 526 HB3 LYS 29 HB3 LYS 29 -9.166 1.946 -8.973 527 HG2 LYS 29 HG2 LYS 29 -10.905 0.834 -6.738 528 HG3 LYS 29 HG3 LYS 29 -10.656 2.564 -7.084 529 HD2 LYS 29 HD2 LYS 29 -11.475 2.205 -9.341 530 HD3 LYS 29 HD3 LYS 29 -11.921 0.517 -8.936 531 HE2 LYS 29 HE2 LYS 29 -13.335 1.312 -7.078 532 HE3 LYS 29 HE3 LYS 29 -12.880 2.980 -7.389 533 HZ1 LYS 29 HZ1 LYS 29 -14.994 2.518 -8.354 534 HZ2 LYS 29 HZ2 LYS 29 -13.914 2.812 -9.553 535 HZ3 LYS 29 HZ3 LYS 29 -14.395 1.266 -9.242 536 H ILE 30 H ILE 30 -7.444 -0.386 -6.725 537 HA ILE 30 HA ILE 30 -5.000 -0.058 -8.250 538 HB ILE 30 HB ILE 30 -5.618 -0.968 -5.414 539 HG12 ILE 30 HG12 ILE 30 -4.522 1.659 -6.483 540 HG13 ILE 30 HG13 ILE 30 -6.226 1.385 -6.076 541 HG21 ILE 30 HG21 ILE 30 -2.924 -0.220 -6.636 542 HG22 ILE 30 HG22 ILE 30 -3.222 -0.579 -4.917 543 HG23 ILE 30 HG23 ILE 30 -3.412 -1.851 -6.127 544 HD11 ILE 30 HD11 ILE 30 -5.655 1.041 -3.713 545 HD12 ILE 30 HD12 ILE 30 -3.924 1.214 -4.084 546 HD13 ILE 30 HD13 ILE 30 -5.019 2.587 -4.297 547 H GLN 31 H GLN 31 -6.924 -2.821 -7.077 548 HA GLN 31 HA GLN 31 -4.984 -4.847 -7.683 549 HB2 GLN 31 HB2 GLN 31 -6.879 -5.308 -6.214 550 HB3 GLN 31 HB3 GLN 31 -8.032 -4.841 -7.481 551 HG2 GLN 31 HG2 GLN 31 -7.334 -6.691 -8.899 552 HG3 GLN 31 HG3 GLN 31 -6.036 -7.111 -7.798 553 HE21 GLN 31 HE21 GLN 31 -6.744 -9.214 -7.305 554 HE22 GLN 31 HE22 GLN 31 -8.219 -9.529 -6.409 555 H ASP 32 H ASP 32 -7.573 -3.220 -9.556 556 HA ASP 32 HA ASP 32 -7.497 -5.064 -11.733 557 HB2 ASP 32 HB2 ASP 32 -9.371 -3.542 -11.195 558 HB3 ASP 32 HB3 ASP 32 -8.351 -2.154 -11.439 559 H LYS 33 H LYS 33 -5.690 -2.236 -10.853 560 HA LYS 33 HA LYS 33 -4.609 -1.693 -13.499 561 HB2 LYS 33 HB2 LYS 33 -4.257 -0.652 -10.680 562 HB3 LYS 33 HB3 LYS 33 -3.237 -0.052 -12.004 563 HG2 LYS 33 HG2 LYS 33 -6.281 -0.066 -12.143 564 HG3 LYS 33 HG3 LYS 33 -5.348 1.298 -11.490 565 HD2 LYS 33 HD2 LYS 33 -4.110 1.500 -13.601 566 HD3 LYS 33 HD3 LYS 33 -5.064 0.178 -14.311 567 HE2 LYS 33 HE2 LYS 33 -6.222 2.774 -13.213 568 HE3 LYS 33 HE3 LYS 33 -5.892 2.465 -14.924 569 HZ1 LYS 33 HZ1 LYS 33 -7.756 0.934 -13.230 570 HZ2 LYS 33 HZ2 LYS 33 -8.173 2.020 -14.392 571 HZ3 LYS 33 HZ3 LYS 33 -7.435 0.615 -14.811 572 H GLU 34 H GLU 34 -3.566 -3.633 -10.734 573 HA GLU 34 HA GLU 34 -1.033 -4.140 -12.218 574 HB2 GLU 34 HB2 GLU 34 -1.312 -3.521 -9.254 575 HB3 GLU 34 HB3 GLU 34 0.172 -4.114 -10.000 576 HG2 GLU 34 HG2 GLU 34 -1.218 -1.508 -10.771 577 HG3 GLU 34 HG3 GLU 34 0.095 -1.641 -9.606 578 H GLY 35 H GLY 35 -3.442 -5.270 -9.844 579 HA2 GLY 35 HA2 GLY 35 -4.193 -7.563 -10.061 580 HA3 GLY 35 HA3 GLY 35 -2.519 -8.071 -10.344 581 H ILE 36 H ILE 36 -2.801 -5.574 -8.032 582 HA ILE 36 HA ILE 36 -1.689 -7.282 -5.975 583 HB ILE 36 HB ILE 36 -2.551 -4.361 -6.020 584 HG12 ILE 36 HG12 ILE 36 0.242 -5.574 -6.214 585 HG13 ILE 36 HG13 ILE 36 -0.714 -5.119 -7.630 586 HG21 ILE 36 HG21 ILE 36 -0.747 -5.825 -4.049 587 HG22 ILE 36 HG22 ILE 36 -1.196 -4.101 -4.005 588 HG23 ILE 36 HG23 ILE 36 -2.426 -5.346 -3.724 589 HD11 ILE 36 HD11 ILE 36 0.177 -3.226 -5.416 590 HD12 ILE 36 HD12 ILE 36 0.831 -3.314 -7.066 591 HD13 ILE 36 HD13 ILE 36 -0.841 -2.780 -6.806 592 HA PRO 37 HA PRO 37 -5.707 -8.298 -4.397 593 HB2 PRO 37 HB2 PRO 37 -5.021 -9.558 -2.067 594 HB3 PRO 37 HB3 PRO 37 -4.652 -10.263 -3.674 595 HG2 PRO 37 HG2 PRO 37 -2.824 -8.628 -1.896 596 HG3 PRO 37 HG3 PRO 37 -2.475 -10.206 -2.676 597 HD2 PRO 37 HD2 PRO 37 -1.689 -7.845 -3.787 598 HD3 PRO 37 HD3 PRO 37 -2.268 -9.190 -4.816 599 HA PRO 38 HA PRO 38 -6.790 -5.070 -1.512 600 HB2 PRO 38 HB2 PRO 38 -9.045 -6.156 -0.368 601 HB3 PRO 38 HB3 PRO 38 -8.995 -5.499 -2.034 602 HG2 PRO 38 HG2 PRO 38 -8.743 -8.391 -1.161 603 HG3 PRO 38 HG3 PRO 38 -9.757 -7.711 -2.481 604 HD2 PRO 38 HD2 PRO 38 -7.340 -8.852 -2.973 605 HD3 PRO 38 HD3 PRO 38 -7.892 -7.412 -3.883 606 H ASP 39 H ASP 39 -5.981 -8.321 -0.678 607 HA ASP 39 HA ASP 39 -6.228 -8.060 2.166 608 HB2 ASP 39 HB2 ASP 39 -6.371 -10.213 0.974 609 HB3 ASP 39 HB3 ASP 39 -4.699 -10.022 0.422 610 H GLN 40 H GLN 40 -3.858 -6.867 -0.098 611 HA GLN 40 HA GLN 40 -1.906 -6.627 2.149 612 HB2 GLN 40 HB2 GLN 40 -1.370 -7.123 -0.795 613 HB3 GLN 40 HB3 GLN 40 -0.143 -6.747 0.427 614 HG2 GLN 40 HG2 GLN 40 -0.953 -8.743 1.756 615 HG3 GLN 40 HG3 GLN 40 -1.976 -9.170 0.369 616 HE21 GLN 40 HE21 GLN 40 -0.546 -8.908 -1.831 617 HE22 GLN 40 HE22 GLN 40 0.947 -9.826 -1.776 618 H GLN 41 H GLN 41 -3.735 -4.840 -0.298 619 HA GLN 41 HA GLN 41 -1.922 -2.632 -0.511 620 HB2 GLN 41 HB2 GLN 41 -4.945 -2.836 -0.730 621 HB3 GLN 41 HB3 GLN 41 -4.011 -1.392 -1.147 622 HG2 GLN 41 HG2 GLN 41 -2.856 -2.579 -2.936 623 HG3 GLN 41 HG3 GLN 41 -3.633 -4.105 -2.455 624 HE21 GLN 41 HE21 GLN 41 -4.831 -4.380 -4.454 625 HE22 GLN 41 HE22 GLN 41 -6.223 -3.372 -4.751 626 H ARG 42 H ARG 42 -2.270 -0.489 0.278 627 HA ARG 42 HA ARG 42 -4.170 0.046 2.381 628 HB2 ARG 42 HB2 ARG 42 -2.048 -0.973 3.507 629 HB3 ARG 42 HB3 ARG 42 -1.226 0.513 3.018 630 HG2 ARG 42 HG2 ARG 42 -2.035 0.648 5.340 631 HG3 ARG 42 HG3 ARG 42 -2.848 1.849 4.327 632 HD2 ARG 42 HD2 ARG 42 -4.416 0.690 5.879 633 HD3 ARG 42 HD3 ARG 42 -4.849 0.433 4.198 634 HE ARG 42 HE ARG 42 -4.048 -1.820 4.315 635 HH11 ARG 42 HH11 ARG 42 -3.965 -0.154 7.450 636 HH12 ARG 42 HH12 ARG 42 -3.819 -1.639 8.353 637 HH21 ARG 42 HH21 ARG 42 -3.887 -3.727 5.533 638 HH22 ARG 42 HH22 ARG 42 -3.789 -3.656 7.273 639 H LEU 43 H LEU 43 -4.374 2.416 2.651 640 HA LEU 43 HA LEU 43 -2.845 3.982 0.626 641 HB2 LEU 43 HB2 LEU 43 -5.840 3.574 0.833 642 HB3 LEU 43 HB3 LEU 43 -5.190 5.115 0.236 643 HG LEU 43 HG LEU 43 -4.580 2.372 -0.935 644 HD11 LEU 43 HD11 LEU 43 -6.199 3.075 -2.674 645 HD12 LEU 43 HD12 LEU 43 -6.971 2.996 -1.084 646 HD13 LEU 43 HD13 LEU 43 -6.519 4.574 -1.770 647 HD21 LEU 43 HD21 LEU 43 -4.088 5.218 -1.938 648 HD22 LEU 43 HD22 LEU 43 -2.843 4.040 -1.454 649 HD23 LEU 43 HD23 LEU 43 -3.833 3.740 -2.893 650 H ILE 44 H ILE 44 -2.587 6.132 1.059 651 HA ILE 44 HA ILE 44 -3.452 7.112 3.731 652 HB ILE 44 HB ILE 44 -0.660 7.169 2.520 653 HG12 ILE 44 HG12 ILE 44 -0.250 6.403 5.026 654 HG13 ILE 44 HG13 ILE 44 -1.950 5.945 4.970 655 HG21 ILE 44 HG21 ILE 44 -1.208 9.428 3.489 656 HG22 ILE 44 HG22 ILE 44 -1.604 8.615 5.029 657 HG23 ILE 44 HG23 ILE 44 0.040 8.573 4.387 658 HD11 ILE 44 HD11 ILE 44 0.242 4.960 3.088 659 HD12 ILE 44 HD12 ILE 44 -0.466 4.057 4.449 660 HD13 ILE 44 HD13 ILE 44 -1.460 4.431 3.041 661 H PHE 45 H PHE 45 -3.771 9.395 3.793 662 HA PHE 45 HA PHE 45 -3.470 10.989 1.331 663 HB2 PHE 45 HB2 PHE 45 -5.704 9.834 1.228 664 HB3 PHE 45 HB3 PHE 45 -6.111 10.553 2.783 665 HD1 PHE 45 HD1 PHE 45 -4.694 11.848 -0.467 666 HD2 PHE 45 HD2 PHE 45 -7.607 12.310 2.668 667 HE1 PHE 45 HE1 PHE 45 -5.638 13.792 -1.643 668 HE2 PHE 45 HE2 PHE 45 -8.546 14.281 1.507 669 HZ PHE 45 HZ PHE 45 -7.564 15.041 -0.647 670 H ALA 46 H ALA 46 -3.227 13.156 1.805 671 HA ALA 46 HA ALA 46 -2.395 14.837 3.052 672 HB1 ALA 46 HB1 ALA 46 -4.770 14.165 4.830 673 HB2 ALA 46 HB2 ALA 46 -3.903 15.715 4.776 674 HB3 ALA 46 HB3 ALA 46 -4.820 15.157 3.357 675 H GLY 47 H GLY 47 -1.763 11.854 3.950 676 HA2 GLY 47 HA2 GLY 47 0.167 11.315 5.175 677 HA3 GLY 47 HA3 GLY 47 -0.070 12.710 6.226 678 H LYS 48 H LYS 48 -2.999 10.891 5.689 679 HA LYS 48 HA LYS 48 -2.401 9.157 8.027 680 HB2 LYS 48 HB2 LYS 48 -4.667 9.486 8.909 681 HB3 LYS 48 HB3 LYS 48 -3.693 10.956 8.919 682 HG2 LYS 48 HG2 LYS 48 -5.783 11.653 8.248 683 HG3 LYS 48 HG3 LYS 48 -4.821 11.604 6.755 684 HD2 LYS 48 HD2 LYS 48 -5.941 9.398 6.191 685 HD3 LYS 48 HD3 LYS 48 -6.957 9.582 7.630 686 HE2 LYS 48 HE2 LYS 48 -6.759 11.498 5.271 687 HE3 LYS 48 HE3 LYS 48 -8.102 10.394 5.612 688 HZ1 LYS 48 HZ1 LYS 48 -7.246 12.628 7.331 689 HZ2 LYS 48 HZ2 LYS 48 -8.570 12.621 6.357 690 HZ3 LYS 48 HZ3 LYS 48 -8.492 11.608 7.653 691 H GLN 49 H GLN 49 -3.935 7.383 8.218 692 HA GLN 49 HA GLN 49 -3.964 6.100 5.542 693 HB2 GLN 49 HB2 GLN 49 -2.565 5.135 7.304 694 HB3 GLN 49 HB3 GLN 49 -3.965 4.999 8.372 695 HG2 GLN 49 HG2 GLN 49 -5.030 3.440 6.714 696 HG3 GLN 49 HG3 GLN 49 -3.575 3.574 5.703 697 HE21 GLN 49 HE21 GLN 49 -1.438 3.156 7.065 698 HE22 GLN 49 HE22 GLN 49 -1.505 1.763 8.128 699 H LEU 50 H LEU 50 -5.735 5.363 4.618 700 HA LEU 50 HA LEU 50 -8.327 6.168 5.704 701 HB2 LEU 50 HB2 LEU 50 -7.729 4.655 3.137 702 HB3 LEU 50 HB3 LEU 50 -9.138 5.668 3.502 703 HG LEU 50 HG LEU 50 -6.260 6.647 3.171 704 HD11 LEU 50 HD11 LEU 50 -8.702 7.036 1.402 705 HD12 LEU 50 HD12 LEU 50 -7.085 7.711 1.137 706 HD13 LEU 50 HD13 LEU 50 -7.331 5.949 1.050 707 HD21 LEU 50 HD21 LEU 50 -7.179 8.894 3.284 708 HD22 LEU 50 HD22 LEU 50 -8.819 8.260 3.469 709 HD23 LEU 50 HD23 LEU 50 -7.614 8.037 4.775 710 H GLU 51 H GLU 51 -10.216 4.550 5.624 711 HA GLU 51 HA GLU 51 -9.305 1.773 6.205 712 HB2 GLU 51 HB2 GLU 51 -10.932 3.609 7.979 713 HB3 GLU 51 HB3 GLU 51 -11.076 1.845 8.092 714 HG2 GLU 51 HG2 GLU 51 -8.678 1.638 8.523 715 HG3 GLU 51 HG3 GLU 51 -8.470 3.383 8.335 716 H ASP 52 H ASP 52 -10.876 0.184 6.053 717 HA ASP 52 HA ASP 52 -12.605 0.504 3.782 718 HB2 ASP 52 HB2 ASP 52 -12.297 -1.783 5.768 719 HB3 ASP 52 HB3 ASP 52 -13.079 -1.876 4.186 720 H GLY 53 H GLY 53 -13.089 1.503 6.897 721 HA2 GLY 53 HA2 GLY 53 -15.978 0.786 6.911 722 HA3 GLY 53 HA3 GLY 53 -15.005 1.145 8.354 723 H ARG 54 H ARG 54 -14.254 3.138 5.651 724 HA ARG 54 HA ARG 54 -15.854 5.396 6.757 725 HB2 ARG 54 HB2 ARG 54 -13.264 5.565 5.192 726 HB3 ARG 54 HB3 ARG 54 -14.019 6.816 6.173 727 HG2 ARG 54 HG2 ARG 54 -12.857 4.225 7.292 728 HG3 ARG 54 HG3 ARG 54 -11.991 5.764 7.213 729 HD2 ARG 54 HD2 ARG 54 -13.657 6.832 8.624 730 HD3 ARG 54 HD3 ARG 54 -14.602 5.327 8.710 731 HE ARG 54 HE ARG 54 -12.108 4.553 9.568 732 HH11 ARG 54 HH11 ARG 54 -14.320 7.119 10.580 733 HH12 ARG 54 HH12 ARG 54 -13.739 7.119 12.232 734 HH21 ARG 54 HH21 ARG 54 -11.357 4.599 11.672 735 HH22 ARG 54 HH22 ARG 54 -12.062 5.680 12.859 736 H THR 55 H THR 55 -15.102 7.099 4.586 737 HA THR 55 HA THR 55 -15.811 5.837 2.039 738 HB THR 55 HB THR 55 -17.401 7.858 1.639 739 HG1 THR 55 HG1 THR 55 -18.261 8.757 3.424 740 HG21 THR 55 HG21 THR 55 -18.112 5.430 1.907 741 HG22 THR 55 HG22 THR 55 -18.320 5.759 3.645 742 HG23 THR 55 HG23 THR 55 -19.321 6.615 2.449 743 H LEU 56 H LEU 56 -15.178 7.267 0.235 744 HA LEU 56 HA LEU 56 -12.782 8.737 0.792 745 HB2 LEU 56 HB2 LEU 56 -14.669 8.711 -1.602 746 HB3 LEU 56 HB3 LEU 56 -13.135 9.579 -1.578 747 HG LEU 56 HG LEU 56 -13.531 6.566 -1.281 748 HD11 LEU 56 HD11 LEU 56 -13.762 7.429 -3.583 749 HD12 LEU 56 HD12 LEU 56 -12.201 8.267 -3.436 750 HD13 LEU 56 HD13 LEU 56 -12.262 6.492 -3.410 751 HD21 LEU 56 HD21 LEU 56 -10.937 8.165 -1.334 752 HD22 LEU 56 HD22 LEU 56 -11.585 7.294 0.088 753 HD23 LEU 56 HD23 LEU 56 -11.069 6.400 -1.353 754 H SER 57 H SER 57 -16.178 9.534 0.823 755 HA SER 57 HA SER 57 -15.926 12.393 0.780 756 HB2 SER 57 HB2 SER 57 -18.306 12.241 1.396 757 HB3 SER 57 HB3 SER 57 -17.922 11.075 0.110 758 HG SER 57 HG SER 57 -19.171 10.155 1.777 759 H ASP 58 H ASP 58 -15.671 9.900 3.270 760 HA ASP 58 HA ASP 58 -16.095 11.624 5.540 761 HB2 ASP 58 HB2 ASP 58 -16.177 9.051 5.425 762 HB3 ASP 58 HB3 ASP 58 -14.410 9.102 5.461 763 H TYR 59 H TYR 59 -13.525 11.251 3.306 764 HA TYR 59 HA TYR 59 -11.670 12.713 5.115 765 HB2 TYR 59 HB2 TYR 59 -11.067 10.456 3.170 766 HB3 TYR 59 HB3 TYR 59 -9.830 11.478 3.907 767 HD1 TYR 59 HD1 TYR 59 -10.778 11.746 6.695 768 HD2 TYR 59 HD2 TYR 59 -10.783 8.326 4.090 769 HE1 TYR 59 HE1 TYR 59 -10.588 10.251 8.664 770 HE2 TYR 59 HE2 TYR 59 -10.531 6.829 6.047 771 HH TYR 59 HH TYR 59 -10.365 6.695 8.338 772 H ASN 60 H ASN 60 -13.687 13.500 3.060 773 HA ASN 60 HA ASN 60 -13.969 14.960 1.423 774 HB2 ASN 60 HB2 ASN 60 -12.992 17.041 1.868 775 HB3 ASN 60 HB3 ASN 60 -13.123 16.198 3.416 776 HD21 ASN 60 HD21 ASN 60 -11.336 15.760 4.637 777 HD22 ASN 60 HD22 ASN 60 -9.712 16.247 4.183 778 H ILE 61 H ILE 61 -12.004 12.735 0.630 779 HA ILE 61 HA ILE 61 -10.062 13.848 -1.127 780 HB ILE 61 HB ILE 61 -11.555 11.200 -1.132 781 HG12 ILE 61 HG12 ILE 61 -8.692 11.873 -0.357 782 HG13 ILE 61 HG13 ILE 61 -10.025 11.834 0.815 783 HG21 ILE 61 HG21 ILE 61 -9.112 12.053 -2.752 784 HG22 ILE 61 HG22 ILE 61 -9.754 10.398 -2.661 785 HG23 ILE 61 HG23 ILE 61 -10.719 11.677 -3.412 786 HD11 ILE 61 HD11 ILE 61 -10.436 9.472 0.322 787 HD12 ILE 61 HD12 ILE 61 -9.107 9.476 -0.872 788 HD13 ILE 61 HD13 ILE 61 -8.762 9.740 0.846 789 H GLN 62 H GLN 62 -10.108 14.557 -3.195 790 HA GLN 62 HA GLN 62 -12.699 14.580 -4.686 791 HB2 GLN 62 HB2 GLN 62 -10.599 16.772 -4.617 792 HB3 GLN 62 HB3 GLN 62 -12.205 16.841 -5.357 793 HG2 GLN 62 HG2 GLN 62 -11.634 16.573 -2.377 794 HG3 GLN 62 HG3 GLN 62 -12.007 18.074 -3.188 795 HE21 GLN 62 HE21 GLN 62 -13.466 16.593 -1.028 796 HE22 GLN 62 HE22 GLN 62 -15.102 16.393 -1.633 797 H LYS 63 H LYS 63 -11.990 15.584 -6.998 798 HA LYS 63 HA LYS 63 -10.426 13.592 -8.306 799 HB2 LYS 63 HB2 LYS 63 -10.781 14.933 -10.240 800 HB3 LYS 63 HB3 LYS 63 -12.267 14.959 -9.282 801 HG2 LYS 63 HG2 LYS 63 -11.616 17.190 -8.359 802 HG3 LYS 63 HG3 LYS 63 -10.146 17.157 -9.358 803 HD2 LYS 63 HD2 LYS 63 -11.810 18.488 -10.491 804 HD3 LYS 63 HD3 LYS 63 -11.568 16.977 -11.396 805 HE2 LYS 63 HE2 LYS 63 -13.599 16.024 -10.379 806 HE3 LYS 63 HE3 LYS 63 -13.817 17.490 -9.405 807 HZ1 LYS 63 HZ1 LYS 63 -14.094 18.725 -11.434 808 HZ2 LYS 63 HZ2 LYS 63 -13.877 17.374 -12.346 809 HZ3 LYS 63 HZ3 LYS 63 -15.191 17.505 -11.369 810 H GLU 64 H GLU 64 -8.427 13.482 -8.976 811 HA GLU 64 HA GLU 64 -6.206 13.814 -9.109 812 HB2 GLU 64 HB2 GLU 64 -6.991 16.739 -9.363 813 HB3 GLU 64 HB3 GLU 64 -5.503 15.971 -9.939 814 HG2 GLU 64 HG2 GLU 64 -6.891 14.502 -11.433 815 HG3 GLU 64 HG3 GLU 64 -8.333 15.393 -10.916 816 H SER 65 H SER 65 -7.440 14.015 -6.319 817 HA SER 65 HA SER 65 -6.102 16.107 -4.942 818 HB2 SER 65 HB2 SER 65 -7.478 13.572 -4.009 819 HB3 SER 65 HB3 SER 65 -6.841 14.820 -2.907 820 HG SER 65 HG SER 65 -8.165 16.335 -3.958 821 H THR 66 H THR 66 -4.930 13.129 -6.075 822 HA THR 66 HA THR 66 -3.140 11.822 -5.790 823 HB THR 66 HB THR 66 -1.978 14.324 -4.574 824 HG1 THR 66 HG1 THR 66 -2.612 14.482 -6.730 825 HG21 THR 66 HG21 THR 66 -0.611 12.388 -3.875 826 HG22 THR 66 HG22 THR 66 -0.601 11.759 -5.532 827 HG23 THR 66 HG23 THR 66 0.237 13.275 -5.151 828 H LEU 67 H LEU 67 -2.552 10.235 -4.530 829 HA LEU 67 HA LEU 67 -2.819 10.392 -1.560 830 HB2 LEU 67 HB2 LEU 67 -4.226 8.601 -3.538 831 HB3 LEU 67 HB3 LEU 67 -3.696 7.908 -2.002 832 HG LEU 67 HG LEU 67 -4.965 9.791 -0.839 833 HD11 LEU 67 HD11 LEU 67 -5.428 11.261 -2.775 834 HD12 LEU 67 HD12 LEU 67 -6.265 9.925 -3.602 835 HD13 LEU 67 HD13 LEU 67 -6.942 10.633 -2.115 836 HD21 LEU 67 HD21 LEU 67 -6.461 7.695 -2.462 837 HD22 LEU 67 HD22 LEU 67 -5.657 7.438 -0.893 838 HD23 LEU 67 HD23 LEU 67 -7.061 8.522 -1.003 839 H HIS 68 H HIS 68 -1.989 8.003 -0.798 840 HA HIS 68 HA HIS 68 0.424 7.338 -2.408 841 HB2 HIS 68 HB2 HIS 68 0.388 7.803 0.591 842 HB3 HIS 68 HB3 HIS 68 1.789 7.357 -0.391 843 HD2 HIS 68 HD2 HIS 68 2.539 9.298 -2.318 844 HE1 HIS 68 HE1 HIS 68 0.810 12.553 -0.201 845 HE2 HIS 68 HE2 HIS 68 2.403 11.898 -2.076 846 H LEU 69 H LEU 69 0.979 5.242 -2.430 847 HA LEU 69 HA LEU 69 -0.842 3.285 -1.106 848 HB2 LEU 69 HB2 LEU 69 -1.437 3.523 -3.440 849 HB3 LEU 69 HB3 LEU 69 0.257 3.522 -3.929 850 HG LEU 69 HG LEU 69 0.503 1.170 -3.307 851 HD11 LEU 69 HD11 LEU 69 -1.094 0.936 -1.484 852 HD12 LEU 69 HD12 LEU 69 -2.446 1.353 -2.561 853 HD13 LEU 69 HD13 LEU 69 -1.557 -0.169 -2.793 854 HD21 LEU 69 HD21 LEU 69 -1.933 1.711 -5.053 855 HD22 LEU 69 HD22 LEU 69 -0.237 1.812 -5.576 856 HD23 LEU 69 HD23 LEU 69 -0.916 0.246 -5.082 857 H VAL 70 H VAL 70 0.112 1.732 -0.020 858 HA VAL 70 HA VAL 70 2.806 0.778 -0.732 859 HB VAL 70 HB VAL 70 2.070 1.621 2.107 860 HG11 VAL 70 HG11 VAL 70 4.636 0.562 0.847 861 HG12 VAL 70 HG12 VAL 70 4.523 1.217 2.494 862 HG13 VAL 70 HG13 VAL 70 3.644 -0.261 2.069 863 HG21 VAL 70 HG21 VAL 70 2.454 3.635 0.770 864 HG22 VAL 70 HG22 VAL 70 3.846 3.350 1.822 865 HG23 VAL 70 HG23 VAL 70 3.947 2.935 0.096 866 H LEU 71 H LEU 71 3.156 -1.406 0.354 867 HA LEU 71 HA LEU 71 0.648 -2.649 1.277 868 HB2 LEU 71 HB2 LEU 71 0.893 -4.453 -0.467 869 HB3 LEU 71 HB3 LEU 71 0.348 -2.876 -1.028 870 HG LEU 71 HG LEU 71 2.677 -2.367 -1.824 871 HD11 LEU 71 HD11 LEU 71 3.108 -5.325 -1.214 872 HD12 LEU 71 HD12 LEU 71 4.171 -4.330 -2.229 873 HD13 LEU 71 HD13 LEU 71 4.020 -3.957 -0.514 874 HD21 LEU 71 HD21 LEU 71 1.326 -4.857 -2.931 875 HD22 LEU 71 HD22 LEU 71 0.876 -3.172 -3.288 876 HD23 LEU 71 HD23 LEU 71 2.456 -3.803 -3.807 877 H ARG 72 H ARG 72 0.945 -4.937 1.899 878 HA ARG 72 HA ARG 72 3.400 -5.223 3.497 879 HB2 ARG 72 HB2 ARG 72 0.791 -6.736 3.174 880 HB3 ARG 72 HB3 ARG 72 2.190 -7.527 3.912 881 HG2 ARG 72 HG2 ARG 72 0.770 -6.538 5.638 882 HG3 ARG 72 HG3 ARG 72 2.368 -5.779 5.608 883 HD2 ARG 72 HD2 ARG 72 1.426 -3.869 4.325 884 HD3 ARG 72 HD3 ARG 72 -0.183 -4.620 4.426 885 HE ARG 72 HE ARG 72 0.908 -4.435 7.039 886 HH11 ARG 72 HH11 ARG 72 -0.303 -2.294 4.504 887 HH12 ARG 72 HH12 ARG 72 -0.792 -1.050 5.634 888 HH21 ARG 72 HH21 ARG 72 0.268 -2.822 8.473 889 HH22 ARG 72 HH22 ARG 72 -0.462 -1.344 7.890 890 H LEU 73 H LEU 73 4.811 -6.980 3.455 891 HA LEU 73 HA LEU 73 5.497 -7.790 0.752 892 HB2 LEU 73 HB2 LEU 73 6.794 -7.704 3.531 893 HB3 LEU 73 HB3 LEU 73 7.624 -8.251 2.072 894 HG LEU 73 HG LEU 73 6.475 -5.456 2.548 895 HD11 LEU 73 HD11 LEU 73 9.344 -6.474 2.432 896 HD12 LEU 73 HD12 LEU 73 8.857 -4.772 2.594 897 HD13 LEU 73 HD13 LEU 73 8.479 -5.923 3.891 898 HD21 LEU 73 HD21 LEU 73 8.078 -6.604 0.224 899 HD22 LEU 73 HD22 LEU 73 6.395 -6.024 0.161 900 HD23 LEU 73 HD23 LEU 73 7.716 -4.877 0.463 901 H ARG 74 H ARG 74 3.301 -8.956 2.279 902 HA ARG 74 HA ARG 74 2.339 -10.862 2.988 903 HB2 ARG 74 HB2 ARG 74 3.290 -11.653 0.805 904 HB3 ARG 74 HB3 ARG 74 4.693 -12.259 1.678 905 HG2 ARG 74 HG2 ARG 74 3.215 -14.092 1.241 906 HG3 ARG 74 HG3 ARG 74 3.192 -13.795 2.988 907 HD2 ARG 74 HD2 ARG 74 1.162 -12.583 1.091 908 HD3 ARG 74 HD3 ARG 74 0.954 -14.214 1.774 909 HE ARG 74 HE ARG 74 1.408 -12.661 3.993 910 HH11 ARG 74 HH11 ARG 74 -0.907 -12.526 1.321 911 HH12 ARG 74 HH12 ARG 74 -2.149 -11.763 2.292 912 HH21 ARG 74 HH21 ARG 74 -0.251 -11.674 5.224 913 HH22 ARG 74 HH22 ARG 74 -1.782 -11.285 4.466 914 H GLY 75 H GLY 75 5.711 -10.440 3.740 915 HA2 GLY 75 HA2 GLY 75 5.951 -10.493 6.290 916 HA3 GLY 75 HA3 GLY 75 5.508 -12.226 6.084 917 H GLY 76 H GLY 76 7.039 -11.643 3.306 918 HA2 GLY 76 HA2 GLY 76 9.773 -11.265 3.776 919 HA3 GLY 76 HA3 GLY 76 9.463 -12.993 4.031 Start of MODEL 10 1 H LEU 491 H LEU 491 15.684 6.594 9.884 2 HA LEU 491 HA LEU 491 18.305 5.985 10.094 3 HB2 LEU 491 HB2 LEU 491 16.884 3.621 9.258 4 HB3 LEU 491 HB3 LEU 491 17.479 4.107 10.828 5 HG LEU 491 HG LEU 491 15.325 5.445 11.139 6 HD11 LEU 491 HD11 LEU 491 14.640 5.495 8.712 7 HD12 LEU 491 HD12 LEU 491 14.487 3.731 8.748 8 HD13 LEU 491 HD13 LEU 491 13.411 4.738 9.747 9 HD21 LEU 491 HD21 LEU 491 15.833 3.277 12.152 10 HD22 LEU 491 HD22 LEU 491 14.098 3.444 11.781 11 HD23 LEU 491 HD23 LEU 491 15.146 2.448 10.736 12 HA PRO 492 HA PRO 492 20.030 5.407 5.960 13 HB2 PRO 492 HB2 PRO 492 21.498 3.197 7.345 14 HB3 PRO 492 HB3 PRO 492 22.159 4.540 6.360 15 HG2 PRO 492 HG2 PRO 492 22.400 4.571 9.057 16 HG3 PRO 492 HG3 PRO 492 21.950 6.068 8.168 17 HD2 PRO 492 HD2 PRO 492 20.117 4.131 9.621 18 HD3 PRO 492 HD3 PRO 492 20.133 5.917 9.676 19 H LEU 493 H LEU 493 20.761 3.287 4.738 20 HA LEU 493 HA LEU 493 18.478 1.569 4.402 21 HB2 LEU 493 HB2 LEU 493 20.689 2.501 2.948 22 HB3 LEU 493 HB3 LEU 493 21.119 0.823 3.213 23 HG LEU 493 HG LEU 493 18.451 1.819 2.115 24 HD11 LEU 493 HD11 LEU 493 20.881 0.762 0.617 25 HD12 LEU 493 HD12 LEU 493 19.302 1.137 -0.117 26 HD13 LEU 493 HD13 LEU 493 20.272 2.439 0.602 27 HD21 LEU 493 HD21 LEU 493 18.163 -0.504 1.311 28 HD22 LEU 493 HD22 LEU 493 19.726 -0.955 2.033 29 HD23 LEU 493 HD23 LEU 493 18.367 -0.484 3.077 30 H GLN 494 H GLN 494 19.571 1.589 7.023 31 HA GLN 494 HA GLN 494 21.337 -0.562 7.562 32 HB2 GLN 494 HB2 GLN 494 20.126 -0.296 9.907 33 HB3 GLN 494 HB3 GLN 494 21.290 0.874 9.278 34 HG2 GLN 494 HG2 GLN 494 19.560 2.091 10.266 35 HG3 GLN 494 HG3 GLN 494 19.439 2.328 8.523 36 HE21 GLN 494 HE21 GLN 494 17.953 1.097 11.422 37 HE22 GLN 494 HE22 GLN 494 16.408 0.632 10.722 38 H ALA 495 H ALA 495 17.824 -0.364 7.428 39 HA ALA 495 HA ALA 495 17.690 -3.324 7.515 40 HB1 ALA 495 HB1 ALA 495 15.822 -3.181 9.169 41 HB2 ALA 495 HB2 ALA 495 17.369 -2.584 9.826 42 HB3 ALA 495 HB3 ALA 495 16.124 -1.429 9.307 43 H LEU 496 H LEU 496 16.913 -0.568 5.845 44 HA LEU 496 HA LEU 496 14.257 -1.201 4.963 45 HB2 LEU 496 HB2 LEU 496 16.577 0.476 4.003 46 HB3 LEU 496 HB3 LEU 496 15.286 0.086 2.867 47 HG LEU 496 HG LEU 496 13.612 0.997 4.493 48 HD11 LEU 496 HD11 LEU 496 14.921 0.769 6.566 49 HD12 LEU 496 HD12 LEU 496 16.093 1.967 5.979 50 HD13 LEU 496 HD13 LEU 496 14.415 2.456 6.310 51 HD21 LEU 496 HD21 LEU 496 14.505 2.360 2.637 52 HD22 LEU 496 HD22 LEU 496 14.207 3.374 4.066 53 HD23 LEU 496 HD23 LEU 496 15.870 2.871 3.654 54 HA PRO 497 HA PRO 497 14.825 -4.649 2.220 55 HB2 PRO 497 HB2 PRO 497 13.494 -2.865 0.186 56 HB3 PRO 497 HB3 PRO 497 13.124 -4.573 0.573 57 HG2 PRO 497 HG2 PRO 497 11.550 -2.597 1.542 58 HG3 PRO 497 HG3 PRO 497 12.048 -3.953 2.616 59 HD2 PRO 497 HD2 PRO 497 13.189 -1.160 2.461 60 HD3 PRO 497 HD3 PRO 497 12.839 -2.159 3.907 61 H GLU 498 H GLU 498 16.103 -5.321 0.386 62 HA GLU 498 HA GLU 498 18.392 -3.603 0.021 63 HB2 GLU 498 HB2 GLU 498 18.424 -6.108 0.377 64 HB3 GLU 498 HB3 GLU 498 17.784 -6.281 -1.274 65 HG2 GLU 498 HG2 GLU 498 20.197 -6.561 -1.315 66 HG3 GLU 498 HG3 GLU 498 19.785 -5.046 -2.132 67 H GLY 499 H GLY 499 17.048 -1.932 -0.964 68 HA2 GLY 499 HA2 GLY 499 17.924 -1.330 -3.496 69 HA3 GLY 499 HA3 GLY 499 16.387 -2.185 -3.776 70 H VAL 500 H VAL 500 15.204 -1.217 -1.237 71 HA VAL 500 HA VAL 500 14.030 1.239 -2.143 72 HB VAL 500 HB VAL 500 13.996 -0.233 0.514 73 HG11 VAL 500 HG11 VAL 500 13.282 2.106 0.932 74 HG12 VAL 500 HG12 VAL 500 12.202 2.040 -0.478 75 HG13 VAL 500 HG13 VAL 500 11.877 1.036 0.953 76 HG21 VAL 500 HG21 VAL 500 12.002 -0.065 -1.788 77 HG22 VAL 500 HG22 VAL 500 13.044 -1.461 -1.434 78 HG23 VAL 500 HG23 VAL 500 11.775 -0.984 -0.286 79 H ASP 501 H ASP 501 14.005 3.248 -0.736 80 HA ASP 501 HA ASP 501 16.627 3.863 0.541 81 HB2 ASP 501 HB2 ASP 501 16.476 4.423 -2.036 82 HB3 ASP 501 HB3 ASP 501 15.386 5.702 -1.513 83 H GLN 502 H GLN 502 16.525 5.412 2.045 84 HA GLN 502 HA GLN 502 14.071 5.827 3.397 85 HB2 GLN 502 HB2 GLN 502 15.500 7.691 4.512 86 HB3 GLN 502 HB3 GLN 502 15.922 5.995 4.760 87 HG2 GLN 502 HG2 GLN 502 17.189 7.596 2.509 88 HG3 GLN 502 HG3 GLN 502 17.781 7.711 4.173 89 HE21 GLN 502 HE21 GLN 502 16.697 4.562 3.937 90 HE22 GLN 502 HE22 GLN 502 18.210 3.808 3.476 91 H GLU 503 H GLU 503 15.622 7.639 0.747 92 HA GLU 503 HA GLU 503 14.002 9.984 1.181 93 HB2 GLU 503 HB2 GLU 503 14.943 10.818 -0.836 94 HB3 GLU 503 HB3 GLU 503 16.231 9.880 -0.060 95 HG2 GLU 503 HG2 GLU 503 15.559 7.927 -1.533 96 HG3 GLU 503 HG3 GLU 503 14.431 9.002 -2.364 97 H VAL 504 H VAL 504 13.053 6.926 0.287 98 HA VAL 504 HA VAL 504 10.589 8.053 -0.886 99 HB VAL 504 HB VAL 504 12.110 7.314 -2.678 100 HG11 VAL 504 HG11 VAL 504 12.329 4.891 -3.139 101 HG12 VAL 504 HG12 VAL 504 13.136 5.338 -1.627 102 HG13 VAL 504 HG13 VAL 504 11.549 4.521 -1.584 103 HG21 VAL 504 HG21 VAL 504 10.414 6.201 -3.989 104 HG22 VAL 504 HG22 VAL 504 9.526 5.719 -2.528 105 HG23 VAL 504 HG23 VAL 504 9.657 7.440 -2.968 106 H PHE 505 H PHE 505 11.737 6.792 1.694 107 HA PHE 505 HA PHE 505 9.371 5.040 2.232 108 HB2 PHE 505 HB2 PHE 505 11.031 3.488 2.464 109 HB3 PHE 505 HB3 PHE 505 12.278 4.702 2.691 110 HD1 PHE 505 HD1 PHE 505 12.602 5.820 4.900 111 HD2 PHE 505 HD2 PHE 505 10.069 2.389 4.394 112 HE1 PHE 505 HE1 PHE 505 12.788 5.336 7.317 113 HE2 PHE 505 HE2 PHE 505 10.297 1.870 6.822 114 HZ PHE 505 HZ PHE 505 11.661 3.330 8.279 115 H LYS 506 H LYS 506 11.285 7.863 3.027 116 HA LYS 506 HA LYS 506 10.012 8.320 5.594 117 HB2 LYS 506 HB2 LYS 506 11.607 10.042 3.668 118 HB3 LYS 506 HB3 LYS 506 10.891 10.692 5.159 119 HG2 LYS 506 HG2 LYS 506 12.060 8.977 6.495 120 HG3 LYS 506 HG3 LYS 506 12.839 8.347 5.042 121 HD2 LYS 506 HD2 LYS 506 13.113 11.202 6.076 122 HD3 LYS 506 HD3 LYS 506 14.285 9.892 6.345 123 HE2 LYS 506 HE2 LYS 506 14.641 9.700 3.918 124 HE3 LYS 506 HE3 LYS 506 13.473 11.003 3.632 125 HZ1 LYS 506 HZ1 LYS 506 14.896 12.490 4.832 126 HZ2 LYS 506 HZ2 LYS 506 15.936 11.280 5.225 127 HZ3 LYS 506 HZ3 LYS 506 15.784 11.761 3.660 128 H GLN 507 H GLN 507 8.575 8.089 2.634 129 HA GLN 507 HA GLN 507 6.830 10.436 2.886 130 HB2 GLN 507 HB2 GLN 507 6.214 8.105 1.090 131 HB3 GLN 507 HB3 GLN 507 5.970 9.835 0.824 132 HG2 GLN 507 HG2 GLN 507 8.543 8.230 0.634 133 HG3 GLN 507 HG3 GLN 507 7.704 9.056 -0.671 134 HE21 GLN 507 HE21 GLN 507 10.527 9.276 0.403 135 HE22 GLN 507 HE22 GLN 507 10.748 10.964 0.753 136 H LEU 508 H LEU 508 7.161 7.513 4.414 137 HA LEU 508 HA LEU 508 4.330 6.688 4.592 138 HB2 LEU 508 HB2 LEU 508 7.010 5.643 5.578 139 HB3 LEU 508 HB3 LEU 508 5.489 4.875 5.984 140 HG LEU 508 HG LEU 508 5.100 4.172 3.750 141 HD11 LEU 508 HD11 LEU 508 5.679 6.100 2.412 142 HD12 LEU 508 HD12 LEU 508 7.404 5.922 2.829 143 HD13 LEU 508 HD13 LEU 508 6.580 4.690 1.844 144 HD21 LEU 508 HD21 LEU 508 7.010 2.770 3.355 145 HD22 LEU 508 HD22 LEU 508 8.098 3.925 4.162 146 HD23 LEU 508 HD23 LEU 508 6.911 3.023 5.115 147 HA PRO 509 HA PRO 509 3.956 8.430 8.740 148 HB2 PRO 509 HB2 PRO 509 2.122 6.728 9.837 149 HB3 PRO 509 HB3 PRO 509 1.690 7.962 8.624 150 HG2 PRO 509 HG2 PRO 509 2.277 5.019 8.210 151 HG3 PRO 509 HG3 PRO 509 0.906 5.961 7.531 152 HD2 PRO 509 HD2 PRO 509 3.170 5.418 6.086 153 HD3 PRO 509 HD3 PRO 509 2.302 6.976 5.917 154 H ALA 510 H ALA 510 4.171 7.744 11.004 155 HA ALA 510 HA ALA 510 6.455 6.151 11.477 156 HB1 ALA 510 HB1 ALA 510 5.806 6.503 13.850 157 HB2 ALA 510 HB2 ALA 510 5.682 8.004 12.897 158 HB3 ALA 510 HB3 ALA 510 4.213 7.096 13.303 159 H ASP 511 H ASP 511 3.124 5.188 11.047 160 HA ASP 511 HA ASP 511 3.611 2.626 12.443 161 HB2 ASP 511 HB2 ASP 511 1.194 2.265 12.184 162 HB3 ASP 511 HB3 ASP 511 1.556 3.785 13.016 163 H ILE 512 H ILE 512 4.244 3.827 9.440 164 HA ILE 512 HA ILE 512 4.124 1.032 8.409 165 HB ILE 512 HB ILE 512 3.989 3.600 6.806 166 HG12 ILE 512 HG12 ILE 512 2.033 1.328 7.364 167 HG13 ILE 512 HG13 ILE 512 1.899 2.992 7.955 168 HG21 ILE 512 HG21 ILE 512 5.297 1.823 5.630 169 HG22 ILE 512 HG22 ILE 512 3.946 0.691 5.869 170 HG23 ILE 512 HG23 ILE 512 3.754 2.132 4.840 171 HD11 ILE 512 HD11 ILE 512 1.713 3.783 5.586 172 HD12 ILE 512 HD12 ILE 512 1.686 2.077 5.062 173 HD13 ILE 512 HD13 ILE 512 0.396 2.705 6.103 174 H GLN 513 H GLN 513 6.127 3.713 9.404 175 HA GLN 513 HA GLN 513 8.583 3.032 8.195 176 HB2 GLN 513 HB2 GLN 513 7.614 4.378 10.634 177 HB3 GLN 513 HB3 GLN 513 9.084 3.438 10.946 178 HG2 GLN 513 HG2 GLN 513 9.614 5.753 10.358 179 HG3 GLN 513 HG3 GLN 513 10.291 4.587 9.209 180 HE21 GLN 513 HE21 GLN 513 9.732 4.689 7.064 181 HE22 GLN 513 HE22 GLN 513 8.619 5.865 6.407 182 H GLU 514 H GLU 514 6.799 1.539 10.899 183 HA GLU 514 HA GLU 514 8.841 -0.446 11.433 184 HB2 GLU 514 HB2 GLU 514 7.222 -1.287 13.063 185 HB3 GLU 514 HB3 GLU 514 7.366 0.474 13.180 186 HG2 GLU 514 HG2 GLU 514 5.286 0.731 11.861 187 HG3 GLU 514 HG3 GLU 514 5.157 -1.026 11.709 188 H GLU 515 H GLU 515 6.756 -0.209 8.818 189 HA GLU 515 HA GLU 515 6.169 -3.132 8.783 190 HB2 GLU 515 HB2 GLU 515 5.154 -0.847 7.052 191 HB3 GLU 515 HB3 GLU 515 4.650 -2.533 6.921 192 HG2 GLU 515 HG2 GLU 515 4.323 -0.913 9.478 193 HG3 GLU 515 HG3 GLU 515 3.113 -0.946 8.197 194 H ILE 516 H ILE 516 8.254 -0.707 7.392 195 HA ILE 516 HA ILE 516 8.995 -2.542 5.160 196 HB ILE 516 HB ILE 516 9.344 0.420 5.680 197 HG12 ILE 516 HG12 ILE 516 8.329 0.713 3.545 198 HG13 ILE 516 HG13 ILE 516 8.429 -1.016 3.162 199 HG21 ILE 516 HG21 ILE 516 10.732 0.495 3.589 200 HG22 ILE 516 HG22 ILE 516 11.548 -0.348 4.918 201 HG23 ILE 516 HG23 ILE 516 10.774 -1.277 3.602 202 HD11 ILE 516 HD11 ILE 516 6.135 -0.215 3.749 203 HD12 ILE 516 HD12 ILE 516 6.711 -1.530 4.791 204 HD13 ILE 516 HD13 ILE 516 6.729 0.161 5.383 205 H LEU 517 H LEU 517 10.173 -0.927 8.118 206 HA LEU 517 HA LEU 517 12.858 -1.960 7.951 207 HB2 LEU 517 HB2 LEU 517 11.073 -0.975 10.211 208 HB3 LEU 517 HB3 LEU 517 12.734 -1.512 10.488 209 HG LEU 517 HG LEU 517 12.005 0.698 8.519 210 HD11 LEU 517 HD11 LEU 517 12.748 2.269 10.246 211 HD12 LEU 517 HD12 LEU 517 11.368 1.322 10.836 212 HD13 LEU 517 HD13 LEU 517 13.019 0.928 11.385 213 HD21 LEU 517 HD21 LEU 517 14.636 -0.080 9.859 214 HD22 LEU 517 HD22 LEU 517 14.210 -0.435 8.166 215 HD23 LEU 517 HD23 LEU 517 14.410 1.246 8.707 216 H SER 518 H SER 518 9.945 -3.532 8.163 217 HA SER 518 HA SER 518 11.222 -5.915 9.410 218 HB2 SER 518 HB2 SER 518 8.370 -4.966 9.873 219 HB3 SER 518 HB3 SER 518 9.086 -6.472 10.482 220 HG SER 518 HG SER 518 9.149 -4.754 12.014 221 H GLY 519 H GLY 519 10.282 -4.749 6.562 222 HA2 GLY 519 HA2 GLY 519 8.891 -7.236 5.666 223 HA3 GLY 519 HA3 GLY 519 9.008 -5.707 4.769 224 H LYS 520 H LYS 520 11.660 -5.071 4.980 225 HA LYS 520 HA LYS 520 13.672 -5.340 4.082 226 HB2 LYS 520 HB2 LYS 520 13.400 -8.086 5.323 227 HB3 LYS 520 HB3 LYS 520 14.908 -7.193 5.007 228 HG2 LYS 520 HG2 LYS 520 14.244 -5.476 6.646 229 HG3 LYS 520 HG3 LYS 520 12.685 -6.294 6.907 230 HD2 LYS 520 HD2 LYS 520 13.943 -8.342 7.643 231 HD3 LYS 520 HD3 LYS 520 15.441 -7.373 7.591 232 HE2 LYS 520 HE2 LYS 520 14.366 -5.745 9.165 233 HE3 LYS 520 HE3 LYS 520 12.937 -6.789 9.226 234 HZ1 LYS 520 HZ1 LYS 520 15.649 -7.566 10.077 235 HZ2 LYS 520 HZ2 LYS 520 14.401 -7.191 11.077 236 HZ3 LYS 520 HZ3 LYS 520 14.325 -8.533 10.129 237 H SER 521 H SER 521 11.288 -6.868 2.481 238 HA SER 521 HA SER 521 13.008 -7.798 0.316 239 HB2 SER 521 HB2 SER 521 13.064 -9.693 1.932 240 HB3 SER 521 HB3 SER 521 11.292 -9.763 1.902 241 HG SER 521 HG SER 521 12.368 -11.244 0.462 242 H ARG 522 H ARG 522 11.484 -9.015 -1.284 243 HA ARG 522 HA ARG 522 9.769 -9.082 -2.680 244 HB2 ARG 522 HB2 ARG 522 8.577 -9.269 -0.261 245 HB3 ARG 522 HB3 ARG 522 7.805 -7.783 -0.840 246 HG2 ARG 522 HG2 ARG 522 6.421 -9.615 -1.563 247 HG3 ARG 522 HG3 ARG 522 7.302 -9.017 -2.995 248 HD2 ARG 522 HD2 ARG 522 7.242 -11.489 -2.909 249 HD3 ARG 522 HD3 ARG 522 8.883 -10.864 -2.865 250 HE ARG 522 HE ARG 522 9.073 -11.433 -0.559 251 HH11 ARG 522 HH11 ARG 522 5.988 -12.495 -1.970 252 HH12 ARG 522 HH12 ARG 522 5.707 -13.661 -0.687 253 HH21 ARG 522 HH21 ARG 522 8.612 -12.951 1.087 254 HH22 ARG 522 HH22 ARG 522 7.129 -13.885 0.998 255 H GLU 523 H GLU 523 11.182 -6.287 -1.751 256 HA GLU 523 HA GLU 523 10.159 -4.976 -4.146 257 HB2 GLU 523 HB2 GLU 523 9.638 -2.875 -3.038 258 HB3 GLU 523 HB3 GLU 523 8.557 -4.179 -2.506 259 HG2 GLU 523 HG2 GLU 523 10.012 -4.476 -0.470 260 HG3 GLU 523 HG3 GLU 523 10.919 -3.035 -0.966 261 H ASN 524 H ASN 524 11.452 -3.159 -4.800 262 HA ASN 524 HA ASN 524 14.162 -2.974 -3.626 263 HB2 ASN 524 HB2 ASN 524 13.568 -3.778 -6.522 264 HB3 ASN 524 HB3 ASN 524 15.167 -3.528 -5.821 265 HD21 ASN 524 HD21 ASN 524 12.185 -5.504 -5.573 266 HD22 ASN 524 HD22 ASN 524 12.965 -6.949 -4.969 267 H LEU 525 H LEU 525 11.906 -1.184 -3.829 268 HA LEU 525 HA LEU 525 11.224 0.807 -4.547 269 HB2 LEU 525 HB2 LEU 525 12.866 2.287 -4.272 270 HB3 LEU 525 HB3 LEU 525 14.023 0.977 -4.387 271 HG LEU 525 HG LEU 525 13.708 1.412 -7.025 272 HD11 LEU 525 HD11 LEU 525 12.061 3.321 -6.569 273 HD12 LEU 525 HD12 LEU 525 13.364 4.158 -5.709 274 HD13 LEU 525 HD13 LEU 525 13.520 3.828 -7.450 275 HD21 LEU 525 HD21 LEU 525 15.437 3.052 -5.134 276 HD22 LEU 525 HD22 LEU 525 15.831 1.455 -5.824 277 HD23 LEU 525 HD23 LEU 525 15.702 2.876 -6.883 278 H LYS 526 H LYS 526 11.644 -1.699 -6.353 279 HA LYS 526 HA LYS 526 10.624 -0.491 -8.874 280 HB2 LYS 526 HB2 LYS 526 12.758 -2.575 -8.346 281 HB3 LYS 526 HB3 LYS 526 12.016 -2.379 -9.962 282 HG2 LYS 526 HG2 LYS 526 12.843 -0.104 -10.113 283 HG3 LYS 526 HG3 LYS 526 13.449 -0.150 -8.444 284 HD2 LYS 526 HD2 LYS 526 14.350 -2.118 -10.561 285 HD3 LYS 526 HD3 LYS 526 15.175 -0.557 -10.276 286 HE2 LYS 526 HE2 LYS 526 15.557 -1.198 -7.919 287 HE3 LYS 526 HE3 LYS 526 14.761 -2.752 -8.197 288 HZ1 LYS 526 HZ1 LYS 526 17.211 -1.819 -9.540 289 HZ2 LYS 526 HZ2 LYS 526 17.133 -2.952 -8.352 290 HZ3 LYS 526 HZ3 LYS 526 16.462 -3.256 -9.820 291 H1 MET 1 H1 MET 1 -12.657 12.456 -13.762 292 H2 MET 1 H2 MET 1 -14.098 13.104 -13.305 293 H3 MET 1 H3 MET 1 -13.929 11.473 -13.428 294 HA MET 1 HA MET 1 -12.524 13.197 -11.507 295 HB2 MET 1 HB2 MET 1 -14.869 13.028 -10.881 296 HB3 MET 1 HB3 MET 1 -14.849 11.261 -11.102 297 HG2 MET 1 HG2 MET 1 -13.241 10.998 -9.306 298 HG3 MET 1 HG3 MET 1 -13.084 12.750 -9.137 299 HE1 MET 1 HE1 MET 1 -13.447 12.761 -6.593 300 HE2 MET 1 HE2 MET 1 -14.739 11.854 -5.770 301 HE3 MET 1 HE3 MET 1 -13.476 10.987 -6.675 302 H GLN 2 H GLN 2 -10.780 12.418 -10.602 303 HA GLN 2 HA GLN 2 -10.418 9.572 -10.184 304 HB2 GLN 2 HB2 GLN 2 -8.443 9.334 -11.581 305 HB3 GLN 2 HB3 GLN 2 -9.741 9.989 -12.600 306 HG2 GLN 2 HG2 GLN 2 -8.718 12.310 -11.779 307 HG3 GLN 2 HG3 GLN 2 -7.294 11.350 -11.462 308 HE21 GLN 2 HE21 GLN 2 -6.008 12.323 -13.086 309 HE22 GLN 2 HE22 GLN 2 -6.331 12.118 -14.795 310 H ILE 3 H ILE 3 -8.084 9.273 -9.259 311 HA ILE 3 HA ILE 3 -7.118 11.696 -7.853 312 HB ILE 3 HB ILE 3 -7.029 10.702 -5.741 313 HG12 ILE 3 HG12 ILE 3 -7.349 8.061 -7.164 314 HG13 ILE 3 HG13 ILE 3 -6.181 8.589 -5.971 315 HG21 ILE 3 HG21 ILE 3 -9.694 9.828 -6.919 316 HG22 ILE 3 HG22 ILE 3 -9.349 10.204 -5.209 317 HG23 ILE 3 HG23 ILE 3 -9.263 11.482 -6.428 318 HD11 ILE 3 HD11 ILE 3 -9.102 7.917 -5.446 319 HD12 ILE 3 HD12 ILE 3 -7.681 6.967 -4.977 320 HD13 ILE 3 HD13 ILE 3 -7.970 8.550 -4.221 321 H PHE 4 H PHE 4 -4.953 10.951 -6.657 322 HA PHE 4 HA PHE 4 -3.447 9.134 -8.497 323 HB2 PHE 4 HB2 PHE 4 -2.480 11.754 -7.298 324 HB3 PHE 4 HB3 PHE 4 -1.568 10.692 -8.313 325 HD1 PHE 4 HD1 PHE 4 -2.731 10.188 -10.721 326 HD2 PHE 4 HD2 PHE 4 -3.590 13.590 -8.230 327 HE1 PHE 4 HE1 PHE 4 -3.565 11.428 -12.695 328 HE2 PHE 4 HE2 PHE 4 -4.444 14.818 -10.200 329 HZ PHE 4 HZ PHE 4 -4.427 13.747 -12.437 330 H VAL 5 H VAL 5 -2.807 7.409 -7.302 331 HA VAL 5 HA VAL 5 -2.097 7.956 -4.465 332 HB VAL 5 HB VAL 5 -2.810 5.829 -3.904 333 HG11 VAL 5 HG11 VAL 5 -4.708 7.360 -4.487 334 HG12 VAL 5 HG12 VAL 5 -4.752 6.681 -6.113 335 HG13 VAL 5 HG13 VAL 5 -5.112 5.649 -4.716 336 HG21 VAL 5 HG21 VAL 5 -2.839 5.080 -6.844 337 HG22 VAL 5 HG22 VAL 5 -1.736 4.469 -5.575 338 HG23 VAL 5 HG23 VAL 5 -3.455 4.063 -5.519 339 H LYS 6 H LYS 6 -0.002 7.720 -3.868 340 HA LYS 6 HA LYS 6 1.831 6.903 -6.052 341 HB2 LYS 6 HB2 LYS 6 2.055 9.174 -5.330 342 HB3 LYS 6 HB3 LYS 6 2.228 8.679 -3.634 343 HG2 LYS 6 HG2 LYS 6 4.340 7.665 -4.023 344 HG3 LYS 6 HG3 LYS 6 4.144 7.700 -5.788 345 HD2 LYS 6 HD2 LYS 6 4.155 10.249 -4.162 346 HD3 LYS 6 HD3 LYS 6 5.671 9.474 -4.704 347 HE2 LYS 6 HE2 LYS 6 4.951 9.579 -7.022 348 HE3 LYS 6 HE3 LYS 6 3.396 10.294 -6.548 349 HZ1 LYS 6 HZ1 LYS 6 4.953 11.967 -7.269 350 HZ2 LYS 6 HZ2 LYS 6 4.624 12.176 -5.670 351 HZ3 LYS 6 HZ3 LYS 6 6.050 11.504 -6.139 352 H THR 7 H THR 7 3.393 5.421 -5.853 353 HA THR 7 HA THR 7 2.867 3.357 -3.852 354 HB THR 7 HB THR 7 4.365 2.028 -5.323 355 HG1 THR 7 HG1 THR 7 5.239 3.072 -7.121 356 HG21 THR 7 HG21 THR 7 2.332 3.654 -6.924 357 HG22 THR 7 HG22 THR 7 2.992 2.062 -7.348 358 HG23 THR 7 HG23 THR 7 1.951 2.238 -5.914 359 H LEU 8 H LEU 8 4.918 2.025 -3.270 360 HA LEU 8 HA LEU 8 6.658 3.574 -1.623 361 HB2 LEU 8 HB2 LEU 8 5.697 1.165 -1.444 362 HB3 LEU 8 HB3 LEU 8 7.031 0.674 -2.468 363 HG LEU 8 HG LEU 8 7.243 0.317 0.020 364 HD11 LEU 8 HD11 LEU 8 9.504 2.104 -0.881 365 HD12 LEU 8 HD12 LEU 8 9.537 0.698 0.196 366 HD13 LEU 8 HD13 LEU 8 9.254 0.460 -1.537 367 HD21 LEU 8 HD21 LEU 8 6.268 2.465 0.750 368 HD22 LEU 8 HD22 LEU 8 7.869 2.164 1.465 369 HD23 LEU 8 HD23 LEU 8 7.710 3.319 0.131 370 H THR 9 H THR 9 6.658 3.787 -4.800 371 HA THR 9 HA THR 9 9.623 3.603 -5.061 372 HB THR 9 HB THR 9 9.420 2.850 -7.316 373 HG1 THR 9 HG1 THR 9 7.403 2.502 -8.249 374 HG21 THR 9 HG21 THR 9 8.434 0.652 -7.007 375 HG22 THR 9 HG22 THR 9 9.187 1.133 -5.467 376 HG23 THR 9 HG23 THR 9 7.422 1.234 -5.667 377 H GLY 10 H GLY 10 7.181 5.757 -4.763 378 HA2 GLY 10 HA2 GLY 10 7.342 8.043 -5.012 379 HA3 GLY 10 HA3 GLY 10 8.825 7.854 -5.960 380 H LYS 11 H LYS 11 5.952 6.045 -6.900 381 HA LYS 11 HA LYS 11 5.515 7.948 -9.156 382 HB2 LYS 11 HB2 LYS 11 6.850 5.942 -9.693 383 HB3 LYS 11 HB3 LYS 11 5.523 4.894 -9.174 384 HG2 LYS 11 HG2 LYS 11 4.837 7.015 -11.176 385 HG3 LYS 11 HG3 LYS 11 5.872 5.680 -11.730 386 HD2 LYS 11 HD2 LYS 11 4.206 4.030 -10.989 387 HD3 LYS 11 HD3 LYS 11 3.181 5.317 -10.337 388 HE2 LYS 11 HE2 LYS 11 2.323 4.633 -12.501 389 HE3 LYS 11 HE3 LYS 11 2.946 6.285 -12.612 390 HZ1 LYS 11 HZ1 LYS 11 3.651 4.946 -14.468 391 HZ2 LYS 11 HZ2 LYS 11 4.955 5.396 -13.582 392 HZ3 LYS 11 HZ3 LYS 11 4.379 3.856 -13.474 393 H THR 12 H THR 12 3.370 8.301 -9.748 394 HA THR 12 HA THR 12 1.442 7.204 -7.767 395 HB THR 12 HB THR 12 2.021 9.775 -8.134 396 HG1 THR 12 HG1 THR 12 0.056 10.104 -7.127 397 HG21 THR 12 HG21 THR 12 1.198 9.799 -10.493 398 HG22 THR 12 HG22 THR 12 -0.416 9.317 -9.890 399 HG23 THR 12 HG23 THR 12 0.275 10.881 -9.414 400 H ILE 13 H ILE 13 -0.770 6.822 -8.476 401 HA ILE 13 HA ILE 13 -0.933 5.916 -11.318 402 HB ILE 13 HB ILE 13 -1.897 4.444 -8.839 403 HG12 ILE 13 HG12 ILE 13 0.385 3.817 -10.763 404 HG13 ILE 13 HG13 ILE 13 0.562 4.350 -9.087 405 HG21 ILE 13 HG21 ILE 13 -2.528 2.665 -10.428 406 HG22 ILE 13 HG22 ILE 13 -3.355 4.171 -10.835 407 HG23 ILE 13 HG23 ILE 13 -1.940 3.659 -11.786 408 HD11 ILE 13 HD11 ILE 13 0.872 1.957 -9.178 409 HD12 ILE 13 HD12 ILE 13 -0.650 2.305 -8.324 410 HD13 ILE 13 HD13 ILE 13 -0.678 1.731 -10.011 411 H THR 14 H THR 14 -2.622 6.724 -12.352 412 HA THR 14 HA THR 14 -4.552 8.392 -10.991 413 HB THR 14 HB THR 14 -4.577 7.378 -13.865 414 HG1 THR 14 HG1 THR 14 -3.359 9.228 -14.297 415 HG21 THR 14 HG21 THR 14 -6.632 8.520 -13.087 416 HG22 THR 14 HG22 THR 14 -5.644 9.882 -12.500 417 HG23 THR 14 HG23 THR 14 -5.740 9.527 -14.245 418 H LEU 15 H LEU 15 -6.607 7.838 -10.336 419 HA LEU 15 HA LEU 15 -7.720 5.211 -11.199 420 HB2 LEU 15 HB2 LEU 15 -7.442 6.165 -8.328 421 HB3 LEU 15 HB3 LEU 15 -8.260 4.690 -8.846 422 HG LEU 15 HG LEU 15 -5.308 5.253 -9.313 423 HD11 LEU 15 HD11 LEU 15 -6.640 3.525 -7.188 424 HD12 LEU 15 HD12 LEU 15 -4.888 3.800 -7.402 425 HD13 LEU 15 HD13 LEU 15 -5.948 5.132 -6.887 426 HD21 LEU 15 HD21 LEU 15 -5.147 2.839 -9.680 427 HD22 LEU 15 HD22 LEU 15 -6.892 2.651 -9.419 428 HD23 LEU 15 HD23 LEU 15 -6.296 3.554 -10.835 429 H GLU 16 H GLU 16 -9.811 5.322 -11.595 430 HA GLU 16 HA GLU 16 -11.282 7.835 -11.073 431 HB2 GLU 16 HB2 GLU 16 -11.412 6.928 -13.311 432 HB3 GLU 16 HB3 GLU 16 -11.804 5.309 -12.691 433 HG2 GLU 16 HG2 GLU 16 -13.919 6.109 -11.810 434 HG3 GLU 16 HG3 GLU 16 -13.551 7.771 -12.317 435 H VAL 17 H VAL 17 -12.684 8.077 -9.513 436 HA VAL 17 HA VAL 17 -13.935 5.768 -8.155 437 HB VAL 17 HB VAL 17 -13.243 6.623 -5.952 438 HG11 VAL 17 HG11 VAL 17 -10.948 5.811 -5.953 439 HG12 VAL 17 HG12 VAL 17 -11.962 4.790 -6.994 440 HG13 VAL 17 HG13 VAL 17 -10.847 5.984 -7.717 441 HG21 VAL 17 HG21 VAL 17 -12.760 8.964 -6.569 442 HG22 VAL 17 HG22 VAL 17 -11.359 8.217 -5.779 443 HG23 VAL 17 HG23 VAL 17 -11.371 8.430 -7.544 444 H GLU 18 H GLU 18 -15.297 6.833 -6.219 445 HA GLU 18 HA GLU 18 -16.454 9.444 -6.997 446 HB2 GLU 18 HB2 GLU 18 -18.130 6.944 -6.509 447 HB3 GLU 18 HB3 GLU 18 -18.724 8.560 -6.909 448 HG2 GLU 18 HG2 GLU 18 -17.475 8.392 -9.104 449 HG3 GLU 18 HG3 GLU 18 -17.102 6.709 -8.669 450 HA PRO 19 HA PRO 19 -16.805 10.052 -2.589 451 HB2 PRO 19 HB2 PRO 19 -19.718 10.630 -2.977 452 HB3 PRO 19 HB3 PRO 19 -18.477 11.658 -2.208 453 HG2 PRO 19 HG2 PRO 19 -19.379 12.273 -4.676 454 HG3 PRO 19 HG3 PRO 19 -17.637 12.412 -4.264 455 HD2 PRO 19 HD2 PRO 19 -19.031 10.201 -5.761 456 HD3 PRO 19 HD3 PRO 19 -17.466 11.005 -6.113 457 H SER 20 H SER 20 -18.284 7.435 -4.135 458 HA SER 20 HA SER 20 -19.270 6.358 -1.546 459 HB2 SER 20 HB2 SER 20 -20.555 6.151 -4.293 460 HB3 SER 20 HB3 SER 20 -21.075 5.267 -2.845 461 HG SER 20 HG SER 20 -22.264 7.209 -3.161 462 H ASP 21 H ASP 21 -17.185 6.036 -4.229 463 HA ASP 21 HA ASP 21 -17.004 3.110 -4.162 464 HB2 ASP 21 HB2 ASP 21 -15.289 5.304 -5.315 465 HB3 ASP 21 HB3 ASP 21 -14.870 3.598 -5.441 466 H THR 22 H THR 22 -16.925 3.201 -1.821 467 HA THR 22 HA THR 22 -14.749 4.348 -0.358 468 HB THR 22 HB THR 22 -16.814 3.794 0.738 469 HG1 THR 22 HG1 THR 22 -15.920 2.807 2.502 470 HG21 THR 22 HG21 THR 22 -17.430 1.487 1.254 471 HG22 THR 22 HG22 THR 22 -17.547 1.854 -0.479 472 HG23 THR 22 HG23 THR 22 -16.159 0.907 0.131 473 H ILE 23 H ILE 23 -13.401 2.666 1.129 474 HA ILE 23 HA ILE 23 -11.256 2.142 -0.519 475 HB ILE 23 HB ILE 23 -11.782 0.770 2.129 476 HG12 ILE 23 HG12 ILE 23 -12.295 3.062 2.511 477 HG13 ILE 23 HG13 ILE 23 -10.656 2.806 3.099 478 HG21 ILE 23 HG21 ILE 23 -9.233 1.678 0.734 479 HG22 ILE 23 HG22 ILE 23 -9.336 1.018 2.386 480 HG23 ILE 23 HG23 ILE 23 -9.766 -0.003 1.002 481 HD11 ILE 23 HD11 ILE 23 -11.431 4.104 0.437 482 HD12 ILE 23 HD12 ILE 23 -10.847 4.930 1.875 483 HD13 ILE 23 HD13 ILE 23 -9.756 3.828 1.004 484 H GLU 24 H GLU 24 -13.838 -0.253 0.314 485 HA GLU 24 HA GLU 24 -12.284 -2.452 -0.707 486 HB2 GLU 24 HB2 GLU 24 -14.317 -3.723 -0.598 487 HB3 GLU 24 HB3 GLU 24 -14.220 -2.689 0.842 488 HG2 GLU 24 HG2 GLU 24 -15.772 -1.081 -0.222 489 HG3 GLU 24 HG3 GLU 24 -15.871 -2.112 -1.657 490 H ASN 25 H ASN 25 -14.202 0.056 -2.236 491 HA ASN 25 HA ASN 25 -14.430 -1.293 -4.795 492 HB2 ASN 25 HB2 ASN 25 -14.723 1.623 -4.026 493 HB3 ASN 25 HB3 ASN 25 -15.149 0.960 -5.580 494 HD21 ASN 25 HD21 ASN 25 -16.029 1.262 -2.307 495 HD22 ASN 25 HD22 ASN 25 -17.578 0.397 -2.356 496 H VAL 26 H VAL 26 -12.354 1.079 -3.149 497 HA VAL 26 HA VAL 26 -10.841 2.006 -5.397 498 HB VAL 26 HB VAL 26 -10.163 1.872 -2.435 499 HG11 VAL 26 HG11 VAL 26 -8.859 3.371 -4.728 500 HG12 VAL 26 HG12 VAL 26 -8.543 3.687 -3.002 501 HG13 VAL 26 HG13 VAL 26 -8.141 2.105 -3.702 502 HG21 VAL 26 HG21 VAL 26 -11.296 4.133 -4.137 503 HG22 VAL 26 HG22 VAL 26 -12.184 3.195 -2.912 504 HG23 VAL 26 HG23 VAL 26 -10.844 4.247 -2.418 505 H LYS 27 H LYS 27 -10.395 -0.631 -3.000 506 HA LYS 27 HA LYS 27 -7.774 -1.308 -3.806 507 HB2 LYS 27 HB2 LYS 27 -10.036 -2.847 -2.492 508 HB3 LYS 27 HB3 LYS 27 -8.437 -3.551 -2.827 509 HG2 LYS 27 HG2 LYS 27 -7.321 -1.796 -1.548 510 HG3 LYS 27 HG3 LYS 27 -8.878 -1.030 -1.174 511 HD2 LYS 27 HD2 LYS 27 -9.596 -3.018 0.067 512 HD3 LYS 27 HD3 LYS 27 -8.130 -3.888 -0.453 513 HE2 LYS 27 HE2 LYS 27 -6.768 -2.061 0.631 514 HE3 LYS 27 HE3 LYS 27 -8.261 -1.436 1.344 515 HZ1 LYS 27 HZ1 LYS 27 -7.191 -4.154 1.744 516 HZ2 LYS 27 HZ2 LYS 27 -7.099 -2.929 2.837 517 HZ3 LYS 27 HZ3 LYS 27 -8.563 -3.556 2.432 518 H ALA 28 H ALA 28 -10.880 -1.946 -5.398 519 HA ALA 28 HA ALA 28 -9.776 -4.020 -7.119 520 HB1 ALA 28 HB1 ALA 28 -12.201 -3.842 -6.652 521 HB2 ALA 28 HB2 ALA 28 -12.228 -2.240 -7.431 522 HB3 ALA 28 HB3 ALA 28 -11.859 -3.689 -8.389 523 H LYS 29 H LYS 29 -9.748 -0.532 -7.011 524 HA LYS 29 HA LYS 29 -9.324 -0.040 -9.828 525 HB2 LYS 29 HB2 LYS 29 -8.437 1.686 -7.468 526 HB3 LYS 29 HB3 LYS 29 -8.910 2.237 -9.082 527 HG2 LYS 29 HG2 LYS 29 -10.776 0.949 -7.053 528 HG3 LYS 29 HG3 LYS 29 -10.513 2.699 -7.240 529 HD2 LYS 29 HD2 LYS 29 -11.211 2.533 -9.564 530 HD3 LYS 29 HD3 LYS 29 -11.655 0.817 -9.329 531 HE2 LYS 29 HE2 LYS 29 -13.195 1.423 -7.510 532 HE3 LYS 29 HE3 LYS 29 -12.723 3.115 -7.626 533 HZ1 LYS 29 HZ1 LYS 29 -14.112 1.609 -9.739 534 HZ2 LYS 29 HZ2 LYS 29 -14.770 2.760 -8.761 535 HZ3 LYS 29 HZ3 LYS 29 -13.619 3.177 -9.849 536 H ILE 30 H ILE 30 -7.263 -0.153 -6.938 537 HA ILE 30 HA ILE 30 -4.776 0.258 -8.357 538 HB ILE 30 HB ILE 30 -5.426 -0.826 -5.589 539 HG12 ILE 30 HG12 ILE 30 -4.480 1.906 -6.532 540 HG13 ILE 30 HG13 ILE 30 -6.144 1.515 -6.071 541 HG21 ILE 30 HG21 ILE 30 -2.754 0.107 -6.731 542 HG22 ILE 30 HG22 ILE 30 -3.048 -0.359 -5.036 543 HG23 ILE 30 HG23 ILE 30 -3.178 -1.570 -6.310 544 HD11 ILE 30 HD11 ILE 30 -4.990 2.683 -4.260 545 HD12 ILE 30 HD12 ILE 30 -5.388 1.037 -3.744 546 HD13 ILE 30 HD13 ILE 30 -3.721 1.453 -4.217 547 H GLN 31 H GLN 31 -6.731 -2.570 -7.444 548 HA GLN 31 HA GLN 31 -4.739 -4.550 -8.058 549 HB2 GLN 31 HB2 GLN 31 -6.694 -5.109 -6.709 550 HB3 GLN 31 HB3 GLN 31 -7.786 -4.581 -8.010 551 HG2 GLN 31 HG2 GLN 31 -6.997 -6.329 -9.487 552 HG3 GLN 31 HG3 GLN 31 -5.753 -6.811 -8.349 553 HE21 GLN 31 HE21 GLN 31 -6.449 -8.938 -7.963 554 HE22 GLN 31 HE22 GLN 31 -7.974 -9.317 -7.186 555 H ASP 32 H ASP 32 -7.289 -2.870 -9.957 556 HA ASP 32 HA ASP 32 -7.081 -4.578 -12.225 557 HB2 ASP 32 HB2 ASP 32 -8.988 -3.098 -11.694 558 HB3 ASP 32 HB3 ASP 32 -7.964 -1.689 -11.835 559 H LYS 33 H LYS 33 -5.339 -1.781 -11.124 560 HA LYS 33 HA LYS 33 -4.161 -1.087 -13.682 561 HB2 LYS 33 HB2 LYS 33 -3.890 -0.228 -10.793 562 HB3 LYS 33 HB3 LYS 33 -2.846 0.467 -12.049 563 HG2 LYS 33 HG2 LYS 33 -5.890 0.443 -12.256 564 HG3 LYS 33 HG3 LYS 33 -4.982 1.764 -11.493 565 HD2 LYS 33 HD2 LYS 33 -3.702 2.116 -13.566 566 HD3 LYS 33 HD3 LYS 33 -4.625 0.834 -14.374 567 HE2 LYS 33 HE2 LYS 33 -5.832 3.347 -13.145 568 HE3 LYS 33 HE3 LYS 33 -5.474 3.146 -14.860 569 HZ1 LYS 33 HZ1 LYS 33 -6.996 1.273 -14.896 570 HZ2 LYS 33 HZ2 LYS 33 -7.344 1.480 -13.303 571 HZ3 LYS 33 HZ3 LYS 33 -7.762 2.636 -14.393 572 H GLU 34 H GLU 34 -3.201 -3.168 -10.983 573 HA GLU 34 HA GLU 34 -0.614 -3.592 -12.405 574 HB2 GLU 34 HB2 GLU 34 -0.998 -3.139 -9.421 575 HB3 GLU 34 HB3 GLU 34 0.524 -3.639 -10.167 576 HG2 GLU 34 HG2 GLU 34 -0.952 -1.037 -10.752 577 HG3 GLU 34 HG3 GLU 34 0.414 -1.210 -9.657 578 H GLY 35 H GLY 35 -3.066 -4.841 -10.123 579 HA2 GLY 35 HA2 GLY 35 -3.796 -7.136 -10.502 580 HA3 GLY 35 HA3 GLY 35 -2.096 -7.606 -10.718 581 H ILE 36 H ILE 36 -2.517 -5.210 -8.325 582 HA ILE 36 HA ILE 36 -1.498 -6.989 -6.286 583 HB ILE 36 HB ILE 36 -2.423 -4.088 -6.227 584 HG12 ILE 36 HG12 ILE 36 0.397 -5.247 -6.316 585 HG13 ILE 36 HG13 ILE 36 -0.474 -4.710 -7.757 586 HG21 ILE 36 HG21 ILE 36 -0.721 -5.644 -4.232 587 HG22 ILE 36 HG22 ILE 36 -1.184 -3.928 -4.115 588 HG23 ILE 36 HG23 ILE 36 -2.423 -5.197 -3.986 589 HD11 ILE 36 HD11 ILE 36 1.004 -2.924 -6.973 590 HD12 ILE 36 HD12 ILE 36 -0.694 -2.434 -6.800 591 HD13 ILE 36 HD13 ILE 36 0.239 -2.949 -5.372 592 HA PRO 37 HA PRO 37 -5.580 -8.210 -5.043 593 HB2 PRO 37 HB2 PRO 37 -4.971 -9.605 -2.753 594 HB3 PRO 37 HB3 PRO 37 -4.579 -10.216 -4.392 595 HG2 PRO 37 HG2 PRO 37 -2.772 -8.743 -2.463 596 HG3 PRO 37 HG3 PRO 37 -2.408 -10.236 -3.388 597 HD2 PRO 37 HD2 PRO 37 -1.601 -7.775 -4.237 598 HD3 PRO 37 HD3 PRO 37 -2.130 -9.025 -5.408 599 HA PRO 38 HA PRO 38 -6.862 -5.159 -2.105 600 HB2 PRO 38 HB2 PRO 38 -9.157 -6.315 -1.098 601 HB3 PRO 38 HB3 PRO 38 -9.042 -5.630 -2.749 602 HG2 PRO 38 HG2 PRO 38 -8.758 -8.523 -1.909 603 HG3 PRO 38 HG3 PRO 38 -9.729 -7.850 -3.259 604 HD2 PRO 38 HD2 PRO 38 -7.260 -8.921 -3.665 605 HD3 PRO 38 HD3 PRO 38 -7.799 -7.474 -4.570 606 H ASP 39 H ASP 39 -6.104 -8.444 -1.229 607 HA ASP 39 HA ASP 39 -6.433 -8.026 1.614 608 HB2 ASP 39 HB2 ASP 39 -5.104 -10.258 0.028 609 HB3 ASP 39 HB3 ASP 39 -5.447 -10.310 1.768 610 H GLN 40 H GLN 40 -4.052 -6.981 -0.588 611 HA GLN 40 HA GLN 40 -2.017 -6.977 1.599 612 HB2 GLN 40 HB2 GLN 40 -1.646 -7.274 -1.401 613 HB3 GLN 40 HB3 GLN 40 -0.334 -7.003 -0.245 614 HG2 GLN 40 HG2 GLN 40 -0.861 -9.072 0.939 615 HG3 GLN 40 HG3 GLN 40 -2.270 -9.354 -0.100 616 HE21 GLN 40 HE21 GLN 40 1.100 -8.301 -0.923 617 HE22 GLN 40 HE22 GLN 40 1.410 -9.647 -2.001 618 H GLN 41 H GLN 41 -3.869 -4.951 -0.621 619 HA GLN 41 HA GLN 41 -1.994 -2.786 -0.737 620 HB2 GLN 41 HB2 GLN 41 -5.023 -2.895 -0.918 621 HB3 GLN 41 HB3 GLN 41 -4.056 -1.446 -1.249 622 HG2 GLN 41 HG2 GLN 41 -2.919 -2.553 -3.102 623 HG3 GLN 41 HG3 GLN 41 -3.728 -4.090 -2.704 624 HE21 GLN 41 HE21 GLN 41 -4.866 -4.271 -4.717 625 HE22 GLN 41 HE22 GLN 41 -6.231 -3.239 -5.030 626 H ARG 42 H ARG 42 -2.341 -0.666 0.201 627 HA ARG 42 HA ARG 42 -3.876 -0.354 2.659 628 HB2 ARG 42 HB2 ARG 42 -1.676 -1.471 3.308 629 HB3 ARG 42 HB3 ARG 42 -0.842 -0.032 2.700 630 HG2 ARG 42 HG2 ARG 42 -2.028 1.361 4.359 631 HG3 ARG 42 HG3 ARG 42 -2.955 -0.066 4.898 632 HD2 ARG 42 HD2 ARG 42 -0.813 -1.204 5.462 633 HD3 ARG 42 HD3 ARG 42 0.070 0.274 5.034 634 HE ARG 42 HE ARG 42 -1.791 1.105 6.915 635 HH11 ARG 42 HH11 ARG 42 0.763 -1.333 6.826 636 HH12 ARG 42 HH12 ARG 42 1.064 -1.252 8.543 637 HH21 ARG 42 HH21 ARG 42 -1.371 1.206 9.142 638 HH22 ARG 42 HH22 ARG 42 -0.114 0.211 9.849 639 H LEU 43 H LEU 43 -4.534 1.816 2.716 640 HA LEU 43 HA LEU 43 -3.106 3.689 0.880 641 HB2 LEU 43 HB2 LEU 43 -6.010 2.880 0.971 642 HB3 LEU 43 HB3 LEU 43 -5.600 4.556 0.561 643 HG LEU 43 HG LEU 43 -4.576 2.090 -0.892 644 HD11 LEU 43 HD11 LEU 43 -6.787 4.100 -1.504 645 HD12 LEU 43 HD12 LEU 43 -6.246 2.812 -2.601 646 HD13 LEU 43 HD13 LEU 43 -7.018 2.394 -1.059 647 HD21 LEU 43 HD21 LEU 43 -4.440 5.078 -1.519 648 HD22 LEU 43 HD22 LEU 43 -3.062 4.008 -1.158 649 HD23 LEU 43 HD23 LEU 43 -3.991 3.781 -2.649 650 H ILE 44 H ILE 44 -2.886 5.732 1.525 651 HA ILE 44 HA ILE 44 -4.015 6.559 4.151 652 HB ILE 44 HB ILE 44 -1.111 6.663 3.224 653 HG12 ILE 44 HG12 ILE 44 -0.869 5.750 5.671 654 HG13 ILE 44 HG13 ILE 44 -2.580 5.363 5.542 655 HG21 ILE 44 HG21 ILE 44 -0.602 7.950 5.252 656 HG22 ILE 44 HG22 ILE 44 -1.726 8.866 4.249 657 HG23 ILE 44 HG23 ILE 44 -2.307 7.998 5.696 658 HD11 ILE 44 HD11 ILE 44 -1.184 3.423 5.009 659 HD12 ILE 44 HD12 ILE 44 -2.054 3.894 3.562 660 HD13 ILE 44 HD13 ILE 44 -0.337 4.343 3.734 661 H PHE 45 H PHE 45 -4.352 8.789 4.346 662 HA PHE 45 HA PHE 45 -3.758 10.587 2.080 663 HB2 PHE 45 HB2 PHE 45 -5.961 9.513 1.596 664 HB3 PHE 45 HB3 PHE 45 -6.533 10.030 3.187 665 HD1 PHE 45 HD1 PHE 45 -4.745 11.784 0.363 666 HD2 PHE 45 HD2 PHE 45 -8.063 11.732 3.099 667 HE1 PHE 45 HE1 PHE 45 -5.543 13.938 -0.561 668 HE2 PHE 45 HE2 PHE 45 -8.850 13.891 2.187 669 HZ PHE 45 HZ PHE 45 -7.593 15.000 0.351 670 H ALA 46 H ALA 46 -3.619 12.725 2.742 671 HA ALA 46 HA ALA 46 -2.928 14.291 4.200 672 HB1 ALA 46 HB1 ALA 46 -5.480 13.489 5.646 673 HB2 ALA 46 HB2 ALA 46 -4.624 15.035 5.818 674 HB3 ALA 46 HB3 ALA 46 -5.364 14.601 4.262 675 H GLY 47 H GLY 47 -2.351 11.262 4.904 676 HA2 GLY 47 HA2 GLY 47 -0.576 10.603 6.282 677 HA3 GLY 47 HA3 GLY 47 -0.910 11.916 7.407 678 H LYS 48 H LYS 48 -3.784 10.155 6.436 679 HA LYS 48 HA LYS 48 -3.394 8.259 8.688 680 HB2 LYS 48 HB2 LYS 48 -5.697 8.490 9.404 681 HB3 LYS 48 HB3 LYS 48 -4.797 9.999 9.556 682 HG2 LYS 48 HG2 LYS 48 -6.866 10.639 8.771 683 HG3 LYS 48 HG3 LYS 48 -5.803 10.707 7.350 684 HD2 LYS 48 HD2 LYS 48 -6.780 8.570 6.536 685 HD3 LYS 48 HD3 LYS 48 -7.855 8.495 7.945 686 HE2 LYS 48 HE2 LYS 48 -7.765 10.755 5.910 687 HE3 LYS 48 HE3 LYS 48 -8.948 9.440 5.931 688 HZ1 LYS 48 HZ1 LYS 48 -8.553 11.419 8.079 689 HZ2 LYS 48 HZ2 LYS 48 -9.792 11.414 7.003 690 HZ3 LYS 48 HZ3 LYS 48 -9.654 10.199 8.104 691 H GLN 49 H GLN 49 -4.808 6.437 8.599 692 HA GLN 49 HA GLN 49 -4.744 5.399 5.819 693 HB2 GLN 49 HB2 GLN 49 -3.408 4.227 7.488 694 HB3 GLN 49 HB3 GLN 49 -4.813 4.059 8.548 695 HG2 GLN 49 HG2 GLN 49 -5.936 2.664 6.822 696 HG3 GLN 49 HG3 GLN 49 -4.528 2.838 5.762 697 HE21 GLN 49 HE21 GLN 49 -5.584 0.332 6.671 698 HE22 GLN 49 HE22 GLN 49 -4.370 -0.422 7.684 699 H LEU 50 H LEU 50 -6.486 4.762 4.767 700 HA LEU 50 HA LEU 50 -9.062 5.634 5.828 701 HB2 LEU 50 HB2 LEU 50 -8.561 4.240 3.185 702 HB3 LEU 50 HB3 LEU 50 -9.847 5.366 3.621 703 HG LEU 50 HG LEU 50 -6.891 6.045 3.298 704 HD11 LEU 50 HD11 LEU 50 -9.332 6.824 1.660 705 HD12 LEU 50 HD12 LEU 50 -7.670 7.383 1.390 706 HD13 LEU 50 HD13 LEU 50 -8.069 5.663 1.170 707 HD21 LEU 50 HD21 LEU 50 -7.967 7.433 5.063 708 HD22 LEU 50 HD22 LEU 50 -7.584 8.378 3.608 709 HD23 LEU 50 HD23 LEU 50 -9.252 7.868 3.901 710 H GLU 51 H GLU 51 -11.036 4.211 5.760 711 HA GLU 51 HA GLU 51 -10.349 1.351 6.286 712 HB2 GLU 51 HB2 GLU 51 -12.002 3.288 7.917 713 HB3 GLU 51 HB3 GLU 51 -12.268 1.531 8.011 714 HG2 GLU 51 HG2 GLU 51 -9.972 1.151 8.668 715 HG3 GLU 51 HG3 GLU 51 -9.580 2.862 8.447 716 H ASP 52 H ASP 52 -11.931 -0.163 5.902 717 HA ASP 52 HA ASP 52 -13.337 0.212 3.470 718 HB2 ASP 52 HB2 ASP 52 -13.773 -2.084 3.691 719 HB3 ASP 52 HB3 ASP 52 -12.256 -1.833 4.594 720 H GLY 53 H GLY 53 -14.178 0.787 6.746 721 HA2 GLY 53 HA2 GLY 53 -17.058 0.337 6.375 722 HA3 GLY 53 HA3 GLY 53 -16.173 0.682 7.881 723 H ARG 54 H ARG 54 -15.256 2.659 5.227 724 HA ARG 54 HA ARG 54 -16.948 4.929 6.146 725 HB2 ARG 54 HB2 ARG 54 -14.166 5.100 5.019 726 HB3 ARG 54 HB3 ARG 54 -15.041 6.337 5.924 727 HG2 ARG 54 HG2 ARG 54 -14.023 3.697 7.082 728 HG3 ARG 54 HG3 ARG 54 -13.172 5.242 7.187 729 HD2 ARG 54 HD2 ARG 54 -14.909 6.230 8.476 730 HD3 ARG 54 HD3 ARG 54 -15.972 4.806 8.268 731 HE ARG 54 HE ARG 54 -13.588 3.857 9.387 732 HH11 ARG 54 HH11 ARG 54 -16.172 6.068 10.340 733 HH12 ARG 54 HH12 ARG 54 -15.944 5.775 12.051 734 HH21 ARG 54 HH21 ARG 54 -13.285 3.524 11.576 735 HH22 ARG 54 HH22 ARG 54 -14.307 4.315 12.760 736 H THR 55 H THR 55 -15.697 6.614 4.079 737 HA THR 55 HA THR 55 -16.124 5.388 1.472 738 HB THR 55 HB THR 55 -17.703 7.214 0.768 739 HG1 THR 55 HG1 THR 55 -18.878 8.215 2.440 740 HG21 THR 55 HG21 THR 55 -18.494 4.871 1.288 741 HG22 THR 55 HG22 THR 55 -18.903 5.449 2.928 742 HG23 THR 55 HG23 THR 55 -19.719 6.135 1.508 743 H LEU 56 H LEU 56 -15.452 6.933 -0.272 744 HA LEU 56 HA LEU 56 -13.072 8.302 0.423 745 HB2 LEU 56 HB2 LEU 56 -14.895 8.295 -1.992 746 HB3 LEU 56 HB3 LEU 56 -13.486 9.339 -1.945 747 HG LEU 56 HG LEU 56 -13.411 6.309 -1.538 748 HD11 LEU 56 HD11 LEU 56 -13.994 6.891 -3.834 749 HD12 LEU 56 HD12 LEU 56 -12.654 8.067 -3.904 750 HD13 LEU 56 HD13 LEU 56 -12.312 6.322 -3.773 751 HD21 LEU 56 HD21 LEU 56 -11.511 7.402 -0.411 752 HD22 LEU 56 HD22 LEU 56 -10.960 6.598 -1.888 753 HD23 LEU 56 HD23 LEU 56 -11.179 8.356 -1.885 754 H SER 57 H SER 57 -16.422 9.373 0.332 755 HA SER 57 HA SER 57 -15.822 12.205 0.481 756 HB2 SER 57 HB2 SER 57 -17.870 11.404 -0.447 757 HB3 SER 57 HB3 SER 57 -18.278 10.474 0.978 758 HG SER 57 HG SER 57 -19.380 12.499 0.918 759 H ASP 58 H ASP 58 -16.090 9.551 2.745 760 HA ASP 58 HA ASP 58 -16.456 11.139 5.117 761 HB2 ASP 58 HB2 ASP 58 -16.893 8.658 4.878 762 HB3 ASP 58 HB3 ASP 58 -15.138 8.413 4.952 763 H TYR 59 H TYR 59 -13.743 10.699 3.037 764 HA TYR 59 HA TYR 59 -12.003 11.904 5.142 765 HB2 TYR 59 HB2 TYR 59 -10.691 10.807 2.736 766 HB3 TYR 59 HB3 TYR 59 -10.178 10.765 4.413 767 HD1 TYR 59 HD1 TYR 59 -11.204 8.910 5.926 768 HD2 TYR 59 HD2 TYR 59 -11.647 9.052 1.654 769 HE1 TYR 59 HE1 TYR 59 -11.709 6.459 5.886 770 HE2 TYR 59 HE2 TYR 59 -12.256 6.647 1.623 771 HH TYR 59 HH TYR 59 -12.391 4.670 4.582 772 H ASN 60 H ASN 60 -14.004 13.065 3.135 773 HA ASN 60 HA ASN 60 -14.197 14.728 1.700 774 HB2 ASN 60 HB2 ASN 60 -13.281 16.732 2.452 775 HB3 ASN 60 HB3 ASN 60 -13.523 15.713 3.870 776 HD21 ASN 60 HD21 ASN 60 -11.810 15.209 5.189 777 HD22 ASN 60 HD22 ASN 60 -10.169 15.763 4.905 778 H ILE 61 H ILE 61 -12.146 12.614 0.824 779 HA ILE 61 HA ILE 61 -10.180 13.868 -0.795 780 HB ILE 61 HB ILE 61 -11.706 11.257 -0.989 781 HG12 ILE 61 HG12 ILE 61 -8.796 11.929 -0.371 782 HG13 ILE 61 HG13 ILE 61 -10.055 11.685 0.857 783 HG21 ILE 61 HG21 ILE 61 -10.097 10.540 -2.735 784 HG22 ILE 61 HG22 ILE 61 -11.093 11.880 -3.293 785 HG23 ILE 61 HG23 ILE 61 -9.412 12.181 -2.778 786 HD11 ILE 61 HD11 ILE 61 -10.426 9.388 0.007 787 HD12 ILE 61 HD12 ILE 61 -9.093 9.610 -1.151 788 HD13 ILE 61 HD13 ILE 61 -8.765 9.643 0.594 789 H GLN 62 H GLN 62 -10.153 14.600 -2.897 790 HA GLN 62 HA GLN 62 -12.764 14.937 -4.314 791 HB2 GLN 62 HB2 GLN 62 -10.501 16.951 -4.153 792 HB3 GLN 62 HB3 GLN 62 -12.107 17.198 -4.848 793 HG2 GLN 62 HG2 GLN 62 -11.534 16.672 -1.893 794 HG3 GLN 62 HG3 GLN 62 -11.768 18.255 -2.596 795 HE21 GLN 62 HE21 GLN 62 -13.370 16.746 -0.522 796 HE22 GLN 62 HE22 GLN 62 -15.011 16.769 -1.140 797 H LYS 63 H LYS 63 -12.101 15.939 -6.605 798 HA LYS 63 HA LYS 63 -10.619 13.910 -8.008 799 HB2 LYS 63 HB2 LYS 63 -11.056 15.274 -9.916 800 HB3 LYS 63 HB3 LYS 63 -12.516 15.232 -8.915 801 HG2 LYS 63 HG2 LYS 63 -11.934 17.473 -7.989 802 HG3 LYS 63 HG3 LYS 63 -10.468 17.491 -8.995 803 HD2 LYS 63 HD2 LYS 63 -12.189 18.788 -10.103 804 HD3 LYS 63 HD3 LYS 63 -11.898 17.302 -11.031 805 HE2 LYS 63 HE2 LYS 63 -13.885 16.259 -10.018 806 HE3 LYS 63 HE3 LYS 63 -14.156 17.700 -9.022 807 HZ1 LYS 63 HZ1 LYS 63 -15.538 17.693 -10.973 808 HZ2 LYS 63 HZ2 LYS 63 -14.484 18.955 -11.031 809 HZ3 LYS 63 HZ3 LYS 63 -14.229 17.623 -11.963 810 H GLU 64 H GLU 64 -8.676 13.888 -8.924 811 HA GLU 64 HA GLU 64 -6.517 14.311 -9.279 812 HB2 GLU 64 HB2 GLU 64 -7.362 17.221 -8.993 813 HB3 GLU 64 HB3 GLU 64 -5.846 16.629 -9.695 814 HG2 GLU 64 HG2 GLU 64 -7.130 15.375 -11.411 815 HG3 GLU 64 HG3 GLU 64 -8.640 16.012 -10.739 816 H SER 65 H SER 65 -7.675 14.224 -6.340 817 HA SER 65 HA SER 65 -5.710 15.581 -4.785 818 HB2 SER 65 HB2 SER 65 -7.575 13.231 -4.245 819 HB3 SER 65 HB3 SER 65 -6.554 13.996 -3.011 820 HG SER 65 HG SER 65 -7.611 15.971 -3.471 821 H THR 66 H THR 66 -4.434 14.098 -3.208 822 HA THR 66 HA THR 66 -2.932 12.045 -4.788 823 HB THR 66 HB THR 66 -1.768 14.255 -3.061 824 HG1 THR 66 HG1 THR 66 -0.887 14.893 -5.041 825 HG21 THR 66 HG21 THR 66 -0.464 12.195 -2.810 826 HG22 THR 66 HG22 THR 66 -0.453 11.955 -4.572 827 HG23 THR 66 HG23 THR 66 0.418 13.329 -3.843 828 H LEU 67 H LEU 67 -2.578 10.207 -3.710 829 HA LEU 67 HA LEU 67 -2.806 10.109 -0.732 830 HB2 LEU 67 HB2 LEU 67 -4.003 8.227 -2.802 831 HB3 LEU 67 HB3 LEU 67 -3.790 7.809 -1.106 832 HG LEU 67 HG LEU 67 -5.238 9.836 -0.528 833 HD11 LEU 67 HD11 LEU 67 -5.336 11.001 -2.694 834 HD12 LEU 67 HD12 LEU 67 -5.935 9.521 -3.487 835 HD13 LEU 67 HD13 LEU 67 -6.938 10.376 -2.289 836 HD21 LEU 67 HD21 LEU 67 -7.268 8.482 -0.887 837 HD22 LEU 67 HD22 LEU 67 -6.401 7.485 -2.078 838 HD23 LEU 67 HD23 LEU 67 -5.912 7.463 -0.365 839 H HIS 68 H HIS 68 -2.054 7.634 -0.181 840 HA HIS 68 HA HIS 68 0.418 7.084 -1.739 841 HB2 HIS 68 HB2 HIS 68 0.223 7.305 1.282 842 HB3 HIS 68 HB3 HIS 68 1.668 6.882 0.349 843 HD2 HIS 68 HD2 HIS 68 2.515 8.935 -1.448 844 HE1 HIS 68 HE1 HIS 68 0.878 12.071 0.908 845 HE2 HIS 68 HE2 HIS 68 2.474 11.512 -0.993 846 H LEU 69 H LEU 69 0.899 4.978 -1.967 847 HA LEU 69 HA LEU 69 -0.937 2.957 -0.773 848 HB2 LEU 69 HB2 LEU 69 -1.500 3.535 -3.077 849 HB3 LEU 69 HB3 LEU 69 0.163 3.287 -3.597 850 HG LEU 69 HG LEU 69 -1.480 1.513 -4.226 851 HD11 LEU 69 HD11 LEU 69 0.982 1.104 -4.168 852 HD12 LEU 69 HD12 LEU 69 0.792 0.415 -2.536 853 HD13 LEU 69 HD13 LEU 69 -0.012 -0.342 -3.921 854 HD21 LEU 69 HD21 LEU 69 -1.303 0.690 -1.309 855 HD22 LEU 69 HD22 LEU 69 -2.729 1.441 -2.066 856 HD23 LEU 69 HD23 LEU 69 -2.168 -0.154 -2.608 857 H VAL 70 H VAL 70 0.033 1.287 0.165 858 HA VAL 70 HA VAL 70 2.772 0.465 -0.583 859 HB VAL 70 HB VAL 70 1.878 1.088 2.270 860 HG11 VAL 70 HG11 VAL 70 3.391 -0.836 2.280 861 HG12 VAL 70 HG12 VAL 70 4.506 0.000 1.167 862 HG13 VAL 70 HG13 VAL 70 4.270 0.595 2.824 863 HG21 VAL 70 HG21 VAL 70 3.948 2.411 0.461 864 HG22 VAL 70 HG22 VAL 70 2.447 3.144 1.069 865 HG23 VAL 70 HG23 VAL 70 3.750 2.738 2.200 866 H LEU 71 H LEU 71 3.154 -1.818 0.494 867 HA LEU 71 HA LEU 71 0.598 -3.197 0.980 868 HB2 LEU 71 HB2 LEU 71 1.195 -4.893 -0.829 869 HB3 LEU 71 HB3 LEU 71 0.552 -3.335 -1.334 870 HG LEU 71 HG LEU 71 2.787 -2.541 -1.946 871 HD11 LEU 71 HD11 LEU 71 3.718 -5.333 -1.156 872 HD12 LEU 71 HD12 LEU 71 4.675 -4.158 -2.089 873 HD13 LEU 71 HD13 LEU 71 4.231 -3.790 -0.415 874 HD21 LEU 71 HD21 LEU 71 2.090 -5.272 -3.100 875 HD22 LEU 71 HD22 LEU 71 1.357 -3.725 -3.574 876 HD23 LEU 71 HD23 LEU 71 3.080 -4.019 -3.888 877 H ARG 72 H ARG 72 0.958 -5.630 1.237 878 HA ARG 72 HA ARG 72 3.103 -5.993 3.240 879 HB2 ARG 72 HB2 ARG 72 0.549 -7.455 2.464 880 HB3 ARG 72 HB3 ARG 72 1.749 -8.205 3.514 881 HG2 ARG 72 HG2 ARG 72 -0.003 -7.207 4.838 882 HG3 ARG 72 HG3 ARG 72 1.553 -6.423 5.149 883 HD2 ARG 72 HD2 ARG 72 0.908 -4.491 3.823 884 HD3 ARG 72 HD3 ARG 72 -0.558 -5.314 3.264 885 HE ARG 72 HE ARG 72 -1.627 -4.712 5.198 886 HH11 ARG 72 HH11 ARG 72 1.857 -4.433 5.742 887 HH12 ARG 72 HH12 ARG 72 1.660 -3.809 7.367 888 HH21 ARG 72 HH21 ARG 72 -1.835 -3.862 7.306 889 HH22 ARG 72 HH22 ARG 72 -0.402 -3.466 8.229 890 H LEU 73 H LEU 73 3.870 -8.433 3.269 891 HA LEU 73 HA LEU 73 4.539 -9.355 0.575 892 HB2 LEU 73 HB2 LEU 73 6.794 -9.622 1.116 893 HB3 LEU 73 HB3 LEU 73 6.376 -7.976 1.642 894 HG LEU 73 HG LEU 73 6.775 -10.435 3.394 895 HD11 LEU 73 HD11 LEU 73 8.210 -7.762 3.199 896 HD12 LEU 73 HD12 LEU 73 8.604 -9.084 4.331 897 HD13 LEU 73 HD13 LEU 73 8.815 -9.309 2.576 898 HD21 LEU 73 HD21 LEU 73 5.813 -7.636 4.081 899 HD22 LEU 73 HD22 LEU 73 4.938 -9.169 4.313 900 HD23 LEU 73 HD23 LEU 73 6.394 -8.823 5.285 901 H ARG 74 H ARG 74 2.592 -9.926 2.654 902 HA ARG 74 HA ARG 74 1.664 -11.407 4.060 903 HB2 ARG 74 HB2 ARG 74 2.975 -13.373 2.182 904 HB3 ARG 74 HB3 ARG 74 1.607 -13.642 3.293 905 HG2 ARG 74 HG2 ARG 74 0.399 -11.733 2.114 906 HG3 ARG 74 HG3 ARG 74 1.693 -11.773 0.881 907 HD2 ARG 74 HD2 ARG 74 1.242 -14.199 0.574 908 HD3 ARG 74 HD3 ARG 74 -0.100 -14.051 1.742 909 HE ARG 74 HE ARG 74 -0.318 -12.174 -0.465 910 HH11 ARG 74 HH11 ARG 74 -0.985 -15.518 0.475 911 HH12 ARG 74 HH12 ARG 74 -2.268 -15.702 -0.702 912 HH21 ARG 74 HH21 ARG 74 -1.952 -12.441 -1.961 913 HH22 ARG 74 HH22 ARG 74 -2.826 -13.957 -2.081 914 H GLY 75 H GLY 75 4.923 -12.754 3.430 915 HA2 GLY 75 HA2 GLY 75 6.247 -12.608 5.726 916 HA3 GLY 75 HA3 GLY 75 5.034 -13.839 6.169 917 H GLY 76 H GLY 76 5.176 -14.478 3.066 918 HA2 GLY 76 HA2 GLY 76 7.732 -15.577 2.493 919 HA3 GLY 76 HA3 GLY 76 6.724 -16.830 3.238 Start of MODEL 11 1 H LEU 491 H LEU 491 15.000 6.924 11.880 2 HA LEU 491 HA LEU 491 17.557 6.178 11.281 3 HB2 LEU 491 HB2 LEU 491 16.155 4.024 10.337 4 HB3 LEU 491 HB3 LEU 491 16.624 4.328 11.993 5 HG LEU 491 HG LEU 491 14.391 5.395 12.418 6 HD11 LEU 491 HD11 LEU 491 13.846 6.089 10.090 7 HD12 LEU 491 HD12 LEU 491 13.820 4.382 9.594 8 HD13 LEU 491 HD13 LEU 491 12.604 5.001 10.739 9 HD21 LEU 491 HD21 LEU 491 14.394 2.594 11.264 10 HD22 LEU 491 HD22 LEU 491 14.889 3.052 12.907 11 HD23 LEU 491 HD23 LEU 491 13.192 3.264 12.399 12 HA PRO 492 HA PRO 492 17.893 6.867 6.837 13 HB2 PRO 492 HB2 PRO 492 20.492 6.141 6.605 14 HB3 PRO 492 HB3 PRO 492 20.010 7.630 7.478 15 HG2 PRO 492 HG2 PRO 492 20.685 4.927 8.639 16 HG3 PRO 492 HG3 PRO 492 21.272 6.545 9.164 17 HD2 PRO 492 HD2 PRO 492 19.145 5.223 10.350 18 HD3 PRO 492 HD3 PRO 492 19.236 7.001 10.289 19 H LEU 493 H LEU 493 19.408 5.151 5.252 20 HA LEU 493 HA LEU 493 17.710 2.874 5.104 21 HB2 LEU 493 HB2 LEU 493 18.892 2.328 3.117 22 HB3 LEU 493 HB3 LEU 493 18.753 4.093 3.169 23 HG LEU 493 HG LEU 493 21.239 2.422 3.780 24 HD11 LEU 493 HD11 LEU 493 20.571 4.405 1.572 25 HD12 LEU 493 HD12 LEU 493 22.105 3.528 1.767 26 HD13 LEU 493 HD13 LEU 493 20.610 2.638 1.398 27 HD21 LEU 493 HD21 LEU 493 21.263 4.362 5.245 28 HD22 LEU 493 HD22 LEU 493 22.401 4.627 3.913 29 HD23 LEU 493 HD23 LEU 493 20.814 5.436 3.890 30 H GLN 494 H GLN 494 19.136 3.044 7.530 31 HA GLN 494 HA GLN 494 21.190 1.077 7.717 32 HB2 GLN 494 HB2 GLN 494 20.874 1.320 10.092 33 HB3 GLN 494 HB3 GLN 494 20.870 2.889 9.244 34 HG2 GLN 494 HG2 GLN 494 19.197 3.174 10.795 35 HG3 GLN 494 HG3 GLN 494 18.334 2.787 9.300 36 HE21 GLN 494 HE21 GLN 494 16.492 2.190 10.494 37 HE22 GLN 494 HE22 GLN 494 16.421 0.674 11.375 38 H ALA 495 H ALA 495 17.688 0.846 7.685 39 HA ALA 495 HA ALA 495 18.027 -2.100 7.704 40 HB1 ALA 495 HB1 ALA 495 16.042 -0.641 9.482 41 HB2 ALA 495 HB2 ALA 495 16.145 -2.405 9.258 42 HB3 ALA 495 HB3 ALA 495 17.492 -1.521 10.016 43 H LEU 496 H LEU 496 16.948 0.482 5.999 44 HA LEU 496 HA LEU 496 14.424 -0.358 5.017 45 HB2 LEU 496 HB2 LEU 496 16.715 1.365 4.096 46 HB3 LEU 496 HB3 LEU 496 15.589 0.798 2.871 47 HG LEU 496 HG LEU 496 13.682 1.691 4.173 48 HD11 LEU 496 HD11 LEU 496 14.082 3.310 5.972 49 HD12 LEU 496 HD12 LEU 496 14.685 1.706 6.427 50 HD13 LEU 496 HD13 LEU 496 15.825 2.977 5.914 51 HD21 LEU 496 HD21 LEU 496 14.144 4.052 3.605 52 HD22 LEU 496 HD22 LEU 496 15.891 3.692 3.513 53 HD23 LEU 496 HD23 LEU 496 14.770 2.969 2.344 54 HA PRO 497 HA PRO 497 15.137 -3.875 2.436 55 HB2 PRO 497 HB2 PRO 497 14.010 -2.205 0.204 56 HB3 PRO 497 HB3 PRO 497 13.556 -3.872 0.695 57 HG2 PRO 497 HG2 PRO 497 11.975 -1.792 1.389 58 HG3 PRO 497 HG3 PRO 497 12.354 -3.069 2.593 59 HD2 PRO 497 HD2 PRO 497 13.607 -0.333 2.311 60 HD3 PRO 497 HD3 PRO 497 13.082 -1.190 3.790 61 H GLU 498 H GLU 498 16.424 -4.616 0.545 62 HA GLU 498 HA GLU 498 18.814 -3.001 0.371 63 HB2 GLU 498 HB2 GLU 498 18.737 -5.491 0.727 64 HB3 GLU 498 HB3 GLU 498 18.231 -5.665 -0.972 65 HG2 GLU 498 HG2 GLU 498 20.324 -4.578 -1.710 66 HG3 GLU 498 HG3 GLU 498 20.769 -4.253 -0.030 67 H GLY 499 H GLY 499 17.543 -1.294 -0.695 68 HA2 GLY 499 HA2 GLY 499 18.636 -0.593 -3.073 69 HA3 GLY 499 HA3 GLY 499 17.240 -1.558 -3.598 70 H VAL 500 H VAL 500 15.741 -0.630 -1.110 71 HA VAL 500 HA VAL 500 14.369 1.581 -2.297 72 HB VAL 500 HB VAL 500 14.296 0.240 0.416 73 HG11 VAL 500 HG11 VAL 500 12.368 2.331 -0.709 74 HG12 VAL 500 HG12 VAL 500 12.046 1.308 0.703 75 HG13 VAL 500 HG13 VAL 500 13.353 2.495 0.771 76 HG21 VAL 500 HG21 VAL 500 13.586 -1.070 -1.578 77 HG22 VAL 500 HG22 VAL 500 12.199 -0.703 -0.530 78 HG23 VAL 500 HG23 VAL 500 12.456 0.230 -2.019 79 H ASP 501 H ASP 501 13.912 3.618 -0.947 80 HA ASP 501 HA ASP 501 16.427 4.792 0.123 81 HB2 ASP 501 HB2 ASP 501 15.240 5.225 -2.535 82 HB3 ASP 501 HB3 ASP 501 15.320 6.714 -1.609 83 H GLN 502 H GLN 502 16.106 6.835 1.155 84 HA GLN 502 HA GLN 502 13.907 6.833 2.952 85 HB2 GLN 502 HB2 GLN 502 15.823 9.050 2.109 86 HB3 GLN 502 HB3 GLN 502 14.806 9.082 3.570 87 HG2 GLN 502 HG2 GLN 502 16.811 6.874 3.024 88 HG3 GLN 502 HG3 GLN 502 17.249 8.361 3.867 89 HE21 GLN 502 HE21 GLN 502 15.521 5.313 4.102 90 HE22 GLN 502 HE22 GLN 502 15.114 5.450 5.799 91 H GLU 503 H GLU 503 14.614 8.821 0.072 92 HA GLU 503 HA GLU 503 12.297 10.477 0.392 93 HB2 GLU 503 HB2 GLU 503 12.898 11.422 -1.736 94 HB3 GLU 503 HB3 GLU 503 14.384 11.128 -0.802 95 HG2 GLU 503 HG2 GLU 503 14.506 8.872 -2.054 96 HG3 GLU 503 HG3 GLU 503 13.268 9.519 -3.126 97 H VAL 504 H VAL 504 12.245 7.289 -0.197 98 HA VAL 504 HA VAL 504 9.648 7.535 -1.585 99 HB VAL 504 HB VAL 504 10.020 5.646 -2.939 100 HG11 VAL 504 HG11 VAL 504 12.329 7.580 -3.318 101 HG12 VAL 504 HG12 VAL 504 11.604 6.540 -4.563 102 HG13 VAL 504 HG13 VAL 504 10.648 7.855 -3.846 103 HG21 VAL 504 HG21 VAL 504 11.665 4.400 -1.527 104 HG22 VAL 504 HG22 VAL 504 12.232 4.561 -3.197 105 HG23 VAL 504 HG23 VAL 504 12.907 5.611 -1.933 106 H PHE 505 H PHE 505 11.044 6.859 1.230 107 HA PHE 505 HA PHE 505 9.155 4.634 1.843 108 HB2 PHE 505 HB2 PHE 505 11.158 3.588 2.157 109 HB3 PHE 505 HB3 PHE 505 12.033 5.092 2.403 110 HD1 PHE 505 HD1 PHE 505 12.242 6.163 4.488 111 HD2 PHE 505 HD2 PHE 505 10.099 2.471 4.131 112 HE1 PHE 505 HE1 PHE 505 12.462 5.794 6.959 113 HE2 PHE 505 HE2 PHE 505 10.340 2.077 6.575 114 HZ PHE 505 HZ PHE 505 11.517 3.747 7.983 115 H LYS 506 H LYS 506 10.075 7.897 2.328 116 HA LYS 506 HA LYS 506 8.770 8.127 4.953 117 HB2 LYS 506 HB2 LYS 506 10.019 10.136 3.045 118 HB3 LYS 506 HB3 LYS 506 9.295 10.574 4.611 119 HG2 LYS 506 HG2 LYS 506 10.842 9.039 5.779 120 HG3 LYS 506 HG3 LYS 506 11.599 8.610 4.242 121 HD2 LYS 506 HD2 LYS 506 11.508 11.422 5.411 122 HD3 LYS 506 HD3 LYS 506 12.903 10.319 5.458 123 HE2 LYS 506 HE2 LYS 506 12.959 10.280 2.987 124 HE3 LYS 506 HE3 LYS 506 11.578 11.385 2.935 125 HZ1 LYS 506 HZ1 LYS 506 12.914 13.016 4.078 126 HZ2 LYS 506 HZ2 LYS 506 14.197 11.993 4.142 127 HZ3 LYS 506 HZ3 LYS 506 13.663 12.550 2.693 128 H GLN 507 H GLN 507 7.363 7.259 2.351 129 HA GLN 507 HA GLN 507 5.434 9.436 1.909 130 HB2 GLN 507 HB2 GLN 507 5.220 6.664 0.733 131 HB3 GLN 507 HB3 GLN 507 4.762 8.218 0.024 132 HG2 GLN 507 HG2 GLN 507 7.561 7.089 0.438 133 HG3 GLN 507 HG3 GLN 507 6.722 7.284 -1.097 134 HE21 GLN 507 HE21 GLN 507 9.354 8.422 -0.003 135 HE22 GLN 507 HE22 GLN 507 9.201 10.126 -0.263 136 H LEU 508 H LEU 508 5.774 7.411 4.374 137 HA LEU 508 HA LEU 508 2.900 6.732 4.689 138 HB2 LEU 508 HB2 LEU 508 3.774 4.438 5.478 139 HB3 LEU 508 HB3 LEU 508 3.639 4.723 3.744 140 HG LEU 508 HG LEU 508 6.284 5.357 5.020 141 HD11 LEU 508 HD11 LEU 508 5.340 2.529 4.426 142 HD12 LEU 508 HD12 LEU 508 7.001 3.013 4.827 143 HD13 LEU 508 HD13 LEU 508 5.718 3.195 6.039 144 HD21 LEU 508 HD21 LEU 508 7.069 4.304 2.872 145 HD22 LEU 508 HD22 LEU 508 5.373 4.010 2.434 146 HD23 LEU 508 HD23 LEU 508 5.977 5.671 2.578 147 HA PRO 509 HA PRO 509 3.522 7.905 8.861 148 HB2 PRO 509 HB2 PRO 509 1.848 6.150 10.209 149 HB3 PRO 509 HB3 PRO 509 1.292 7.551 9.251 150 HG2 PRO 509 HG2 PRO 509 1.467 4.649 8.438 151 HG3 PRO 509 HG3 PRO 509 0.123 5.804 8.142 152 HD2 PRO 509 HD2 PRO 509 1.968 5.208 6.224 153 HD3 PRO 509 HD3 PRO 509 1.306 6.861 6.397 154 H ALA 510 H ALA 510 4.123 7.193 11.027 155 HA ALA 510 HA ALA 510 6.429 5.589 11.084 156 HB1 ALA 510 HB1 ALA 510 4.539 6.431 13.317 157 HB2 ALA 510 HB2 ALA 510 6.218 5.875 13.531 158 HB3 ALA 510 HB3 ALA 510 5.879 7.393 12.667 159 H ASP 511 H ASP 511 3.021 4.710 11.483 160 HA ASP 511 HA ASP 511 3.620 2.114 12.667 161 HB2 ASP 511 HB2 ASP 511 1.082 3.213 11.371 162 HB3 ASP 511 HB3 ASP 511 1.189 1.724 12.321 163 H ILE 512 H ILE 512 3.962 3.337 9.519 164 HA ILE 512 HA ILE 512 4.062 0.494 8.618 165 HB ILE 512 HB ILE 512 3.693 2.909 6.833 166 HG12 ILE 512 HG12 ILE 512 1.673 0.891 7.887 167 HG13 ILE 512 HG13 ILE 512 1.724 2.624 8.253 168 HG21 ILE 512 HG21 ILE 512 3.366 -0.084 6.306 169 HG22 ILE 512 HG22 ILE 512 3.156 1.224 5.117 170 HG23 ILE 512 HG23 ILE 512 4.754 0.888 5.769 171 HD11 ILE 512 HD11 ILE 512 1.150 1.384 5.529 172 HD12 ILE 512 HD12 ILE 512 0.014 2.229 6.597 173 HD13 ILE 512 HD13 ILE 512 1.346 3.125 5.832 174 H GLN 513 H GLN 513 5.926 3.349 9.360 175 HA GLN 513 HA GLN 513 8.229 2.874 7.771 176 HB2 GLN 513 HB2 GLN 513 8.033 3.661 10.711 177 HB3 GLN 513 HB3 GLN 513 9.505 3.750 9.741 178 HG2 GLN 513 HG2 GLN 513 6.965 5.295 9.094 179 HG3 GLN 513 HG3 GLN 513 8.308 5.933 10.059 180 HE21 GLN 513 HE21 GLN 513 7.259 4.925 6.839 181 HE22 GLN 513 HE22 GLN 513 8.596 5.652 5.974 182 H GLU 514 H GLU 514 6.984 1.330 10.735 183 HA GLU 514 HA GLU 514 9.235 -0.380 11.174 184 HB2 GLU 514 HB2 GLU 514 7.778 -1.442 12.825 185 HB3 GLU 514 HB3 GLU 514 7.638 0.326 12.917 186 HG2 GLU 514 HG2 GLU 514 5.539 0.227 11.612 187 HG3 GLU 514 HG3 GLU 514 5.680 -1.533 11.498 188 H GLU 515 H GLU 515 6.714 -0.542 8.804 189 HA GLU 515 HA GLU 515 6.772 -3.496 8.703 190 HB2 GLU 515 HB2 GLU 515 5.347 -1.395 7.015 191 HB3 GLU 515 HB3 GLU 515 5.180 -3.147 6.812 192 HG2 GLU 515 HG2 GLU 515 4.496 -1.632 9.369 193 HG3 GLU 515 HG3 GLU 515 3.330 -2.108 8.128 194 H ILE 516 H ILE 516 8.378 -0.774 7.205 195 HA ILE 516 HA ILE 516 9.293 -2.494 4.950 196 HB ILE 516 HB ILE 516 9.188 0.500 5.405 197 HG12 ILE 516 HG12 ILE 516 7.895 0.599 3.450 198 HG13 ILE 516 HG13 ILE 516 8.293 -1.063 2.967 199 HG21 ILE 516 HG21 ILE 516 10.699 -1.042 3.259 200 HG22 ILE 516 HG22 ILE 516 10.322 0.681 3.143 201 HG23 ILE 516 HG23 ILE 516 11.384 0.107 4.438 202 HD11 ILE 516 HD11 ILE 516 6.584 -0.327 5.367 203 HD12 ILE 516 HD12 ILE 516 5.950 -0.760 3.764 204 HD13 ILE 516 HD13 ILE 516 6.853 -1.964 4.697 205 H LEU 517 H LEU 517 10.324 -0.862 7.910 206 HA LEU 517 HA LEU 517 13.144 -1.265 7.560 207 HB2 LEU 517 HB2 LEU 517 11.294 -1.017 9.961 208 HB3 LEU 517 HB3 LEU 517 13.042 -1.228 10.140 209 HG LEU 517 HG LEU 517 11.845 0.987 8.422 210 HD11 LEU 517 HD11 LEU 517 12.147 2.482 10.357 211 HD12 LEU 517 HD12 LEU 517 10.981 1.201 10.737 212 HD13 LEU 517 HD13 LEU 517 12.642 1.096 11.360 213 HD21 LEU 517 HD21 LEU 517 14.529 0.744 9.856 214 HD22 LEU 517 HD22 LEU 517 14.284 0.409 8.127 215 HD23 LEU 517 HD23 LEU 517 14.030 2.047 8.760 216 H SER 518 H SER 518 10.696 -3.432 7.485 217 HA SER 518 HA SER 518 12.502 -5.691 8.182 218 HB2 SER 518 HB2 SER 518 9.524 -5.518 8.810 219 HB3 SER 518 HB3 SER 518 10.566 -6.931 9.073 220 HG SER 518 HG SER 518 10.784 -4.381 10.294 221 H GLY 519 H GLY 519 11.515 -4.142 5.688 222 HA2 GLY 519 HA2 GLY 519 10.081 -6.273 4.219 223 HA3 GLY 519 HA3 GLY 519 10.262 -4.579 3.724 224 H LYS 520 H LYS 520 12.828 -6.715 4.928 225 HA LYS 520 HA LYS 520 14.712 -5.995 3.014 226 HB2 LYS 520 HB2 LYS 520 16.107 -7.531 4.052 227 HB3 LYS 520 HB3 LYS 520 15.010 -6.976 5.329 228 HG2 LYS 520 HG2 LYS 520 14.818 -9.603 3.790 229 HG3 LYS 520 HG3 LYS 520 15.403 -9.405 5.442 230 HD2 LYS 520 HD2 LYS 520 13.187 -8.652 6.180 231 HD3 LYS 520 HD3 LYS 520 12.559 -8.787 4.511 232 HE2 LYS 520 HE2 LYS 520 13.121 -11.138 4.435 233 HE3 LYS 520 HE3 LYS 520 13.797 -11.066 6.075 234 HZ1 LYS 520 HZ1 LYS 520 10.975 -10.549 5.363 235 HZ2 LYS 520 HZ2 LYS 520 11.549 -11.914 6.076 236 HZ3 LYS 520 HZ3 LYS 520 11.604 -10.485 6.879 237 H SER 521 H SER 521 12.060 -7.735 2.201 238 HA SER 521 HA SER 521 13.383 -8.871 -0.175 239 HB2 SER 521 HB2 SER 521 13.441 -10.655 1.580 240 HB3 SER 521 HB3 SER 521 11.668 -10.561 1.691 241 HG SER 521 HG SER 521 12.415 -12.199 0.247 242 H ARG 522 H ARG 522 11.649 -9.892 -1.555 243 HA ARG 522 HA ARG 522 9.921 -9.634 -2.943 244 HB2 ARG 522 HB2 ARG 522 8.794 -10.072 -0.555 245 HB3 ARG 522 HB3 ARG 522 8.175 -8.440 -0.820 246 HG2 ARG 522 HG2 ARG 522 6.504 -9.594 -1.859 247 HG3 ARG 522 HG3 ARG 522 7.601 -9.489 -3.247 248 HD2 ARG 522 HD2 ARG 522 7.426 -11.818 -1.280 249 HD3 ARG 522 HD3 ARG 522 6.662 -11.777 -2.878 250 HE ARG 522 HE ARG 522 9.433 -11.282 -3.228 251 HH11 ARG 522 HH11 ARG 522 7.292 -13.896 -2.181 252 HH12 ARG 522 HH12 ARG 522 8.385 -15.152 -2.733 253 HH21 ARG 522 HH21 ARG 522 10.792 -12.920 -3.957 254 HH22 ARG 522 HH22 ARG 522 10.363 -14.602 -3.742 255 H GLU 523 H GLU 523 11.585 -7.035 -1.924 256 HA GLU 523 HA GLU 523 10.430 -5.456 -4.091 257 HB2 GLU 523 HB2 GLU 523 10.109 -3.427 -2.751 258 HB3 GLU 523 HB3 GLU 523 9.042 -4.730 -2.211 259 HG2 GLU 523 HG2 GLU 523 10.638 -5.235 -0.354 260 HG3 GLU 523 HG3 GLU 523 11.631 -3.859 -0.869 261 H ASN 524 H ASN 524 11.815 -3.828 -4.883 262 HA ASN 524 HA ASN 524 14.510 -3.537 -3.719 263 HB2 ASN 524 HB2 ASN 524 13.830 -4.847 -6.361 264 HB3 ASN 524 HB3 ASN 524 15.312 -3.901 -6.211 265 HD21 ASN 524 HD21 ASN 524 13.586 -6.749 -4.869 266 HD22 ASN 524 HD22 ASN 524 15.030 -7.519 -4.262 267 H LEU 525 H LEU 525 12.292 -1.774 -3.790 268 HA LEU 525 HA LEU 525 11.604 0.261 -4.395 269 HB2 LEU 525 HB2 LEU 525 13.282 1.690 -4.197 270 HB3 LEU 525 HB3 LEU 525 14.405 0.363 -4.434 271 HG LEU 525 HG LEU 525 13.907 0.893 -7.023 272 HD11 LEU 525 HD11 LEU 525 13.750 3.323 -7.363 273 HD12 LEU 525 HD12 LEU 525 12.352 2.832 -6.378 274 HD13 LEU 525 HD13 LEU 525 13.745 3.604 -5.605 275 HD21 LEU 525 HD21 LEU 525 15.952 2.249 -7.015 276 HD22 LEU 525 HD22 LEU 525 15.812 2.469 -5.255 277 HD23 LEU 525 HD23 LEU 525 16.114 0.849 -5.937 278 H LYS 526 H LYS 526 11.878 -2.176 -6.366 279 HA LYS 526 HA LYS 526 10.635 -0.813 -8.700 280 HB2 LYS 526 HB2 LYS 526 12.812 -2.914 -8.505 281 HB3 LYS 526 HB3 LYS 526 11.943 -2.606 -10.036 282 HG2 LYS 526 HG2 LYS 526 12.745 -0.325 -10.105 283 HG3 LYS 526 HG3 LYS 526 13.500 -0.479 -8.499 284 HD2 LYS 526 HD2 LYS 526 14.217 -2.267 -10.836 285 HD3 LYS 526 HD3 LYS 526 15.067 -0.738 -10.481 286 HE2 LYS 526 HE2 LYS 526 15.620 -1.569 -8.217 287 HE3 LYS 526 HE3 LYS 526 14.805 -3.103 -8.572 288 HZ1 LYS 526 HZ1 LYS 526 17.146 -2.035 -10.001 289 HZ2 LYS 526 HZ2 LYS 526 17.169 -3.258 -8.907 290 HZ3 LYS 526 HZ3 LYS 526 16.394 -3.461 -10.339 291 H1 MET 1 H1 MET 1 -13.723 11.878 -12.867 292 H2 MET 1 H2 MET 1 -12.464 12.746 -13.478 293 H3 MET 1 H3 MET 1 -13.778 13.520 -12.861 294 HA MET 1 HA MET 1 -11.936 13.636 -11.327 295 HB2 MET 1 HB2 MET 1 -14.140 13.654 -10.321 296 HB3 MET 1 HB3 MET 1 -14.303 11.896 -10.522 297 HG2 MET 1 HG2 MET 1 -12.521 11.483 -8.931 298 HG3 MET 1 HG3 MET 1 -12.188 13.214 -8.788 299 HE1 MET 1 HE1 MET 1 -12.551 11.315 -6.311 300 HE2 MET 1 HE2 MET 1 -12.280 13.065 -6.166 301 HE3 MET 1 HE3 MET 1 -13.603 12.293 -5.259 302 H GLN 2 H GLN 2 -10.167 12.768 -10.450 303 HA GLN 2 HA GLN 2 -9.951 9.886 -10.110 304 HB2 GLN 2 HB2 GLN 2 -8.054 9.596 -11.602 305 HB3 GLN 2 HB3 GLN 2 -9.351 10.372 -12.530 306 HG2 GLN 2 HG2 GLN 2 -8.154 12.592 -11.680 307 HG3 GLN 2 HG3 GLN 2 -6.787 11.535 -11.418 308 HE21 GLN 2 HE21 GLN 2 -5.500 12.539 -13.042 309 HE22 GLN 2 HE22 GLN 2 -5.868 12.387 -14.750 310 H ILE 3 H ILE 3 -7.632 9.422 -9.283 311 HA ILE 3 HA ILE 3 -6.470 11.701 -7.798 312 HB ILE 3 HB ILE 3 -6.409 10.593 -5.725 313 HG12 ILE 3 HG12 ILE 3 -7.060 8.091 -7.259 314 HG13 ILE 3 HG13 ILE 3 -5.859 8.413 -6.026 315 HG21 ILE 3 HG21 ILE 3 -9.199 10.178 -6.849 316 HG22 ILE 3 HG22 ILE 3 -8.751 10.398 -5.137 317 HG23 ILE 3 HG23 ILE 3 -8.503 11.718 -6.278 318 HD11 ILE 3 HD11 ILE 3 -7.664 8.497 -4.299 319 HD12 ILE 3 HD12 ILE 3 -8.849 8.093 -5.571 320 HD13 ILE 3 HD13 ILE 3 -7.580 6.934 -5.141 321 H PHE 4 H PHE 4 -4.404 10.607 -6.541 322 HA PHE 4 HA PHE 4 -3.012 8.896 -8.540 323 HB2 PHE 4 HB2 PHE 4 -1.860 11.382 -7.231 324 HB3 PHE 4 HB3 PHE 4 -1.055 10.335 -8.357 325 HD1 PHE 4 HD1 PHE 4 -2.134 10.095 -10.758 326 HD2 PHE 4 HD2 PHE 4 -3.087 13.266 -8.006 327 HE1 PHE 4 HE1 PHE 4 -2.915 11.500 -12.641 328 HE2 PHE 4 HE2 PHE 4 -3.818 14.681 -9.906 329 HZ PHE 4 HZ PHE 4 -3.751 13.796 -12.220 330 H VAL 5 H VAL 5 -2.668 7.085 -7.374 331 HA VAL 5 HA VAL 5 -2.039 7.381 -4.492 332 HB VAL 5 HB VAL 5 -2.709 5.121 -4.235 333 HG11 VAL 5 HG11 VAL 5 -4.639 6.492 -6.178 334 HG12 VAL 5 HG12 VAL 5 -5.037 5.203 -5.025 335 HG13 VAL 5 HG13 VAL 5 -4.536 6.793 -4.438 336 HG21 VAL 5 HG21 VAL 5 -2.869 4.930 -7.262 337 HG22 VAL 5 HG22 VAL 5 -1.793 4.003 -6.175 338 HG23 VAL 5 HG23 VAL 5 -3.538 3.734 -6.129 339 H LYS 6 H LYS 6 0.049 7.477 -3.940 340 HA LYS 6 HA LYS 6 2.020 6.560 -5.921 341 HB2 LYS 6 HB2 LYS 6 1.993 8.867 -4.841 342 HB3 LYS 6 HB3 LYS 6 2.564 8.076 -3.353 343 HG2 LYS 6 HG2 LYS 6 4.534 7.201 -4.577 344 HG3 LYS 6 HG3 LYS 6 3.904 7.879 -6.092 345 HD2 LYS 6 HD2 LYS 6 5.615 9.349 -5.284 346 HD3 LYS 6 HD3 LYS 6 4.049 10.168 -5.111 347 HE2 LYS 6 HE2 LYS 6 3.985 9.526 -2.718 348 HE3 LYS 6 HE3 LYS 6 5.550 8.700 -2.905 349 HZ1 LYS 6 HZ1 LYS 6 6.518 10.814 -3.493 350 HZ2 LYS 6 HZ2 LYS 6 5.079 11.581 -3.279 351 HZ3 LYS 6 HZ3 LYS 6 5.841 10.880 -2.000 352 H THR 7 H THR 7 3.341 4.866 -5.701 353 HA THR 7 HA THR 7 2.754 2.895 -3.666 354 HB THR 7 HB THR 7 4.385 1.557 -4.992 355 HG1 THR 7 HG1 THR 7 5.383 2.548 -6.728 356 HG21 THR 7 HG21 THR 7 2.015 1.693 -5.715 357 HG22 THR 7 HG22 THR 7 2.412 3.103 -6.726 358 HG23 THR 7 HG23 THR 7 3.125 1.519 -7.095 359 H LEU 8 H LEU 8 4.732 1.586 -2.895 360 HA LEU 8 HA LEU 8 6.353 3.172 -1.155 361 HB2 LEU 8 HB2 LEU 8 5.364 0.729 -1.033 362 HB3 LEU 8 HB3 LEU 8 6.855 0.262 -1.830 363 HG LEU 8 HG LEU 8 6.854 -0.043 0.624 364 HD11 LEU 8 HD11 LEU 8 8.823 2.179 0.006 365 HD12 LEU 8 HD12 LEU 8 8.977 0.886 1.201 366 HD13 LEU 8 HD13 LEU 8 9.038 0.481 -0.522 367 HD21 LEU 8 HD21 LEU 8 6.707 2.990 0.802 368 HD22 LEU 8 HD22 LEU 8 5.374 1.864 1.162 369 HD23 LEU 8 HD23 LEU 8 6.847 1.857 2.154 370 H THR 9 H THR 9 6.636 3.404 -4.277 371 HA THR 9 HA THR 9 9.606 3.198 -4.286 372 HB THR 9 HB THR 9 9.592 2.366 -6.555 373 HG1 THR 9 HG1 THR 9 7.636 1.776 -7.516 374 HG21 THR 9 HG21 THR 9 7.696 0.678 -4.858 375 HG22 THR 9 HG22 THR 9 8.739 0.110 -6.178 376 HG23 THR 9 HG23 THR 9 9.465 0.713 -4.670 377 H GLY 10 H GLY 10 7.117 5.307 -4.331 378 HA2 GLY 10 HA2 GLY 10 7.193 7.562 -4.762 379 HA3 GLY 10 HA3 GLY 10 8.797 7.374 -5.498 380 H LYS 11 H LYS 11 6.024 5.458 -6.563 381 HA LYS 11 HA LYS 11 5.781 7.107 -9.053 382 HB2 LYS 11 HB2 LYS 11 7.086 4.991 -9.225 383 HB3 LYS 11 HB3 LYS 11 5.634 4.083 -8.760 384 HG2 LYS 11 HG2 LYS 11 5.400 6.114 -10.965 385 HG3 LYS 11 HG3 LYS 11 6.233 4.578 -11.321 386 HD2 LYS 11 HD2 LYS 11 4.257 3.308 -10.591 387 HD3 LYS 11 HD3 LYS 11 3.395 4.800 -10.206 388 HE2 LYS 11 HE2 LYS 11 4.431 3.954 -12.927 389 HE3 LYS 11 HE3 LYS 11 2.726 3.964 -12.383 390 HZ1 LYS 11 HZ1 LYS 11 4.444 6.341 -12.665 391 HZ2 LYS 11 HZ2 LYS 11 3.265 5.884 -13.717 392 HZ3 LYS 11 HZ3 LYS 11 2.864 6.334 -12.190 393 H THR 12 H THR 12 3.645 7.367 -9.830 394 HA THR 12 HA THR 12 1.591 6.422 -7.882 395 HB THR 12 HB THR 12 2.423 8.967 -8.093 396 HG1 THR 12 HG1 THR 12 0.482 9.417 -7.073 397 HG21 THR 12 HG21 THR 12 1.599 9.180 -10.466 398 HG22 THR 12 HG22 THR 12 -0.051 8.858 -9.861 399 HG23 THR 12 HG23 THR 12 0.824 10.304 -9.332 400 H ILE 13 H ILE 13 -0.596 6.282 -8.686 401 HA ILE 13 HA ILE 13 -0.730 5.625 -11.596 402 HB ILE 13 HB ILE 13 -1.918 4.036 -9.284 403 HG12 ILE 13 HG12 ILE 13 0.441 3.369 -11.103 404 HG13 ILE 13 HG13 ILE 13 0.540 3.800 -9.389 405 HG21 ILE 13 HG21 ILE 13 -3.248 4.004 -11.396 406 HG22 ILE 13 HG22 ILE 13 -1.808 3.436 -12.276 407 HG23 ILE 13 HG23 ILE 13 -2.562 2.418 -11.029 408 HD11 ILE 13 HD11 ILE 13 -0.824 1.328 -10.524 409 HD12 ILE 13 HD12 ILE 13 0.690 1.392 -9.603 410 HD13 ILE 13 HD13 ILE 13 -0.844 1.819 -8.811 411 H THR 14 H THR 14 -2.443 6.527 -12.603 412 HA THR 14 HA THR 14 -4.153 8.317 -11.079 413 HB THR 14 HB THR 14 -4.287 7.570 -14.025 414 HG1 THR 14 HG1 THR 14 -2.904 9.344 -14.291 415 HG21 THR 14 HG21 THR 14 -5.114 10.038 -12.441 416 HG22 THR 14 HG22 THR 14 -5.232 9.853 -14.209 417 HG23 THR 14 HG23 THR 14 -6.219 8.833 -13.142 418 H LEU 15 H LEU 15 -6.288 7.933 -10.480 419 HA LEU 15 HA LEU 15 -7.596 5.449 -11.465 420 HB2 LEU 15 HB2 LEU 15 -7.143 6.179 -8.544 421 HB3 LEU 15 HB3 LEU 15 -8.100 4.810 -9.123 422 HG LEU 15 HG LEU 15 -5.124 5.200 -9.638 423 HD11 LEU 15 HD11 LEU 15 -6.577 3.401 -7.653 424 HD12 LEU 15 HD12 LEU 15 -4.816 3.457 -7.933 425 HD13 LEU 15 HD13 LEU 15 -5.661 4.864 -7.234 426 HD21 LEU 15 HD21 LEU 15 -6.886 2.736 -9.974 427 HD22 LEU 15 HD22 LEU 15 -6.267 3.735 -11.306 428 HD23 LEU 15 HD23 LEU 15 -5.137 2.841 -10.255 429 H GLU 16 H GLU 16 -9.711 5.674 -11.693 430 HA GLU 16 HA GLU 16 -10.960 8.268 -10.969 431 HB2 GLU 16 HB2 GLU 16 -11.198 7.568 -13.273 432 HB3 GLU 16 HB3 GLU 16 -11.681 5.931 -12.785 433 HG2 GLU 16 HG2 GLU 16 -13.736 6.764 -11.812 434 HG3 GLU 16 HG3 GLU 16 -13.286 8.443 -12.184 435 H VAL 17 H VAL 17 -12.296 8.492 -9.367 436 HA VAL 17 HA VAL 17 -13.831 6.222 -8.262 437 HB VAL 17 HB VAL 17 -13.121 6.812 -5.960 438 HG11 VAL 17 HG11 VAL 17 -10.782 6.004 -7.734 439 HG12 VAL 17 HG12 VAL 17 -10.946 5.706 -5.993 440 HG13 VAL 17 HG13 VAL 17 -12.053 4.912 -7.125 441 HG21 VAL 17 HG21 VAL 17 -12.334 9.120 -6.401 442 HG22 VAL 17 HG22 VAL 17 -11.090 8.146 -5.599 443 HG23 VAL 17 HG23 VAL 17 -10.968 8.473 -7.339 444 H GLU 18 H GLU 18 -15.234 7.150 -6.400 445 HA GLU 18 HA GLU 18 -16.081 9.960 -6.918 446 HB2 GLU 18 HB2 GLU 18 -17.838 7.492 -6.592 447 HB3 GLU 18 HB3 GLU 18 -18.436 9.149 -6.704 448 HG2 GLU 18 HG2 GLU 18 -16.857 7.719 -8.882 449 HG3 GLU 18 HG3 GLU 18 -18.616 7.841 -8.806 450 HA PRO 19 HA PRO 19 -16.182 10.281 -2.500 451 HB2 PRO 19 HB2 PRO 19 -18.947 11.406 -2.673 452 HB3 PRO 19 HB3 PRO 19 -17.487 12.111 -1.915 453 HG2 PRO 19 HG2 PRO 19 -18.395 13.053 -4.299 454 HG3 PRO 19 HG3 PRO 19 -16.641 12.869 -3.970 455 HD2 PRO 19 HD2 PRO 19 -18.451 11.029 -5.535 456 HD3 PRO 19 HD3 PRO 19 -16.789 11.582 -5.914 457 H SER 20 H SER 20 -18.070 8.027 -4.126 458 HA SER 20 HA SER 20 -19.295 7.018 -1.622 459 HB2 SER 20 HB2 SER 20 -21.032 6.096 -3.196 460 HB3 SER 20 HB3 SER 20 -21.041 7.873 -3.055 461 HG SER 20 HG SER 20 -21.147 7.140 -5.230 462 H ASP 21 H ASP 21 -17.008 6.555 -4.086 463 HA ASP 21 HA ASP 21 -17.110 3.614 -4.064 464 HB2 ASP 21 HB2 ASP 21 -15.157 5.619 -5.183 465 HB3 ASP 21 HB3 ASP 21 -15.017 3.866 -5.405 466 H THR 22 H THR 22 -16.980 3.467 -1.810 467 HA THR 22 HA THR 22 -14.862 4.569 -0.201 468 HB THR 22 HB THR 22 -16.813 4.017 0.947 469 HG1 THR 22 HG1 THR 22 -16.096 2.590 2.471 470 HG21 THR 22 HG21 THR 22 -17.922 2.513 -0.508 471 HG22 THR 22 HG22 THR 22 -16.691 1.241 -0.237 472 HG23 THR 22 HG23 THR 22 -17.775 1.759 1.085 473 H ILE 23 H ILE 23 -13.422 2.887 1.175 474 HA ILE 23 HA ILE 23 -11.378 2.377 -0.637 475 HB ILE 23 HB ILE 23 -11.679 1.032 2.068 476 HG12 ILE 23 HG12 ILE 23 -12.198 3.328 2.493 477 HG13 ILE 23 HG13 ILE 23 -10.539 3.027 3.009 478 HG21 ILE 23 HG21 ILE 23 -9.762 0.296 0.777 479 HG22 ILE 23 HG22 ILE 23 -9.251 1.978 0.497 480 HG23 ILE 23 HG23 ILE 23 -9.229 1.296 2.144 481 HD11 ILE 23 HD11 ILE 23 -10.715 5.184 1.902 482 HD12 ILE 23 HD12 ILE 23 -9.712 4.101 0.915 483 HD13 ILE 23 HD13 ILE 23 -11.407 4.444 0.453 484 H GLU 24 H GLU 24 -13.969 0.079 0.332 485 HA GLU 24 HA GLU 24 -12.493 -2.215 -0.596 486 HB2 GLU 24 HB2 GLU 24 -14.596 -3.384 -0.562 487 HB3 GLU 24 HB3 GLU 24 -14.494 -2.351 0.878 488 HG2 GLU 24 HG2 GLU 24 -15.907 -0.663 -0.260 489 HG3 GLU 24 HG3 GLU 24 -16.018 -1.705 -1.687 490 H ASN 25 H ASN 25 -14.094 0.387 -2.210 491 HA ASN 25 HA ASN 25 -14.342 -0.983 -4.766 492 HB2 ASN 25 HB2 ASN 25 -14.628 1.939 -3.990 493 HB3 ASN 25 HB3 ASN 25 -14.993 1.298 -5.571 494 HD21 ASN 25 HD21 ASN 25 -15.993 1.530 -2.309 495 HD22 ASN 25 HD22 ASN 25 -17.556 0.711 -2.462 496 H VAL 26 H VAL 26 -12.207 1.499 -3.203 497 HA VAL 26 HA VAL 26 -10.743 2.149 -5.561 498 HB VAL 26 HB VAL 26 -9.415 3.473 -4.183 499 HG11 VAL 26 HG11 VAL 26 -11.833 4.056 -4.322 500 HG12 VAL 26 HG12 VAL 26 -12.076 3.288 -2.734 501 HG13 VAL 26 HG13 VAL 26 -11.009 4.700 -2.879 502 HG21 VAL 26 HG21 VAL 26 -8.519 1.997 -2.593 503 HG22 VAL 26 HG22 VAL 26 -9.379 3.267 -1.690 504 HG23 VAL 26 HG23 VAL 26 -10.111 1.653 -1.896 505 H LYS 27 H LYS 27 -10.244 -0.228 -2.960 506 HA LYS 27 HA LYS 27 -7.716 -1.171 -3.711 507 HB2 LYS 27 HB2 LYS 27 -10.195 -2.493 -2.549 508 HB3 LYS 27 HB3 LYS 27 -8.695 -3.397 -2.800 509 HG2 LYS 27 HG2 LYS 27 -7.442 -1.881 -1.380 510 HG3 LYS 27 HG3 LYS 27 -8.841 -0.802 -1.207 511 HD2 LYS 27 HD2 LYS 27 -10.102 -2.566 -0.062 512 HD3 LYS 27 HD3 LYS 27 -8.758 -3.712 -0.312 513 HE2 LYS 27 HE2 LYS 27 -7.270 -2.240 0.990 514 HE3 LYS 27 HE3 LYS 27 -8.601 -1.107 1.266 515 HZ1 LYS 27 HZ1 LYS 27 -8.325 -2.600 3.125 516 HZ2 LYS 27 HZ2 LYS 27 -9.782 -2.838 2.407 517 HZ3 LYS 27 HZ3 LYS 27 -8.560 -3.913 2.161 518 H ALA 28 H ALA 28 -10.904 -1.696 -5.271 519 HA ALA 28 HA ALA 28 -9.858 -3.764 -7.027 520 HB1 ALA 28 HB1 ALA 28 -12.402 -2.110 -7.263 521 HB2 ALA 28 HB2 ALA 28 -12.002 -3.585 -8.159 522 HB3 ALA 28 HB3 ALA 28 -12.248 -3.666 -6.401 523 H LYS 29 H LYS 29 -10.107 -0.215 -7.093 524 HA LYS 29 HA LYS 29 -9.664 0.072 -9.926 525 HB2 LYS 29 HB2 LYS 29 -9.263 1.883 -7.534 526 HB3 LYS 29 HB3 LYS 29 -8.673 2.345 -9.126 527 HG2 LYS 29 HG2 LYS 29 -10.795 3.341 -8.791 528 HG3 LYS 29 HG3 LYS 29 -10.953 2.111 -10.066 529 HD2 LYS 29 HD2 LYS 29 -12.032 0.569 -8.514 530 HD3 LYS 29 HD3 LYS 29 -11.596 1.593 -7.149 531 HE2 LYS 29 HE2 LYS 29 -13.967 1.802 -7.732 532 HE3 LYS 29 HE3 LYS 29 -13.107 3.340 -7.853 533 HZ1 LYS 29 HZ1 LYS 29 -12.995 3.040 -10.225 534 HZ2 LYS 29 HZ2 LYS 29 -13.755 1.581 -10.131 535 HZ3 LYS 29 HZ3 LYS 29 -14.559 2.959 -9.740 536 H ILE 30 H ILE 30 -7.550 -0.452 -7.116 537 HA ILE 30 HA ILE 30 -5.100 0.045 -8.652 538 HB ILE 30 HB ILE 30 -5.728 -0.965 -5.850 539 HG12 ILE 30 HG12 ILE 30 -4.482 1.645 -6.797 540 HG13 ILE 30 HG13 ILE 30 -6.217 1.446 -6.492 541 HG21 ILE 30 HG21 ILE 30 -3.011 -0.305 -7.076 542 HG22 ILE 30 HG22 ILE 30 -3.313 -0.683 -5.363 543 HG23 ILE 30 HG23 ILE 30 -3.572 -1.924 -6.588 544 HD11 ILE 30 HD11 ILE 30 -5.119 2.465 -4.560 545 HD12 ILE 30 HD12 ILE 30 -5.768 0.868 -4.139 546 HD13 ILE 30 HD13 ILE 30 -4.021 1.077 -4.415 547 H GLN 31 H GLN 31 -7.110 -2.694 -7.585 548 HA GLN 31 HA GLN 31 -5.255 -4.768 -8.279 549 HB2 GLN 31 HB2 GLN 31 -7.209 -5.226 -6.880 550 HB3 GLN 31 HB3 GLN 31 -8.297 -4.646 -8.158 551 HG2 GLN 31 HG2 GLN 31 -7.624 -6.426 -9.655 552 HG3 GLN 31 HG3 GLN 31 -6.382 -6.973 -8.538 553 HE21 GLN 31 HE21 GLN 31 -7.160 -9.049 -8.076 554 HE22 GLN 31 HE22 GLN 31 -8.702 -9.345 -7.298 555 H ASP 32 H ASP 32 -7.770 -2.958 -10.082 556 HA ASP 32 HA ASP 32 -7.730 -4.646 -12.365 557 HB2 ASP 32 HB2 ASP 32 -9.521 -3.034 -11.737 558 HB3 ASP 32 HB3 ASP 32 -8.407 -1.705 -11.950 559 H LYS 33 H LYS 33 -5.802 -1.949 -11.305 560 HA LYS 33 HA LYS 33 -4.634 -1.366 -13.913 561 HB2 LYS 33 HB2 LYS 33 -4.361 -0.396 -11.065 562 HB3 LYS 33 HB3 LYS 33 -3.248 0.184 -12.318 563 HG2 LYS 33 HG2 LYS 33 -6.264 0.299 -12.698 564 HG3 LYS 33 HG3 LYS 33 -5.372 1.583 -11.861 565 HD2 LYS 33 HD2 LYS 33 -3.875 1.833 -13.821 566 HD3 LYS 33 HD3 LYS 33 -4.856 0.653 -14.714 567 HE2 LYS 33 HE2 LYS 33 -5.926 3.232 -13.485 568 HE3 LYS 33 HE3 LYS 33 -5.431 3.077 -15.174 569 HZ1 LYS 33 HZ1 LYS 33 -7.107 1.370 -15.439 570 HZ2 LYS 33 HZ2 LYS 33 -7.571 1.519 -13.870 571 HZ3 LYS 33 HZ3 LYS 33 -7.793 2.769 -14.911 572 H GLU 34 H GLU 34 -3.739 -3.372 -11.139 573 HA GLU 34 HA GLU 34 -1.154 -3.911 -12.537 574 HB2 GLU 34 HB2 GLU 34 -1.564 -3.429 -9.563 575 HB3 GLU 34 HB3 GLU 34 -0.060 -4.010 -10.288 576 HG2 GLU 34 HG2 GLU 34 -1.400 -1.346 -10.924 577 HG3 GLU 34 HG3 GLU 34 -0.055 -1.570 -9.810 578 H GLY 35 H GLY 35 -3.649 -5.094 -10.251 579 HA2 GLY 35 HA2 GLY 35 -4.465 -7.356 -10.668 580 HA3 GLY 35 HA3 GLY 35 -2.787 -7.888 -10.902 581 H ILE 36 H ILE 36 -3.067 -5.521 -8.479 582 HA ILE 36 HA ILE 36 -2.165 -7.406 -6.468 583 HB ILE 36 HB ILE 36 -2.782 -4.421 -6.390 584 HG12 ILE 36 HG12 ILE 36 -0.116 -5.898 -6.564 585 HG13 ILE 36 HG13 ILE 36 -0.955 -5.195 -7.957 586 HG21 ILE 36 HG21 ILE 36 -1.224 -6.147 -4.419 587 HG22 ILE 36 HG22 ILE 36 -1.497 -4.390 -4.302 588 HG23 ILE 36 HG23 ILE 36 -2.862 -5.502 -4.145 589 HD11 ILE 36 HD11 ILE 36 0.101 -3.674 -5.536 590 HD12 ILE 36 HD12 ILE 36 0.746 -3.643 -7.184 591 HD13 ILE 36 HD13 ILE 36 -0.857 -2.951 -6.855 592 HA PRO 37 HA PRO 37 -6.320 -8.213 -5.161 593 HB2 PRO 37 HB2 PRO 37 -5.838 -9.673 -2.897 594 HB3 PRO 37 HB3 PRO 37 -5.486 -10.296 -4.542 595 HG2 PRO 37 HG2 PRO 37 -3.576 -8.990 -2.595 596 HG3 PRO 37 HG3 PRO 37 -3.344 -10.519 -3.509 597 HD2 PRO 37 HD2 PRO 37 -2.317 -8.133 -4.377 598 HD3 PRO 37 HD3 PRO 37 -2.951 -9.334 -5.537 599 HA PRO 38 HA PRO 38 -7.318 -5.155 -2.071 600 HB2 PRO 38 HB2 PRO 38 -9.680 -6.183 -1.091 601 HB3 PRO 38 HB3 PRO 38 -9.537 -5.417 -2.705 602 HG2 PRO 38 HG2 PRO 38 -9.478 -8.366 -2.032 603 HG3 PRO 38 HG3 PRO 38 -10.409 -7.549 -3.327 604 HD2 PRO 38 HD2 PRO 38 -8.042 -8.785 -3.823 605 HD3 PRO 38 HD3 PRO 38 -8.476 -7.255 -4.649 606 H ASP 39 H ASP 39 -6.698 -8.485 -1.480 607 HA ASP 39 HA ASP 39 -7.050 -8.380 1.387 608 HB2 ASP 39 HB2 ASP 39 -7.471 -10.396 -0.005 609 HB3 ASP 39 HB3 ASP 39 -5.747 -10.456 -0.403 610 H GLN 40 H GLN 40 -4.556 -7.250 -0.690 611 HA GLN 40 HA GLN 40 -2.623 -7.465 1.578 612 HB2 GLN 40 HB2 GLN 40 -2.114 -7.640 -1.405 613 HB3 GLN 40 HB3 GLN 40 -0.849 -7.417 -0.183 614 HG2 GLN 40 HG2 GLN 40 -1.644 -9.514 0.958 615 HG3 GLN 40 HG3 GLN 40 -2.743 -9.784 -0.413 616 HE21 GLN 40 HE21 GLN 40 -1.484 -9.415 -2.649 617 HE22 GLN 40 HE22 GLN 40 0.014 -10.322 -2.770 618 H GLN 41 H GLN 41 -4.221 -5.246 -0.675 619 HA GLN 41 HA GLN 41 -2.242 -3.191 -0.568 620 HB2 GLN 41 HB2 GLN 41 -5.261 -3.103 -0.920 621 HB3 GLN 41 HB3 GLN 41 -4.191 -1.714 -1.158 622 HG2 GLN 41 HG2 GLN 41 -3.012 -2.876 -2.965 623 HG3 GLN 41 HG3 GLN 41 -3.985 -4.338 -2.682 624 HE21 GLN 41 HE21 GLN 41 -5.146 -4.418 -4.660 625 HE22 GLN 41 HE22 GLN 41 -6.311 -3.188 -5.064 626 H ARG 42 H ARG 42 -2.397 -1.158 0.478 627 HA ARG 42 HA ARG 42 -4.087 -0.806 2.848 628 HB2 ARG 42 HB2 ARG 42 -1.963 -2.004 3.573 629 HB3 ARG 42 HB3 ARG 42 -1.042 -0.604 2.994 630 HG2 ARG 42 HG2 ARG 42 -2.205 0.850 4.609 631 HG3 ARG 42 HG3 ARG 42 -3.233 -0.515 5.115 632 HD2 ARG 42 HD2 ARG 42 -1.193 -1.769 5.800 633 HD3 ARG 42 HD3 ARG 42 -0.206 -0.355 5.371 634 HE ARG 42 HE ARG 42 -2.145 0.583 7.155 635 HH11 ARG 42 HH11 ARG 42 0.442 -1.826 7.244 636 HH12 ARG 42 HH12 ARG 42 0.688 -1.651 8.970 637 HH21 ARG 42 HH21 ARG 42 -1.824 0.767 9.363 638 HH22 ARG 42 HH22 ARG 42 -0.583 -0.173 10.169 639 H LEU 43 H LEU 43 -4.546 1.474 3.045 640 HA LEU 43 HA LEU 43 -3.203 3.156 0.992 641 HB2 LEU 43 HB2 LEU 43 -5.255 2.011 0.142 642 HB3 LEU 43 HB3 LEU 43 -6.190 2.759 1.443 643 HG LEU 43 HG LEU 43 -5.629 4.989 0.550 644 HD11 LEU 43 HD11 LEU 43 -4.318 3.391 -1.703 645 HD12 LEU 43 HD12 LEU 43 -4.668 5.132 -1.764 646 HD13 LEU 43 HD13 LEU 43 -3.492 4.512 -0.588 647 HD21 LEU 43 HD21 LEU 43 -7.685 3.789 -0.159 648 HD22 LEU 43 HD22 LEU 43 -7.052 4.789 -1.487 649 HD23 LEU 43 HD23 LEU 43 -6.788 3.030 -1.491 650 H ILE 44 H ILE 44 -2.920 5.253 1.518 651 HA ILE 44 HA ILE 44 -3.972 6.239 4.122 652 HB ILE 44 HB ILE 44 -1.085 6.176 3.146 653 HG12 ILE 44 HG12 ILE 44 -0.889 5.344 5.651 654 HG13 ILE 44 HG13 ILE 44 -2.598 4.959 5.476 655 HG21 ILE 44 HG21 ILE 44 -1.608 8.437 4.126 656 HG22 ILE 44 HG22 ILE 44 -2.144 7.610 5.613 657 HG23 ILE 44 HG23 ILE 44 -0.464 7.508 5.086 658 HD11 ILE 44 HD11 ILE 44 -0.310 3.892 3.765 659 HD12 ILE 44 HD12 ILE 44 -1.224 3.005 5.016 660 HD13 ILE 44 HD13 ILE 44 -2.023 3.483 3.516 661 H PHE 45 H PHE 45 -4.153 8.504 4.247 662 HA PHE 45 HA PHE 45 -3.556 10.182 1.897 663 HB2 PHE 45 HB2 PHE 45 -5.809 9.236 1.483 664 HB3 PHE 45 HB3 PHE 45 -6.340 9.769 3.074 665 HD1 PHE 45 HD1 PHE 45 -4.643 11.324 0.086 666 HD2 PHE 45 HD2 PHE 45 -7.630 11.674 3.155 667 HE1 PHE 45 HE1 PHE 45 -5.351 13.479 -0.867 668 HE2 PHE 45 HE2 PHE 45 -8.339 13.852 2.221 669 HZ PHE 45 HZ PHE 45 -7.194 14.776 0.210 670 H ALA 46 H ALA 46 -3.340 12.351 2.470 671 HA ALA 46 HA ALA 46 -2.529 13.933 3.842 672 HB1 ALA 46 HB1 ALA 46 -5.030 13.273 5.435 673 HB2 ALA 46 HB2 ALA 46 -4.122 14.799 5.488 674 HB3 ALA 46 HB3 ALA 46 -4.959 14.318 3.999 675 H GLY 47 H GLY 47 -1.992 10.925 4.598 676 HA2 GLY 47 HA2 GLY 47 -0.209 10.219 5.921 677 HA3 GLY 47 HA3 GLY 47 -0.416 11.590 7.010 678 H LYS 48 H LYS 48 -3.401 9.908 6.238 679 HA LYS 48 HA LYS 48 -2.987 8.078 8.532 680 HB2 LYS 48 HB2 LYS 48 -5.209 8.474 9.404 681 HB3 LYS 48 HB3 LYS 48 -4.214 9.926 9.451 682 HG2 LYS 48 HG2 LYS 48 -6.307 10.661 8.796 683 HG3 LYS 48 HG3 LYS 48 -5.336 10.651 7.308 684 HD2 LYS 48 HD2 LYS 48 -6.475 8.595 6.559 685 HD3 LYS 48 HD3 LYS 48 -7.403 8.513 8.067 686 HE2 LYS 48 HE2 LYS 48 -7.470 10.808 6.068 687 HE3 LYS 48 HE3 LYS 48 -8.668 9.507 6.173 688 HZ1 LYS 48 HZ1 LYS 48 -9.154 10.225 8.416 689 HZ2 LYS 48 HZ2 LYS 48 -8.056 11.445 8.305 690 HZ3 LYS 48 HZ3 LYS 48 -9.399 11.453 7.356 691 H GLN 49 H GLN 49 -4.540 6.336 8.589 692 HA GLN 49 HA GLN 49 -4.615 5.216 5.862 693 HB2 GLN 49 HB2 GLN 49 -3.429 4.034 7.652 694 HB3 GLN 49 HB3 GLN 49 -4.906 3.978 8.623 695 HG2 GLN 49 HG2 GLN 49 -5.991 2.593 6.861 696 HG3 GLN 49 HG3 GLN 49 -4.519 2.677 5.884 697 HE21 GLN 49 HE21 GLN 49 -5.792 0.271 6.802 698 HE22 GLN 49 HE22 GLN 49 -4.679 -0.538 7.891 699 H LEU 50 H LEU 50 -6.418 4.142 5.058 700 HA LEU 50 HA LEU 50 -8.970 5.399 5.961 701 HB2 LEU 50 HB2 LEU 50 -8.371 4.235 3.226 702 HB3 LEU 50 HB3 LEU 50 -9.633 5.381 3.682 703 HG LEU 50 HG LEU 50 -6.635 5.935 3.583 704 HD11 LEU 50 HD11 LEU 50 -7.731 5.764 1.377 705 HD12 LEU 50 HD12 LEU 50 -8.938 6.968 1.885 706 HD13 LEU 50 HD13 LEU 50 -7.232 7.433 1.730 707 HD21 LEU 50 HD21 LEU 50 -7.886 7.237 5.388 708 HD22 LEU 50 HD22 LEU 50 -7.124 8.221 4.127 709 HD23 LEU 50 HD23 LEU 50 -8.873 7.929 4.070 710 H GLU 51 H GLU 51 -11.002 4.005 5.531 711 HA GLU 51 HA GLU 51 -10.335 1.134 6.012 712 HB2 GLU 51 HB2 GLU 51 -11.957 3.026 7.716 713 HB3 GLU 51 HB3 GLU 51 -12.293 1.285 7.714 714 HG2 GLU 51 HG2 GLU 51 -9.954 0.804 8.301 715 HG3 GLU 51 HG3 GLU 51 -9.581 2.531 8.270 716 H ASP 52 H ASP 52 -11.864 -0.366 5.529 717 HA ASP 52 HA ASP 52 -13.297 0.183 3.117 718 HB2 ASP 52 HB2 ASP 52 -13.319 -2.240 4.953 719 HB3 ASP 52 HB3 ASP 52 -13.904 -2.189 3.285 720 H GLY 53 H GLY 53 -14.171 0.929 6.241 721 HA2 GLY 53 HA2 GLY 53 -17.042 0.284 5.817 722 HA3 GLY 53 HA3 GLY 53 -16.266 0.566 7.389 723 H ARG 54 H ARG 54 -15.014 2.774 5.137 724 HA ARG 54 HA ARG 54 -16.833 4.909 6.130 725 HB2 ARG 54 HB2 ARG 54 -14.142 5.248 4.842 726 HB3 ARG 54 HB3 ARG 54 -14.995 6.381 5.890 727 HG2 ARG 54 HG2 ARG 54 -13.860 3.706 6.829 728 HG3 ARG 54 HG3 ARG 54 -13.015 5.256 6.962 729 HD2 ARG 54 HD2 ARG 54 -14.716 6.175 8.359 730 HD3 ARG 54 HD3 ARG 54 -15.753 4.733 8.156 731 HE ARG 54 HE ARG 54 -13.318 3.804 9.166 732 HH11 ARG 54 HH11 ARG 54 -15.864 6.008 10.246 733 HH12 ARG 54 HH12 ARG 54 -15.576 5.684 11.942 734 HH21 ARG 54 HH21 ARG 54 -12.949 3.430 11.352 735 HH22 ARG 54 HH22 ARG 54 -13.922 4.218 12.577 736 H THR 55 H THR 55 -15.648 6.706 4.112 737 HA THR 55 HA THR 55 -16.311 5.740 1.433 738 HB THR 55 HB THR 55 -17.729 7.937 1.185 739 HG1 THR 55 HG1 THR 55 -18.722 8.586 3.043 740 HG21 THR 55 HG21 THR 55 -18.549 5.511 1.086 741 HG22 THR 55 HG22 THR 55 -18.911 5.653 2.816 742 HG23 THR 55 HG23 THR 55 -19.760 6.694 1.647 743 H LEU 56 H LEU 56 -15.428 7.249 -0.186 744 HA LEU 56 HA LEU 56 -12.984 8.421 0.682 745 HB2 LEU 56 HB2 LEU 56 -14.618 8.684 -1.864 746 HB3 LEU 56 HB3 LEU 56 -13.081 9.526 -1.630 747 HG LEU 56 HG LEU 56 -13.445 6.498 -1.447 748 HD11 LEU 56 HD11 LEU 56 -12.231 8.290 -3.596 749 HD12 LEU 56 HD12 LEU 56 -12.177 6.510 -3.590 750 HD13 LEU 56 HD13 LEU 56 -13.735 7.344 -3.741 751 HD21 LEU 56 HD21 LEU 56 -10.935 8.230 -1.486 752 HD22 LEU 56 HD22 LEU 56 -11.529 7.304 -0.086 753 HD23 LEU 56 HD23 LEU 56 -10.968 6.454 -1.533 754 H SER 57 H SER 57 -16.257 9.587 0.547 755 HA SER 57 HA SER 57 -15.742 12.393 0.713 756 HB2 SER 57 HB2 SER 57 -18.137 12.418 1.312 757 HB3 SER 57 HB3 SER 57 -17.850 11.313 -0.048 758 HG SER 57 HG SER 57 -19.183 10.397 1.556 759 H ASP 58 H ASP 58 -15.728 9.740 3.022 760 HA ASP 58 HA ASP 58 -16.072 11.383 5.381 761 HB2 ASP 58 HB2 ASP 58 -16.644 8.936 5.194 762 HB3 ASP 58 HB3 ASP 58 -14.906 8.589 5.155 763 H TYR 59 H TYR 59 -13.406 10.750 3.262 764 HA TYR 59 HA TYR 59 -11.579 11.878 5.332 765 HB2 TYR 59 HB2 TYR 59 -10.398 10.685 2.891 766 HB3 TYR 59 HB3 TYR 59 -9.808 10.684 4.543 767 HD1 TYR 59 HD1 TYR 59 -10.701 8.871 6.131 768 HD2 TYR 59 HD2 TYR 59 -11.648 9.017 1.949 769 HE1 TYR 59 HE1 TYR 59 -11.271 6.399 6.143 770 HE2 TYR 59 HE2 TYR 59 -12.307 6.616 1.992 771 HH TYR 59 HH TYR 59 -12.392 4.703 3.279 772 H ASN 60 H ASN 60 -13.541 13.156 3.391 773 HA ASN 60 HA ASN 60 -13.699 14.831 1.954 774 HB2 ASN 60 HB2 ASN 60 -12.666 16.788 2.698 775 HB3 ASN 60 HB3 ASN 60 -12.892 15.772 4.117 776 HD21 ASN 60 HD21 ASN 60 -11.165 15.137 5.353 777 HD22 ASN 60 HD22 ASN 60 -9.510 15.621 5.015 778 H ILE 61 H ILE 61 -11.825 12.625 0.985 779 HA ILE 61 HA ILE 61 -9.780 13.797 -0.605 780 HB ILE 61 HB ILE 61 -11.408 11.250 -0.849 781 HG12 ILE 61 HG12 ILE 61 -8.482 11.748 -0.167 782 HG13 ILE 61 HG13 ILE 61 -9.760 11.646 1.055 783 HG21 ILE 61 HG21 ILE 61 -9.005 12.111 -2.525 784 HG22 ILE 61 HG22 ILE 61 -9.748 10.491 -2.530 785 HG23 ILE 61 HG23 ILE 61 -10.663 11.879 -3.125 786 HD11 ILE 61 HD11 ILE 61 -10.293 9.347 0.302 787 HD12 ILE 61 HD12 ILE 61 -8.979 9.437 -0.891 788 HD13 ILE 61 HD13 ILE 61 -8.608 9.504 0.850 789 H GLN 62 H GLN 62 -9.717 14.664 -2.605 790 HA GLN 62 HA GLN 62 -12.239 14.991 -4.173 791 HB2 GLN 62 HB2 GLN 62 -10.021 17.034 -3.854 792 HB3 GLN 62 HB3 GLN 62 -11.606 17.275 -4.603 793 HG2 GLN 62 HG2 GLN 62 -11.097 16.697 -1.647 794 HG3 GLN 62 HG3 GLN 62 -11.372 18.287 -2.321 795 HE21 GLN 62 HE21 GLN 62 -12.946 16.731 -0.295 796 HE22 GLN 62 HE22 GLN 62 -14.576 16.670 -0.927 797 H LYS 63 H LYS 63 -11.361 16.105 -6.393 798 HA LYS 63 HA LYS 63 -9.848 14.093 -7.737 799 HB2 LYS 63 HB2 LYS 63 -10.011 15.557 -9.602 800 HB3 LYS 63 HB3 LYS 63 -11.551 15.621 -8.730 801 HG2 LYS 63 HG2 LYS 63 -10.839 17.754 -7.652 802 HG3 LYS 63 HG3 LYS 63 -9.306 17.682 -8.548 803 HD2 LYS 63 HD2 LYS 63 -10.807 19.176 -9.704 804 HD3 LYS 63 HD3 LYS 63 -10.561 17.710 -10.681 805 HE2 LYS 63 HE2 LYS 63 -12.715 16.801 -9.884 806 HE3 LYS 63 HE3 LYS 63 -12.944 18.222 -8.853 807 HZ1 LYS 63 HZ1 LYS 63 -14.150 18.417 -10.909 808 HZ2 LYS 63 HZ2 LYS 63 -12.985 19.571 -10.835 809 HZ3 LYS 63 HZ3 LYS 63 -12.776 18.249 -11.795 810 H GLU 64 H GLU 64 -7.814 13.925 -8.344 811 HA GLU 64 HA GLU 64 -5.572 14.150 -8.329 812 HB2 GLU 64 HB2 GLU 64 -6.268 17.113 -8.424 813 HB3 GLU 64 HB3 GLU 64 -4.737 16.366 -8.919 814 HG2 GLU 64 HG2 GLU 64 -5.974 15.035 -10.629 815 HG3 GLU 64 HG3 GLU 64 -7.468 15.872 -10.177 816 H SER 65 H SER 65 -6.899 14.111 -5.616 817 HA SER 65 HA SER 65 -5.543 16.052 -4.004 818 HB2 SER 65 HB2 SER 65 -7.183 13.581 -3.370 819 HB3 SER 65 HB3 SER 65 -6.484 14.643 -2.127 820 HG SER 65 HG SER 65 -7.605 16.384 -3.099 821 H THR 66 H THR 66 -4.535 13.054 -5.289 822 HA THR 66 HA THR 66 -2.790 11.664 -5.018 823 HB THR 66 HB THR 66 -1.671 14.054 -3.559 824 HG1 THR 66 HG1 THR 66 -0.628 14.293 -5.560 825 HG21 THR 66 HG21 THR 66 -0.280 11.502 -4.514 826 HG22 THR 66 HG22 THR 66 0.556 12.989 -4.003 827 HG23 THR 66 HG23 THR 66 -0.405 12.065 -2.837 828 H LEU 67 H LEU 67 -2.358 9.936 -3.848 829 HA LEU 67 HA LEU 67 -2.821 9.889 -0.901 830 HB2 LEU 67 HB2 LEU 67 -4.048 8.175 -3.079 831 HB3 LEU 67 HB3 LEU 67 -3.746 7.514 -1.467 832 HG LEU 67 HG LEU 67 -5.119 9.432 -0.524 833 HD11 LEU 67 HD11 LEU 67 -5.296 10.931 -2.457 834 HD12 LEU 67 HD12 LEU 67 -5.957 9.616 -3.455 835 HD13 LEU 67 HD13 LEU 67 -6.897 10.272 -2.093 836 HD21 LEU 67 HD21 LEU 67 -6.424 7.358 -2.324 837 HD22 LEU 67 HD22 LEU 67 -5.847 7.095 -0.662 838 HD23 LEU 67 HD23 LEU 67 -7.201 8.199 -0.956 839 H HIS 68 H HIS 68 -2.124 7.424 -0.260 840 HA HIS 68 HA HIS 68 0.430 6.829 -1.667 841 HB2 HIS 68 HB2 HIS 68 0.110 7.087 1.338 842 HB3 HIS 68 HB3 HIS 68 1.598 6.719 0.451 843 HD2 HIS 68 HD2 HIS 68 2.518 8.786 -1.230 844 HE1 HIS 68 HE1 HIS 68 0.591 11.880 0.958 845 HE2 HIS 68 HE2 HIS 68 2.357 11.363 -0.800 846 H LEU 69 H LEU 69 0.485 4.782 -2.227 847 HA LEU 69 HA LEU 69 -1.225 2.775 -0.856 848 HB2 LEU 69 HB2 LEU 69 -1.645 3.011 -3.226 849 HB3 LEU 69 HB3 LEU 69 0.084 3.005 -3.590 850 HG LEU 69 HG LEU 69 0.250 0.645 -2.865 851 HD11 LEU 69 HD11 LEU 69 -2.783 0.826 -2.604 852 HD12 LEU 69 HD12 LEU 69 -1.818 -0.671 -2.539 853 HD13 LEU 69 HD13 LEU 69 -1.644 0.546 -1.268 854 HD21 LEU 69 HD21 LEU 69 -1.893 1.207 -4.946 855 HD22 LEU 69 HD22 LEU 69 -0.138 1.199 -5.224 856 HD23 LEU 69 HD23 LEU 69 -0.970 -0.307 -4.776 857 H VAL 70 H VAL 70 -0.356 1.106 0.182 858 HA VAL 70 HA VAL 70 2.425 0.242 -0.309 859 HB VAL 70 HB VAL 70 1.362 0.793 2.495 860 HG11 VAL 70 HG11 VAL 70 4.064 -0.091 1.399 861 HG12 VAL 70 HG12 VAL 70 3.805 0.463 3.067 862 HG13 VAL 70 HG13 VAL 70 2.998 -1.002 2.497 863 HG21 VAL 70 HG21 VAL 70 3.361 2.358 0.798 864 HG22 VAL 70 HG22 VAL 70 1.803 2.951 1.407 865 HG23 VAL 70 HG23 VAL 70 3.114 2.585 2.542 866 H LEU 71 H LEU 71 2.653 -2.027 0.897 867 HA LEU 71 HA LEU 71 0.041 -3.323 1.268 868 HB2 LEU 71 HB2 LEU 71 0.594 -5.077 -0.465 869 HB3 LEU 71 HB3 LEU 71 0.123 -3.493 -1.054 870 HG LEU 71 HG LEU 71 2.521 -2.920 -1.468 871 HD11 LEU 71 HD11 LEU 71 2.964 -5.865 -0.830 872 HD12 LEU 71 HD12 LEU 71 4.144 -4.800 -1.620 873 HD13 LEU 71 HD13 LEU 71 3.671 -4.485 0.056 874 HD21 LEU 71 HD21 LEU 71 1.479 -5.454 -2.791 875 HD22 LEU 71 HD22 LEU 71 1.008 -3.794 -3.216 876 HD23 LEU 71 HD23 LEU 71 2.685 -4.328 -3.471 877 H ARG 72 H ARG 72 0.361 -5.764 1.718 878 HA ARG 72 HA ARG 72 2.178 -5.880 3.988 879 HB2 ARG 72 HB2 ARG 72 -0.091 -7.487 2.830 880 HB3 ARG 72 HB3 ARG 72 1.014 -8.296 3.942 881 HG2 ARG 72 HG2 ARG 72 -0.988 -7.287 5.060 882 HG3 ARG 72 HG3 ARG 72 0.571 -6.764 5.711 883 HD2 ARG 72 HD2 ARG 72 0.439 -4.661 4.484 884 HD3 ARG 72 HD3 ARG 72 -1.062 -5.178 3.703 885 HE ARG 72 HE ARG 72 -0.709 -4.620 6.632 886 HH11 ARG 72 HH11 ARG 72 -2.807 -4.836 3.786 887 HH12 ARG 72 HH12 ARG 72 -4.208 -4.232 4.640 888 HH21 ARG 72 HH21 ARG 72 -2.555 -3.857 7.709 889 HH22 ARG 72 HH22 ARG 72 -4.065 -3.681 6.849 890 H LEU 73 H LEU 73 3.047 -8.331 4.249 891 HA LEU 73 HA LEU 73 4.604 -9.023 1.849 892 HB2 LEU 73 HB2 LEU 73 5.599 -7.458 3.937 893 HB3 LEU 73 HB3 LEU 73 6.003 -9.077 4.494 894 HG LEU 73 HG LEU 73 7.131 -9.444 2.218 895 HD11 LEU 73 HD11 LEU 73 5.929 -7.710 0.936 896 HD12 LEU 73 HD12 LEU 73 6.534 -6.454 2.034 897 HD13 LEU 73 HD13 LEU 73 7.663 -7.318 0.966 898 HD21 LEU 73 HD21 LEU 73 8.084 -7.103 3.921 899 HD22 LEU 73 HD22 LEU 73 8.415 -8.822 4.234 900 HD23 LEU 73 HD23 LEU 73 9.097 -8.034 2.791 901 H ARG 74 H ARG 74 2.284 -9.916 3.364 902 HA ARG 74 HA ARG 74 1.231 -11.605 4.418 903 HB2 ARG 74 HB2 ARG 74 3.478 -13.162 3.093 904 HB3 ARG 74 HB3 ARG 74 2.091 -13.875 3.927 905 HG2 ARG 74 HG2 ARG 74 1.874 -11.963 1.553 906 HG3 ARG 74 HG3 ARG 74 1.835 -13.740 1.430 907 HD2 ARG 74 HD2 ARG 74 -0.072 -13.770 3.033 908 HD3 ARG 74 HD3 ARG 74 -0.104 -11.994 2.988 909 HE ARG 74 HE ARG 74 -0.249 -13.180 0.340 910 HH11 ARG 74 HH11 ARG 74 -2.163 -12.323 3.194 911 HH12 ARG 74 HH12 ARG 74 -3.650 -12.169 2.276 912 HH21 ARG 74 HH21 ARG 74 -2.234 -12.999 -0.800 913 HH22 ARG 74 HH22 ARG 74 -3.690 -12.570 0.071 914 H GLY 75 H GLY 75 4.715 -11.913 5.022 915 HA2 GLY 75 HA2 GLY 75 4.995 -11.491 7.627 916 HA3 GLY 75 HA3 GLY 75 4.213 -13.089 7.684 917 H GLY 76 H GLY 76 5.660 -13.404 4.874 918 HA2 GLY 76 HA2 GLY 76 8.465 -13.521 5.327 919 HA3 GLY 76 HA3 GLY 76 7.758 -15.095 5.728 Start of MODEL 12 1 H LEU 491 H LEU 491 14.376 6.869 12.470 2 HA LEU 491 HA LEU 491 16.878 5.922 11.938 3 HB2 LEU 491 HB2 LEU 491 15.293 4.125 10.587 4 HB3 LEU 491 HB3 LEU 491 15.701 4.106 12.288 5 HG LEU 491 HG LEU 491 13.589 5.387 12.796 6 HD11 LEU 491 HD11 LEU 491 13.080 4.874 9.830 7 HD12 LEU 491 HD12 LEU 491 11.865 5.455 10.998 8 HD13 LEU 491 HD13 LEU 491 13.266 6.470 10.579 9 HD21 LEU 491 HD21 LEU 491 13.355 2.793 11.259 10 HD22 LEU 491 HD22 LEU 491 13.732 2.999 12.992 11 HD23 LEU 491 HD23 LEU 491 12.128 3.460 12.372 12 HA PRO 492 HA PRO 492 17.597 6.956 7.597 13 HB2 PRO 492 HB2 PRO 492 20.128 6.071 7.464 14 HB3 PRO 492 HB3 PRO 492 19.703 7.448 8.525 15 HG2 PRO 492 HG2 PRO 492 20.105 4.561 9.295 16 HG3 PRO 492 HG3 PRO 492 20.727 6.030 10.114 17 HD2 PRO 492 HD2 PRO 492 18.387 4.655 10.828 18 HD3 PRO 492 HD3 PRO 492 18.676 6.364 11.223 19 H LEU 493 H LEU 493 19.128 5.197 6.032 20 HA LEU 493 HA LEU 493 17.314 3.052 5.525 21 HB2 LEU 493 HB2 LEU 493 18.710 2.521 3.692 22 HB3 LEU 493 HB3 LEU 493 18.699 4.284 3.830 23 HG LEU 493 HG LEU 493 20.942 2.384 4.660 24 HD11 LEU 493 HD11 LEU 493 22.174 3.550 2.875 25 HD12 LEU 493 HD12 LEU 493 20.698 2.787 2.238 26 HD13 LEU 493 HD13 LEU 493 20.744 4.546 2.526 27 HD21 LEU 493 HD21 LEU 493 22.242 4.464 5.113 28 HD22 LEU 493 HD22 LEU 493 20.745 5.408 4.932 29 HD23 LEU 493 HD23 LEU 493 20.912 4.213 6.252 30 H GLN 494 H GLN 494 18.358 2.996 8.130 31 HA GLN 494 HA GLN 494 20.331 1.021 8.574 32 HB2 GLN 494 HB2 GLN 494 19.589 1.144 10.860 33 HB3 GLN 494 HB3 GLN 494 19.563 2.759 10.109 34 HG2 GLN 494 HG2 GLN 494 17.605 2.848 11.232 35 HG3 GLN 494 HG3 GLN 494 17.055 2.275 9.656 36 HE21 GLN 494 HE21 GLN 494 15.266 1.871 11.354 37 HE22 GLN 494 HE22 GLN 494 15.201 0.225 11.985 38 H ALA 495 H ALA 495 16.879 0.737 7.915 39 HA ALA 495 HA ALA 495 17.246 -2.208 7.877 40 HB1 ALA 495 HB1 ALA 495 15.091 -2.519 9.071 41 HB2 ALA 495 HB2 ALA 495 16.323 -1.741 10.079 42 HB3 ALA 495 HB3 ALA 495 15.024 -0.760 9.363 43 H LEU 496 H LEU 496 16.453 0.436 6.100 44 HA LEU 496 HA LEU 496 14.085 -0.323 4.761 45 HB2 LEU 496 HB2 LEU 496 16.470 1.403 4.234 46 HB3 LEU 496 HB3 LEU 496 15.585 0.843 2.817 47 HG LEU 496 HG LEU 496 13.457 1.649 3.858 48 HD11 LEU 496 HD11 LEU 496 15.335 3.058 5.802 49 HD12 LEU 496 HD12 LEU 496 13.572 3.276 5.678 50 HD13 LEU 496 HD13 LEU 496 14.242 1.716 6.206 51 HD21 LEU 496 HD21 LEU 496 15.661 3.710 3.392 52 HD22 LEU 496 HD22 LEU 496 14.685 2.927 2.136 53 HD23 LEU 496 HD23 LEU 496 13.899 4.017 3.292 54 HA PRO 497 HA PRO 497 15.343 -3.999 2.532 55 HB2 PRO 497 HB2 PRO 497 13.431 -2.877 0.497 56 HB3 PRO 497 HB3 PRO 497 13.504 -4.536 1.166 57 HG2 PRO 497 HG2 PRO 497 11.602 -2.791 2.010 58 HG3 PRO 497 HG3 PRO 497 12.456 -3.836 3.196 59 HD2 PRO 497 HD2 PRO 497 12.982 -0.934 2.539 60 HD3 PRO 497 HD3 PRO 497 12.920 -1.746 4.136 61 H GLU 498 H GLU 498 16.429 -4.542 0.478 62 HA GLU 498 HA GLU 498 17.974 -2.324 -0.596 63 HB2 GLU 498 HB2 GLU 498 18.842 -4.690 -0.086 64 HB3 GLU 498 HB3 GLU 498 17.916 -5.229 -1.508 65 HG2 GLU 498 HG2 GLU 498 20.174 -4.815 -2.237 66 HG3 GLU 498 HG3 GLU 498 19.173 -3.491 -2.858 67 H GLY 499 H GLY 499 15.732 -1.483 -1.091 68 HA2 GLY 499 HA2 GLY 499 15.374 -1.254 -3.879 69 HA3 GLY 499 HA3 GLY 499 14.264 -2.511 -3.280 70 H VAL 500 H VAL 500 15.209 0.230 -1.259 71 HA VAL 500 HA VAL 500 12.708 1.711 -1.781 72 HB VAL 500 HB VAL 500 13.521 0.590 0.938 73 HG11 VAL 500 HG11 VAL 500 11.317 1.539 1.676 74 HG12 VAL 500 HG12 VAL 500 12.481 2.788 1.229 75 HG13 VAL 500 HG13 VAL 500 11.169 2.348 0.103 76 HG21 VAL 500 HG21 VAL 500 11.145 -0.030 -0.869 77 HG22 VAL 500 HG22 VAL 500 12.470 -1.138 -0.451 78 HG23 VAL 500 HG23 VAL 500 11.332 -0.603 0.802 79 H ASP 501 H ASP 501 12.803 3.864 -0.660 80 HA ASP 501 HA ASP 501 15.548 4.693 0.144 81 HB2 ASP 501 HB2 ASP 501 15.002 5.125 -2.360 82 HB3 ASP 501 HB3 ASP 501 13.861 6.331 -1.771 83 H GLN 502 H GLN 502 15.593 6.656 1.359 84 HA GLN 502 HA GLN 502 13.562 6.929 3.314 85 HB2 GLN 502 HB2 GLN 502 15.679 8.882 2.309 86 HB3 GLN 502 HB3 GLN 502 14.822 9.025 3.856 87 HG2 GLN 502 HG2 GLN 502 16.455 6.577 3.097 88 HG3 GLN 502 HG3 GLN 502 17.151 7.976 3.915 89 HE21 GLN 502 HE21 GLN 502 15.011 5.195 4.232 90 HE22 GLN 502 HE22 GLN 502 14.786 5.310 5.965 91 H GLU 503 H GLU 503 14.232 8.670 0.283 92 HA GLU 503 HA GLU 503 12.297 10.695 0.774 93 HB2 GLU 503 HB2 GLU 503 12.721 11.449 -1.454 94 HB3 GLU 503 HB3 GLU 503 14.256 10.779 -0.859 95 HG2 GLU 503 HG2 GLU 503 13.568 8.587 -1.996 96 HG3 GLU 503 HG3 GLU 503 12.252 9.485 -2.756 97 H VAL 504 H VAL 504 11.690 7.466 0.320 98 HA VAL 504 HA VAL 504 8.920 8.145 -0.438 99 HB VAL 504 HB VAL 504 10.209 7.285 -2.403 100 HG11 VAL 504 HG11 VAL 504 11.632 5.632 -1.305 101 HG12 VAL 504 HG12 VAL 504 10.204 4.673 -0.848 102 HG13 VAL 504 HG13 VAL 504 10.644 4.865 -2.561 103 HG21 VAL 504 HG21 VAL 504 8.455 5.824 -3.196 104 HG22 VAL 504 HG22 VAL 504 7.888 5.512 -1.545 105 HG23 VAL 504 HG23 VAL 504 7.741 7.145 -2.242 106 H PHE 505 H PHE 505 10.695 7.290 2.064 107 HA PHE 505 HA PHE 505 8.695 5.310 3.038 108 HB2 PHE 505 HB2 PHE 505 10.608 4.025 2.873 109 HB3 PHE 505 HB3 PHE 505 11.676 5.404 3.118 110 HD1 PHE 505 HD1 PHE 505 11.992 6.398 5.312 111 HD2 PHE 505 HD2 PHE 505 10.004 2.644 4.782 112 HE1 PHE 505 HE1 PHE 505 12.456 5.823 7.705 113 HE2 PHE 505 HE2 PHE 505 10.493 2.049 7.166 114 HZ PHE 505 HZ PHE 505 11.696 3.596 8.602 115 H LYS 506 H LYS 506 10.467 8.344 3.535 116 HA LYS 506 HA LYS 506 9.790 8.586 6.348 117 HB2 LYS 506 HB2 LYS 506 10.613 10.602 4.225 118 HB3 LYS 506 HB3 LYS 506 10.455 10.981 5.950 119 HG2 LYS 506 HG2 LYS 506 12.183 9.330 6.507 120 HG3 LYS 506 HG3 LYS 506 12.330 8.867 4.804 121 HD2 LYS 506 HD2 LYS 506 12.910 11.629 5.965 122 HD3 LYS 506 HD3 LYS 506 14.127 10.433 5.466 123 HE2 LYS 506 HE2 LYS 506 13.290 10.554 3.147 124 HE3 LYS 506 HE3 LYS 506 12.078 11.754 3.640 125 HZ1 LYS 506 HZ1 LYS 506 14.026 12.791 2.710 126 HZ2 LYS 506 HZ2 LYS 506 13.877 13.204 4.293 127 HZ3 LYS 506 HZ3 LYS 506 14.998 12.094 3.837 128 H GLN 507 H GLN 507 7.973 8.653 3.536 129 HA GLN 507 HA GLN 507 6.080 10.769 4.289 130 HB2 GLN 507 HB2 GLN 507 6.369 8.804 1.980 131 HB3 GLN 507 HB3 GLN 507 4.993 9.903 2.131 132 HG2 GLN 507 HG2 GLN 507 6.801 10.753 0.623 133 HG3 GLN 507 HG3 GLN 507 6.390 11.844 1.960 134 HE21 GLN 507 HE21 GLN 507 8.866 9.524 0.787 135 HE22 GLN 507 HE22 GLN 507 10.137 10.123 1.823 136 H LEU 508 H LEU 508 6.624 7.570 5.144 137 HA LEU 508 HA LEU 508 3.825 6.682 5.339 138 HB2 LEU 508 HB2 LEU 508 6.409 5.530 6.455 139 HB3 LEU 508 HB3 LEU 508 4.875 4.668 6.281 140 HG LEU 508 HG LEU 508 6.525 5.769 3.957 141 HD11 LEU 508 HD11 LEU 508 6.242 2.935 5.019 142 HD12 LEU 508 HD12 LEU 508 7.153 3.429 3.574 143 HD13 LEU 508 HD13 LEU 508 7.684 3.956 5.183 144 HD21 LEU 508 HD21 LEU 508 4.112 3.906 4.057 145 HD22 LEU 508 HD22 LEU 508 4.121 5.573 3.443 146 HD23 LEU 508 HD23 LEU 508 5.047 4.316 2.597 147 HA PRO 509 HA PRO 509 3.507 7.924 9.684 148 HB2 PRO 509 HB2 PRO 509 1.695 6.090 10.592 149 HB3 PRO 509 HB3 PRO 509 1.245 7.471 9.561 150 HG2 PRO 509 HG2 PRO 509 1.800 4.599 8.762 151 HG3 PRO 509 HG3 PRO 509 0.429 5.634 8.229 152 HD2 PRO 509 HD2 PRO 509 2.684 5.247 6.704 153 HD3 PRO 509 HD3 PRO 509 1.804 6.805 6.715 154 H ALA 510 H ALA 510 3.907 7.042 11.791 155 HA ALA 510 HA ALA 510 6.160 5.366 11.963 156 HB1 ALA 510 HB1 ALA 510 4.050 6.193 13.994 157 HB2 ALA 510 HB2 ALA 510 5.657 5.527 14.411 158 HB3 ALA 510 HB3 ALA 510 5.516 7.103 13.581 159 H ASP 511 H ASP 511 2.809 4.474 11.616 160 HA ASP 511 HA ASP 511 3.307 1.807 12.803 161 HB2 ASP 511 HB2 ASP 511 0.895 1.473 12.580 162 HB3 ASP 511 HB3 ASP 511 1.268 2.937 13.502 163 H ILE 512 H ILE 512 3.790 3.275 9.844 164 HA ILE 512 HA ILE 512 3.601 0.575 8.582 165 HB ILE 512 HB ILE 512 3.523 3.297 7.248 166 HG12 ILE 512 HG12 ILE 512 1.516 1.031 7.580 167 HG13 ILE 512 HG13 ILE 512 1.416 2.647 8.301 168 HG21 ILE 512 HG21 ILE 512 3.455 0.502 6.016 169 HG22 ILE 512 HG22 ILE 512 3.259 2.034 5.133 170 HG23 ILE 512 HG23 ILE 512 4.806 1.653 5.885 171 HD11 ILE 512 HD11 ILE 512 -0.069 2.577 6.421 172 HD12 ILE 512 HD12 ILE 512 1.303 3.617 5.979 173 HD13 ILE 512 HD13 ILE 512 1.192 1.956 5.342 174 H GLN 513 H GLN 513 5.759 3.182 9.617 175 HA GLN 513 HA GLN 513 8.127 2.501 8.275 176 HB2 GLN 513 HB2 GLN 513 7.335 3.513 10.972 177 HB3 GLN 513 HB3 GLN 513 8.866 2.622 10.967 178 HG2 GLN 513 HG2 GLN 513 9.186 5.033 10.735 179 HG3 GLN 513 HG3 GLN 513 9.890 4.057 9.445 180 HE21 GLN 513 HE21 GLN 513 9.519 4.627 7.399 181 HE22 GLN 513 HE22 GLN 513 8.270 5.717 6.862 182 H GLU 514 H GLU 514 6.697 0.940 11.182 183 HA GLU 514 HA GLU 514 8.627 -1.088 11.426 184 HB2 GLU 514 HB2 GLU 514 6.961 -2.190 12.876 185 HB3 GLU 514 HB3 GLU 514 7.063 -0.447 13.204 186 HG2 GLU 514 HG2 GLU 514 5.037 -0.055 11.861 187 HG3 GLU 514 HG3 GLU 514 4.941 -1.782 11.473 188 H GLU 515 H GLU 515 6.279 -0.768 8.931 189 HA GLU 515 HA GLU 515 6.174 -3.677 8.410 190 HB2 GLU 515 HB2 GLU 515 5.055 -1.323 6.838 191 HB3 GLU 515 HB3 GLU 515 4.719 -3.026 6.541 192 HG2 GLU 515 HG2 GLU 515 4.028 -1.591 9.139 193 HG3 GLU 515 HG3 GLU 515 2.920 -1.777 7.781 194 H ILE 516 H ILE 516 7.949 -0.783 7.391 195 HA ILE 516 HA ILE 516 8.965 -2.207 4.990 196 HB ILE 516 HB ILE 516 9.912 0.516 5.844 197 HG12 ILE 516 HG12 ILE 516 7.599 0.930 6.040 198 HG13 ILE 516 HG13 ILE 516 8.137 1.565 4.486 199 HG21 ILE 516 HG21 ILE 516 10.042 0.801 3.382 200 HG22 ILE 516 HG22 ILE 516 10.968 -0.604 3.947 201 HG23 ILE 516 HG23 ILE 516 9.389 -0.840 3.167 202 HD11 ILE 516 HD11 ILE 516 7.197 -0.409 3.328 203 HD12 ILE 516 HD12 ILE 516 6.616 -1.035 4.895 204 HD13 ILE 516 HD13 ILE 516 5.977 0.496 4.262 205 H LEU 517 H LEU 517 10.022 -0.844 8.118 206 HA LEU 517 HA LEU 517 12.797 -1.550 7.831 207 HB2 LEU 517 HB2 LEU 517 11.016 -1.014 10.246 208 HB3 LEU 517 HB3 LEU 517 12.741 -1.295 10.361 209 HG LEU 517 HG LEU 517 13.012 0.929 10.193 210 HD11 LEU 517 HD11 LEU 517 12.141 0.722 7.329 211 HD12 LEU 517 HD12 LEU 517 13.129 1.987 8.110 212 HD13 LEU 517 HD13 LEU 517 13.758 0.350 7.980 213 HD21 LEU 517 HD21 LEU 517 10.380 1.567 9.015 214 HD22 LEU 517 HD22 LEU 517 10.535 1.021 10.714 215 HD23 LEU 517 HD23 LEU 517 11.407 2.452 10.167 216 H SER 518 H SER 518 9.978 -3.369 8.224 217 HA SER 518 HA SER 518 10.880 -5.586 9.778 218 HB2 SER 518 HB2 SER 518 8.506 -5.111 9.045 219 HB3 SER 518 HB3 SER 518 8.984 -5.587 7.396 220 HG SER 518 HG SER 518 9.075 -7.196 9.738 221 H GLY 519 H GLY 519 10.717 -5.170 6.174 222 HA2 GLY 519 HA2 GLY 519 12.926 -5.798 5.072 223 HA3 GLY 519 HA3 GLY 519 12.675 -7.381 5.843 224 H LYS 520 H LYS 520 12.527 -6.172 2.925 225 HA LYS 520 HA LYS 520 10.128 -7.669 2.105 226 HB2 LYS 520 HB2 LYS 520 10.732 -4.813 1.280 227 HB3 LYS 520 HB3 LYS 520 9.413 -5.880 0.723 228 HG2 LYS 520 HG2 LYS 520 8.585 -6.018 3.064 229 HG3 LYS 520 HG3 LYS 520 9.748 -4.744 3.509 230 HD2 LYS 520 HD2 LYS 520 8.770 -3.224 1.858 231 HD3 LYS 520 HD3 LYS 520 7.647 -4.482 1.303 232 HE2 LYS 520 HE2 LYS 520 7.729 -3.389 4.135 233 HE3 LYS 520 HE3 LYS 520 6.639 -2.797 2.868 234 HZ1 LYS 520 HZ1 LYS 520 5.698 -4.987 2.720 235 HZ2 LYS 520 HZ2 LYS 520 6.691 -5.555 3.909 236 HZ3 LYS 520 HZ3 LYS 520 5.569 -4.420 4.254 237 H SER 521 H SER 521 10.210 -8.123 -0.171 238 HA SER 521 HA SER 521 12.879 -8.076 -1.460 239 HB2 SER 521 HB2 SER 521 11.358 -10.592 -0.671 240 HB3 SER 521 HB3 SER 521 12.774 -10.530 -1.744 241 HG SER 521 HG SER 521 13.950 -9.643 0.013 242 H ARG 522 H ARG 522 10.275 -6.888 -2.149 243 HA ARG 522 HA ARG 522 9.806 -8.177 -4.759 244 HB2 ARG 522 HB2 ARG 522 8.178 -8.643 -2.613 245 HB3 ARG 522 HB3 ARG 522 7.440 -7.159 -3.237 246 HG2 ARG 522 HG2 ARG 522 6.296 -8.797 -4.432 247 HG3 ARG 522 HG3 ARG 522 7.625 -8.370 -5.550 248 HD2 ARG 522 HD2 ARG 522 7.813 -10.609 -3.503 249 HD3 ARG 522 HD3 ARG 522 7.154 -10.892 -5.129 250 HE ARG 522 HE ARG 522 9.965 -10.242 -4.416 251 HH11 ARG 522 HH11 ARG 522 7.601 -11.089 -6.915 252 HH12 ARG 522 HH12 ARG 522 8.839 -11.459 -8.098 253 HH21 ARG 522 HH21 ARG 522 11.526 -10.739 -5.966 254 HH22 ARG 522 HH22 ARG 522 11.044 -11.271 -7.557 255 H GLU 523 H GLU 523 11.033 -5.609 -3.482 256 HA GLU 523 HA GLU 523 9.809 -3.725 -5.412 257 HB2 GLU 523 HB2 GLU 523 10.013 -1.922 -3.675 258 HB3 GLU 523 HB3 GLU 523 8.717 -3.096 -3.387 259 HG2 GLU 523 HG2 GLU 523 11.457 -3.257 -2.074 260 HG3 GLU 523 HG3 GLU 523 10.053 -2.449 -1.342 261 H ASN 524 H ASN 524 11.243 -2.013 -6.040 262 HA ASN 524 HA ASN 524 14.109 -2.338 -5.444 263 HB2 ASN 524 HB2 ASN 524 12.820 -2.889 -8.176 264 HB3 ASN 524 HB3 ASN 524 14.550 -2.652 -7.924 265 HD21 ASN 524 HD21 ASN 524 11.776 -4.797 -7.117 266 HD22 ASN 524 HD22 ASN 524 12.768 -6.212 -6.840 267 H LEU 525 H LEU 525 12.076 -0.308 -5.105 268 HA LEU 525 HA LEU 525 11.640 1.853 -5.463 269 HB2 LEU 525 HB2 LEU 525 13.497 3.303 -5.113 270 HB3 LEU 525 HB3 LEU 525 13.516 1.880 -4.078 271 HG LEU 525 HG LEU 525 15.202 0.854 -5.701 272 HD11 LEU 525 HD11 LEU 525 14.781 2.382 -7.581 273 HD12 LEU 525 HD12 LEU 525 15.275 3.767 -6.590 274 HD13 LEU 525 HD13 LEU 525 16.478 2.529 -7.052 275 HD21 LEU 525 HD21 LEU 525 17.051 2.152 -4.674 276 HD22 LEU 525 HD22 LEU 525 15.885 3.420 -4.204 277 HD23 LEU 525 HD23 LEU 525 15.766 1.800 -3.489 278 H LYS 526 H LYS 526 12.062 0.150 -7.934 279 HA LYS 526 HA LYS 526 11.888 2.351 -9.945 280 HB2 LYS 526 HB2 LYS 526 13.082 -0.438 -10.012 281 HB3 LYS 526 HB3 LYS 526 12.691 0.434 -11.514 282 HG2 LYS 526 HG2 LYS 526 14.215 2.241 -10.919 283 HG3 LYS 526 HG3 LYS 526 14.598 1.465 -9.366 284 HD2 LYS 526 HD2 LYS 526 14.989 0.097 -12.040 285 HD3 LYS 526 HD3 LYS 526 16.265 1.063 -11.269 286 HE2 LYS 526 HE2 LYS 526 14.925 -1.361 -9.986 287 HE3 LYS 526 HE3 LYS 526 16.480 -1.380 -10.829 288 HZ1 LYS 526 HZ1 LYS 526 15.843 0.140 -8.400 289 HZ2 LYS 526 HZ2 LYS 526 16.818 -1.173 -8.511 290 HZ3 LYS 526 HZ3 LYS 526 17.274 0.240 -9.215 291 H1 MET 1 H1 MET 1 -13.331 13.840 -13.004 292 H2 MET 1 H2 MET 1 -13.242 12.252 -13.403 293 H3 MET 1 H3 MET 1 -11.884 13.178 -13.414 294 HA MET 1 HA MET 1 -11.972 13.490 -11.063 295 HB2 MET 1 HB2 MET 1 -14.405 13.376 -10.765 296 HB3 MET 1 HB3 MET 1 -14.428 11.697 -11.329 297 HG2 MET 1 HG2 MET 1 -14.605 11.745 -8.915 298 HG3 MET 1 HG3 MET 1 -13.079 11.005 -9.398 299 HE1 MET 1 HE1 MET 1 -12.356 12.729 -5.933 300 HE2 MET 1 HE2 MET 1 -13.891 12.001 -6.461 301 HE3 MET 1 HE3 MET 1 -12.348 11.206 -6.848 302 H GLN 2 H GLN 2 -10.159 12.580 -10.579 303 HA GLN 2 HA GLN 2 -10.012 9.701 -10.272 304 HB2 GLN 2 HB2 GLN 2 -8.205 9.332 -11.845 305 HB3 GLN 2 HB3 GLN 2 -9.493 10.175 -12.731 306 HG2 GLN 2 HG2 GLN 2 -8.187 12.331 -11.965 307 HG3 GLN 2 HG3 GLN 2 -6.865 11.235 -11.648 308 HE21 GLN 2 HE21 GLN 2 -5.542 12.177 -13.286 309 HE22 GLN 2 HE22 GLN 2 -5.872 11.964 -14.994 310 H ILE 3 H ILE 3 -7.679 9.190 -9.508 311 HA ILE 3 HA ILE 3 -6.436 11.484 -8.094 312 HB ILE 3 HB ILE 3 -6.345 10.401 -6.009 313 HG12 ILE 3 HG12 ILE 3 -7.091 7.894 -7.505 314 HG13 ILE 3 HG13 ILE 3 -5.827 8.199 -6.332 315 HG21 ILE 3 HG21 ILE 3 -9.150 9.998 -7.096 316 HG22 ILE 3 HG22 ILE 3 -8.687 10.241 -5.392 317 HG23 ILE 3 HG23 ILE 3 -8.438 11.543 -6.556 318 HD11 ILE 3 HD11 ILE 3 -7.529 6.772 -5.352 319 HD12 ILE 3 HD12 ILE 3 -7.562 8.351 -4.530 320 HD13 ILE 3 HD13 ILE 3 -8.801 7.937 -5.744 321 H PHE 4 H PHE 4 -4.317 10.467 -6.936 322 HA PHE 4 HA PHE 4 -3.020 8.648 -8.912 323 HB2 PHE 4 HB2 PHE 4 -1.768 11.139 -7.718 324 HB3 PHE 4 HB3 PHE 4 -1.034 10.035 -8.840 325 HD1 PHE 4 HD1 PHE 4 -2.148 9.770 -11.181 326 HD2 PHE 4 HD2 PHE 4 -3.015 13.021 -8.504 327 HE1 PHE 4 HE1 PHE 4 -2.952 11.140 -13.095 328 HE2 PHE 4 HE2 PHE 4 -3.780 14.390 -10.425 329 HZ PHE 4 HZ PHE 4 -3.753 13.450 -12.714 330 H VAL 5 H VAL 5 -2.892 6.882 -7.626 331 HA VAL 5 HA VAL 5 -2.030 7.235 -4.818 332 HB VAL 5 HB VAL 5 -2.744 5.017 -4.449 333 HG11 VAL 5 HG11 VAL 5 -4.702 6.242 -6.456 334 HG12 VAL 5 HG12 VAL 5 -5.071 5.011 -5.231 335 HG13 VAL 5 HG13 VAL 5 -4.597 6.641 -4.737 336 HG21 VAL 5 HG21 VAL 5 -2.922 4.650 -7.461 337 HG22 VAL 5 HG22 VAL 5 -1.794 3.835 -6.338 338 HG23 VAL 5 HG23 VAL 5 -3.523 3.496 -6.243 339 H LYS 6 H LYS 6 0.073 6.956 -4.210 340 HA LYS 6 HA LYS 6 1.904 5.994 -6.354 341 HB2 LYS 6 HB2 LYS 6 2.204 8.319 -5.792 342 HB3 LYS 6 HB3 LYS 6 2.348 7.928 -4.066 343 HG2 LYS 6 HG2 LYS 6 4.413 6.800 -4.373 344 HG3 LYS 6 HG3 LYS 6 4.227 6.735 -6.141 345 HD2 LYS 6 HD2 LYS 6 4.329 9.372 -4.671 346 HD3 LYS 6 HD3 LYS 6 5.825 8.514 -5.126 347 HE2 LYS 6 HE2 LYS 6 5.145 8.488 -7.471 348 HE3 LYS 6 HE3 LYS 6 3.620 9.306 -7.063 349 HZ1 LYS 6 HZ1 LYS 6 6.325 10.418 -6.699 350 HZ2 LYS 6 HZ2 LYS 6 5.262 10.853 -7.868 351 HZ3 LYS 6 HZ3 LYS 6 4.924 11.179 -6.296 352 H THR 7 H THR 7 3.319 4.431 -6.038 353 HA THR 7 HA THR 7 2.802 2.524 -3.948 354 HB THR 7 HB THR 7 4.628 1.273 -5.090 355 HG1 THR 7 HG1 THR 7 5.721 2.243 -6.723 356 HG21 THR 7 HG21 THR 7 3.537 1.058 -7.283 357 HG22 THR 7 HG22 THR 7 2.320 1.174 -5.993 358 HG23 THR 7 HG23 THR 7 2.660 2.584 -7.018 359 H LEU 8 H LEU 8 4.627 1.429 -2.832 360 HA LEU 8 HA LEU 8 6.107 3.159 -1.116 361 HB2 LEU 8 HB2 LEU 8 5.150 0.870 -0.693 362 HB3 LEU 8 HB3 LEU 8 6.417 0.172 -1.685 363 HG LEU 8 HG LEU 8 6.502 0.222 0.945 364 HD11 LEU 8 HD11 LEU 8 9.001 0.790 -0.679 365 HD12 LEU 8 HD12 LEU 8 8.909 0.040 0.922 366 HD13 LEU 8 HD13 LEU 8 8.207 -0.788 -0.481 367 HD21 LEU 8 HD21 LEU 8 6.301 2.664 1.183 368 HD22 LEU 8 HD22 LEU 8 7.808 2.037 1.890 369 HD23 LEU 8 HD23 LEU 8 7.850 2.880 0.333 370 H THR 9 H THR 9 6.598 2.593 -4.350 371 HA THR 9 HA THR 9 9.570 2.652 -4.110 372 HB THR 9 HB THR 9 9.579 1.676 -6.404 373 HG1 THR 9 HG1 THR 9 7.606 0.760 -7.097 374 HG21 THR 9 HG21 THR 9 8.996 -0.594 -5.699 375 HG22 THR 9 HG22 THR 9 9.804 0.263 -4.366 376 HG23 THR 9 HG23 THR 9 8.039 0.045 -4.342 377 H GLY 10 H GLY 10 6.875 4.580 -4.935 378 HA2 GLY 10 HA2 GLY 10 7.289 6.891 -5.223 379 HA3 GLY 10 HA3 GLY 10 8.818 6.543 -6.050 380 H LYS 11 H LYS 11 5.967 4.710 -7.001 381 HA LYS 11 HA LYS 11 5.750 6.441 -9.428 382 HB2 LYS 11 HB2 LYS 11 6.930 4.304 -9.709 383 HB3 LYS 11 HB3 LYS 11 5.500 3.413 -9.165 384 HG2 LYS 11 HG2 LYS 11 5.125 5.391 -11.398 385 HG3 LYS 11 HG3 LYS 11 5.995 3.883 -11.762 386 HD2 LYS 11 HD2 LYS 11 4.102 2.550 -10.924 387 HD3 LYS 11 HD3 LYS 11 3.233 4.022 -10.476 388 HE2 LYS 11 HE2 LYS 11 2.381 3.203 -12.595 389 HE3 LYS 11 HE3 LYS 11 3.216 4.743 -12.847 390 HZ1 LYS 11 HZ1 LYS 11 4.349 2.074 -13.372 391 HZ2 LYS 11 HZ2 LYS 11 3.806 3.126 -14.510 392 HZ3 LYS 11 HZ3 LYS 11 5.130 3.502 -13.614 393 H THR 12 H THR 12 3.687 6.998 -10.102 394 HA THR 12 HA THR 12 1.586 6.228 -8.149 395 HB THR 12 HB THR 12 2.490 8.720 -8.796 396 HG1 THR 12 HG1 THR 12 0.661 9.324 -7.641 397 HG21 THR 12 HG21 THR 12 1.361 8.581 -11.048 398 HG22 THR 12 HG22 THR 12 -0.194 8.387 -10.179 399 HG23 THR 12 HG23 THR 12 0.747 9.878 -9.993 400 H ILE 13 H ILE 13 -0.620 6.051 -8.935 401 HA ILE 13 HA ILE 13 -0.832 5.203 -11.785 402 HB ILE 13 HB ILE 13 -2.024 3.758 -9.382 403 HG12 ILE 13 HG12 ILE 13 0.299 2.950 -11.183 404 HG13 ILE 13 HG13 ILE 13 0.428 3.453 -9.485 405 HG21 ILE 13 HG21 ILE 13 -3.360 3.667 -11.489 406 HG22 ILE 13 HG22 ILE 13 -1.943 3.002 -12.332 407 HG23 ILE 13 HG23 ILE 13 -2.725 2.083 -11.025 408 HD11 ILE 13 HD11 ILE 13 0.511 1.043 -9.596 409 HD12 ILE 13 HD12 ILE 13 -1.017 1.536 -8.827 410 HD13 ILE 13 HD13 ILE 13 -1.001 0.976 -10.519 411 H THR 14 H THR 14 -2.494 6.191 -12.804 412 HA THR 14 HA THR 14 -4.190 8.016 -11.313 413 HB THR 14 HB THR 14 -4.309 7.196 -14.245 414 HG1 THR 14 HG1 THR 14 -2.958 8.975 -14.550 415 HG21 THR 14 HG21 THR 14 -6.284 8.437 -13.414 416 HG22 THR 14 HG22 THR 14 -5.214 9.688 -12.735 417 HG23 THR 14 HG23 THR 14 -5.315 9.450 -14.499 418 H LEU 15 H LEU 15 -6.341 7.668 -10.723 419 HA LEU 15 HA LEU 15 -7.669 5.182 -11.662 420 HB2 LEU 15 HB2 LEU 15 -7.253 5.956 -8.747 421 HB3 LEU 15 HB3 LEU 15 -8.195 4.580 -9.332 422 HG LEU 15 HG LEU 15 -5.213 4.951 -9.773 423 HD11 LEU 15 HD11 LEU 15 -5.845 4.627 -7.373 424 HD12 LEU 15 HD12 LEU 15 -6.712 3.144 -7.822 425 HD13 LEU 15 HD13 LEU 15 -4.947 3.238 -8.036 426 HD21 LEU 15 HD21 LEU 15 -6.987 2.504 -10.161 427 HD22 LEU 15 HD22 LEU 15 -6.279 3.473 -11.465 428 HD23 LEU 15 HD23 LEU 15 -5.219 2.578 -10.347 429 H GLU 16 H GLU 16 -9.768 5.449 -11.929 430 HA GLU 16 HA GLU 16 -10.997 8.044 -11.200 431 HB2 GLU 16 HB2 GLU 16 -11.261 7.346 -13.508 432 HB3 GLU 16 HB3 GLU 16 -11.761 5.717 -13.021 433 HG2 GLU 16 HG2 GLU 16 -13.789 6.587 -12.009 434 HG3 GLU 16 HG3 GLU 16 -13.326 8.254 -12.402 435 H VAL 17 H VAL 17 -12.359 8.274 -9.605 436 HA VAL 17 HA VAL 17 -13.760 5.950 -8.420 437 HB VAL 17 HB VAL 17 -12.998 6.565 -6.160 438 HG11 VAL 17 HG11 VAL 17 -10.660 6.036 -8.042 439 HG12 VAL 17 HG12 VAL 17 -10.697 5.744 -6.295 440 HG13 VAL 17 HG13 VAL 17 -11.762 4.809 -7.368 441 HG21 VAL 17 HG21 VAL 17 -11.091 8.470 -7.580 442 HG22 VAL 17 HG22 VAL 17 -12.482 8.952 -6.578 443 HG23 VAL 17 HG23 VAL 17 -11.113 8.105 -5.838 444 H GLU 18 H GLU 18 -15.090 6.848 -6.461 445 HA GLU 18 HA GLU 18 -16.161 9.570 -7.043 446 HB2 GLU 18 HB2 GLU 18 -17.703 7.050 -6.293 447 HB3 GLU 18 HB3 GLU 18 -18.408 8.656 -6.486 448 HG2 GLU 18 HG2 GLU 18 -17.033 7.060 -8.686 449 HG3 GLU 18 HG3 GLU 18 -18.773 7.162 -8.414 450 HA PRO 19 HA PRO 19 -15.651 10.239 -2.720 451 HB2 PRO 19 HB2 PRO 19 -18.486 11.187 -2.525 452 HB3 PRO 19 HB3 PRO 19 -16.975 12.024 -2.056 453 HG2 PRO 19 HG2 PRO 19 -18.300 12.723 -4.335 454 HG3 PRO 19 HG3 PRO 19 -16.508 12.661 -4.273 455 HD2 PRO 19 HD2 PRO 19 -18.417 10.599 -5.380 456 HD3 PRO 19 HD3 PRO 19 -16.881 11.209 -6.070 457 H SER 20 H SER 20 -17.660 7.796 -3.864 458 HA SER 20 HA SER 20 -18.423 6.935 -1.120 459 HB2 SER 20 HB2 SER 20 -19.951 6.650 -3.734 460 HB3 SER 20 HB3 SER 20 -20.411 5.914 -2.183 461 HG SER 20 HG SER 20 -21.470 7.912 -2.555 462 H ASP 21 H ASP 21 -16.475 6.350 -3.771 463 HA ASP 21 HA ASP 21 -16.538 3.428 -3.714 464 HB2 ASP 21 HB2 ASP 21 -14.635 5.472 -4.852 465 HB3 ASP 21 HB3 ASP 21 -14.425 3.728 -5.055 466 H THR 22 H THR 22 -16.457 3.582 -1.358 467 HA THR 22 HA THR 22 -14.251 4.564 0.141 468 HB THR 22 HB THR 22 -16.265 4.167 1.266 469 HG1 THR 22 HG1 THR 22 -15.542 2.947 2.964 470 HG21 THR 22 HG21 THR 22 -16.104 1.261 0.460 471 HG22 THR 22 HG22 THR 22 -17.235 1.958 1.659 472 HG23 THR 22 HG23 THR 22 -17.327 2.478 -0.028 473 H ILE 23 H ILE 23 -12.940 2.884 1.629 474 HA ILE 23 HA ILE 23 -10.821 2.239 -0.041 475 HB ILE 23 HB ILE 23 -11.304 1.017 2.676 476 HG12 ILE 23 HG12 ILE 23 -11.771 3.337 2.941 477 HG13 ILE 23 HG13 ILE 23 -10.116 3.080 3.501 478 HG21 ILE 23 HG21 ILE 23 -9.360 0.155 1.495 479 HG22 ILE 23 HG22 ILE 23 -8.796 1.807 1.136 480 HG23 ILE 23 HG23 ILE 23 -8.835 1.219 2.816 481 HD11 ILE 23 HD11 ILE 23 -9.257 3.966 1.332 482 HD12 ILE 23 HD12 ILE 23 -10.933 4.249 0.798 483 HD13 ILE 23 HD13 ILE 23 -10.294 5.137 2.184 484 H GLU 24 H GLU 24 -13.544 0.052 0.779 485 HA GLU 24 HA GLU 24 -12.077 -2.285 -0.109 486 HB2 GLU 24 HB2 GLU 24 -14.184 -3.435 0.023 487 HB3 GLU 24 HB3 GLU 24 -14.018 -2.375 1.439 488 HG2 GLU 24 HG2 GLU 24 -15.462 -0.698 0.347 489 HG3 GLU 24 HG3 GLU 24 -15.634 -1.751 -1.069 490 H ASN 25 H ASN 25 -13.712 0.303 -1.732 491 HA ASN 25 HA ASN 25 -14.145 -1.146 -4.216 492 HB2 ASN 25 HB2 ASN 25 -14.337 1.796 -3.530 493 HB3 ASN 25 HB3 ASN 25 -14.817 1.105 -5.063 494 HD21 ASN 25 HD21 ASN 25 -15.610 1.526 -1.785 495 HD22 ASN 25 HD22 ASN 25 -17.186 0.710 -1.785 496 H VAL 26 H VAL 26 -11.891 1.394 -2.924 497 HA VAL 26 HA VAL 26 -10.546 1.846 -5.418 498 HB VAL 26 HB VAL 26 -8.719 2.709 -3.671 499 HG11 VAL 26 HG11 VAL 26 -11.455 4.003 -4.063 500 HG12 VAL 26 HG12 VAL 26 -9.959 4.841 -3.576 501 HG13 VAL 26 HG13 VAL 26 -10.071 4.102 -5.184 502 HG21 VAL 26 HG21 VAL 26 -11.190 2.657 -1.970 503 HG22 VAL 26 HG22 VAL 26 -9.720 1.649 -1.744 504 HG23 VAL 26 HG23 VAL 26 -9.628 3.416 -1.597 505 H LYS 27 H LYS 27 -10.076 -0.505 -2.776 506 HA LYS 27 HA LYS 27 -7.556 -1.462 -3.548 507 HB2 LYS 27 HB2 LYS 27 -10.039 -2.692 -2.321 508 HB3 LYS 27 HB3 LYS 27 -8.595 -3.669 -2.632 509 HG2 LYS 27 HG2 LYS 27 -7.227 -2.269 -1.230 510 HG3 LYS 27 HG3 LYS 27 -8.513 -1.059 -1.066 511 HD2 LYS 27 HD2 LYS 27 -9.926 -2.686 0.135 512 HD3 LYS 27 HD3 LYS 27 -8.681 -3.941 -0.076 513 HE2 LYS 27 HE2 LYS 27 -7.071 -2.564 1.163 514 HE3 LYS 27 HE3 LYS 27 -8.265 -1.285 1.359 515 HZ1 LYS 27 HZ1 LYS 27 -8.540 -4.012 2.448 516 HZ2 LYS 27 HZ2 LYS 27 -8.149 -2.670 3.316 517 HZ3 LYS 27 HZ3 LYS 27 -9.630 -2.788 2.620 518 H ALA 28 H ALA 28 -10.759 -1.869 -5.083 519 HA ALA 28 HA ALA 28 -9.826 -4.006 -6.831 520 HB1 ALA 28 HB1 ALA 28 -12.202 -3.793 -6.153 521 HB2 ALA 28 HB2 ALA 28 -12.297 -2.236 -7.015 522 HB3 ALA 28 HB3 ALA 28 -11.993 -3.732 -7.920 523 H LYS 29 H LYS 29 -10.022 -0.443 -6.955 524 HA LYS 29 HA LYS 29 -9.605 -0.190 -9.787 525 HB2 LYS 29 HB2 LYS 29 -9.096 1.606 -7.397 526 HB3 LYS 29 HB3 LYS 29 -8.554 2.062 -9.007 527 HG2 LYS 29 HG2 LYS 29 -10.653 3.096 -8.512 528 HG3 LYS 29 HG3 LYS 29 -10.841 1.978 -9.876 529 HD2 LYS 29 HD2 LYS 29 -12.055 0.422 -8.589 530 HD3 LYS 29 HD3 LYS 29 -11.408 1.067 -7.065 531 HE2 LYS 29 HE2 LYS 29 -13.757 1.648 -7.318 532 HE3 LYS 29 HE3 LYS 29 -12.733 3.087 -7.277 533 HZ1 LYS 29 HZ1 LYS 29 -14.392 3.236 -8.988 534 HZ2 LYS 29 HZ2 LYS 29 -12.896 3.230 -9.657 535 HZ3 LYS 29 HZ3 LYS 29 -13.833 1.875 -9.726 536 H ILE 30 H ILE 30 -7.476 -0.797 -7.016 537 HA ILE 30 HA ILE 30 -5.036 -0.248 -8.569 538 HB ILE 30 HB ILE 30 -5.649 -1.162 -5.735 539 HG12 ILE 30 HG12 ILE 30 -4.501 1.465 -6.759 540 HG13 ILE 30 HG13 ILE 30 -6.233 1.207 -6.479 541 HG21 ILE 30 HG21 ILE 30 -2.949 -0.424 -6.954 542 HG22 ILE 30 HG22 ILE 30 -3.264 -0.765 -5.236 543 HG23 ILE 30 HG23 ILE 30 -3.445 -2.054 -6.436 544 HD11 ILE 30 HD11 ILE 30 -4.070 1.031 -4.353 545 HD12 ILE 30 HD12 ILE 30 -5.253 2.339 -4.569 546 HD13 ILE 30 HD13 ILE 30 -5.811 0.720 -4.103 547 H GLN 31 H GLN 31 -7.003 -2.971 -7.390 548 HA GLN 31 HA GLN 31 -5.150 -5.053 -8.060 549 HB2 GLN 31 HB2 GLN 31 -7.087 -5.484 -6.620 550 HB3 GLN 31 HB3 GLN 31 -8.193 -4.930 -7.894 551 HG2 GLN 31 HG2 GLN 31 -7.544 -6.748 -9.362 552 HG3 GLN 31 HG3 GLN 31 -6.293 -7.274 -8.246 553 HE21 GLN 31 HE21 GLN 31 -7.120 -9.364 -7.875 554 HE22 GLN 31 HE22 GLN 31 -8.625 -9.644 -7.026 555 H ASP 32 H ASP 32 -7.696 -3.289 -9.868 556 HA ASP 32 HA ASP 32 -7.717 -5.039 -12.099 557 HB2 ASP 32 HB2 ASP 32 -9.484 -3.382 -11.486 558 HB3 ASP 32 HB3 ASP 32 -8.352 -2.079 -11.762 559 H LYS 33 H LYS 33 -5.769 -2.291 -11.180 560 HA LYS 33 HA LYS 33 -4.660 -1.788 -13.818 561 HB2 LYS 33 HB2 LYS 33 -4.309 -0.761 -11.001 562 HB3 LYS 33 HB3 LYS 33 -3.221 -0.211 -12.289 563 HG2 LYS 33 HG2 LYS 33 -6.243 -0.103 -12.613 564 HG3 LYS 33 HG3 LYS 33 -5.333 1.196 -11.813 565 HD2 LYS 33 HD2 LYS 33 -3.884 1.412 -13.806 566 HD3 LYS 33 HD3 LYS 33 -4.874 0.205 -14.653 567 HE2 LYS 33 HE2 LYS 33 -5.936 2.815 -13.489 568 HE3 LYS 33 HE3 LYS 33 -5.467 2.597 -15.179 569 HZ1 LYS 33 HZ1 LYS 33 -7.568 1.062 -13.794 570 HZ2 LYS 33 HZ2 LYS 33 -7.826 2.290 -14.856 571 HZ3 LYS 33 HZ3 LYS 33 -7.140 0.886 -15.367 572 H GLU 34 H GLU 34 -3.691 -3.752 -11.035 573 HA GLU 34 HA GLU 34 -1.158 -4.323 -12.502 574 HB2 GLU 34 HB2 GLU 34 -1.462 -3.780 -9.525 575 HB3 GLU 34 HB3 GLU 34 0.022 -4.360 -10.292 576 HG2 GLU 34 HG2 GLU 34 -1.370 -1.719 -10.919 577 HG3 GLU 34 HG3 GLU 34 0.024 -1.911 -9.862 578 H GLY 35 H GLY 35 -3.583 -5.446 -10.123 579 HA2 GLY 35 HA2 GLY 35 -4.409 -7.718 -10.468 580 HA3 GLY 35 HA3 GLY 35 -2.741 -8.254 -10.727 581 H ILE 36 H ILE 36 -2.969 -5.831 -8.345 582 HA ILE 36 HA ILE 36 -1.997 -7.652 -6.315 583 HB ILE 36 HB ILE 36 -2.726 -4.693 -6.275 584 HG12 ILE 36 HG12 ILE 36 0.005 -6.049 -6.412 585 HG13 ILE 36 HG13 ILE 36 -0.864 -5.473 -7.839 586 HG21 ILE 36 HG21 ILE 36 -1.096 -6.336 -4.290 587 HG22 ILE 36 HG22 ILE 36 -1.411 -4.584 -4.202 588 HG23 ILE 36 HG23 ILE 36 -2.745 -5.737 -4.008 589 HD11 ILE 36 HD11 ILE 36 -0.894 -3.170 -6.892 590 HD12 ILE 36 HD12 ILE 36 0.050 -3.746 -5.497 591 HD13 ILE 36 HD13 ILE 36 0.754 -3.786 -7.126 592 HA PRO 37 HA PRO 37 -6.087 -8.612 -4.910 593 HB2 PRO 37 HB2 PRO 37 -5.481 -9.882 -2.538 594 HB3 PRO 37 HB3 PRO 37 -5.205 -10.616 -4.149 595 HG2 PRO 37 HG2 PRO 37 -3.221 -9.162 -2.388 596 HG3 PRO 37 HG3 PRO 37 -3.003 -10.726 -3.242 597 HD2 PRO 37 HD2 PRO 37 -2.070 -8.365 -4.248 598 HD3 PRO 37 HD3 PRO 37 -2.728 -9.625 -5.331 599 HA PRO 38 HA PRO 38 -7.147 -5.355 -2.090 600 HB2 PRO 38 HB2 PRO 38 -9.546 -6.274 -1.109 601 HB3 PRO 38 HB3 PRO 38 -9.343 -5.701 -2.794 602 HG2 PRO 38 HG2 PRO 38 -9.287 -8.557 -1.778 603 HG3 PRO 38 HG3 PRO 38 -10.194 -7.896 -3.179 604 HD2 PRO 38 HD2 PRO 38 -7.798 -9.148 -3.494 605 HD3 PRO 38 HD3 PRO 38 -8.242 -7.724 -4.483 606 H ASP 39 H ASP 39 -6.562 -8.628 -1.164 607 HA ASP 39 HA ASP 39 -7.041 -8.222 1.666 608 HB2 ASP 39 HB2 ASP 39 -5.730 -10.503 0.135 609 HB3 ASP 39 HB3 ASP 39 -6.187 -10.553 1.845 610 H GLN 40 H GLN 40 -4.420 -7.365 -0.401 611 HA GLN 40 HA GLN 40 -2.574 -7.491 1.946 612 HB2 GLN 40 HB2 GLN 40 -1.887 -7.792 -0.998 613 HB3 GLN 40 HB3 GLN 40 -0.757 -7.829 0.372 614 HG2 GLN 40 HG2 GLN 40 -2.109 -9.776 1.301 615 HG3 GLN 40 HG3 GLN 40 -2.990 -9.808 -0.240 616 HE21 GLN 40 HE21 GLN 40 -0.890 -9.305 -2.077 617 HE22 GLN 40 HE22 GLN 40 0.220 -10.657 -2.017 618 H GLN 41 H GLN 41 -4.037 -5.366 -0.454 619 HA GLN 41 HA GLN 41 -2.029 -3.334 -0.442 620 HB2 GLN 41 HB2 GLN 41 -5.046 -3.206 -0.755 621 HB3 GLN 41 HB3 GLN 41 -3.942 -1.855 -1.065 622 HG2 GLN 41 HG2 GLN 41 -2.835 -3.107 -2.858 623 HG3 GLN 41 HG3 GLN 41 -3.836 -4.532 -2.498 624 HE21 GLN 41 HE21 GLN 41 -5.064 -4.671 -4.408 625 HE22 GLN 41 HE22 GLN 41 -6.196 -3.423 -4.865 626 H ARG 42 H ARG 42 -2.237 -1.219 0.501 627 HA ARG 42 HA ARG 42 -3.845 -0.811 2.917 628 HB2 ARG 42 HB2 ARG 42 -1.657 -1.966 3.578 629 HB3 ARG 42 HB3 ARG 42 -0.803 -0.544 2.966 630 HG2 ARG 42 HG2 ARG 42 -1.968 0.872 4.626 631 HG3 ARG 42 HG3 ARG 42 -2.923 -0.533 5.164 632 HD2 ARG 42 HD2 ARG 42 -0.807 -1.714 5.741 633 HD3 ARG 42 HD3 ARG 42 0.108 -0.256 5.314 634 HE ARG 42 HE ARG 42 -1.638 0.715 7.159 635 HH11 ARG 42 HH11 ARG 42 0.452 -2.138 7.201 636 HH12 ARG 42 HH12 ARG 42 0.636 -2.110 8.939 637 HH21 ARG 42 HH21 ARG 42 -1.356 0.744 9.392 638 HH22 ARG 42 HH22 ARG 42 -0.368 -0.468 10.178 639 H LEU 43 H LEU 43 -4.341 1.476 3.022 640 HA LEU 43 HA LEU 43 -3.064 3.077 0.865 641 HB2 LEU 43 HB2 LEU 43 -5.169 1.916 0.166 642 HB3 LEU 43 HB3 LEU 43 -6.031 2.745 1.467 643 HG LEU 43 HG LEU 43 -5.508 4.911 0.443 644 HD11 LEU 43 HD11 LEU 43 -4.294 3.212 -1.789 645 HD12 LEU 43 HD12 LEU 43 -4.615 4.958 -1.902 646 HD13 LEU 43 HD13 LEU 43 -3.411 4.355 -0.746 647 HD21 LEU 43 HD21 LEU 43 -6.748 2.862 -1.460 648 HD22 LEU 43 HD22 LEU 43 -7.592 3.696 -0.139 649 HD23 LEU 43 HD23 LEU 43 -7.003 4.624 -1.535 650 H ILE 44 H ILE 44 -2.810 5.224 1.269 651 HA ILE 44 HA ILE 44 -3.639 6.281 3.917 652 HB ILE 44 HB ILE 44 -0.830 6.175 2.731 653 HG12 ILE 44 HG12 ILE 44 -0.489 5.323 5.231 654 HG13 ILE 44 HG13 ILE 44 -2.203 4.932 5.119 655 HG21 ILE 44 HG21 ILE 44 -1.674 7.606 5.284 656 HG22 ILE 44 HG22 ILE 44 -0.047 7.501 4.613 657 HG23 ILE 44 HG23 ILE 44 -1.269 8.440 3.762 658 HD11 ILE 44 HD11 ILE 44 -1.637 3.571 3.016 659 HD12 ILE 44 HD12 ILE 44 0.070 3.868 3.398 660 HD13 ILE 44 HD13 ILE 44 -0.976 2.966 4.532 661 H PHE 45 H PHE 45 -3.826 8.540 3.984 662 HA PHE 45 HA PHE 45 -3.256 10.172 1.606 663 HB2 PHE 45 HB2 PHE 45 -5.498 9.180 1.202 664 HB3 PHE 45 HB3 PHE 45 -6.054 9.793 2.756 665 HD1 PHE 45 HD1 PHE 45 -4.288 11.212 -0.262 666 HD2 PHE 45 HD2 PHE 45 -7.357 11.686 2.713 667 HE1 PHE 45 HE1 PHE 45 -4.987 13.325 -1.331 668 HE2 PHE 45 HE2 PHE 45 -8.038 13.822 1.669 669 HZ PHE 45 HZ PHE 45 -6.849 14.660 -0.345 670 H ALA 46 H ALA 46 -3.207 12.400 2.117 671 HA ALA 46 HA ALA 46 -2.389 14.015 3.453 672 HB1 ALA 46 HB1 ALA 46 -4.757 13.222 5.191 673 HB2 ALA 46 HB2 ALA 46 -3.906 14.782 5.229 674 HB3 ALA 46 HB3 ALA 46 -4.817 14.295 3.778 675 H GLY 47 H GLY 47 -1.628 11.065 4.072 676 HA2 GLY 47 HA2 GLY 47 0.190 10.315 5.287 677 HA3 GLY 47 HA3 GLY 47 0.094 11.709 6.361 678 H LYS 48 H LYS 48 -2.952 10.003 5.871 679 HA LYS 48 HA LYS 48 -2.330 8.255 8.184 680 HB2 LYS 48 HB2 LYS 48 -4.544 8.605 9.153 681 HB3 LYS 48 HB3 LYS 48 -3.526 10.042 9.180 682 HG2 LYS 48 HG2 LYS 48 -5.679 10.755 8.677 683 HG3 LYS 48 HG3 LYS 48 -4.733 10.883 7.173 684 HD2 LYS 48 HD2 LYS 48 -5.852 8.871 6.293 685 HD3 LYS 48 HD3 LYS 48 -6.802 8.688 7.783 686 HE2 LYS 48 HE2 LYS 48 -6.841 11.099 5.934 687 HE3 LYS 48 HE3 LYS 48 -8.054 9.804 5.975 688 HZ1 LYS 48 HZ1 LYS 48 -8.522 10.408 8.257 689 HZ2 LYS 48 HZ2 LYS 48 -7.421 11.627 8.200 690 HZ3 LYS 48 HZ3 LYS 48 -8.766 11.686 7.257 691 H GLN 49 H GLN 49 -3.792 6.497 8.415 692 HA GLN 49 HA GLN 49 -4.075 5.238 5.760 693 HB2 GLN 49 HB2 GLN 49 -2.797 4.120 7.555 694 HB3 GLN 49 HB3 GLN 49 -4.244 4.114 8.583 695 HG2 GLN 49 HG2 GLN 49 -5.415 2.731 6.859 696 HG3 GLN 49 HG3 GLN 49 -3.938 2.719 5.883 697 HE21 GLN 49 HE21 GLN 49 -5.262 0.371 6.824 698 HE22 GLN 49 HE22 GLN 49 -4.202 -0.428 7.966 699 H LEU 50 H LEU 50 -5.942 4.342 5.023 700 HA LEU 50 HA LEU 50 -8.381 5.637 6.128 701 HB2 LEU 50 HB2 LEU 50 -8.053 4.385 3.385 702 HB3 LEU 50 HB3 LEU 50 -9.249 5.565 3.934 703 HG LEU 50 HG LEU 50 -6.262 6.062 3.580 704 HD11 LEU 50 HD11 LEU 50 -6.980 7.537 1.748 705 HD12 LEU 50 HD12 LEU 50 -7.500 5.861 1.459 706 HD13 LEU 50 HD13 LEU 50 -8.672 7.074 2.024 707 HD21 LEU 50 HD21 LEU 50 -7.321 7.407 5.443 708 HD22 LEU 50 HD22 LEU 50 -6.734 8.387 4.082 709 HD23 LEU 50 HD23 LEU 50 -8.467 8.054 4.239 710 H GLU 51 H GLU 51 -10.457 4.363 6.037 711 HA GLU 51 HA GLU 51 -9.912 1.469 6.575 712 HB2 GLU 51 HB2 GLU 51 -11.406 3.559 8.149 713 HB3 GLU 51 HB3 GLU 51 -11.883 1.854 8.261 714 HG2 GLU 51 HG2 GLU 51 -9.627 1.214 8.931 715 HG3 GLU 51 HG3 GLU 51 -9.053 2.870 8.707 716 H ASP 52 H ASP 52 -11.430 -0.005 6.053 717 HA ASP 52 HA ASP 52 -12.968 0.547 3.707 718 HB2 ASP 52 HB2 ASP 52 -12.922 -1.886 5.537 719 HB3 ASP 52 HB3 ASP 52 -13.568 -1.828 3.899 720 H GLY 53 H GLY 53 -13.685 1.322 6.851 721 HA2 GLY 53 HA2 GLY 53 -16.579 0.717 6.571 722 HA3 GLY 53 HA3 GLY 53 -15.722 1.028 8.094 723 H ARG 54 H ARG 54 -14.655 3.075 5.572 724 HA ARG 54 HA ARG 54 -16.344 5.337 6.526 725 HB2 ARG 54 HB2 ARG 54 -13.609 5.485 5.289 726 HB3 ARG 54 HB3 ARG 54 -14.433 6.725 6.234 727 HG2 ARG 54 HG2 ARG 54 -13.427 4.067 7.363 728 HG3 ARG 54 HG3 ARG 54 -12.533 5.593 7.424 729 HD2 ARG 54 HD2 ARG 54 -14.196 6.631 8.769 730 HD3 ARG 54 HD3 ARG 54 -15.304 5.242 8.601 731 HE ARG 54 HE ARG 54 -12.939 4.202 9.662 732 HH11 ARG 54 HH11 ARG 54 -15.348 6.588 10.670 733 HH12 ARG 54 HH12 ARG 54 -15.076 6.308 12.375 734 HH21 ARG 54 HH21 ARG 54 -12.595 3.872 11.841 735 HH22 ARG 54 HH22 ARG 54 -13.517 4.751 13.047 736 H THR 55 H THR 55 -15.070 6.981 4.406 737 HA THR 55 HA THR 55 -15.791 5.853 1.808 738 HB THR 55 HB THR 55 -17.216 8.021 1.425 739 HG1 THR 55 HG1 THR 55 -18.155 8.828 3.239 740 HG21 THR 55 HG21 THR 55 -18.026 5.584 1.548 741 HG22 THR 55 HG22 THR 55 -18.390 5.893 3.259 742 HG23 THR 55 HG23 THR 55 -19.234 6.817 1.995 743 H LEU 56 H LEU 56 -15.009 7.291 0.052 744 HA LEU 56 HA LEU 56 -12.513 8.501 0.700 745 HB2 LEU 56 HB2 LEU 56 -14.296 8.989 -1.717 746 HB3 LEU 56 HB3 LEU 56 -12.596 9.423 -1.573 747 HG LEU 56 HG LEU 56 -13.844 6.677 -1.807 748 HD11 LEU 56 HD11 LEU 56 -12.261 6.472 -3.666 749 HD12 LEU 56 HD12 LEU 56 -13.191 7.975 -3.854 750 HD13 LEU 56 HD13 LEU 56 -11.524 8.035 -3.246 751 HD21 LEU 56 HD21 LEU 56 -10.989 7.281 -0.929 752 HD22 LEU 56 HD22 LEU 56 -12.238 6.403 0.003 753 HD23 LEU 56 HD23 LEU 56 -11.578 5.697 -1.478 754 H SER 57 H SER 57 -15.813 9.675 0.592 755 HA SER 57 HA SER 57 -15.328 12.478 0.707 756 HB2 SER 57 HB2 SER 57 -17.714 12.489 1.370 757 HB3 SER 57 HB3 SER 57 -17.422 11.382 0.008 758 HG SER 57 HG SER 57 -18.731 10.459 1.629 759 H ASP 58 H ASP 58 -15.259 9.907 3.122 760 HA ASP 58 HA ASP 58 -15.526 11.655 5.410 761 HB2 ASP 58 HB2 ASP 58 -16.091 9.204 5.378 762 HB3 ASP 58 HB3 ASP 58 -14.356 8.853 5.267 763 H TYR 59 H TYR 59 -12.943 11.002 3.223 764 HA TYR 59 HA TYR 59 -11.060 12.266 5.169 765 HB2 TYR 59 HB2 TYR 59 -9.890 10.975 2.793 766 HB3 TYR 59 HB3 TYR 59 -9.321 10.997 4.447 767 HD1 TYR 59 HD1 TYR 59 -10.391 9.269 6.094 768 HD2 TYR 59 HD2 TYR 59 -10.953 9.212 1.834 769 HE1 TYR 59 HE1 TYR 59 -11.002 6.826 6.190 770 HE2 TYR 59 HE2 TYR 59 -11.655 6.835 1.951 771 HH TYR 59 HH TYR 59 -11.766 5.016 5.008 772 H ASN 60 H ASN 60 -13.123 13.286 3.145 773 HA ASN 60 HA ASN 60 -13.379 14.846 1.607 774 HB2 ASN 60 HB2 ASN 60 -12.884 16.844 2.440 775 HB3 ASN 60 HB3 ASN 60 -12.353 15.885 3.818 776 HD21 ASN 60 HD21 ASN 60 -9.895 15.183 3.629 777 HD22 ASN 60 HD22 ASN 60 -8.819 16.499 3.208 778 H ILE 61 H ILE 61 -11.554 12.705 0.686 779 HA ILE 61 HA ILE 61 -9.503 13.770 -0.960 780 HB ILE 61 HB ILE 61 -11.311 11.347 -1.240 781 HG12 ILE 61 HG12 ILE 61 -8.387 11.602 -0.426 782 HG13 ILE 61 HG13 ILE 61 -9.735 11.519 0.727 783 HG21 ILE 61 HG21 ILE 61 -10.443 11.956 -3.474 784 HG22 ILE 61 HG22 ILE 61 -8.790 12.036 -2.817 785 HG23 ILE 61 HG23 ILE 61 -9.663 10.486 -2.885 786 HD11 ILE 61 HD11 ILE 61 -10.378 9.305 -0.240 787 HD12 ILE 61 HD12 ILE 61 -8.922 9.364 -1.264 788 HD13 ILE 61 HD13 ILE 61 -8.766 9.316 0.509 789 H GLN 62 H GLN 62 -9.454 14.629 -2.976 790 HA GLN 62 HA GLN 62 -12.005 15.078 -4.464 791 HB2 GLN 62 HB2 GLN 62 -9.673 17.006 -4.235 792 HB3 GLN 62 HB3 GLN 62 -11.265 17.320 -4.934 793 HG2 GLN 62 HG2 GLN 62 -10.695 16.757 -1.987 794 HG3 GLN 62 HG3 GLN 62 -10.899 18.347 -2.681 795 HE21 GLN 62 HE21 GLN 62 -12.499 16.901 -0.584 796 HE22 GLN 62 HE22 GLN 62 -14.150 16.947 -1.172 797 H LYS 63 H LYS 63 -11.139 16.115 -6.719 798 HA LYS 63 HA LYS 63 -9.749 14.015 -8.080 799 HB2 LYS 63 HB2 LYS 63 -9.909 15.456 -9.960 800 HB3 LYS 63 HB3 LYS 63 -11.421 15.601 -9.051 801 HG2 LYS 63 HG2 LYS 63 -10.590 17.720 -8.025 802 HG3 LYS 63 HG3 LYS 63 -9.086 17.563 -8.960 803 HD2 LYS 63 HD2 LYS 63 -10.546 19.096 -10.111 804 HD3 LYS 63 HD3 LYS 63 -10.411 17.600 -11.060 805 HE2 LYS 63 HE2 LYS 63 -12.582 16.827 -10.177 806 HE3 LYS 63 HE3 LYS 63 -12.699 18.271 -9.164 807 HZ1 LYS 63 HZ1 LYS 63 -13.957 18.490 -11.191 808 HZ2 LYS 63 HZ2 LYS 63 -12.742 19.596 -11.162 809 HZ3 LYS 63 HZ3 LYS 63 -12.615 18.256 -12.111 810 H GLU 64 H GLU 64 -7.749 13.764 -8.752 811 HA GLU 64 HA GLU 64 -5.491 13.910 -8.801 812 HB2 GLU 64 HB2 GLU 64 -6.090 16.893 -8.892 813 HB3 GLU 64 HB3 GLU 64 -4.602 16.094 -9.427 814 HG2 GLU 64 HG2 GLU 64 -5.934 14.805 -11.105 815 HG3 GLU 64 HG3 GLU 64 -7.387 15.681 -10.602 816 H SER 65 H SER 65 -6.761 13.960 -6.055 817 HA SER 65 HA SER 65 -5.318 15.864 -4.485 818 HB2 SER 65 HB2 SER 65 -6.984 13.424 -3.822 819 HB3 SER 65 HB3 SER 65 -6.217 14.441 -2.581 820 HG SER 65 HG SER 65 -7.322 16.232 -3.469 821 H THR 66 H THR 66 -4.387 12.832 -5.761 822 HA THR 66 HA THR 66 -2.664 11.413 -5.504 823 HB THR 66 HB THR 66 -1.447 13.814 -4.148 824 HG1 THR 66 HG1 THR 66 -0.497 14.016 -6.193 825 HG21 THR 66 HG21 THR 66 -0.142 11.230 -5.140 826 HG22 THR 66 HG22 THR 66 0.739 12.697 -4.658 827 HG23 THR 66 HG23 THR 66 -0.200 11.793 -3.458 828 H LEU 67 H LEU 67 -2.252 9.694 -4.295 829 HA LEU 67 HA LEU 67 -2.636 9.773 -1.334 830 HB2 LEU 67 HB2 LEU 67 -3.965 8.021 -3.420 831 HB3 LEU 67 HB3 LEU 67 -3.627 7.387 -1.813 832 HG LEU 67 HG LEU 67 -4.919 9.332 -0.844 833 HD11 LEU 67 HD11 LEU 67 -6.712 10.239 -2.348 834 HD12 LEU 67 HD12 LEU 67 -5.103 10.833 -2.778 835 HD13 LEU 67 HD13 LEU 67 -5.858 9.537 -3.743 836 HD21 LEU 67 HD21 LEU 67 -6.350 7.311 -2.614 837 HD22 LEU 67 HD22 LEU 67 -5.731 7.020 -0.969 838 HD23 LEU 67 HD23 LEU 67 -7.053 8.173 -1.225 839 H HIS 68 H HIS 68 -1.959 7.354 -0.573 840 HA HIS 68 HA HIS 68 0.523 6.610 -2.039 841 HB2 HIS 68 HB2 HIS 68 0.323 7.079 0.955 842 HB3 HIS 68 HB3 HIS 68 1.762 6.579 0.058 843 HD2 HIS 68 HD2 HIS 68 2.649 8.481 -1.863 844 HE1 HIS 68 HE1 HIS 68 1.062 11.801 0.265 845 HE2 HIS 68 HE2 HIS 68 2.658 11.085 -1.582 846 H LEU 69 H LEU 69 0.554 4.545 -2.453 847 HA LEU 69 HA LEU 69 -1.142 2.631 -0.951 848 HB2 LEU 69 HB2 LEU 69 -1.514 2.763 -3.353 849 HB3 LEU 69 HB3 LEU 69 0.223 2.682 -3.665 850 HG LEU 69 HG LEU 69 0.277 0.358 -2.796 851 HD11 LEU 69 HD11 LEU 69 -1.669 0.417 -1.287 852 HD12 LEU 69 HD12 LEU 69 -2.756 0.696 -2.668 853 HD13 LEU 69 HD13 LEU 69 -1.880 -0.847 -2.510 854 HD21 LEU 69 HD21 LEU 69 -1.747 0.910 -4.998 855 HD22 LEU 69 HD22 LEU 69 0.015 0.820 -5.190 856 HD23 LEU 69 HD23 LEU 69 -0.897 -0.634 -4.731 857 H VAL 70 H VAL 70 -0.272 0.919 0.099 858 HA VAL 70 HA VAL 70 2.581 0.196 -0.241 859 HB VAL 70 HB VAL 70 1.251 0.729 2.445 860 HG11 VAL 70 HG11 VAL 70 2.811 -1.159 2.619 861 HG12 VAL 70 HG12 VAL 70 4.050 -0.246 1.710 862 HG13 VAL 70 HG13 VAL 70 3.551 0.277 3.332 863 HG21 VAL 70 HG21 VAL 70 3.529 2.140 0.979 864 HG22 VAL 70 HG22 VAL 70 1.924 2.822 1.344 865 HG23 VAL 70 HG23 VAL 70 3.048 2.447 2.661 866 H LEU 71 H LEU 71 2.901 -2.100 0.712 867 HA LEU 71 HA LEU 71 0.405 -3.606 1.023 868 HB2 LEU 71 HB2 LEU 71 1.078 -5.163 -0.878 869 HB3 LEU 71 HB3 LEU 71 0.385 -3.601 -1.300 870 HG LEU 71 HG LEU 71 2.611 -2.692 -1.813 871 HD11 LEU 71 HD11 LEU 71 4.075 -4.037 -0.373 872 HD12 LEU 71 HD12 LEU 71 3.593 -5.521 -1.239 873 HD13 LEU 71 HD13 LEU 71 4.532 -4.263 -2.067 874 HD21 LEU 71 HD21 LEU 71 1.224 -3.764 -3.543 875 HD22 LEU 71 HD22 LEU 71 2.956 -4.006 -3.860 876 HD23 LEU 71 HD23 LEU 71 1.990 -5.337 -3.187 877 H ARG 72 H ARG 72 0.892 -6.027 1.187 878 HA ARG 72 HA ARG 72 3.063 -6.324 3.180 879 HB2 ARG 72 HB2 ARG 72 0.561 -7.837 2.413 880 HB3 ARG 72 HB3 ARG 72 1.832 -8.653 3.326 881 HG2 ARG 72 HG2 ARG 72 0.020 -7.633 4.738 882 HG3 ARG 72 HG3 ARG 72 1.668 -7.140 5.159 883 HD2 ARG 72 HD2 ARG 72 1.401 -5.018 4.059 884 HD3 ARG 72 HD3 ARG 72 -0.141 -5.514 3.347 885 HE ARG 72 HE ARG 72 0.302 -5.112 6.287 886 HH11 ARG 72 HH11 ARG 72 -1.749 -4.898 3.412 887 HH12 ARG 72 HH12 ARG 72 -3.110 -4.243 4.286 888 HH21 ARG 72 HH21 ARG 72 -1.497 -4.272 7.408 889 HH22 ARG 72 HH22 ARG 72 -2.965 -3.882 6.543 890 H LEU 73 H LEU 73 4.045 -8.622 3.157 891 HA LEU 73 HA LEU 73 4.973 -9.205 0.405 892 HB2 LEU 73 HB2 LEU 73 6.414 -8.034 2.493 893 HB3 LEU 73 HB3 LEU 73 6.826 -9.736 2.673 894 HG LEU 73 HG LEU 73 8.460 -8.599 1.272 895 HD11 LEU 73 HD11 LEU 73 6.665 -10.293 -0.509 896 HD12 LEU 73 HD12 LEU 73 8.395 -9.958 -0.759 897 HD13 LEU 73 HD13 LEU 73 7.871 -10.925 0.635 898 HD21 LEU 73 HD21 LEU 73 7.860 -7.419 -0.766 899 HD22 LEU 73 HD22 LEU 73 6.154 -7.868 -0.586 900 HD23 LEU 73 HD23 LEU 73 6.909 -6.760 0.580 901 H ARG 74 H ARG 74 2.844 -10.316 1.994 902 HA ARG 74 HA ARG 74 1.825 -12.300 2.408 903 HB2 ARG 74 HB2 ARG 74 3.140 -12.791 0.237 904 HB3 ARG 74 HB3 ARG 74 4.241 -13.726 1.258 905 HG2 ARG 74 HG2 ARG 74 2.606 -15.250 0.330 906 HG3 ARG 74 HG3 ARG 74 2.298 -15.085 2.073 907 HD2 ARG 74 HD2 ARG 74 0.485 -13.462 1.592 908 HD3 ARG 74 HD3 ARG 74 0.849 -13.568 -0.140 909 HE ARG 74 HE ARG 74 0.319 -16.187 0.795 910 HH11 ARG 74 HH11 ARG 74 -1.344 -13.106 0.352 911 HH12 ARG 74 HH12 ARG 74 -2.913 -13.846 0.118 912 HH21 ARG 74 HH21 ARG 74 -1.740 -17.132 0.483 913 HH22 ARG 74 HH22 ARG 74 -3.133 -16.119 0.185 914 H GLY 75 H GLY 75 5.123 -11.964 3.437 915 HA2 GLY 75 HA2 GLY 75 4.478 -13.350 5.980 916 HA3 GLY 75 HA3 GLY 75 5.978 -13.748 5.094 917 H GLY 76 H GLY 76 5.081 -10.548 4.529 918 HA2 GLY 76 HA2 GLY 76 6.113 -9.257 6.902 919 HA3 GLY 76 HA3 GLY 76 7.320 -9.305 5.604 Start of MODEL 13 1 H LEU 491 H LEU 491 14.268 6.816 11.082 2 HA LEU 491 HA LEU 491 16.927 6.664 11.176 3 HB2 LEU 491 HB2 LEU 491 15.954 4.103 10.301 4 HB3 LEU 491 HB3 LEU 491 16.466 4.668 11.882 5 HG LEU 491 HG LEU 491 14.119 5.547 12.267 6 HD11 LEU 491 HD11 LEU 491 13.565 3.872 9.775 7 HD12 LEU 491 HD12 LEU 491 12.335 4.550 10.862 8 HD13 LEU 491 HD13 LEU 491 13.349 5.634 9.891 9 HD21 LEU 491 HD21 LEU 491 14.465 2.587 11.696 10 HD22 LEU 491 HD22 LEU 491 14.999 3.448 13.162 11 HD23 LEU 491 HD23 LEU 491 13.262 3.326 12.783 12 HA PRO 492 HA PRO 492 18.556 6.479 6.998 13 HB2 PRO 492 HB2 PRO 492 21.025 5.557 7.601 14 HB3 PRO 492 HB3 PRO 492 20.470 7.179 8.113 15 HG2 PRO 492 HG2 PRO 492 20.621 4.652 9.753 16 HG3 PRO 492 HG3 PRO 492 21.093 6.314 10.214 17 HD2 PRO 492 HD2 PRO 492 18.653 5.128 10.850 18 HD3 PRO 492 HD3 PRO 492 18.850 6.885 10.717 19 H LEU 493 H LEU 493 20.185 4.648 5.947 20 HA LEU 493 HA LEU 493 18.533 2.372 5.509 21 HB2 LEU 493 HB2 LEU 493 20.524 3.816 4.237 22 HB3 LEU 493 HB3 LEU 493 21.425 2.393 4.709 23 HG LEU 493 HG LEU 493 18.812 2.491 3.136 24 HD11 LEU 493 HD11 LEU 493 21.650 1.858 2.220 25 HD12 LEU 493 HD12 LEU 493 20.195 1.794 1.199 26 HD13 LEU 493 HD13 LEU 493 20.738 3.346 1.862 27 HD21 LEU 493 HD21 LEU 493 20.634 0.104 3.705 28 HD22 LEU 493 HD22 LEU 493 19.007 0.357 4.385 29 HD23 LEU 493 HD23 LEU 493 19.212 0.084 2.642 30 H GLN 494 H GLN 494 19.228 2.601 8.258 31 HA GLN 494 HA GLN 494 21.358 0.805 8.910 32 HB2 GLN 494 HB2 GLN 494 19.968 0.792 11.167 33 HB3 GLN 494 HB3 GLN 494 20.944 2.178 10.637 34 HG2 GLN 494 HG2 GLN 494 18.964 3.056 11.514 35 HG3 GLN 494 HG3 GLN 494 18.910 3.283 9.767 36 HE21 GLN 494 HE21 GLN 494 17.485 1.776 12.555 37 HE22 GLN 494 HE22 GLN 494 16.100 1.047 11.752 38 H ALA 495 H ALA 495 17.902 0.448 8.467 39 HA ALA 495 HA ALA 495 18.206 -2.501 8.420 40 HB1 ALA 495 HB1 ALA 495 16.229 -2.756 9.916 41 HB2 ALA 495 HB2 ALA 495 17.577 -1.928 10.731 42 HB3 ALA 495 HB3 ALA 495 16.197 -0.986 10.136 43 H LEU 496 H LEU 496 17.216 0.190 6.806 44 HA LEU 496 HA LEU 496 14.688 -0.651 5.761 45 HB2 LEU 496 HB2 LEU 496 16.885 1.189 4.700 46 HB3 LEU 496 HB3 LEU 496 15.253 1.087 4.025 47 HG LEU 496 HG LEU 496 15.906 1.903 6.891 48 HD11 LEU 496 HD11 LEU 496 15.000 3.549 4.491 49 HD12 LEU 496 HD12 LEU 496 15.210 4.151 6.152 50 HD13 LEU 496 HD13 LEU 496 16.621 3.587 5.232 51 HD21 LEU 496 HD21 LEU 496 13.655 0.831 6.631 52 HD22 LEU 496 HD22 LEU 496 13.564 2.553 7.018 53 HD23 LEU 496 HD23 LEU 496 13.277 2.000 5.347 54 HA PRO 497 HA PRO 497 15.608 -3.716 2.790 55 HB2 PRO 497 HB2 PRO 497 14.487 -1.869 0.688 56 HB3 PRO 497 HB3 PRO 497 14.073 -3.586 0.985 57 HG2 PRO 497 HG2 PRO 497 12.402 -1.646 1.832 58 HG3 PRO 497 HG3 PRO 497 12.800 -3.015 2.936 59 HD2 PRO 497 HD2 PRO 497 13.968 -0.230 2.906 60 HD3 PRO 497 HD3 PRO 497 13.413 -1.199 4.302 61 H GLU 498 H GLU 498 17.195 -4.316 1.262 62 HA GLU 498 HA GLU 498 19.264 -2.323 0.798 63 HB2 GLU 498 HB2 GLU 498 19.677 -4.716 1.508 64 HB3 GLU 498 HB3 GLU 498 19.183 -5.227 -0.122 65 HG2 GLU 498 HG2 GLU 498 21.034 -3.955 -1.111 66 HG3 GLU 498 HG3 GLU 498 21.345 -3.161 0.434 67 H GLY 499 H GLY 499 17.365 -1.256 -0.334 68 HA2 GLY 499 HA2 GLY 499 17.981 -0.824 -3.026 69 HA3 GLY 499 HA3 GLY 499 16.726 -2.084 -3.000 70 H VAL 500 H VAL 500 16.786 0.405 -0.464 71 HA VAL 500 HA VAL 500 14.593 1.908 -1.799 72 HB VAL 500 HB VAL 500 14.514 0.510 0.892 73 HG11 VAL 500 HG11 VAL 500 12.640 2.699 -0.117 74 HG12 VAL 500 HG12 VAL 500 12.318 1.635 1.267 75 HG13 VAL 500 HG13 VAL 500 13.667 2.770 1.336 76 HG21 VAL 500 HG21 VAL 500 12.636 0.585 -1.511 77 HG22 VAL 500 HG22 VAL 500 13.721 -0.755 -1.087 78 HG23 VAL 500 HG23 VAL 500 12.357 -0.338 -0.020 79 H ASP 501 H ASP 501 14.163 3.962 -0.698 80 HA ASP 501 HA ASP 501 16.632 5.084 0.590 81 HB2 ASP 501 HB2 ASP 501 16.272 5.728 -1.812 82 HB3 ASP 501 HB3 ASP 501 14.718 6.432 -1.358 83 H GLN 502 H GLN 502 16.374 6.486 2.217 84 HA GLN 502 HA GLN 502 13.973 6.220 3.786 85 HB2 GLN 502 HB2 GLN 502 15.238 8.142 5.093 86 HB3 GLN 502 HB3 GLN 502 15.781 6.470 5.168 87 HG2 GLN 502 HG2 GLN 502 16.939 8.125 2.949 88 HG3 GLN 502 HG3 GLN 502 17.407 8.545 4.591 89 HE21 GLN 502 HE21 GLN 502 16.690 5.199 3.427 90 HE22 GLN 502 HE22 GLN 502 18.316 4.613 3.689 91 H GLU 503 H GLU 503 15.232 8.713 1.542 92 HA GLU 503 HA GLU 503 13.088 10.555 2.219 93 HB2 GLU 503 HB2 GLU 503 15.148 10.440 -0.006 94 HB3 GLU 503 HB3 GLU 503 13.878 11.691 0.048 95 HG2 GLU 503 HG2 GLU 503 14.516 12.322 2.302 96 HG3 GLU 503 HG3 GLU 503 15.747 11.066 2.358 97 H VAL 504 H VAL 504 12.857 7.620 1.067 98 HA VAL 504 HA VAL 504 10.391 8.260 -0.460 99 HB VAL 504 HB VAL 504 12.476 6.102 -1.041 100 HG11 VAL 504 HG11 VAL 504 10.376 5.025 -1.449 101 HG12 VAL 504 HG12 VAL 504 9.712 6.477 -2.246 102 HG13 VAL 504 HG13 VAL 504 11.022 5.540 -3.013 103 HG21 VAL 504 HG21 VAL 504 11.401 8.429 -2.682 104 HG22 VAL 504 HG22 VAL 504 13.009 8.332 -1.925 105 HG23 VAL 504 HG23 VAL 504 12.586 7.218 -3.236 106 H PHE 505 H PHE 505 11.427 7.326 2.459 107 HA PHE 505 HA PHE 505 9.158 5.432 2.773 108 HB2 PHE 505 HB2 PHE 505 10.730 3.822 2.873 109 HB3 PHE 505 HB3 PHE 505 12.039 4.965 3.134 110 HD1 PHE 505 HD1 PHE 505 12.632 5.822 5.332 111 HD2 PHE 505 HD2 PHE 505 9.670 2.755 4.834 112 HE1 PHE 505 HE1 PHE 505 12.826 5.248 7.742 113 HE2 PHE 505 HE2 PHE 505 9.901 2.147 7.243 114 HZ PHE 505 HZ PHE 505 11.461 3.408 8.691 115 H LYS 506 H LYS 506 11.140 8.034 4.087 116 HA LYS 506 HA LYS 506 10.097 7.921 6.769 117 HB2 LYS 506 HB2 LYS 506 11.364 10.136 5.122 118 HB3 LYS 506 HB3 LYS 506 10.912 10.323 6.827 119 HG2 LYS 506 HG2 LYS 506 12.345 8.434 7.456 120 HG3 LYS 506 HG3 LYS 506 12.838 8.202 5.781 121 HD2 LYS 506 HD2 LYS 506 13.337 10.685 7.477 122 HD3 LYS 506 HD3 LYS 506 14.550 9.486 6.968 123 HE2 LYS 506 HE2 LYS 506 14.153 10.109 4.605 124 HE3 LYS 506 HE3 LYS 506 12.957 11.309 5.123 125 HZ1 LYS 506 HZ1 LYS 506 15.096 12.304 4.754 126 HZ2 LYS 506 HZ2 LYS 506 14.688 12.428 6.337 127 HZ3 LYS 506 HZ3 LYS 506 15.803 11.318 5.870 128 H GLN 507 H GLN 507 8.530 8.701 3.837 129 HA GLN 507 HA GLN 507 6.841 10.810 4.930 130 HB2 GLN 507 HB2 GLN 507 6.360 9.193 2.407 131 HB3 GLN 507 HB3 GLN 507 5.745 10.796 2.818 132 HG2 GLN 507 HG2 GLN 507 7.487 11.239 1.294 133 HG3 GLN 507 HG3 GLN 507 8.243 11.540 2.868 134 HE21 GLN 507 HE21 GLN 507 10.353 10.843 2.799 135 HE22 GLN 507 HE22 GLN 507 10.853 9.323 2.099 136 H LEU 508 H LEU 508 6.958 7.433 5.211 137 HA LEU 508 HA LEU 508 4.089 6.878 5.373 138 HB2 LEU 508 HB2 LEU 508 6.511 5.272 6.285 139 HB3 LEU 508 HB3 LEU 508 4.869 4.659 5.997 140 HG LEU 508 HG LEU 508 6.702 5.847 3.866 141 HD11 LEU 508 HD11 LEU 508 7.465 3.661 4.841 142 HD12 LEU 508 HD12 LEU 508 5.912 2.948 4.344 143 HD13 LEU 508 HD13 LEU 508 7.038 3.584 3.122 144 HD21 LEU 508 HD21 LEU 508 4.007 4.448 3.697 145 HD22 LEU 508 HD22 LEU 508 4.342 6.155 3.314 146 HD23 LEU 508 HD23 LEU 508 5.031 4.867 2.305 147 HA PRO 509 HA PRO 509 3.615 7.898 9.671 148 HB2 PRO 509 HB2 PRO 509 1.784 5.953 10.441 149 HB3 PRO 509 HB3 PRO 509 1.388 7.478 9.602 150 HG2 PRO 509 HG2 PRO 509 1.751 4.706 8.462 151 HG3 PRO 509 HG3 PRO 509 0.516 5.923 8.016 152 HD2 PRO 509 HD2 PRO 509 2.768 5.470 6.519 153 HD3 PRO 509 HD3 PRO 509 2.050 7.103 6.673 154 H ALA 510 H ALA 510 3.894 6.959 11.829 155 HA ALA 510 HA ALA 510 6.247 5.420 11.992 156 HB1 ALA 510 HB1 ALA 510 4.082 6.020 14.041 157 HB2 ALA 510 HB2 ALA 510 5.731 5.467 14.433 158 HB3 ALA 510 HB3 ALA 510 5.470 7.054 13.661 159 H ASP 511 H ASP 511 2.879 4.409 11.809 160 HA ASP 511 HA ASP 511 3.477 1.701 12.793 161 HB2 ASP 511 HB2 ASP 511 0.971 2.897 11.534 162 HB3 ASP 511 HB3 ASP 511 1.080 1.304 12.298 163 H ILE 512 H ILE 512 4.034 3.310 9.907 164 HA ILE 512 HA ILE 512 4.164 0.645 8.575 165 HB ILE 512 HB ILE 512 3.892 3.367 7.274 166 HG12 ILE 512 HG12 ILE 512 1.960 1.048 7.687 167 HG13 ILE 512 HG13 ILE 512 1.826 2.694 8.336 168 HG21 ILE 512 HG21 ILE 512 3.666 2.094 5.171 169 HG22 ILE 512 HG22 ILE 512 5.221 1.740 5.918 170 HG23 ILE 512 HG23 ILE 512 3.890 0.566 6.054 171 HD11 ILE 512 HD11 ILE 512 0.301 2.494 6.490 172 HD12 ILE 512 HD12 ILE 512 1.633 3.564 5.996 173 HD13 ILE 512 HD13 ILE 512 1.568 1.878 5.417 174 H GLN 513 H GLN 513 5.948 3.318 9.910 175 HA GLN 513 HA GLN 513 8.418 3.024 8.560 176 HB2 GLN 513 HB2 GLN 513 7.817 3.409 11.528 177 HB3 GLN 513 HB3 GLN 513 9.437 3.522 10.832 178 HG2 GLN 513 HG2 GLN 513 7.114 5.289 9.987 179 HG3 GLN 513 HG3 GLN 513 8.336 5.737 11.190 180 HE21 GLN 513 HE21 GLN 513 7.539 5.698 7.875 181 HE22 GLN 513 HE22 GLN 513 9.116 6.073 7.220 182 H GLU 514 H GLU 514 6.881 1.103 11.149 183 HA GLU 514 HA GLU 514 9.085 -0.714 11.477 184 HB2 GLU 514 HB2 GLU 514 7.553 -1.906 12.953 185 HB3 GLU 514 HB3 GLU 514 7.437 -0.160 13.245 186 HG2 GLU 514 HG2 GLU 514 5.399 -0.047 11.860 187 HG3 GLU 514 HG3 GLU 514 5.502 -1.790 11.555 188 H GLU 515 H GLU 515 6.914 -0.433 8.885 189 HA GLU 515 HA GLU 515 6.705 -3.376 8.520 190 HB2 GLU 515 HB2 GLU 515 5.390 -1.075 7.039 191 HB3 GLU 515 HB3 GLU 515 5.058 -2.797 6.786 192 HG2 GLU 515 HG2 GLU 515 4.641 -1.371 9.452 193 HG3 GLU 515 HG3 GLU 515 3.393 -1.544 8.219 194 H ILE 516 H ILE 516 8.513 -0.632 7.378 195 HA ILE 516 HA ILE 516 9.376 -2.161 4.959 196 HB ILE 516 HB ILE 516 9.442 0.754 5.753 197 HG12 ILE 516 HG12 ILE 516 8.340 1.165 3.696 198 HG13 ILE 516 HG13 ILE 516 8.601 -0.494 3.113 199 HG21 ILE 516 HG21 ILE 516 10.995 -0.584 3.497 200 HG22 ILE 516 HG22 ILE 516 10.774 1.167 3.661 201 HG23 ILE 516 HG23 ILE 516 11.693 0.280 4.891 202 HD11 ILE 516 HD11 ILE 516 6.260 -0.005 3.810 203 HD12 ILE 516 HD12 ILE 516 6.977 -1.348 4.700 204 HD13 ILE 516 HD13 ILE 516 6.838 0.263 5.473 205 H LEU 517 H LEU 517 10.426 -0.795 8.070 206 HA LEU 517 HA LEU 517 13.201 -1.487 7.870 207 HB2 LEU 517 HB2 LEU 517 11.237 -1.295 10.191 208 HB3 LEU 517 HB3 LEU 517 12.966 -1.610 10.406 209 HG LEU 517 HG LEU 517 11.928 0.820 8.891 210 HD11 LEU 517 HD11 LEU 517 12.730 0.630 11.825 211 HD12 LEU 517 HD12 LEU 517 12.249 2.107 10.944 212 HD13 LEU 517 HD13 LEU 517 11.066 0.818 11.233 213 HD21 LEU 517 HD21 LEU 517 14.567 0.311 10.335 214 HD22 LEU 517 HD22 LEU 517 14.343 0.116 8.580 215 HD23 LEU 517 HD23 LEU 517 14.159 1.713 9.334 216 H SER 518 H SER 518 10.499 -3.408 7.591 217 HA SER 518 HA SER 518 12.063 -5.873 8.141 218 HB2 SER 518 HB2 SER 518 9.170 -5.377 8.954 219 HB3 SER 518 HB3 SER 518 10.028 -6.926 9.081 220 HG SER 518 HG SER 518 10.050 -5.713 11.040 221 H GLY 519 H GLY 519 11.122 -4.153 5.749 222 HA2 GLY 519 HA2 GLY 519 9.586 -6.239 4.271 223 HA3 GLY 519 HA3 GLY 519 9.451 -4.494 3.976 224 H LYS 520 H LYS 520 12.317 -6.564 4.517 225 HA LYS 520 HA LYS 520 13.994 -5.247 2.740 226 HB2 LYS 520 HB2 LYS 520 15.553 -6.920 3.251 227 HB3 LYS 520 HB3 LYS 520 14.557 -6.724 4.704 228 HG2 LYS 520 HG2 LYS 520 14.227 -8.937 2.618 229 HG3 LYS 520 HG3 LYS 520 15.139 -9.104 4.111 230 HD2 LYS 520 HD2 LYS 520 12.149 -8.533 3.969 231 HD3 LYS 520 HD3 LYS 520 12.902 -10.108 4.259 232 HE2 LYS 520 HE2 LYS 520 14.012 -9.216 6.283 233 HE3 LYS 520 HE3 LYS 520 13.217 -7.651 6.030 234 HZ1 LYS 520 HZ1 LYS 520 12.044 -9.053 7.606 235 HZ2 LYS 520 HZ2 LYS 520 11.107 -8.735 6.297 236 HZ3 LYS 520 HZ3 LYS 520 11.819 -10.208 6.458 237 H SER 521 H SER 521 11.417 -6.923 1.634 238 HA SER 521 HA SER 521 12.719 -7.509 -0.961 239 HB2 SER 521 HB2 SER 521 12.789 -9.600 0.431 240 HB3 SER 521 HB3 SER 521 11.014 -9.546 0.521 241 HG SER 521 HG SER 521 11.831 -10.859 -1.197 242 H ARG 522 H ARG 522 10.879 -8.393 -2.421 243 HA ARG 522 HA ARG 522 9.057 -7.950 -3.668 244 HB2 ARG 522 HB2 ARG 522 8.018 -8.200 -1.150 245 HB3 ARG 522 HB3 ARG 522 7.508 -6.549 -1.557 246 HG2 ARG 522 HG2 ARG 522 5.742 -7.706 -2.472 247 HG3 ARG 522 HG3 ARG 522 6.835 -7.780 -3.872 248 HD2 ARG 522 HD2 ARG 522 6.401 -9.868 -1.699 249 HD3 ARG 522 HD3 ARG 522 5.926 -10.006 -3.402 250 HE ARG 522 HE ARG 522 8.523 -9.808 -3.782 251 HH11 ARG 522 HH11 ARG 522 6.977 -11.435 -1.037 252 HH12 ARG 522 HH12 ARG 522 8.244 -12.622 -0.890 253 HH21 ARG 522 HH21 ARG 522 10.164 -11.390 -3.548 254 HH22 ARG 522 HH22 ARG 522 10.032 -12.587 -2.283 255 H GLU 523 H GLU 523 11.047 -5.603 -2.544 256 HA GLU 523 HA GLU 523 10.031 -3.656 -4.481 257 HB2 GLU 523 HB2 GLU 523 9.850 -1.829 -2.821 258 HB3 GLU 523 HB3 GLU 523 8.680 -3.122 -2.527 259 HG2 GLU 523 HG2 GLU 523 10.344 -4.065 -0.807 260 HG3 GLU 523 HG3 GLU 523 11.276 -2.579 -1.029 261 H ASN 524 H ASN 524 11.628 -2.360 -5.275 262 HA ASN 524 HA ASN 524 14.208 -2.147 -3.864 263 HB2 ASN 524 HB2 ASN 524 13.765 -3.433 -6.596 264 HB3 ASN 524 HB3 ASN 524 15.305 -2.703 -6.142 265 HD21 ASN 524 HD21 ASN 524 13.046 -5.359 -5.441 266 HD22 ASN 524 HD22 ASN 524 14.191 -6.317 -4.528 267 H LEU 525 H LEU 525 12.153 -0.316 -4.192 268 HA LEU 525 HA LEU 525 11.583 1.707 -4.883 269 HB2 LEU 525 HB2 LEU 525 13.050 3.329 -4.546 270 HB3 LEU 525 HB3 LEU 525 13.736 1.979 -3.668 271 HG LEU 525 HG LEU 525 15.336 1.663 -5.678 272 HD11 LEU 525 HD11 LEU 525 15.694 3.835 -6.930 273 HD12 LEU 525 HD12 LEU 525 14.176 3.022 -7.361 274 HD13 LEU 525 HD13 LEU 525 14.139 4.410 -6.263 275 HD21 LEU 525 HD21 LEU 525 16.767 3.504 -4.859 276 HD22 LEU 525 HD22 LEU 525 15.359 4.225 -4.040 277 HD23 LEU 525 HD23 LEU 525 15.972 2.642 -3.519 278 H LYS 526 H LYS 526 12.866 -0.302 -7.198 279 HA LYS 526 HA LYS 526 11.895 1.435 -9.398 280 HB2 LYS 526 HB2 LYS 526 13.580 -1.065 -9.106 281 HB3 LYS 526 HB3 LYS 526 12.887 -0.626 -10.685 282 HG2 LYS 526 HG2 LYS 526 14.966 0.298 -10.895 283 HG3 LYS 526 HG3 LYS 526 14.049 1.683 -10.284 284 HD2 LYS 526 HD2 LYS 526 16.195 1.538 -9.139 285 HD3 LYS 526 HD3 LYS 526 14.913 1.165 -7.985 286 HE2 LYS 526 HE2 LYS 526 16.789 -0.369 -7.707 287 HE3 LYS 526 HE3 LYS 526 15.375 -1.262 -8.251 288 HZ1 LYS 526 HZ1 LYS 526 16.284 -1.206 -10.483 289 HZ2 LYS 526 HZ2 LYS 526 17.592 -0.348 -9.972 290 HZ3 LYS 526 HZ3 LYS 526 17.361 -1.889 -9.451 291 H1 MET 1 H1 MET 1 -13.770 11.546 -13.451 292 H2 MET 1 H2 MET 1 -14.540 12.853 -12.820 293 H3 MET 1 H3 MET 1 -14.432 11.459 -11.948 294 HA MET 1 HA MET 1 -12.166 13.163 -12.736 295 HB2 MET 1 HB2 MET 1 -11.993 13.848 -10.484 296 HB3 MET 1 HB3 MET 1 -13.690 14.089 -10.919 297 HG2 MET 1 HG2 MET 1 -14.286 11.974 -9.777 298 HG3 MET 1 HG3 MET 1 -12.589 11.664 -9.430 299 HE1 MET 1 HE1 MET 1 -14.564 11.410 -7.136 300 HE2 MET 1 HE2 MET 1 -12.793 11.333 -6.922 301 HE3 MET 1 HE3 MET 1 -13.785 12.356 -5.849 302 H GLN 2 H GLN 2 -10.321 12.594 -10.977 303 HA GLN 2 HA GLN 2 -10.153 9.732 -10.494 304 HB2 GLN 2 HB2 GLN 2 -8.289 9.313 -12.005 305 HB3 GLN 2 HB3 GLN 2 -9.592 10.063 -12.947 306 HG2 GLN 2 HG2 GLN 2 -8.330 12.295 -12.238 307 HG3 GLN 2 HG3 GLN 2 -6.976 11.228 -11.970 308 HE21 GLN 2 HE21 GLN 2 -5.707 12.084 -13.677 309 HE22 GLN 2 HE22 GLN 2 -6.127 11.868 -15.362 310 H ILE 3 H ILE 3 -7.880 9.207 -9.684 311 HA ILE 3 HA ILE 3 -6.557 11.492 -8.322 312 HB ILE 3 HB ILE 3 -6.493 10.445 -6.219 313 HG12 ILE 3 HG12 ILE 3 -7.394 7.947 -7.644 314 HG13 ILE 3 HG13 ILE 3 -6.096 8.219 -6.493 315 HG21 ILE 3 HG21 ILE 3 -9.332 10.165 -7.250 316 HG22 ILE 3 HG22 ILE 3 -8.822 10.439 -5.565 317 HG23 ILE 3 HG23 ILE 3 -8.528 11.688 -6.768 318 HD11 ILE 3 HD11 ILE 3 -7.854 6.909 -5.451 319 HD12 ILE 3 HD12 ILE 3 -7.782 8.510 -4.671 320 HD13 ILE 3 HD13 ILE 3 -9.066 8.137 -5.849 321 H PHE 4 H PHE 4 -4.501 10.391 -7.104 322 HA PHE 4 HA PHE 4 -3.216 8.586 -9.098 323 HB2 PHE 4 HB2 PHE 4 -1.943 11.043 -7.853 324 HB3 PHE 4 HB3 PHE 4 -1.215 9.954 -8.994 325 HD1 PHE 4 HD1 PHE 4 -2.489 9.700 -11.324 326 HD2 PHE 4 HD2 PHE 4 -3.052 12.989 -8.602 327 HE1 PHE 4 HE1 PHE 4 -3.297 11.106 -13.192 328 HE2 PHE 4 HE2 PHE 4 -3.816 14.404 -10.486 329 HZ PHE 4 HZ PHE 4 -3.951 13.470 -12.776 330 H VAL 5 H VAL 5 -3.049 6.800 -7.905 331 HA VAL 5 HA VAL 5 -2.398 7.001 -5.021 332 HB VAL 5 HB VAL 5 -3.239 4.627 -6.732 333 HG11 VAL 5 HG11 VAL 5 -3.697 3.588 -4.521 334 HG12 VAL 5 HG12 VAL 5 -1.978 3.984 -4.722 335 HG13 VAL 5 HG13 VAL 5 -3.022 5.024 -3.716 336 HG21 VAL 5 HG21 VAL 5 -4.836 6.405 -4.830 337 HG22 VAL 5 HG22 VAL 5 -5.040 6.344 -6.589 338 HG23 VAL 5 HG23 VAL 5 -5.431 4.925 -5.595 339 H LYS 6 H LYS 6 -0.251 7.204 -4.632 340 HA LYS 6 HA LYS 6 1.653 6.061 -6.549 341 HB2 LYS 6 HB2 LYS 6 1.719 8.441 -5.671 342 HB3 LYS 6 HB3 LYS 6 2.231 7.766 -4.105 343 HG2 LYS 6 HG2 LYS 6 4.197 6.727 -5.216 344 HG3 LYS 6 HG3 LYS 6 3.621 7.320 -6.787 345 HD2 LYS 6 HD2 LYS 6 5.358 8.795 -6.034 346 HD3 LYS 6 HD3 LYS 6 3.818 9.664 -5.928 347 HE2 LYS 6 HE2 LYS 6 3.705 9.136 -3.502 348 HE3 LYS 6 HE3 LYS 6 5.242 8.260 -3.624 349 HZ1 LYS 6 HZ1 LYS 6 6.284 10.319 -4.301 350 HZ2 LYS 6 HZ2 LYS 6 4.863 11.131 -4.172 351 HZ3 LYS 6 HZ3 LYS 6 5.569 10.494 -2.833 352 H THR 7 H THR 7 3.053 4.424 -6.171 353 HA THR 7 HA THR 7 2.591 2.671 -3.908 354 HB THR 7 HB THR 7 4.337 1.299 -5.037 355 HG1 THR 7 HG1 THR 7 5.316 2.114 -6.850 356 HG21 THR 7 HG21 THR 7 2.323 2.480 -7.001 357 HG22 THR 7 HG22 THR 7 3.108 0.893 -7.120 358 HG23 THR 7 HG23 THR 7 1.960 1.226 -5.797 359 H LEU 8 H LEU 8 4.557 1.680 -2.815 360 HA LEU 8 HA LEU 8 6.004 3.538 -1.253 361 HB2 LEU 8 HB2 LEU 8 5.410 1.207 -0.694 362 HB3 LEU 8 HB3 LEU 8 6.500 0.598 -1.926 363 HG LEU 8 HG LEU 8 7.192 0.502 0.526 364 HD11 LEU 8 HD11 LEU 8 8.761 0.071 -1.330 365 HD12 LEU 8 HD12 LEU 8 9.203 1.792 -1.358 366 HD13 LEU 8 HD13 LEU 8 9.535 0.814 0.078 367 HD21 LEU 8 HD21 LEU 8 8.263 2.455 1.490 368 HD22 LEU 8 HD22 LEU 8 7.848 3.438 0.069 369 HD23 LEU 8 HD23 LEU 8 6.558 2.807 1.117 370 H THR 9 H THR 9 6.533 2.388 -4.511 371 HA THR 9 HA THR 9 9.446 2.837 -4.353 372 HB THR 9 HB THR 9 9.426 1.814 -6.629 373 HG1 THR 9 HG1 THR 9 7.459 0.924 -7.326 374 HG21 THR 9 HG21 THR 9 7.882 0.238 -4.510 375 HG22 THR 9 HG22 THR 9 8.799 -0.450 -5.870 376 HG23 THR 9 HG23 THR 9 9.646 0.423 -4.569 377 H GLY 10 H GLY 10 6.651 4.626 -5.043 378 HA2 GLY 10 HA2 GLY 10 6.817 6.927 -5.408 379 HA3 GLY 10 HA3 GLY 10 8.424 6.699 -6.138 380 H LYS 11 H LYS 11 5.688 4.702 -7.140 381 HA LYS 11 HA LYS 11 5.431 6.329 -9.636 382 HB2 LYS 11 HB2 LYS 11 6.637 4.199 -9.847 383 HB3 LYS 11 HB3 LYS 11 5.238 3.310 -9.233 384 HG2 LYS 11 HG2 LYS 11 4.788 5.181 -11.539 385 HG3 LYS 11 HG3 LYS 11 5.658 3.662 -11.857 386 HD2 LYS 11 HD2 LYS 11 3.767 2.358 -10.937 387 HD3 LYS 11 HD3 LYS 11 2.906 3.846 -10.543 388 HE2 LYS 11 HE2 LYS 11 2.037 2.942 -12.622 389 HE3 LYS 11 HE3 LYS 11 2.874 4.469 -12.946 390 HZ1 LYS 11 HZ1 LYS 11 4.002 1.776 -13.351 391 HZ2 LYS 11 HZ2 LYS 11 3.447 2.770 -14.536 392 HZ3 LYS 11 HZ3 LYS 11 4.777 3.191 -13.668 393 H THR 12 H THR 12 3.288 6.609 -10.446 394 HA THR 12 HA THR 12 1.223 5.842 -8.432 395 HB THR 12 HB THR 12 2.125 8.343 -8.753 396 HG1 THR 12 HG1 THR 12 0.196 8.886 -7.770 397 HG21 THR 12 HG21 THR 12 1.315 8.486 -11.135 398 HG22 THR 12 HG22 THR 12 -0.347 8.239 -10.525 399 HG23 THR 12 HG23 THR 12 0.566 9.676 -10.040 400 H ILE 13 H ILE 13 -0.957 5.763 -9.179 401 HA ILE 13 HA ILE 13 -1.215 4.963 -12.049 402 HB ILE 13 HB ILE 13 -2.415 3.550 -9.638 403 HG12 ILE 13 HG12 ILE 13 -0.053 2.743 -11.398 404 HG13 ILE 13 HG13 ILE 13 0.006 3.189 -9.689 405 HG21 ILE 13 HG21 ILE 13 -2.353 2.774 -12.589 406 HG22 ILE 13 HG22 ILE 13 -3.136 1.861 -11.277 407 HG23 ILE 13 HG23 ILE 13 -3.761 3.447 -11.738 408 HD11 ILE 13 HD11 ILE 13 -1.464 1.248 -9.143 409 HD12 ILE 13 HD12 ILE 13 -1.375 0.741 -10.850 410 HD13 ILE 13 HD13 ILE 13 0.093 0.786 -9.854 411 H THR 14 H THR 14 -2.976 5.855 -13.044 412 HA THR 14 HA THR 14 -4.519 7.807 -11.502 413 HB THR 14 HB THR 14 -4.669 7.041 -14.448 414 HG1 THR 14 HG1 THR 14 -2.609 7.791 -13.893 415 HG21 THR 14 HG21 THR 14 -5.632 9.300 -14.672 416 HG22 THR 14 HG22 THR 14 -6.622 8.294 -13.589 417 HG23 THR 14 HG23 THR 14 -5.526 9.521 -12.905 418 H LEU 15 H LEU 15 -6.685 7.576 -10.927 419 HA LEU 15 HA LEU 15 -8.110 5.105 -11.758 420 HB2 LEU 15 HB2 LEU 15 -7.548 5.919 -8.881 421 HB3 LEU 15 HB3 LEU 15 -8.559 4.564 -9.396 422 HG LEU 15 HG LEU 15 -5.591 4.844 -10.006 423 HD11 LEU 15 HD11 LEU 15 -6.974 3.132 -7.898 424 HD12 LEU 15 HD12 LEU 15 -5.221 3.255 -8.200 425 HD13 LEU 15 HD13 LEU 15 -6.118 4.660 -7.575 426 HD21 LEU 15 HD21 LEU 15 -5.687 2.448 -10.482 427 HD22 LEU 15 HD22 LEU 15 -7.436 2.417 -10.165 428 HD23 LEU 15 HD23 LEU 15 -6.808 3.321 -11.555 429 H GLU 16 H GLU 16 -10.275 5.359 -11.793 430 HA GLU 16 HA GLU 16 -11.344 8.058 -11.136 431 HB2 GLU 16 HB2 GLU 16 -11.719 7.366 -13.406 432 HB3 GLU 16 HB3 GLU 16 -12.248 5.750 -12.899 433 HG2 GLU 16 HG2 GLU 16 -14.233 6.662 -11.850 434 HG3 GLU 16 HG3 GLU 16 -13.720 8.324 -12.212 435 H VAL 17 H VAL 17 -12.575 8.375 -9.458 436 HA VAL 17 HA VAL 17 -14.182 6.192 -8.273 437 HB VAL 17 HB VAL 17 -13.360 6.725 -6.016 438 HG11 VAL 17 HG11 VAL 17 -11.194 5.605 -6.141 439 HG12 VAL 17 HG12 VAL 17 -12.343 4.834 -7.256 440 HG13 VAL 17 HG13 VAL 17 -11.080 5.928 -7.876 441 HG21 VAL 17 HG21 VAL 17 -11.240 8.382 -7.442 442 HG22 VAL 17 HG22 VAL 17 -12.559 9.023 -6.428 443 HG23 VAL 17 HG23 VAL 17 -11.291 8.018 -5.705 444 H GLU 18 H GLU 18 -15.451 7.210 -6.333 445 HA GLU 18 HA GLU 18 -16.229 10.035 -6.874 446 HB2 GLU 18 HB2 GLU 18 -18.050 7.643 -6.385 447 HB3 GLU 18 HB3 GLU 18 -18.596 9.317 -6.528 448 HG2 GLU 18 HG2 GLU 18 -17.200 7.733 -8.730 449 HG3 GLU 18 HG3 GLU 18 -18.937 7.969 -8.567 450 HA PRO 19 HA PRO 19 -16.045 10.437 -2.485 451 HB2 PRO 19 HB2 PRO 19 -18.772 11.656 -2.428 452 HB3 PRO 19 HB3 PRO 19 -17.223 12.322 -1.846 453 HG2 PRO 19 HG2 PRO 19 -18.346 13.225 -4.164 454 HG3 PRO 19 HG3 PRO 19 -16.575 13.015 -3.999 455 HD2 PRO 19 HD2 PRO 19 -18.555 11.166 -5.325 456 HD3 PRO 19 HD3 PRO 19 -16.927 11.679 -5.875 457 H SER 20 H SER 20 -18.171 8.259 -3.915 458 HA SER 20 HA SER 20 -19.101 7.271 -1.267 459 HB2 SER 20 HB2 SER 20 -20.561 7.291 -3.932 460 HB3 SER 20 HB3 SER 20 -21.121 6.476 -2.456 461 HG SER 20 HG SER 20 -22.026 8.573 -2.708 462 H ASP 21 H ASP 21 -17.224 6.739 -4.037 463 HA ASP 21 HA ASP 21 -17.375 3.799 -3.990 464 HB2 ASP 21 HB2 ASP 21 -15.468 5.762 -5.260 465 HB3 ASP 21 HB3 ASP 21 -15.410 4.011 -5.508 466 H THR 22 H THR 22 -17.128 3.882 -1.682 467 HA THR 22 HA THR 22 -14.796 4.889 -0.348 468 HB THR 22 HB THR 22 -16.853 4.566 0.835 469 HG1 THR 22 HG1 THR 22 -15.993 3.525 2.602 470 HG21 THR 22 HG21 THR 22 -17.825 2.694 -0.303 471 HG22 THR 22 HG22 THR 22 -16.529 1.615 0.292 472 HG23 THR 22 HG23 THR 22 -17.701 2.361 1.432 473 H ILE 23 H ILE 23 -13.542 3.109 1.148 474 HA ILE 23 HA ILE 23 -11.539 2.344 -0.599 475 HB ILE 23 HB ILE 23 -12.030 1.035 2.085 476 HG12 ILE 23 HG12 ILE 23 -12.336 3.375 2.479 477 HG13 ILE 23 HG13 ILE 23 -10.719 2.937 3.037 478 HG21 ILE 23 HG21 ILE 23 -10.183 0.123 0.779 479 HG22 ILE 23 HG22 ILE 23 -9.499 1.746 0.546 480 HG23 ILE 23 HG23 ILE 23 -9.560 1.032 2.176 481 HD11 ILE 23 HD11 ILE 23 -9.773 3.881 0.913 482 HD12 ILE 23 HD12 ILE 23 -11.424 4.372 0.434 483 HD13 ILE 23 HD13 ILE 23 -10.675 5.072 1.875 484 H GLU 24 H GLU 24 -14.287 0.262 0.485 485 HA GLU 24 HA GLU 24 -13.049 -2.137 -0.489 486 HB2 GLU 24 HB2 GLU 24 -15.184 -3.178 -0.215 487 HB3 GLU 24 HB3 GLU 24 -14.952 -2.048 1.132 488 HG2 GLU 24 HG2 GLU 24 -16.376 -0.386 -0.030 489 HG3 GLU 24 HG3 GLU 24 -16.601 -1.514 -1.377 490 H ASN 25 H ASN 25 -14.637 0.513 -2.084 491 HA ASN 25 HA ASN 25 -15.101 -0.922 -4.576 492 HB2 ASN 25 HB2 ASN 25 -15.151 2.042 -3.906 493 HB3 ASN 25 HB3 ASN 25 -15.670 1.359 -5.426 494 HD21 ASN 25 HD21 ASN 25 -16.419 1.843 -2.148 495 HD22 ASN 25 HD22 ASN 25 -18.038 1.113 -2.135 496 H VAL 26 H VAL 26 -12.803 1.411 -3.146 497 HA VAL 26 HA VAL 26 -11.257 2.073 -5.466 498 HB VAL 26 HB VAL 26 -10.579 2.003 -2.491 499 HG11 VAL 26 HG11 VAL 26 -8.811 3.645 -3.120 500 HG12 VAL 26 HG12 VAL 26 -8.544 2.013 -3.770 501 HG13 VAL 26 HG13 VAL 26 -9.164 3.306 -4.836 502 HG21 VAL 26 HG21 VAL 26 -11.052 4.412 -2.563 503 HG22 VAL 26 HG22 VAL 26 -11.552 4.264 -4.275 504 HG23 VAL 26 HG23 VAL 26 -12.483 3.454 -2.995 505 H LYS 27 H LYS 27 -10.871 -0.409 -2.898 506 HA LYS 27 HA LYS 27 -8.423 -1.457 -3.750 507 HB2 LYS 27 HB2 LYS 27 -10.889 -2.635 -2.427 508 HB3 LYS 27 HB3 LYS 27 -9.403 -3.572 -2.708 509 HG2 LYS 27 HG2 LYS 27 -8.090 -2.101 -1.353 510 HG3 LYS 27 HG3 LYS 27 -9.406 -0.914 -1.219 511 HD2 LYS 27 HD2 LYS 27 -10.756 -2.458 0.079 512 HD3 LYS 27 HD3 LYS 27 -9.603 -3.780 -0.215 513 HE2 LYS 27 HE2 LYS 27 -7.843 -2.505 0.961 514 HE3 LYS 27 HE3 LYS 27 -8.992 -1.209 1.304 515 HZ1 LYS 27 HZ1 LYS 27 -9.257 -3.988 2.234 516 HZ2 LYS 27 HZ2 LYS 27 -8.798 -2.710 3.161 517 HZ3 LYS 27 HZ3 LYS 27 -10.315 -2.765 2.544 518 H ALA 28 H ALA 28 -11.594 -1.723 -5.312 519 HA ALA 28 HA ALA 28 -10.708 -3.948 -6.996 520 HB1 ALA 28 HB1 ALA 28 -13.091 -3.643 -6.362 521 HB2 ALA 28 HB2 ALA 28 -13.119 -2.103 -7.259 522 HB3 ALA 28 HB3 ALA 28 -12.843 -3.628 -8.124 523 H LYS 29 H LYS 29 -10.665 -0.397 -7.075 524 HA LYS 29 HA LYS 29 -10.246 -0.140 -9.916 525 HB2 LYS 29 HB2 LYS 29 -9.763 1.640 -7.499 526 HB3 LYS 29 HB3 LYS 29 -9.152 2.091 -9.081 527 HG2 LYS 29 HG2 LYS 29 -11.233 3.178 -8.729 528 HG3 LYS 29 HG3 LYS 29 -11.434 1.983 -10.024 529 HD2 LYS 29 HD2 LYS 29 -12.608 0.473 -8.575 530 HD3 LYS 29 HD3 LYS 29 -12.095 1.380 -7.135 531 HE2 LYS 29 HE2 LYS 29 -14.456 1.788 -7.657 532 HE3 LYS 29 HE3 LYS 29 -13.491 3.271 -7.752 533 HZ1 LYS 29 HZ1 LYS 29 -13.443 3.055 -10.123 534 HZ2 LYS 29 HZ2 LYS 29 -14.299 1.645 -10.069 535 HZ3 LYS 29 HZ3 LYS 29 -14.997 3.061 -9.607 536 H ILE 30 H ILE 30 -8.090 -0.638 -7.096 537 HA ILE 30 HA ILE 30 -5.679 -0.270 -8.723 538 HB ILE 30 HB ILE 30 -6.170 -1.195 -5.856 539 HG12 ILE 30 HG12 ILE 30 -5.177 1.446 -7.009 540 HG13 ILE 30 HG13 ILE 30 -6.810 1.155 -6.390 541 HG21 ILE 30 HG21 ILE 30 -3.559 -0.463 -7.254 542 HG22 ILE 30 HG22 ILE 30 -3.742 -0.834 -5.521 543 HG23 ILE 30 HG23 ILE 30 -4.028 -2.095 -6.722 544 HD11 ILE 30 HD11 ILE 30 -5.524 2.292 -4.695 545 HD12 ILE 30 HD12 ILE 30 -5.841 0.636 -4.145 546 HD13 ILE 30 HD13 ILE 30 -4.233 1.079 -4.774 547 H GLN 31 H GLN 31 -7.693 -2.924 -7.454 548 HA GLN 31 HA GLN 31 -5.901 -5.054 -8.118 549 HB2 GLN 31 HB2 GLN 31 -7.791 -5.404 -6.611 550 HB3 GLN 31 HB3 GLN 31 -8.935 -4.868 -7.860 551 HG2 GLN 31 HG2 GLN 31 -8.390 -6.743 -9.281 552 HG3 GLN 31 HG3 GLN 31 -7.083 -7.247 -8.218 553 HE21 GLN 31 HE21 GLN 31 -7.786 -9.237 -7.474 554 HE22 GLN 31 HE22 GLN 31 -9.297 -9.485 -6.619 555 H ASP 32 H ASP 32 -8.421 -3.262 -9.943 556 HA ASP 32 HA ASP 32 -8.509 -5.105 -12.110 557 HB2 ASP 32 HB2 ASP 32 -10.239 -3.392 -11.537 558 HB3 ASP 32 HB3 ASP 32 -9.091 -2.123 -11.877 559 H LYS 33 H LYS 33 -6.501 -2.368 -11.312 560 HA LYS 33 HA LYS 33 -5.421 -1.942 -13.971 561 HB2 LYS 33 HB2 LYS 33 -4.966 -0.909 -11.168 562 HB3 LYS 33 HB3 LYS 33 -3.901 -0.402 -12.494 563 HG2 LYS 33 HG2 LYS 33 -6.930 -0.197 -12.713 564 HG3 LYS 33 HG3 LYS 33 -5.952 1.081 -11.964 565 HD2 LYS 33 HD2 LYS 33 -4.583 1.258 -14.008 566 HD3 LYS 33 HD3 LYS 33 -5.614 0.045 -14.804 567 HE2 LYS 33 HE2 LYS 33 -6.585 2.686 -13.640 568 HE3 LYS 33 HE3 LYS 33 -6.201 2.437 -15.348 569 HZ1 LYS 33 HZ1 LYS 33 -7.904 0.737 -15.418 570 HZ2 LYS 33 HZ2 LYS 33 -8.280 0.990 -13.840 571 HZ3 LYS 33 HZ3 LYS 33 -8.543 2.173 -14.948 572 H GLU 34 H GLU 34 -4.455 -3.898 -11.180 573 HA GLU 34 HA GLU 34 -1.988 -4.597 -12.704 574 HB2 GLU 34 HB2 GLU 34 -2.180 -3.963 -9.739 575 HB3 GLU 34 HB3 GLU 34 -0.746 -4.631 -10.527 576 HG2 GLU 34 HG2 GLU 34 -2.038 -1.951 -11.202 577 HG3 GLU 34 HG3 GLU 34 -0.633 -2.167 -10.163 578 H GLY 35 H GLY 35 -4.446 -5.578 -10.313 579 HA2 GLY 35 HA2 GLY 35 -5.327 -7.825 -10.504 580 HA3 GLY 35 HA3 GLY 35 -3.689 -8.422 -10.823 581 H ILE 36 H ILE 36 -3.763 -5.921 -8.510 582 HA ILE 36 HA ILE 36 -2.734 -7.688 -6.455 583 HB ILE 36 HB ILE 36 -3.408 -4.717 -6.543 584 HG12 ILE 36 HG12 ILE 36 -0.707 -6.131 -6.658 585 HG13 ILE 36 HG13 ILE 36 -1.598 -5.624 -8.097 586 HG21 ILE 36 HG21 ILE 36 -2.069 -4.521 -4.497 587 HG22 ILE 36 HG22 ILE 36 -3.418 -5.639 -4.227 588 HG23 ILE 36 HG23 ILE 36 -1.779 -6.281 -4.495 589 HD11 ILE 36 HD11 ILE 36 -0.619 -3.781 -5.876 590 HD12 ILE 36 HD12 ILE 36 0.077 -3.944 -7.500 591 HD13 ILE 36 HD13 ILE 36 -1.549 -3.274 -7.317 592 HA PRO 37 HA PRO 37 -6.760 -8.506 -4.815 593 HB2 PRO 37 HB2 PRO 37 -6.075 -9.589 -2.370 594 HB3 PRO 37 HB3 PRO 37 -5.884 -10.454 -3.928 595 HG2 PRO 37 HG2 PRO 37 -3.797 -8.922 -2.371 596 HG3 PRO 37 HG3 PRO 37 -3.650 -10.542 -3.139 597 HD2 PRO 37 HD2 PRO 37 -2.725 -8.263 -4.328 598 HD3 PRO 37 HD3 PRO 37 -3.446 -9.589 -5.294 599 HA PRO 38 HA PRO 38 -7.830 -5.069 -2.296 600 HB2 PRO 38 HB2 PRO 38 -10.030 -6.021 -0.941 601 HB3 PRO 38 HB3 PRO 38 -10.029 -5.654 -2.698 602 HG2 PRO 38 HG2 PRO 38 -9.657 -8.337 -1.342 603 HG3 PRO 38 HG3 PRO 38 -10.727 -7.934 -2.728 604 HD2 PRO 38 HD2 PRO 38 -8.278 -9.058 -3.088 605 HD3 PRO 38 HD3 PRO 38 -8.905 -7.815 -4.217 606 H ASP 39 H ASP 39 -6.726 -8.001 -0.953 607 HA ASP 39 HA ASP 39 -7.005 -7.025 1.816 608 HB2 ASP 39 HB2 ASP 39 -7.787 -9.291 1.204 609 HB3 ASP 39 HB3 ASP 39 -6.122 -9.722 0.766 610 H GLN 40 H GLN 40 -4.616 -6.849 -0.637 611 HA GLN 40 HA GLN 40 -2.518 -6.761 1.480 612 HB2 GLN 40 HB2 GLN 40 -2.237 -7.731 -1.380 613 HB3 GLN 40 HB3 GLN 40 -0.930 -7.569 -0.196 614 HG2 GLN 40 HG2 GLN 40 -2.220 -9.146 1.323 615 HG3 GLN 40 HG3 GLN 40 -3.319 -9.437 -0.046 616 HE21 GLN 40 HE21 GLN 40 -1.774 -9.681 -2.229 617 HE22 GLN 40 HE22 GLN 40 -0.610 -10.979 -2.045 618 H GLN 41 H GLN 41 -4.190 -4.672 -0.488 619 HA GLN 41 HA GLN 41 -2.107 -3.237 -1.803 620 HB2 GLN 41 HB2 GLN 41 -4.964 -2.713 -0.964 621 HB3 GLN 41 HB3 GLN 41 -4.031 -1.429 -1.744 622 HG2 GLN 41 HG2 GLN 41 -3.594 -2.836 -3.687 623 HG3 GLN 41 HG3 GLN 41 -4.297 -4.241 -2.865 624 HE21 GLN 41 HE21 GLN 41 -5.833 -4.563 -4.559 625 HE22 GLN 41 HE22 GLN 41 -7.245 -3.536 -4.651 626 H ARG 42 H ARG 42 -3.854 -2.479 1.146 627 HA ARG 42 HA ARG 42 -3.553 -1.049 2.881 628 HB2 ARG 42 HB2 ARG 42 -1.465 -2.491 3.070 629 HB3 ARG 42 HB3 ARG 42 -0.575 -1.109 2.388 630 HG2 ARG 42 HG2 ARG 42 -1.454 0.331 4.221 631 HG3 ARG 42 HG3 ARG 42 -2.378 -1.053 4.846 632 HD2 ARG 42 HD2 ARG 42 -0.212 -2.300 5.094 633 HD3 ARG 42 HD3 ARG 42 0.650 -0.810 4.671 634 HE ARG 42 HE ARG 42 -0.978 -0.007 6.730 635 HH11 ARG 42 HH11 ARG 42 1.279 -2.690 6.344 636 HH12 ARG 42 HH12 ARG 42 1.674 -2.764 8.044 637 HH21 ARG 42 HH21 ARG 42 -0.449 -0.110 8.940 638 HH22 ARG 42 HH22 ARG 42 0.713 -1.285 9.511 639 H LEU 43 H LEU 43 -4.692 0.570 1.801 640 HA LEU 43 HA LEU 43 -3.252 2.579 0.231 641 HB2 LEU 43 HB2 LEU 43 -5.482 1.523 -0.364 642 HB3 LEU 43 HB3 LEU 43 -6.171 2.309 1.062 643 HG LEU 43 HG LEU 43 -5.489 4.526 0.084 644 HD11 LEU 43 HD11 LEU 43 -3.721 3.692 -1.484 645 HD12 LEU 43 HD12 LEU 43 -4.968 2.811 -2.393 646 HD13 LEU 43 HD13 LEU 43 -4.988 4.586 -2.346 647 HD21 LEU 43 HD21 LEU 43 -7.335 4.524 -1.582 648 HD22 LEU 43 HD22 LEU 43 -7.310 2.740 -1.597 649 HD23 LEU 43 HD23 LEU 43 -7.781 3.607 -0.127 650 H ILE 44 H ILE 44 -2.864 4.667 0.882 651 HA ILE 44 HA ILE 44 -3.718 5.538 3.599 652 HB ILE 44 HB ILE 44 -0.908 5.493 2.422 653 HG12 ILE 44 HG12 ILE 44 -0.443 4.664 4.833 654 HG13 ILE 44 HG13 ILE 44 -2.174 4.379 4.955 655 HG21 ILE 44 HG21 ILE 44 -1.796 6.958 4.937 656 HG22 ILE 44 HG22 ILE 44 -0.147 6.821 4.328 657 HG23 ILE 44 HG23 ILE 44 -1.321 7.760 3.410 658 HD11 ILE 44 HD11 ILE 44 -2.070 2.688 3.218 659 HD12 ILE 44 HD12 ILE 44 -0.420 3.193 2.760 660 HD13 ILE 44 HD13 ILE 44 -0.721 2.390 4.314 661 H PHE 45 H PHE 45 -3.957 7.799 3.802 662 HA PHE 45 HA PHE 45 -3.258 9.603 1.589 663 HB2 PHE 45 HB2 PHE 45 -5.485 8.747 0.959 664 HB3 PHE 45 HB3 PHE 45 -6.131 9.203 2.528 665 HD1 PHE 45 HD1 PHE 45 -4.373 10.773 -0.411 666 HD2 PHE 45 HD2 PHE 45 -7.145 11.272 2.840 667 HE1 PHE 45 HE1 PHE 45 -4.978 13.003 -1.276 668 HE2 PHE 45 HE2 PHE 45 -7.713 13.533 2.009 669 HZ PHE 45 HZ PHE 45 -6.630 14.412 -0.046 670 H ALA 46 H ALA 46 -3.312 11.803 2.251 671 HA ALA 46 HA ALA 46 -2.497 13.314 3.713 672 HB1 ALA 46 HB1 ALA 46 -4.861 12.372 5.379 673 HB2 ALA 46 HB2 ALA 46 -4.029 13.933 5.532 674 HB3 ALA 46 HB3 ALA 46 -4.930 13.553 4.049 675 H GLY 47 H GLY 47 -1.693 10.346 4.078 676 HA2 GLY 47 HA2 GLY 47 0.112 9.500 5.237 677 HA3 GLY 47 HA3 GLY 47 0.020 10.812 6.411 678 H LYS 48 H LYS 48 -3.012 9.110 5.757 679 HA LYS 48 HA LYS 48 -2.406 7.202 7.938 680 HB2 LYS 48 HB2 LYS 48 -4.633 7.539 8.942 681 HB3 LYS 48 HB3 LYS 48 -3.517 8.888 9.127 682 HG2 LYS 48 HG2 LYS 48 -5.640 9.777 8.717 683 HG3 LYS 48 HG3 LYS 48 -4.644 10.064 7.271 684 HD2 LYS 48 HD2 LYS 48 -5.833 8.239 6.102 685 HD3 LYS 48 HD3 LYS 48 -6.840 7.935 7.538 686 HE2 LYS 48 HE2 LYS 48 -6.691 10.547 5.985 687 HE3 LYS 48 HE3 LYS 48 -7.976 9.339 5.855 688 HZ1 LYS 48 HZ1 LYS 48 -8.478 9.711 8.176 689 HZ2 LYS 48 HZ2 LYS 48 -7.276 10.825 8.295 690 HZ3 LYS 48 HZ3 LYS 48 -8.572 11.126 7.340 691 H GLN 49 H GLN 49 -3.978 5.513 8.110 692 HA GLN 49 HA GLN 49 -4.333 4.432 5.371 693 HB2 GLN 49 HB2 GLN 49 -2.883 3.202 6.872 694 HB3 GLN 49 HB3 GLN 49 -4.140 3.139 8.113 695 HG2 GLN 49 HG2 GLN 49 -5.553 1.761 6.615 696 HG3 GLN 49 HG3 GLN 49 -4.343 1.896 5.328 697 HE21 GLN 49 HE21 GLN 49 -5.350 -0.567 6.482 698 HE22 GLN 49 HE22 GLN 49 -3.988 -1.377 7.226 699 H LEU 50 H LEU 50 -6.236 4.147 4.505 700 HA LEU 50 HA LEU 50 -8.542 5.224 5.915 701 HB2 LEU 50 HB2 LEU 50 -8.471 4.028 3.126 702 HB3 LEU 50 HB3 LEU 50 -9.560 5.260 3.777 703 HG LEU 50 HG LEU 50 -6.574 5.577 3.228 704 HD11 LEU 50 HD11 LEU 50 -9.015 6.853 1.937 705 HD12 LEU 50 HD12 LEU 50 -7.319 7.207 1.542 706 HD13 LEU 50 HD13 LEU 50 -7.983 5.598 1.206 707 HD21 LEU 50 HD21 LEU 50 -8.564 7.660 4.201 708 HD22 LEU 50 HD22 LEU 50 -7.345 6.876 5.238 709 HD23 LEU 50 HD23 LEU 50 -6.831 7.899 3.887 710 H GLU 51 H GLU 51 -10.734 4.070 5.791 711 HA GLU 51 HA GLU 51 -10.353 1.139 6.246 712 HB2 GLU 51 HB2 GLU 51 -11.733 3.241 7.904 713 HB3 GLU 51 HB3 GLU 51 -12.258 1.547 7.975 714 HG2 GLU 51 HG2 GLU 51 -10.013 0.824 8.598 715 HG3 GLU 51 HG3 GLU 51 -9.399 2.474 8.410 716 H ASP 52 H ASP 52 -12.033 -0.207 5.769 717 HA ASP 52 HA ASP 52 -13.543 0.529 3.439 718 HB2 ASP 52 HB2 ASP 52 -13.639 -1.952 5.202 719 HB3 ASP 52 HB3 ASP 52 -14.322 -1.803 3.579 720 H GLY 53 H GLY 53 -14.151 1.210 6.633 721 HA2 GLY 53 HA2 GLY 53 -17.094 0.827 6.407 722 HA3 GLY 53 HA3 GLY 53 -16.182 1.034 7.915 723 H ARG 54 H ARG 54 -15.121 3.068 5.339 724 HA ARG 54 HA ARG 54 -16.590 5.407 6.447 725 HB2 ARG 54 HB2 ARG 54 -13.877 5.400 5.152 726 HB3 ARG 54 HB3 ARG 54 -14.585 6.671 6.153 727 HG2 ARG 54 HG2 ARG 54 -13.776 3.910 7.184 728 HG3 ARG 54 HG3 ARG 54 -12.745 5.347 7.252 729 HD2 ARG 54 HD2 ARG 54 -14.268 6.500 8.664 730 HD3 ARG 54 HD3 ARG 54 -15.508 5.223 8.501 731 HE ARG 54 HE ARG 54 -13.186 3.986 9.474 732 HH11 ARG 54 HH11 ARG 54 -15.451 6.461 10.585 733 HH12 ARG 54 HH12 ARG 54 -15.187 6.104 12.277 734 HH21 ARG 54 HH21 ARG 54 -12.840 3.564 11.641 735 HH22 ARG 54 HH22 ARG 54 -13.712 4.429 12.889 736 H THR 55 H THR 55 -15.295 7.047 4.351 737 HA THR 55 HA THR 55 -16.082 6.024 1.724 738 HB THR 55 HB THR 55 -17.367 8.290 1.417 739 HG1 THR 55 HG1 THR 55 -18.265 9.077 3.255 740 HG21 THR 55 HG21 THR 55 -18.341 5.925 1.403 741 HG22 THR 55 HG22 THR 55 -18.650 6.135 3.138 742 HG23 THR 55 HG23 THR 55 -19.463 7.193 1.960 743 H LEU 56 H LEU 56 -15.208 7.408 0.014 744 HA LEU 56 HA LEU 56 -12.677 8.543 0.656 745 HB2 LEU 56 HB2 LEU 56 -14.509 8.788 -1.758 746 HB3 LEU 56 HB3 LEU 56 -12.922 9.569 -1.676 747 HG LEU 56 HG LEU 56 -13.392 6.569 -1.385 748 HD11 LEU 56 HD11 LEU 56 -12.303 6.476 -3.625 749 HD12 LEU 56 HD12 LEU 56 -13.856 7.335 -3.662 750 HD13 LEU 56 HD13 LEU 56 -12.328 8.256 -3.692 751 HD21 LEU 56 HD21 LEU 56 -11.334 7.330 -0.221 752 HD22 LEU 56 HD22 LEU 56 -10.929 6.438 -1.698 753 HD23 LEU 56 HD23 LEU 56 -10.843 8.210 -1.693 754 H SER 57 H SER 57 -15.928 9.820 0.722 755 HA SER 57 HA SER 57 -15.260 12.609 0.783 756 HB2 SER 57 HB2 SER 57 -17.634 12.773 1.454 757 HB3 SER 57 HB3 SER 57 -17.445 11.619 0.120 758 HG SER 57 HG SER 57 -18.769 10.814 1.782 759 H ASP 58 H ASP 58 -15.288 10.004 3.144 760 HA ASP 58 HA ASP 58 -15.433 11.706 5.478 761 HB2 ASP 58 HB2 ASP 58 -16.121 9.278 5.375 762 HB3 ASP 58 HB3 ASP 58 -14.405 8.849 5.268 763 H TYR 59 H TYR 59 -12.899 10.914 3.254 764 HA TYR 59 HA TYR 59 -10.931 12.000 5.216 765 HB2 TYR 59 HB2 TYR 59 -9.819 10.723 2.818 766 HB3 TYR 59 HB3 TYR 59 -9.299 10.631 4.490 767 HD1 TYR 59 HD1 TYR 59 -10.405 8.895 6.007 768 HD2 TYR 59 HD2 TYR 59 -11.123 9.133 1.779 769 HE1 TYR 59 HE1 TYR 59 -11.181 6.502 5.990 770 HE2 TYR 59 HE2 TYR 59 -12.009 6.811 1.789 771 HH TYR 59 HH TYR 59 -12.093 4.820 4.736 772 H ASN 60 H ASN 60 -12.915 13.315 3.332 773 HA ASN 60 HA ASN 60 -13.066 14.968 1.890 774 HB2 ASN 60 HB2 ASN 60 -11.900 16.883 2.522 775 HB3 ASN 60 HB3 ASN 60 -12.046 15.896 3.975 776 HD21 ASN 60 HD21 ASN 60 -10.258 15.256 5.089 777 HD22 ASN 60 HD22 ASN 60 -8.615 15.648 4.610 778 H ILE 61 H ILE 61 -11.327 12.630 0.871 779 HA ILE 61 HA ILE 61 -9.373 13.691 -0.891 780 HB ILE 61 HB ILE 61 -11.111 11.197 -0.978 781 HG12 ILE 61 HG12 ILE 61 -8.138 11.622 -0.461 782 HG13 ILE 61 HG13 ILE 61 -9.362 11.502 0.821 783 HG21 ILE 61 HG21 ILE 61 -8.791 11.943 -2.817 784 HG22 ILE 61 HG22 ILE 61 -9.590 10.353 -2.753 785 HG23 ILE 61 HG23 ILE 61 -10.489 11.768 -3.309 786 HD11 ILE 61 HD11 ILE 61 -8.246 9.353 0.530 787 HD12 ILE 61 HD12 ILE 61 -9.949 9.228 0.042 788 HD13 ILE 61 HD13 ILE 61 -8.669 9.326 -1.192 789 H GLN 62 H GLN 62 -9.407 14.559 -2.865 790 HA GLN 62 HA GLN 62 -11.976 14.843 -4.363 791 HB2 GLN 62 HB2 GLN 62 -9.766 16.913 -4.197 792 HB3 GLN 62 HB3 GLN 62 -11.394 17.120 -4.846 793 HG2 GLN 62 HG2 GLN 62 -10.689 16.635 -1.914 794 HG3 GLN 62 HG3 GLN 62 -11.011 18.198 -2.614 795 HE21 GLN 62 HE21 GLN 62 -12.454 16.703 -0.451 796 HE22 GLN 62 HE22 GLN 62 -14.123 16.628 -0.983 797 H LYS 63 H LYS 63 -11.215 15.798 -6.678 798 HA LYS 63 HA LYS 63 -9.699 13.754 -7.929 799 HB2 LYS 63 HB2 LYS 63 -9.930 15.126 -9.875 800 HB3 LYS 63 HB3 LYS 63 -11.437 15.205 -8.946 801 HG2 LYS 63 HG2 LYS 63 -10.589 17.370 -7.918 802 HG3 LYS 63 HG3 LYS 63 -9.282 17.350 -9.125 803 HD2 LYS 63 HD2 LYS 63 -12.262 17.222 -9.728 804 HD3 LYS 63 HD3 LYS 63 -11.284 18.704 -9.827 805 HE2 LYS 63 HE2 LYS 63 -10.705 16.180 -11.420 806 HE3 LYS 63 HE3 LYS 63 -11.720 17.500 -12.022 807 HZ1 LYS 63 HZ1 LYS 63 -9.496 17.771 -12.788 808 HZ2 LYS 63 HZ2 LYS 63 -9.861 18.991 -11.754 809 HZ3 LYS 63 HZ3 LYS 63 -8.886 17.763 -11.267 810 H GLU 64 H GLU 64 -7.693 13.603 -8.661 811 HA GLU 64 HA GLU 64 -5.453 13.860 -8.749 812 HB2 GLU 64 HB2 GLU 64 -6.177 16.816 -8.789 813 HB3 GLU 64 HB3 GLU 64 -4.662 16.087 -9.357 814 HG2 GLU 64 HG2 GLU 64 -5.932 14.793 -11.056 815 HG3 GLU 64 HG3 GLU 64 -7.438 15.538 -10.492 816 H SER 65 H SER 65 -6.721 13.856 -5.981 817 HA SER 65 HA SER 65 -5.268 15.781 -4.423 818 HB2 SER 65 HB2 SER 65 -6.947 13.351 -3.742 819 HB3 SER 65 HB3 SER 65 -6.168 14.362 -2.509 820 HG SER 65 HG SER 65 -7.946 15.285 -4.514 821 H THR 66 H THR 66 -4.377 12.792 -5.751 822 HA THR 66 HA THR 66 -2.643 11.363 -5.557 823 HB THR 66 HB THR 66 -1.434 13.674 -4.042 824 HG1 THR 66 HG1 THR 66 -1.945 14.071 -6.190 825 HG21 THR 66 HG21 THR 66 -0.210 11.608 -3.475 826 HG22 THR 66 HG22 THR 66 -0.144 11.155 -5.196 827 HG23 THR 66 HG23 THR 66 0.745 12.581 -4.607 828 H LEU 67 H LEU 67 -2.334 9.579 -4.443 829 HA LEU 67 HA LEU 67 -2.833 9.514 -1.495 830 HB2 LEU 67 HB2 LEU 67 -4.072 7.943 -3.753 831 HB3 LEU 67 HB3 LEU 67 -3.745 7.123 -2.223 832 HG LEU 67 HG LEU 67 -5.056 8.931 -1.052 833 HD11 LEU 67 HD11 LEU 67 -6.797 10.049 -2.457 834 HD12 LEU 67 HD12 LEU 67 -5.166 10.647 -2.805 835 HD13 LEU 67 HD13 LEU 67 -5.936 9.497 -3.921 836 HD21 LEU 67 HD21 LEU 67 -5.873 6.657 -1.461 837 HD22 LEU 67 HD22 LEU 67 -7.187 7.835 -1.585 838 HD23 LEU 67 HD23 LEU 67 -6.471 7.138 -3.065 839 H HIS 68 H HIS 68 -2.180 7.089 -0.804 840 HA HIS 68 HA HIS 68 0.357 6.395 -2.176 841 HB2 HIS 68 HB2 HIS 68 0.015 6.756 0.819 842 HB3 HIS 68 HB3 HIS 68 1.499 6.272 -0.017 843 HD2 HIS 68 HD2 HIS 68 2.474 8.224 -1.844 844 HE1 HIS 68 HE1 HIS 68 0.807 11.491 0.311 845 HE2 HIS 68 HE2 HIS 68 2.483 10.825 -1.483 846 H LEU 69 H LEU 69 1.071 4.231 -1.791 847 HA LEU 69 HA LEU 69 -0.941 2.330 -0.715 848 HB2 LEU 69 HB2 LEU 69 -1.366 2.673 -3.137 849 HB3 LEU 69 HB3 LEU 69 0.343 2.366 -3.485 850 HG LEU 69 HG LEU 69 0.040 0.038 -2.538 851 HD11 LEU 69 HD11 LEU 69 -1.997 0.488 -1.187 852 HD12 LEU 69 HD12 LEU 69 -2.900 0.838 -2.682 853 HD13 LEU 69 HD13 LEU 69 -2.254 -0.799 -2.384 854 HD21 LEU 69 HD21 LEU 69 -0.003 0.482 -4.964 855 HD22 LEU 69 HD22 LEU 69 -1.154 -0.803 -4.530 856 HD23 LEU 69 HD23 LEU 69 -1.744 0.838 -4.874 857 H VAL 70 H VAL 70 0.065 0.458 0.197 858 HA VAL 70 HA VAL 70 2.997 0.242 -0.100 859 HB VAL 70 HB VAL 70 1.741 0.629 2.644 860 HG11 VAL 70 HG11 VAL 70 4.627 0.540 1.649 861 HG12 VAL 70 HG12 VAL 70 4.111 0.807 3.327 862 HG13 VAL 70 HG13 VAL 70 3.810 -0.759 2.554 863 HG21 VAL 70 HG21 VAL 70 3.387 2.580 0.978 864 HG22 VAL 70 HG22 VAL 70 1.678 2.784 1.449 865 HG23 VAL 70 HG23 VAL 70 2.943 2.791 2.688 866 H LEU 71 H LEU 71 1.944 -1.626 -1.237 867 HA LEU 71 HA LEU 71 0.386 -3.487 0.136 868 HB2 LEU 71 HB2 LEU 71 1.121 -5.076 -1.715 869 HB3 LEU 71 HB3 LEU 71 0.312 -3.575 -2.154 870 HG LEU 71 HG LEU 71 2.495 -2.552 -2.756 871 HD11 LEU 71 HD11 LEU 71 3.598 -5.331 -2.148 872 HD12 LEU 71 HD12 LEU 71 4.465 -4.062 -3.043 873 HD13 LEU 71 HD13 LEU 71 4.057 -3.811 -1.338 874 HD21 LEU 71 HD21 LEU 71 1.106 -3.723 -4.424 875 HD22 LEU 71 HD22 LEU 71 2.840 -3.894 -4.788 876 HD23 LEU 71 HD23 LEU 71 1.950 -5.250 -4.059 877 H ARG 72 H ARG 72 0.860 -5.788 0.469 878 HA ARG 72 HA ARG 72 2.770 -5.946 2.625 879 HB2 ARG 72 HB2 ARG 72 1.095 -8.138 1.331 880 HB3 ARG 72 HB3 ARG 72 1.923 -8.236 2.888 881 HG2 ARG 72 HG2 ARG 72 -0.547 -6.731 2.190 882 HG3 ARG 72 HG3 ARG 72 -0.150 -7.794 3.570 883 HD2 ARG 72 HD2 ARG 72 1.434 -5.989 4.368 884 HD3 ARG 72 HD3 ARG 72 0.781 -4.938 3.097 885 HE ARG 72 HE ARG 72 -1.468 -5.249 4.177 886 HH11 ARG 72 HH11 ARG 72 1.471 -5.695 6.106 887 HH12 ARG 72 HH12 ARG 72 0.677 -5.302 7.611 888 HH21 ARG 72 HH21 ARG 72 -2.469 -4.749 6.163 889 HH22 ARG 72 HH22 ARG 72 -1.539 -4.777 7.642 890 H LEU 73 H LEU 73 3.609 -8.482 2.619 891 HA LEU 73 HA LEU 73 5.888 -8.267 0.747 892 HB2 LEU 73 HB2 LEU 73 6.085 -8.200 3.354 893 HB3 LEU 73 HB3 LEU 73 5.719 -9.926 3.305 894 HG LEU 73 HG LEU 73 7.758 -10.219 1.803 895 HD11 LEU 73 HD11 LEU 73 8.239 -7.324 2.650 896 HD12 LEU 73 HD12 LEU 73 9.415 -8.375 1.827 897 HD13 LEU 73 HD13 LEU 73 7.928 -7.875 0.992 898 HD21 LEU 73 HD21 LEU 73 8.203 -8.933 4.536 899 HD22 LEU 73 HD22 LEU 73 7.819 -10.647 4.248 900 HD23 LEU 73 HD23 LEU 73 9.358 -9.974 3.669 901 H ARG 74 H ARG 74 3.215 -9.473 0.361 902 HA ARG 74 HA ARG 74 2.151 -11.195 -0.639 903 HB2 ARG 74 HB2 ARG 74 4.018 -10.953 -2.218 904 HB3 ARG 74 HB3 ARG 74 4.959 -12.148 -1.320 905 HG2 ARG 74 HG2 ARG 74 3.896 -13.135 -3.322 906 HG3 ARG 74 HG3 ARG 74 3.347 -13.905 -1.828 907 HD2 ARG 74 HD2 ARG 74 1.282 -12.514 -1.879 908 HD3 ARG 74 HD3 ARG 74 1.844 -11.759 -3.382 909 HE ARG 74 HE ARG 74 1.233 -13.661 -4.560 910 HH11 ARG 74 HH11 ARG 74 1.180 -14.375 -1.086 911 HH12 ARG 74 HH12 ARG 74 0.376 -15.912 -1.306 912 HH21 ARG 74 HH21 ARG 74 0.179 -15.659 -4.799 913 HH22 ARG 74 HH22 ARG 74 -0.182 -16.639 -3.399 914 H GLY 75 H GLY 75 4.621 -12.069 1.649 915 HA2 GLY 75 HA2 GLY 75 3.319 -13.668 3.336 916 HA3 GLY 75 HA3 GLY 75 3.551 -14.780 1.960 917 H GLY 76 H GLY 76 6.116 -13.039 1.444 918 HA2 GLY 76 HA2 GLY 76 8.012 -13.264 3.448 919 HA3 GLY 76 HA3 GLY 76 7.949 -14.885 2.728 Start of MODEL 14 1 H LEU 491 H LEU 491 13.753 8.097 10.534 2 HA LEU 491 HA LEU 491 16.365 7.684 10.673 3 HB2 LEU 491 HB2 LEU 491 14.890 5.330 9.645 4 HB3 LEU 491 HB3 LEU 491 15.796 5.620 11.126 5 HG LEU 491 HG LEU 491 13.773 6.985 11.955 6 HD11 LEU 491 HD11 LEU 491 12.556 7.131 9.733 7 HD12 LEU 491 HD12 LEU 491 12.414 5.366 9.753 8 HD13 LEU 491 HD13 LEU 491 11.605 6.334 11.001 9 HD21 LEU 491 HD21 LEU 491 13.461 4.003 11.441 10 HD22 LEU 491 HD22 LEU 491 14.456 4.742 12.723 11 HD23 LEU 491 HD23 LEU 491 12.686 4.948 12.729 12 HA PRO 492 HA PRO 492 18.018 7.529 6.502 13 HB2 PRO 492 HB2 PRO 492 20.522 6.778 7.142 14 HB3 PRO 492 HB3 PRO 492 19.869 8.350 7.699 15 HG2 PRO 492 HG2 PRO 492 20.108 5.774 9.251 16 HG3 PRO 492 HG3 PRO 492 20.526 7.433 9.779 17 HD2 PRO 492 HD2 PRO 492 18.112 6.146 10.337 18 HD3 PRO 492 HD3 PRO 492 18.263 7.912 10.279 19 H LEU 493 H LEU 493 19.768 5.735 5.581 20 HA LEU 493 HA LEU 493 18.307 3.379 5.071 21 HB2 LEU 493 HB2 LEU 493 20.391 4.861 4.019 22 HB3 LEU 493 HB3 LEU 493 21.287 3.509 4.673 23 HG LEU 493 HG LEU 493 18.918 3.371 2.751 24 HD11 LEU 493 HD11 LEU 493 20.599 2.757 1.034 25 HD12 LEU 493 HD12 LEU 493 20.917 4.364 1.715 26 HD13 LEU 493 HD13 LEU 493 21.894 2.966 2.235 27 HD21 LEU 493 HD21 LEU 493 19.557 1.008 2.380 28 HD22 LEU 493 HD22 LEU 493 20.832 1.152 3.611 29 HD23 LEU 493 HD23 LEU 493 19.121 1.286 4.079 30 H GLN 494 H GLN 494 18.648 3.714 7.863 31 HA GLN 494 HA GLN 494 20.669 1.984 8.864 32 HB2 GLN 494 HB2 GLN 494 19.531 2.393 10.988 33 HB3 GLN 494 HB3 GLN 494 19.625 3.886 10.020 34 HG2 GLN 494 HG2 GLN 494 17.502 4.137 10.595 35 HG3 GLN 494 HG3 GLN 494 17.230 3.129 9.178 36 HE21 GLN 494 HE21 GLN 494 15.218 3.224 10.782 37 HE22 GLN 494 HE22 GLN 494 15.046 1.767 11.758 38 H ALA 495 H ALA 495 17.384 1.503 7.713 39 HA ALA 495 HA ALA 495 17.682 -1.402 8.113 40 HB1 ALA 495 HB1 ALA 495 15.425 -1.516 9.242 41 HB2 ALA 495 HB2 ALA 495 16.673 -0.723 10.216 42 HB3 ALA 495 HB3 ALA 495 15.460 0.264 9.369 43 H LEU 496 H LEU 496 16.949 1.045 6.020 44 HA LEU 496 HA LEU 496 14.532 0.198 4.829 45 HB2 LEU 496 HB2 LEU 496 16.989 1.723 3.948 46 HB3 LEU 496 HB3 LEU 496 15.823 1.209 2.740 47 HG LEU 496 HG LEU 496 15.373 3.479 3.393 48 HD11 LEU 496 HD11 LEU 496 13.041 3.324 3.835 49 HD12 LEU 496 HD12 LEU 496 13.478 1.902 2.862 50 HD13 LEU 496 HD13 LEU 496 13.200 1.736 4.614 51 HD21 LEU 496 HD21 LEU 496 14.892 2.442 6.210 52 HD22 LEU 496 HD22 LEU 496 16.285 3.427 5.683 53 HD23 LEU 496 HD23 LEU 496 14.649 4.107 5.636 54 HA PRO 497 HA PRO 497 15.611 -3.616 2.741 55 HB2 PRO 497 HB2 PRO 497 13.844 -2.386 0.626 56 HB3 PRO 497 HB3 PRO 497 13.797 -4.054 1.277 57 HG2 PRO 497 HG2 PRO 497 11.974 -2.245 2.101 58 HG3 PRO 497 HG3 PRO 497 12.780 -3.305 3.313 59 HD2 PRO 497 HD2 PRO 497 13.428 -0.436 2.590 60 HD3 PRO 497 HD3 PRO 497 13.293 -1.187 4.213 61 H GLU 498 H GLU 498 16.805 -4.284 0.811 62 HA GLU 498 HA GLU 498 18.461 -2.151 -0.292 63 HB2 GLU 498 HB2 GLU 498 19.312 -4.430 0.418 64 HB3 GLU 498 HB3 GLU 498 18.479 -5.119 -0.995 65 HG2 GLU 498 HG2 GLU 498 19.834 -3.740 -2.507 66 HG3 GLU 498 HG3 GLU 498 20.482 -2.835 -1.138 67 H GLY 499 H GLY 499 16.290 -1.308 -0.967 68 HA2 GLY 499 HA2 GLY 499 16.125 -1.198 -3.781 69 HA3 GLY 499 HA3 GLY 499 14.940 -2.398 -3.203 70 H VAL 500 H VAL 500 15.803 0.400 -1.199 71 HA VAL 500 HA VAL 500 13.381 1.888 -1.988 72 HB VAL 500 HB VAL 500 13.857 0.772 0.810 73 HG11 VAL 500 HG11 VAL 500 11.658 2.582 -0.276 74 HG12 VAL 500 HG12 VAL 500 11.595 1.758 1.294 75 HG13 VAL 500 HG13 VAL 500 12.826 2.992 1.003 76 HG21 VAL 500 HG21 VAL 500 11.649 0.217 -1.216 77 HG22 VAL 500 HG22 VAL 500 12.917 -0.927 -0.706 78 HG23 VAL 500 HG23 VAL 500 11.697 -0.384 0.457 79 H ASP 501 H ASP 501 13.315 4.011 -0.855 80 HA ASP 501 HA ASP 501 15.933 4.920 0.277 81 HB2 ASP 501 HB2 ASP 501 15.445 5.472 -2.256 82 HB3 ASP 501 HB3 ASP 501 14.287 6.620 -1.603 83 H GLN 502 H GLN 502 15.783 6.397 1.857 84 HA GLN 502 HA GLN 502 13.413 6.503 3.419 85 HB2 GLN 502 HB2 GLN 502 14.743 8.499 4.472 86 HB3 GLN 502 HB3 GLN 502 15.289 6.842 4.694 87 HG2 GLN 502 HG2 GLN 502 16.314 8.489 2.366 88 HG3 GLN 502 HG3 GLN 502 16.997 8.682 3.989 89 HE21 GLN 502 HE21 GLN 502 16.029 5.456 3.737 90 HE22 GLN 502 HE22 GLN 502 17.575 4.784 3.256 91 H GLU 503 H GLU 503 14.588 8.579 0.767 92 HA GLU 503 HA GLU 503 12.812 10.745 1.399 93 HB2 GLU 503 HB2 GLU 503 13.466 11.689 -0.682 94 HB3 GLU 503 HB3 GLU 503 14.902 10.868 -0.031 95 HG2 GLU 503 HG2 GLU 503 14.303 8.878 -1.476 96 HG3 GLU 503 HG3 GLU 503 12.997 9.829 -2.180 97 H VAL 504 H VAL 504 12.067 7.639 0.447 98 HA VAL 504 HA VAL 504 9.402 8.547 -0.438 99 HB VAL 504 HB VAL 504 10.817 8.004 -2.389 100 HG11 VAL 504 HG11 VAL 504 10.648 5.147 -1.340 101 HG12 VAL 504 HG12 VAL 504 11.226 5.628 -2.948 102 HG13 VAL 504 HG13 VAL 504 12.125 6.130 -1.512 103 HG21 VAL 504 HG21 VAL 504 9.113 6.751 -3.574 104 HG22 VAL 504 HG22 VAL 504 8.406 6.179 -2.051 105 HG23 VAL 504 HG23 VAL 504 8.349 7.910 -2.464 106 H PHE 505 H PHE 505 10.850 7.415 2.021 107 HA PHE 505 HA PHE 505 8.821 5.314 2.623 108 HB2 PHE 505 HB2 PHE 505 10.671 4.012 2.724 109 HB3 PHE 505 HB3 PHE 505 11.762 5.377 2.881 110 HD1 PHE 505 HD1 PHE 505 12.072 6.508 5.122 111 HD2 PHE 505 HD2 PHE 505 10.087 2.726 4.655 112 HE1 PHE 505 HE1 PHE 505 12.568 5.954 7.497 113 HE2 PHE 505 HE2 PHE 505 10.594 2.187 7.051 114 HZ PHE 505 HZ PHE 505 11.814 3.766 8.435 115 H LYS 506 H LYS 506 10.412 8.322 3.502 116 HA LYS 506 HA LYS 506 9.301 8.494 6.159 117 HB2 LYS 506 HB2 LYS 506 10.415 10.531 4.205 118 HB3 LYS 506 HB3 LYS 506 9.833 10.959 5.827 119 HG2 LYS 506 HG2 LYS 506 11.401 9.375 6.855 120 HG3 LYS 506 HG3 LYS 506 12.018 8.907 5.265 121 HD2 LYS 506 HD2 LYS 506 12.134 11.713 6.429 122 HD3 LYS 506 HD3 LYS 506 13.479 10.552 6.411 123 HE2 LYS 506 HE2 LYS 506 13.426 10.518 3.945 124 HE3 LYS 506 HE3 LYS 506 12.082 11.672 3.950 125 HZ1 LYS 506 HZ1 LYS 506 14.195 12.769 3.634 126 HZ2 LYS 506 HZ2 LYS 506 13.529 13.243 5.062 127 HZ3 LYS 506 HZ3 LYS 506 14.768 12.170 5.055 128 H GLN 507 H GLN 507 7.660 8.095 3.407 129 HA GLN 507 HA GLN 507 5.656 10.221 3.713 130 HB2 GLN 507 HB2 GLN 507 5.290 7.816 1.949 131 HB3 GLN 507 HB3 GLN 507 4.829 9.498 1.663 132 HG2 GLN 507 HG2 GLN 507 7.596 8.246 1.487 133 HG3 GLN 507 HG3 GLN 507 6.626 8.866 0.159 134 HE21 GLN 507 HE21 GLN 507 9.396 9.580 1.022 135 HE22 GLN 507 HE22 GLN 507 9.365 11.285 1.342 136 H LEU 508 H LEU 508 6.310 7.728 5.591 137 HA LEU 508 HA LEU 508 3.580 6.505 5.698 138 HB2 LEU 508 HB2 LEU 508 6.256 5.431 6.647 139 HB3 LEU 508 HB3 LEU 508 4.739 4.535 6.565 140 HG LEU 508 HG LEU 508 6.247 5.646 4.150 141 HD11 LEU 508 HD11 LEU 508 6.883 3.308 3.759 142 HD12 LEU 508 HD12 LEU 508 7.522 3.873 5.315 143 HD13 LEU 508 HD13 LEU 508 6.094 2.822 5.282 144 HD21 LEU 508 HD21 LEU 508 3.895 3.728 4.401 145 HD22 LEU 508 HD22 LEU 508 3.827 5.387 3.760 146 HD23 LEU 508 HD23 LEU 508 4.740 4.137 2.889 147 HA PRO 509 HA PRO 509 3.551 7.677 10.075 148 HB2 PRO 509 HB2 PRO 509 1.901 5.739 11.080 149 HB3 PRO 509 HB3 PRO 509 1.303 7.119 10.121 150 HG2 PRO 509 HG2 PRO 509 1.921 4.291 9.208 151 HG3 PRO 509 HG3 PRO 509 0.468 5.272 8.816 152 HD2 PRO 509 HD2 PRO 509 2.605 5.019 7.107 153 HD3 PRO 509 HD3 PRO 509 1.657 6.533 7.223 154 H ALA 510 H ALA 510 4.168 6.746 12.127 155 HA ALA 510 HA ALA 510 6.468 5.131 12.053 156 HB1 ALA 510 HB1 ALA 510 5.880 6.769 13.796 157 HB2 ALA 510 HB2 ALA 510 4.497 5.770 14.280 158 HB3 ALA 510 HB3 ALA 510 6.159 5.164 14.530 159 H ASP 511 H ASP 511 3.113 4.199 11.979 160 HA ASP 511 HA ASP 511 3.634 1.514 13.061 161 HB2 ASP 511 HB2 ASP 511 1.555 2.826 13.588 162 HB3 ASP 511 HB3 ASP 511 1.115 2.771 11.876 163 H ILE 512 H ILE 512 4.007 3.034 10.051 164 HA ILE 512 HA ILE 512 3.932 0.323 8.807 165 HB ILE 512 HB ILE 512 3.531 2.996 7.433 166 HG12 ILE 512 HG12 ILE 512 1.659 0.669 8.079 167 HG13 ILE 512 HG13 ILE 512 1.581 2.309 8.738 168 HG21 ILE 512 HG21 ILE 512 3.082 1.623 5.422 169 HG22 ILE 512 HG22 ILE 512 4.725 1.345 5.996 170 HG23 ILE 512 HG23 ILE 512 3.459 0.143 6.340 171 HD11 ILE 512 HD11 ILE 512 1.059 1.485 5.855 172 HD12 ILE 512 HD12 ILE 512 -0.101 2.112 7.031 173 HD13 ILE 512 HD13 ILE 512 1.190 3.173 6.413 174 H GLN 513 H GLN 513 5.935 3.051 9.746 175 HA GLN 513 HA GLN 513 8.258 2.561 8.219 176 HB2 GLN 513 HB2 GLN 513 7.554 3.553 10.938 177 HB3 GLN 513 HB3 GLN 513 9.117 2.724 10.885 178 HG2 GLN 513 HG2 GLN 513 9.336 5.147 10.594 179 HG3 GLN 513 HG3 GLN 513 10.003 4.180 9.273 180 HE21 GLN 513 HE21 GLN 513 9.449 4.669 7.232 181 HE22 GLN 513 HE22 GLN 513 8.121 5.705 6.775 182 H GLU 514 H GLU 514 7.042 0.860 11.152 183 HA GLU 514 HA GLU 514 9.135 -1.022 11.290 184 HB2 GLU 514 HB2 GLU 514 7.651 -2.243 12.801 185 HB3 GLU 514 HB3 GLU 514 7.555 -0.498 13.117 186 HG2 GLU 514 HG2 GLU 514 5.478 -0.342 11.829 187 HG3 GLU 514 HG3 GLU 514 5.552 -2.074 11.458 188 H GLU 515 H GLU 515 6.614 -0.811 8.954 189 HA GLU 515 HA GLU 515 6.681 -3.685 8.313 190 HB2 GLU 515 HB2 GLU 515 5.378 -1.336 6.873 191 HB3 GLU 515 HB3 GLU 515 5.137 -3.041 6.503 192 HG2 GLU 515 HG2 GLU 515 4.493 -1.854 9.238 193 HG3 GLU 515 HG3 GLU 515 3.336 -1.880 7.905 194 H ILE 516 H ILE 516 8.441 -0.785 7.423 195 HA ILE 516 HA ILE 516 9.352 -2.103 4.903 196 HB ILE 516 HB ILE 516 10.164 0.666 5.726 197 HG12 ILE 516 HG12 ILE 516 7.825 0.900 6.017 198 HG13 ILE 516 HG13 ILE 516 8.265 1.621 4.469 199 HG21 ILE 516 HG21 ILE 516 9.616 -0.701 3.063 200 HG22 ILE 516 HG22 ILE 516 10.181 0.973 3.262 201 HG23 ILE 516 HG23 ILE 516 11.208 -0.381 3.777 202 HD11 ILE 516 HD11 ILE 516 6.991 -1.122 4.829 203 HD12 ILE 516 HD12 ILE 516 6.177 0.367 4.307 204 HD13 ILE 516 HD13 ILE 516 7.434 -0.370 3.275 205 H LEU 517 H LEU 517 10.459 -0.561 7.949 206 HA LEU 517 HA LEU 517 13.232 -1.194 7.631 207 HB2 LEU 517 HB2 LEU 517 11.467 -0.736 10.073 208 HB3 LEU 517 HB3 LEU 517 13.209 -0.950 10.158 209 HG LEU 517 HG LEU 517 13.400 1.278 9.985 210 HD11 LEU 517 HD11 LEU 517 12.406 1.085 7.162 211 HD12 LEU 517 HD12 LEU 517 13.411 2.362 7.916 212 HD13 LEU 517 HD13 LEU 517 14.063 0.743 7.725 213 HD21 LEU 517 HD21 LEU 517 10.696 1.840 8.960 214 HD22 LEU 517 HD22 LEU 517 10.950 1.253 10.629 215 HD23 LEU 517 HD23 LEU 517 11.755 2.723 10.096 216 H SER 518 H SER 518 10.491 -3.126 8.057 217 HA SER 518 HA SER 518 11.458 -5.314 9.566 218 HB2 SER 518 HB2 SER 518 9.113 -5.049 8.849 219 HB3 SER 518 HB3 SER 518 9.593 -5.300 7.157 220 HG SER 518 HG SER 518 8.840 -7.220 8.181 221 H GLY 519 H GLY 519 11.985 -4.451 6.105 222 HA2 GLY 519 HA2 GLY 519 14.141 -4.951 5.161 223 HA3 GLY 519 HA3 GLY 519 14.230 -6.425 6.139 224 H LYS 520 H LYS 520 11.467 -5.231 4.136 225 HA LYS 520 HA LYS 520 10.820 -7.733 3.101 226 HB2 LYS 520 HB2 LYS 520 10.251 -4.922 2.096 227 HB3 LYS 520 HB3 LYS 520 9.398 -6.384 1.579 228 HG2 LYS 520 HG2 LYS 520 8.773 -6.794 4.000 229 HG3 LYS 520 HG3 LYS 520 9.440 -5.193 4.379 230 HD2 LYS 520 HD2 LYS 520 7.196 -5.771 2.404 231 HD3 LYS 520 HD3 LYS 520 6.987 -5.111 4.038 232 HE2 LYS 520 HE2 LYS 520 8.288 -3.119 3.434 233 HE3 LYS 520 HE3 LYS 520 8.612 -3.792 1.830 234 HZ1 LYS 520 HZ1 LYS 520 5.969 -3.043 2.880 235 HZ2 LYS 520 HZ2 LYS 520 6.833 -2.249 1.717 236 HZ3 LYS 520 HZ3 LYS 520 6.241 -3.742 1.412 237 H SER 521 H SER 521 10.506 -7.959 0.764 238 HA SER 521 HA SER 521 12.933 -7.494 -0.887 239 HB2 SER 521 HB2 SER 521 11.905 -10.230 -0.022 240 HB3 SER 521 HB3 SER 521 13.104 -9.936 -1.303 241 HG SER 521 HG SER 521 14.083 -10.385 0.732 242 H ARG 522 H ARG 522 10.210 -6.580 -1.153 243 HA ARG 522 HA ARG 522 9.364 -7.977 -3.629 244 HB2 ARG 522 HB2 ARG 522 8.120 -8.211 -1.194 245 HB3 ARG 522 HB3 ARG 522 7.317 -6.765 -1.815 246 HG2 ARG 522 HG2 ARG 522 5.953 -8.456 -2.654 247 HG3 ARG 522 HG3 ARG 522 7.082 -8.201 -4.013 248 HD2 ARG 522 HD2 ARG 522 7.440 -10.275 -1.812 249 HD3 ARG 522 HD3 ARG 522 6.666 -10.637 -3.365 250 HE ARG 522 HE ARG 522 9.538 -10.007 -2.887 251 HH11 ARG 522 HH11 ARG 522 7.015 -11.042 -5.158 252 HH12 ARG 522 HH12 ARG 522 8.178 -11.540 -6.369 253 HH21 ARG 522 HH21 ARG 522 10.989 -10.691 -4.455 254 HH22 ARG 522 HH22 ARG 522 10.407 -11.392 -5.952 255 H GLU 523 H GLU 523 10.864 -5.371 -2.809 256 HA GLU 523 HA GLU 523 9.440 -3.585 -4.652 257 HB2 GLU 523 HB2 GLU 523 9.596 -1.726 -2.918 258 HB3 GLU 523 HB3 GLU 523 8.376 -2.979 -2.645 259 HG2 GLU 523 HG2 GLU 523 10.034 -4.134 -1.095 260 HG3 GLU 523 HG3 GLU 523 11.053 -2.691 -1.234 261 H ASN 524 H ASN 524 10.816 -2.033 -5.582 262 HA ASN 524 HA ASN 524 13.714 -2.227 -5.044 263 HB2 ASN 524 HB2 ASN 524 12.357 -3.189 -7.612 264 HB3 ASN 524 HB3 ASN 524 14.101 -2.961 -7.414 265 HD21 ASN 524 HD21 ASN 524 11.274 -4.890 -6.347 266 HD22 ASN 524 HD22 ASN 524 12.211 -6.264 -5.807 267 H LEU 525 H LEU 525 11.974 -0.086 -4.813 268 HA LEU 525 HA LEU 525 11.524 2.008 -5.470 269 HB2 LEU 525 HB2 LEU 525 13.358 3.414 -5.771 270 HB3 LEU 525 HB3 LEU 525 13.698 2.217 -4.525 271 HG LEU 525 HG LEU 525 14.617 1.583 -7.322 272 HD11 LEU 525 HD11 LEU 525 15.144 3.969 -7.068 273 HD12 LEU 525 HD12 LEU 525 15.899 3.657 -5.492 274 HD13 LEU 525 HD13 LEU 525 16.636 2.988 -6.976 275 HD21 LEU 525 HD21 LEU 525 15.916 1.421 -4.571 276 HD22 LEU 525 HD22 LEU 525 14.916 0.135 -5.278 277 HD23 LEU 525 HD23 LEU 525 16.463 0.597 -6.054 278 H LYS 526 H LYS 526 11.211 -0.032 -7.669 279 HA LYS 526 HA LYS 526 11.018 1.863 -9.949 280 HB2 LYS 526 HB2 LYS 526 12.269 -0.901 -9.816 281 HB3 LYS 526 HB3 LYS 526 11.830 -0.138 -11.367 282 HG2 LYS 526 HG2 LYS 526 13.351 1.702 -10.952 283 HG3 LYS 526 HG3 LYS 526 13.769 1.067 -9.345 284 HD2 LYS 526 HD2 LYS 526 14.162 -0.509 -11.909 285 HD3 LYS 526 HD3 LYS 526 15.423 0.522 -11.196 286 HE2 LYS 526 HE2 LYS 526 15.367 -0.787 -9.121 287 HE3 LYS 526 HE3 LYS 526 14.067 -1.805 -9.751 288 HZ1 LYS 526 HZ1 LYS 526 16.752 -1.573 -10.935 289 HZ2 LYS 526 HZ2 LYS 526 16.226 -2.820 -10.002 290 HZ3 LYS 526 HZ3 LYS 526 15.541 -2.548 -11.473 291 H1 MET 1 H1 MET 1 -11.178 13.604 -13.046 292 H2 MET 1 H2 MET 1 -12.597 14.351 -12.689 293 H3 MET 1 H3 MET 1 -12.596 12.781 -13.186 294 HA MET 1 HA MET 1 -11.415 13.777 -10.687 295 HB2 MET 1 HB2 MET 1 -13.874 13.806 -10.578 296 HB3 MET 1 HB3 MET 1 -13.944 12.149 -11.214 297 HG2 MET 1 HG2 MET 1 -14.273 12.123 -8.818 298 HG3 MET 1 HG3 MET 1 -12.754 11.322 -9.223 299 HE1 MET 1 HE1 MET 1 -13.706 12.249 -6.303 300 HE2 MET 1 HE2 MET 1 -12.194 11.382 -6.633 301 HE3 MET 1 HE3 MET 1 -12.169 12.867 -5.658 302 H GLN 2 H GLN 2 -9.656 12.744 -10.259 303 HA GLN 2 HA GLN 2 -9.689 9.859 -10.067 304 HB2 GLN 2 HB2 GLN 2 -7.880 9.445 -11.632 305 HB3 GLN 2 HB3 GLN 2 -9.124 10.376 -12.496 306 HG2 GLN 2 HG2 GLN 2 -7.718 12.438 -11.611 307 HG3 GLN 2 HG3 GLN 2 -6.445 11.270 -11.394 308 HE21 GLN 2 HE21 GLN 2 -5.115 12.262 -13.005 309 HE22 GLN 2 HE22 GLN 2 -5.499 12.175 -14.714 310 H ILE 3 H ILE 3 -7.402 9.166 -9.303 311 HA ILE 3 HA ILE 3 -6.030 11.314 -7.781 312 HB ILE 3 HB ILE 3 -6.078 10.165 -5.730 313 HG12 ILE 3 HG12 ILE 3 -6.877 7.777 -7.341 314 HG13 ILE 3 HG13 ILE 3 -5.774 7.943 -5.994 315 HG21 ILE 3 HG21 ILE 3 -8.874 10.046 -6.898 316 HG22 ILE 3 HG22 ILE 3 -8.439 10.213 -5.176 317 HG23 ILE 3 HG23 ILE 3 -8.040 11.507 -6.309 318 HD11 ILE 3 HD11 ILE 3 -7.692 6.614 -5.323 319 HD12 ILE 3 HD12 ILE 3 -7.733 8.154 -4.438 320 HD13 ILE 3 HD13 ILE 3 -8.808 7.895 -5.834 321 H PHE 4 H PHE 4 -4.042 10.094 -6.567 322 HA PHE 4 HA PHE 4 -2.775 8.292 -8.567 323 HB2 PHE 4 HB2 PHE 4 -1.460 10.704 -7.271 324 HB3 PHE 4 HB3 PHE 4 -0.736 9.601 -8.406 325 HD1 PHE 4 HD1 PHE 4 -1.839 9.444 -10.791 326 HD2 PHE 4 HD2 PHE 4 -2.597 12.652 -8.022 327 HE1 PHE 4 HE1 PHE 4 -2.512 10.906 -12.669 328 HE2 PHE 4 HE2 PHE 4 -3.224 14.123 -9.920 329 HZ PHE 4 HZ PHE 4 -3.195 13.251 -12.234 330 H VAL 5 H VAL 5 -2.497 6.478 -7.466 331 HA VAL 5 HA VAL 5 -2.176 6.606 -4.530 332 HB VAL 5 HB VAL 5 -2.742 4.199 -4.617 333 HG11 VAL 5 HG11 VAL 5 -4.690 6.037 -6.104 334 HG12 VAL 5 HG12 VAL 5 -5.100 4.564 -5.200 335 HG13 VAL 5 HG13 VAL 5 -4.463 5.975 -4.341 336 HG21 VAL 5 HG21 VAL 5 -1.929 3.699 -6.935 337 HG22 VAL 5 HG22 VAL 5 -3.605 3.206 -6.652 338 HG23 VAL 5 HG23 VAL 5 -3.260 4.689 -7.579 339 H LYS 6 H LYS 6 0.068 7.431 -4.793 340 HA LYS 6 HA LYS 6 1.994 6.040 -6.265 341 HB2 LYS 6 HB2 LYS 6 2.044 8.436 -5.345 342 HB3 LYS 6 HB3 LYS 6 2.614 7.723 -3.816 343 HG2 LYS 6 HG2 LYS 6 4.509 6.665 -5.044 344 HG3 LYS 6 HG3 LYS 6 3.875 7.340 -6.566 345 HD2 LYS 6 HD2 LYS 6 5.684 8.720 -5.872 346 HD3 LYS 6 HD3 LYS 6 4.172 9.627 -5.653 347 HE2 LYS 6 HE2 LYS 6 4.203 9.029 -3.228 348 HE3 LYS 6 HE3 LYS 6 5.713 8.138 -3.482 349 HZ1 LYS 6 HZ1 LYS 6 6.740 10.199 -4.162 350 HZ2 LYS 6 HZ2 LYS 6 5.338 11.025 -3.926 351 HZ3 LYS 6 HZ3 LYS 6 6.120 10.350 -2.649 352 H THR 7 H THR 7 3.354 4.392 -5.893 353 HA THR 7 HA THR 7 2.741 2.664 -3.664 354 HB THR 7 HB THR 7 4.422 1.168 -4.751 355 HG1 THR 7 HG1 THR 7 5.564 1.936 -6.488 356 HG21 THR 7 HG21 THR 7 3.326 0.893 -6.918 357 HG22 THR 7 HG22 THR 7 2.107 1.255 -5.672 358 HG23 THR 7 HG23 THR 7 2.620 2.520 -6.809 359 H LEU 8 H LEU 8 4.724 1.533 -2.585 360 HA LEU 8 HA LEU 8 6.196 3.393 -1.009 361 HB2 LEU 8 HB2 LEU 8 5.471 1.075 -0.438 362 HB3 LEU 8 HB3 LEU 8 6.658 0.425 -1.555 363 HG LEU 8 HG LEU 8 7.180 0.376 0.917 364 HD11 LEU 8 HD11 LEU 8 9.352 1.832 -0.608 365 HD12 LEU 8 HD12 LEU 8 9.500 0.622 0.672 366 HD13 LEU 8 HD13 LEU 8 8.909 0.132 -0.924 367 HD21 LEU 8 HD21 LEU 8 7.766 3.328 0.512 368 HD22 LEU 8 HD22 LEU 8 6.422 2.659 1.475 369 HD23 LEU 8 HD23 LEU 8 8.106 2.372 1.969 370 H THR 9 H THR 9 6.742 2.072 -4.216 371 HA THR 9 HA THR 9 9.667 2.359 -4.049 372 HB THR 9 HB THR 9 9.585 1.471 -6.373 373 HG1 THR 9 HG1 THR 9 7.581 0.822 -7.175 374 HG21 THR 9 HG21 THR 9 7.901 -0.120 -4.387 375 HG22 THR 9 HG22 THR 9 8.755 -0.784 -5.797 376 HG23 THR 9 HG23 THR 9 9.681 -0.089 -4.448 377 H GLY 10 H GLY 10 6.840 4.075 -5.191 378 HA2 GLY 10 HA2 GLY 10 7.073 6.462 -5.262 379 HA3 GLY 10 HA3 GLY 10 8.667 6.265 -6.060 380 H LYS 11 H LYS 11 6.473 4.051 -7.296 381 HA LYS 11 HA LYS 11 5.885 5.626 -9.707 382 HB2 LYS 11 HB2 LYS 11 6.492 3.184 -9.528 383 HB3 LYS 11 HB3 LYS 11 4.910 2.893 -8.780 384 HG2 LYS 11 HG2 LYS 11 3.791 3.955 -10.791 385 HG3 LYS 11 HG3 LYS 11 5.379 4.025 -11.573 386 HD2 LYS 11 HD2 LYS 11 4.094 2.107 -12.360 387 HD3 LYS 11 HD3 LYS 11 5.517 1.550 -11.441 388 HE2 LYS 11 HE2 LYS 11 4.061 1.200 -9.458 389 HE3 LYS 11 HE3 LYS 11 2.670 1.798 -10.377 390 HZ1 LYS 11 HZ1 LYS 11 4.257 -0.604 -11.020 391 HZ2 LYS 11 HZ2 LYS 11 2.742 -0.599 -10.389 392 HZ3 LYS 11 HZ3 LYS 11 2.993 -0.043 -11.907 393 H THR 12 H THR 12 3.644 6.155 -10.351 394 HA THR 12 HA THR 12 1.651 5.653 -8.203 395 HB THR 12 HB THR 12 2.633 8.141 -8.458 396 HG1 THR 12 HG1 THR 12 0.777 8.672 -7.377 397 HG21 THR 12 HG21 THR 12 1.722 8.415 -10.807 398 HG22 THR 12 HG22 THR 12 0.087 8.140 -10.127 399 HG23 THR 12 HG23 THR 12 1.029 9.551 -9.622 400 H ILE 13 H ILE 13 -0.580 5.716 -8.966 401 HA ILE 13 HA ILE 13 -0.812 4.989 -11.854 402 HB ILE 13 HB ILE 13 -2.010 3.449 -9.523 403 HG12 ILE 13 HG12 ILE 13 0.391 2.734 -11.283 404 HG13 ILE 13 HG13 ILE 13 0.445 3.173 -9.568 405 HG21 ILE 13 HG21 ILE 13 -1.832 2.777 -12.491 406 HG22 ILE 13 HG22 ILE 13 -2.646 1.814 -11.235 407 HG23 ILE 13 HG23 ILE 13 -3.284 3.406 -11.676 408 HD11 ILE 13 HD11 ILE 13 -0.997 1.215 -9.030 409 HD12 ILE 13 HD12 ILE 13 -0.900 0.713 -10.738 410 HD13 ILE 13 HD13 ILE 13 0.568 0.780 -9.742 411 H THR 14 H THR 14 -2.450 6.034 -12.811 412 HA THR 14 HA THR 14 -4.005 7.904 -11.217 413 HB THR 14 HB THR 14 -4.247 7.258 -14.186 414 HG1 THR 14 HG1 THR 14 -2.713 8.900 -14.443 415 HG21 THR 14 HG21 THR 14 -6.030 8.658 -13.191 416 HG22 THR 14 HG22 THR 14 -4.791 9.750 -12.523 417 HG23 THR 14 HG23 THR 14 -5.005 9.604 -14.288 418 H LEU 15 H LEU 15 -6.117 7.617 -10.532 419 HA LEU 15 HA LEU 15 -7.631 5.291 -11.632 420 HB2 LEU 15 HB2 LEU 15 -7.143 5.871 -8.684 421 HB3 LEU 15 HB3 LEU 15 -8.189 4.603 -9.333 422 HG LEU 15 HG LEU 15 -5.188 4.805 -9.791 423 HD11 LEU 15 HD11 LEU 15 -6.818 3.026 -7.930 424 HD12 LEU 15 HD12 LEU 15 -5.067 2.910 -8.208 425 HD13 LEU 15 HD13 LEU 15 -5.755 4.363 -7.433 426 HD21 LEU 15 HD21 LEU 15 -7.101 2.492 -10.334 427 HD22 LEU 15 HD22 LEU 15 -6.365 3.525 -11.573 428 HD23 LEU 15 HD23 LEU 15 -5.334 2.501 -10.538 429 H GLU 16 H GLU 16 -9.711 5.665 -11.868 430 HA GLU 16 HA GLU 16 -10.786 8.300 -11.047 431 HB2 GLU 16 HB2 GLU 16 -11.052 7.700 -13.385 432 HB3 GLU 16 HB3 GLU 16 -11.673 6.095 -12.953 433 HG2 GLU 16 HG2 GLU 16 -13.652 7.078 -11.942 434 HG3 GLU 16 HG3 GLU 16 -13.063 8.714 -12.281 435 H VAL 17 H VAL 17 -12.143 8.539 -9.454 436 HA VAL 17 HA VAL 17 -13.776 6.292 -8.431 437 HB VAL 17 HB VAL 17 -13.085 6.797 -6.117 438 HG11 VAL 17 HG11 VAL 17 -10.695 6.069 -7.856 439 HG12 VAL 17 HG12 VAL 17 -10.918 5.692 -6.137 440 HG13 VAL 17 HG13 VAL 17 -11.982 4.947 -7.347 441 HG21 VAL 17 HG21 VAL 17 -10.933 8.522 -7.419 442 HG22 VAL 17 HG22 VAL 17 -12.300 9.117 -6.451 443 HG23 VAL 17 HG23 VAL 17 -11.044 8.115 -5.692 444 H GLU 18 H GLU 18 -15.156 7.256 -6.519 445 HA GLU 18 HA GLU 18 -15.929 10.088 -7.058 446 HB2 GLU 18 HB2 GLU 18 -17.738 7.684 -6.575 447 HB3 GLU 18 HB3 GLU 18 -18.288 9.354 -6.712 448 HG2 GLU 18 HG2 GLU 18 -16.881 7.775 -8.909 449 HG3 GLU 18 HG3 GLU 18 -18.624 8.016 -8.753 450 HA PRO 19 HA PRO 19 -15.762 10.513 -2.686 451 HB2 PRO 19 HB2 PRO 19 -18.510 11.710 -2.664 452 HB3 PRO 19 HB3 PRO 19 -16.973 12.386 -2.043 453 HG2 PRO 19 HG2 PRO 19 -18.064 13.284 -4.373 454 HG3 PRO 19 HG3 PRO 19 -16.288 13.084 -4.183 455 HD2 PRO 19 HD2 PRO 19 -18.251 11.240 -5.540 456 HD3 PRO 19 HD3 PRO 19 -16.611 11.746 -6.072 457 H SER 20 H SER 20 -17.820 8.293 -4.116 458 HA SER 20 HA SER 20 -18.911 7.380 -1.502 459 HB2 SER 20 HB2 SER 20 -20.178 7.280 -4.264 460 HB3 SER 20 HB3 SER 20 -20.852 6.553 -2.792 461 HG SER 20 HG SER 20 -20.963 8.631 -1.891 462 H ASP 21 H ASP 21 -16.784 6.778 -4.038 463 HA ASP 21 HA ASP 21 -17.038 3.849 -4.027 464 HB2 ASP 21 HB2 ASP 21 -14.989 5.747 -5.162 465 HB3 ASP 21 HB3 ASP 21 -14.968 3.997 -5.402 466 H THR 22 H THR 22 -16.897 3.720 -1.767 467 HA THR 22 HA THR 22 -14.702 4.681 -0.180 468 HB THR 22 HB THR 22 -16.663 4.244 0.989 469 HG1 THR 22 HG1 THR 22 -16.020 2.742 2.495 470 HG21 THR 22 HG21 THR 22 -17.767 2.042 1.114 471 HG22 THR 22 HG22 THR 22 -17.883 2.835 -0.463 472 HG23 THR 22 HG23 THR 22 -16.732 1.483 -0.228 473 H ILE 23 H ILE 23 -13.343 2.915 1.172 474 HA ILE 23 HA ILE 23 -11.351 2.309 -0.671 475 HB ILE 23 HB ILE 23 -11.660 0.970 2.029 476 HG12 ILE 23 HG12 ILE 23 -12.132 3.261 2.456 477 HG13 ILE 23 HG13 ILE 23 -10.464 2.954 2.955 478 HG21 ILE 23 HG21 ILE 23 -9.207 1.150 2.083 479 HG22 ILE 23 HG22 ILE 23 -9.767 0.204 0.690 480 HG23 ILE 23 HG23 ILE 23 -9.219 1.883 0.461 481 HD11 ILE 23 HD11 ILE 23 -11.369 4.343 0.389 482 HD12 ILE 23 HD12 ILE 23 -10.632 5.094 1.804 483 HD13 ILE 23 HD13 ILE 23 -9.667 3.977 0.810 484 H GLU 24 H GLU 24 -14.030 0.150 0.343 485 HA GLU 24 HA GLU 24 -12.700 -2.228 -0.594 486 HB2 GLU 24 HB2 GLU 24 -14.867 -3.275 -0.509 487 HB3 GLU 24 HB3 GLU 24 -14.678 -2.224 0.911 488 HG2 GLU 24 HG2 GLU 24 -16.002 -0.466 -0.242 489 HG3 GLU 24 HG3 GLU 24 -16.212 -1.537 -1.637 490 H ASN 25 H ASN 25 -14.166 0.460 -2.195 491 HA ASN 25 HA ASN 25 -14.497 -0.876 -4.756 492 HB2 ASN 25 HB2 ASN 25 -14.628 2.063 -3.975 493 HB3 ASN 25 HB3 ASN 25 -15.038 1.440 -5.543 494 HD21 ASN 25 HD21 ASN 25 -16.004 1.700 -2.280 495 HD22 ASN 25 HD22 ASN 25 -17.612 0.968 -2.432 496 H VAL 26 H VAL 26 -12.235 1.489 -3.189 497 HA VAL 26 HA VAL 26 -10.740 2.067 -5.550 498 HB VAL 26 HB VAL 26 -9.368 3.336 -4.211 499 HG11 VAL 26 HG11 VAL 26 -11.991 3.254 -2.688 500 HG12 VAL 26 HG12 VAL 26 -10.877 4.627 -2.857 501 HG13 VAL 26 HG13 VAL 26 -11.760 4.014 -4.279 502 HG21 VAL 26 HG21 VAL 26 -10.055 1.542 -1.887 503 HG22 VAL 26 HG22 VAL 26 -8.478 1.838 -2.632 504 HG23 VAL 26 HG23 VAL 26 -9.267 3.136 -1.713 505 H LYS 27 H LYS 27 -10.325 -0.301 -2.923 506 HA LYS 27 HA LYS 27 -7.871 -1.389 -3.706 507 HB2 LYS 27 HB2 LYS 27 -10.390 -2.564 -2.475 508 HB3 LYS 27 HB3 LYS 27 -8.936 -3.545 -2.740 509 HG2 LYS 27 HG2 LYS 27 -7.592 -2.054 -1.380 510 HG3 LYS 27 HG3 LYS 27 -8.943 -0.919 -1.194 511 HD2 LYS 27 HD2 LYS 27 -10.243 -2.601 0.022 512 HD3 LYS 27 HD3 LYS 27 -8.963 -3.813 -0.235 513 HE2 LYS 27 HE2 LYS 27 -7.366 -2.389 0.988 514 HE3 LYS 27 HE3 LYS 27 -8.623 -1.176 1.258 515 HZ1 LYS 27 HZ1 LYS 27 -9.868 -2.788 2.489 516 HZ2 LYS 27 HZ2 LYS 27 -8.723 -3.946 2.242 517 HZ3 LYS 27 HZ3 LYS 27 -8.374 -2.619 3.152 518 H ALA 28 H ALA 28 -11.105 -1.768 -5.214 519 HA ALA 28 HA ALA 28 -10.182 -3.905 -6.959 520 HB1 ALA 28 HB1 ALA 28 -12.323 -3.632 -8.070 521 HB2 ALA 28 HB2 ALA 28 -12.558 -3.668 -6.307 522 HB3 ALA 28 HB3 ALA 28 -12.633 -2.119 -7.193 523 H LYS 29 H LYS 29 -10.223 -0.352 -7.046 524 HA LYS 29 HA LYS 29 -9.788 -0.110 -9.885 525 HB2 LYS 29 HB2 LYS 29 -9.295 1.694 -7.503 526 HB3 LYS 29 HB3 LYS 29 -8.658 2.105 -9.093 527 HG2 LYS 29 HG2 LYS 29 -10.722 3.226 -8.807 528 HG3 LYS 29 HG3 LYS 29 -10.953 1.977 -10.051 529 HD2 LYS 29 HD2 LYS 29 -12.119 0.540 -8.473 530 HD3 LYS 29 HD3 LYS 29 -11.628 1.568 -7.129 531 HE2 LYS 29 HE2 LYS 29 -13.991 1.888 -7.723 532 HE3 LYS 29 HE3 LYS 29 -13.051 3.375 -7.864 533 HZ1 LYS 29 HZ1 LYS 29 -13.786 1.624 -10.117 534 HZ2 LYS 29 HZ2 LYS 29 -14.509 3.051 -9.740 535 HZ3 LYS 29 HZ3 LYS 29 -12.943 3.034 -10.230 536 H ILE 30 H ILE 30 -7.678 -0.705 -7.083 537 HA ILE 30 HA ILE 30 -5.233 -0.368 -8.672 538 HB ILE 30 HB ILE 30 -5.821 -1.299 -5.832 539 HG12 ILE 30 HG12 ILE 30 -4.567 1.245 -6.938 540 HG13 ILE 30 HG13 ILE 30 -6.252 1.105 -6.413 541 HG21 ILE 30 HG21 ILE 30 -3.118 -0.762 -7.145 542 HG22 ILE 30 HG22 ILE 30 -3.393 -1.142 -5.427 543 HG23 ILE 30 HG23 ILE 30 -3.730 -2.359 -6.655 544 HD11 ILE 30 HD11 ILE 30 -5.494 0.547 -4.120 545 HD12 ILE 30 HD12 ILE 30 -3.800 0.779 -4.643 546 HD13 ILE 30 HD13 ILE 30 -4.929 2.145 -4.661 547 H GLN 31 H GLN 31 -7.364 -2.974 -7.513 548 HA GLN 31 HA GLN 31 -5.629 -5.153 -8.170 549 HB2 GLN 31 HB2 GLN 31 -7.595 -5.478 -6.749 550 HB3 GLN 31 HB3 GLN 31 -8.664 -4.881 -8.039 551 HG2 GLN 31 HG2 GLN 31 -8.095 -6.732 -9.490 552 HG3 GLN 31 HG3 GLN 31 -6.868 -7.308 -8.376 553 HE21 GLN 31 HE21 GLN 31 -7.726 -9.330 -7.859 554 HE22 GLN 31 HE22 GLN 31 -9.259 -9.542 -7.038 555 H ASP 32 H ASP 32 -8.047 -3.254 -10.011 556 HA ASP 32 HA ASP 32 -8.133 -5.008 -12.248 557 HB2 ASP 32 HB2 ASP 32 -9.831 -3.285 -11.637 558 HB3 ASP 32 HB3 ASP 32 -8.648 -2.027 -11.893 559 H LYS 33 H LYS 33 -6.068 -2.380 -11.285 560 HA LYS 33 HA LYS 33 -4.902 -1.910 -13.912 561 HB2 LYS 33 HB2 LYS 33 -4.597 -0.875 -11.091 562 HB3 LYS 33 HB3 LYS 33 -3.437 -0.388 -12.344 563 HG2 LYS 33 HG2 LYS 33 -6.438 -0.163 -12.794 564 HG3 LYS 33 HG3 LYS 33 -5.539 1.100 -11.943 565 HD2 LYS 33 HD2 LYS 33 -3.972 1.293 -13.851 566 HD3 LYS 33 HD3 LYS 33 -4.934 0.117 -14.763 567 HE2 LYS 33 HE2 LYS 33 -5.995 2.747 -13.634 568 HE3 LYS 33 HE3 LYS 33 -5.448 2.532 -15.298 569 HZ1 LYS 33 HZ1 LYS 33 -7.148 0.856 -15.576 570 HZ2 LYS 33 HZ2 LYS 33 -7.664 1.054 -14.029 571 HZ3 LYS 33 HZ3 LYS 33 -7.823 2.280 -15.115 572 H GLU 34 H GLU 34 -4.075 -3.928 -11.146 573 HA GLU 34 HA GLU 34 -1.585 -4.644 -12.612 574 HB2 GLU 34 HB2 GLU 34 -1.736 -3.996 -9.643 575 HB3 GLU 34 HB3 GLU 34 -0.333 -4.706 -10.461 576 HG2 GLU 34 HG2 GLU 34 -0.217 -2.717 -11.955 577 HG3 GLU 34 HG3 GLU 34 -1.548 -1.976 -11.048 578 H GLY 35 H GLY 35 -4.071 -5.606 -10.232 579 HA2 GLY 35 HA2 GLY 35 -4.993 -7.833 -10.563 580 HA3 GLY 35 HA3 GLY 35 -3.352 -8.452 -10.809 581 H ILE 36 H ILE 36 -3.491 -6.028 -8.428 582 HA ILE 36 HA ILE 36 -2.632 -7.898 -6.391 583 HB ILE 36 HB ILE 36 -3.200 -4.902 -6.359 584 HG12 ILE 36 HG12 ILE 36 -0.541 -6.391 -6.510 585 HG13 ILE 36 HG13 ILE 36 -1.397 -5.771 -7.931 586 HG21 ILE 36 HG21 ILE 36 -1.879 -4.861 -4.289 587 HG22 ILE 36 HG22 ILE 36 -3.281 -5.927 -4.102 588 HG23 ILE 36 HG23 ILE 36 -1.665 -6.628 -4.375 589 HD11 ILE 36 HD11 ILE 36 -0.402 -4.080 -5.596 590 HD12 ILE 36 HD12 ILE 36 0.312 -4.174 -7.217 591 HD13 ILE 36 HD13 ILE 36 -1.311 -3.478 -6.999 592 HA PRO 37 HA PRO 37 -6.784 -8.585 -5.014 593 HB2 PRO 37 HB2 PRO 37 -6.296 -9.986 -2.702 594 HB3 PRO 37 HB3 PRO 37 -6.016 -10.676 -4.331 595 HG2 PRO 37 HG2 PRO 37 -4.001 -9.387 -2.476 596 HG3 PRO 37 HG3 PRO 37 -3.846 -10.938 -3.365 597 HD2 PRO 37 HD2 PRO 37 -2.764 -8.615 -4.304 598 HD3 PRO 37 HD3 PRO 37 -3.473 -9.820 -5.422 599 HA PRO 38 HA PRO 38 -7.623 -5.359 -2.085 600 HB2 PRO 38 HB2 PRO 38 -10.018 -6.201 -1.025 601 HB3 PRO 38 HB3 PRO 38 -9.844 -5.577 -2.693 602 HG2 PRO 38 HG2 PRO 38 -9.887 -8.468 -1.781 603 HG3 PRO 38 HG3 PRO 38 -10.811 -7.718 -3.128 604 HD2 PRO 38 HD2 PRO 38 -8.492 -9.072 -3.557 605 HD3 PRO 38 HD3 PRO 38 -8.885 -7.594 -4.488 606 H ASP 39 H ASP 39 -7.103 -8.655 -1.215 607 HA ASP 39 HA ASP 39 -7.420 -8.201 1.642 608 HB2 ASP 39 HB2 ASP 39 -8.066 -10.321 0.471 609 HB3 ASP 39 HB3 ASP 39 -6.348 -10.630 0.177 610 H GLN 40 H GLN 40 -4.908 -7.554 -0.584 611 HA GLN 40 HA GLN 40 -2.906 -7.762 1.632 612 HB2 GLN 40 HB2 GLN 40 -2.551 -8.059 -1.361 613 HB3 GLN 40 HB3 GLN 40 -1.219 -7.751 -0.239 614 HG2 GLN 40 HG2 GLN 40 -1.927 -9.775 1.083 615 HG3 GLN 40 HG3 GLN 40 -3.082 -10.145 -0.214 616 HE21 GLN 40 HE21 GLN 40 -2.028 -10.042 -2.501 617 HE22 GLN 40 HE22 GLN 40 -0.478 -10.858 -2.658 618 H GLN 41 H GLN 41 -4.536 -5.513 -0.572 619 HA GLN 41 HA GLN 41 -2.475 -3.544 -0.598 620 HB2 GLN 41 HB2 GLN 41 -5.496 -3.325 -0.825 621 HB3 GLN 41 HB3 GLN 41 -4.362 -1.996 -1.139 622 HG2 GLN 41 HG2 GLN 41 -3.287 -3.293 -2.939 623 HG3 GLN 41 HG3 GLN 41 -4.337 -4.676 -2.584 624 HE21 GLN 41 HE21 GLN 41 -5.533 -4.764 -4.525 625 HE22 GLN 41 HE22 GLN 41 -6.623 -3.480 -4.984 626 H ARG 42 H ARG 42 -2.542 -1.464 0.388 627 HA ARG 42 HA ARG 42 -3.988 -0.987 2.887 628 HB2 ARG 42 HB2 ARG 42 -2.070 -2.291 3.682 629 HB3 ARG 42 HB3 ARG 42 -0.956 -1.258 2.758 630 HG2 ARG 42 HG2 ARG 42 -1.387 0.627 4.144 631 HG3 ARG 42 HG3 ARG 42 -2.792 -0.152 4.913 632 HD2 ARG 42 HD2 ARG 42 -0.683 -0.149 6.325 633 HD3 ARG 42 HD3 ARG 42 -1.415 -1.740 6.050 634 HE ARG 42 HE ARG 42 0.617 -1.101 4.076 635 HH11 ARG 42 HH11 ARG 42 0.163 -2.255 7.389 636 HH12 ARG 42 HH12 ARG 42 1.617 -3.227 7.363 637 HH21 ARG 42 HH21 ARG 42 2.487 -2.349 4.077 638 HH22 ARG 42 HH22 ARG 42 2.955 -3.244 5.513 639 H LEU 43 H LEU 43 -4.422 1.238 2.903 640 HA LEU 43 HA LEU 43 -2.961 2.840 0.861 641 HB2 LEU 43 HB2 LEU 43 -4.992 1.758 -0.045 642 HB3 LEU 43 HB3 LEU 43 -5.960 2.486 1.244 643 HG LEU 43 HG LEU 43 -5.435 4.724 0.390 644 HD11 LEU 43 HD11 LEU 43 -4.001 3.197 -1.835 645 HD12 LEU 43 HD12 LEU 43 -4.380 4.935 -1.877 646 HD13 LEU 43 HD13 LEU 43 -3.242 4.310 -0.666 647 HD21 LEU 43 HD21 LEU 43 -7.425 3.482 -0.395 648 HD22 LEU 43 HD22 LEU 43 -6.784 4.502 -1.706 649 HD23 LEU 43 HD23 LEU 43 -6.484 2.749 -1.701 650 H ILE 44 H ILE 44 -2.418 4.809 1.523 651 HA ILE 44 HA ILE 44 -3.643 5.925 4.008 652 HB ILE 44 HB ILE 44 -0.723 5.879 3.121 653 HG12 ILE 44 HG12 ILE 44 -0.467 4.962 5.509 654 HG13 ILE 44 HG13 ILE 44 -2.204 4.682 5.500 655 HG21 ILE 44 HG21 ILE 44 -1.944 7.319 5.519 656 HG22 ILE 44 HG22 ILE 44 -0.222 7.158 5.174 657 HG23 ILE 44 HG23 ILE 44 -1.232 8.102 4.085 658 HD11 ILE 44 HD11 ILE 44 -0.248 3.523 3.459 659 HD12 ILE 44 HD12 ILE 44 -0.822 2.668 4.911 660 HD13 ILE 44 HD13 ILE 44 -1.966 3.085 3.642 661 H PHE 45 H PHE 45 -3.658 8.251 4.088 662 HA PHE 45 HA PHE 45 -3.460 9.591 1.396 663 HB2 PHE 45 HB2 PHE 45 -5.781 9.121 1.972 664 HB3 PHE 45 HB3 PHE 45 -5.589 9.948 3.513 665 HD1 PHE 45 HD1 PHE 45 -4.186 11.067 0.228 666 HD2 PHE 45 HD2 PHE 45 -7.202 11.690 3.230 667 HE1 PHE 45 HE1 PHE 45 -4.884 13.136 -0.917 668 HE2 PHE 45 HE2 PHE 45 -7.861 13.805 2.120 669 HZ PHE 45 HZ PHE 45 -6.706 14.540 0.052 670 H ALA 46 H ALA 46 -4.493 11.549 3.868 671 HA ALA 46 HA ALA 46 -2.287 13.275 3.523 672 HB1 ALA 46 HB1 ALA 46 -4.412 13.122 5.698 673 HB2 ALA 46 HB2 ALA 46 -3.459 14.580 5.282 674 HB3 ALA 46 HB3 ALA 46 -4.610 13.871 4.101 675 H GLY 47 H GLY 47 -2.431 10.419 5.211 676 HA2 GLY 47 HA2 GLY 47 -0.071 9.925 6.040 677 HA3 GLY 47 HA3 GLY 47 -0.405 11.170 7.264 678 H LYS 48 H LYS 48 -3.336 9.698 6.566 679 HA LYS 48 HA LYS 48 -2.923 7.568 8.605 680 HB2 LYS 48 HB2 LYS 48 -5.165 7.959 9.429 681 HB3 LYS 48 HB3 LYS 48 -4.246 9.467 9.448 682 HG2 LYS 48 HG2 LYS 48 -6.225 10.192 8.616 683 HG3 LYS 48 HG3 LYS 48 -5.316 9.879 7.115 684 HD2 LYS 48 HD2 LYS 48 -6.522 7.721 6.848 685 HD3 LYS 48 HD3 LYS 48 -7.459 8.036 8.319 686 HE2 LYS 48 HE2 LYS 48 -7.402 9.831 5.869 687 HE3 LYS 48 HE3 LYS 48 -8.662 8.652 6.245 688 HZ1 LYS 48 HZ1 LYS 48 -7.942 10.967 7.926 689 HZ2 LYS 48 HZ2 LYS 48 -9.273 10.855 6.970 690 HZ3 LYS 48 HZ3 LYS 48 -9.112 9.864 8.270 691 H GLN 49 H GLN 49 -4.224 5.787 8.410 692 HA GLN 49 HA GLN 49 -4.402 4.856 5.616 693 HB2 GLN 49 HB2 GLN 49 -3.131 3.543 7.263 694 HB3 GLN 49 HB3 GLN 49 -4.558 3.425 8.301 695 HG2 GLN 49 HG2 GLN 49 -5.750 2.185 6.499 696 HG3 GLN 49 HG3 GLN 49 -4.312 2.303 5.468 697 HE21 GLN 49 HE21 GLN 49 -5.724 -0.098 6.501 698 HE22 GLN 49 HE22 GLN 49 -4.522 -0.998 7.410 699 H LEU 50 H LEU 50 -6.238 4.492 4.587 700 HA LEU 50 HA LEU 50 -8.700 5.483 5.773 701 HB2 LEU 50 HB2 LEU 50 -8.390 4.118 3.081 702 HB3 LEU 50 HB3 LEU 50 -9.566 5.336 3.588 703 HG LEU 50 HG LEU 50 -6.578 5.758 3.144 704 HD11 LEU 50 HD11 LEU 50 -7.885 5.544 1.075 705 HD12 LEU 50 HD12 LEU 50 -9.023 6.789 1.654 706 HD13 LEU 50 HD13 LEU 50 -7.333 7.218 1.314 707 HD21 LEU 50 HD21 LEU 50 -7.399 7.200 4.977 708 HD22 LEU 50 HD22 LEU 50 -7.051 8.153 3.513 709 HD23 LEU 50 HD23 LEU 50 -8.730 7.761 3.923 710 H GLU 51 H GLU 51 -10.799 4.166 5.659 711 HA GLU 51 HA GLU 51 -10.242 1.261 6.112 712 HB2 GLU 51 HB2 GLU 51 -11.814 3.235 7.771 713 HB3 GLU 51 HB3 GLU 51 -12.184 1.495 7.810 714 HG2 GLU 51 HG2 GLU 51 -9.906 0.968 8.480 715 HG3 GLU 51 HG3 GLU 51 -9.424 2.659 8.304 716 H ASP 52 H ASP 52 -11.809 -0.182 5.575 717 HA ASP 52 HA ASP 52 -13.263 0.465 3.196 718 HB2 ASP 52 HB2 ASP 52 -13.331 -2.016 4.956 719 HB3 ASP 52 HB3 ASP 52 -13.917 -1.902 3.296 720 H GLY 53 H GLY 53 -14.058 1.153 6.344 721 HA2 GLY 53 HA2 GLY 53 -16.953 0.584 5.983 722 HA3 GLY 53 HA3 GLY 53 -16.130 0.801 7.543 723 H ARG 54 H ARG 54 -15.109 2.941 5.015 724 HA ARG 54 HA ARG 54 -16.719 5.175 6.147 725 HB2 ARG 54 HB2 ARG 54 -13.966 5.325 4.946 726 HB3 ARG 54 HB3 ARG 54 -14.769 6.546 5.937 727 HG2 ARG 54 HG2 ARG 54 -13.855 3.804 6.947 728 HG3 ARG 54 HG3 ARG 54 -12.910 5.287 7.084 729 HD2 ARG 54 HD2 ARG 54 -14.557 6.335 8.456 730 HD3 ARG 54 HD3 ARG 54 -15.703 4.985 8.237 731 HE ARG 54 HE ARG 54 -13.337 3.877 9.262 732 HH11 ARG 54 HH11 ARG 54 -15.798 6.179 10.340 733 HH12 ARG 54 HH12 ARG 54 -15.548 5.822 12.033 734 HH21 ARG 54 HH21 ARG 54 -13.017 3.456 11.431 735 HH22 ARG 54 HH22 ARG 54 -13.974 4.251 12.665 736 H THR 55 H THR 55 -15.375 6.913 4.134 737 HA THR 55 HA THR 55 -16.113 5.968 1.461 738 HB THR 55 HB THR 55 -17.411 8.230 1.205 739 HG1 THR 55 HG1 THR 55 -18.330 8.963 3.060 740 HG21 THR 55 HG21 THR 55 -18.702 6.031 2.865 741 HG22 THR 55 HG22 THR 55 -19.502 7.099 1.686 742 HG23 THR 55 HG23 THR 55 -18.355 5.851 1.131 743 H LEU 56 H LEU 56 -15.190 7.411 -0.190 744 HA LEU 56 HA LEU 56 -12.685 8.508 0.604 745 HB2 LEU 56 HB2 LEU 56 -14.382 8.785 -1.899 746 HB3 LEU 56 HB3 LEU 56 -12.810 9.582 -1.728 747 HG LEU 56 HG LEU 56 -13.224 6.579 -1.433 748 HD11 LEU 56 HD11 LEU 56 -12.195 8.263 -3.753 749 HD12 LEU 56 HD12 LEU 56 -12.082 6.489 -3.661 750 HD13 LEU 56 HD13 LEU 56 -13.675 7.268 -3.739 751 HD21 LEU 56 HD21 LEU 56 -10.709 8.267 -1.761 752 HD22 LEU 56 HD22 LEU 56 -11.206 7.439 -0.261 753 HD23 LEU 56 HD23 LEU 56 -10.765 6.495 -1.695 754 H SER 57 H SER 57 -15.924 9.794 0.533 755 HA SER 57 HA SER 57 -15.285 12.586 0.665 756 HB2 SER 57 HB2 SER 57 -17.679 12.704 1.316 757 HB3 SER 57 HB3 SER 57 -17.441 11.620 -0.070 758 HG SER 57 HG SER 57 -18.800 10.735 1.547 759 H ASP 58 H ASP 58 -15.358 9.946 2.993 760 HA ASP 58 HA ASP 58 -15.574 11.618 5.347 761 HB2 ASP 58 HB2 ASP 58 -16.235 9.194 5.174 762 HB3 ASP 58 HB3 ASP 58 -14.510 8.782 5.127 763 H TYR 59 H TYR 59 -12.998 10.910 3.166 764 HA TYR 59 HA TYR 59 -11.062 11.997 5.170 765 HB2 TYR 59 HB2 TYR 59 -9.901 10.740 2.794 766 HB3 TYR 59 HB3 TYR 59 -9.423 10.632 4.475 767 HD1 TYR 59 HD1 TYR 59 -10.629 8.908 5.965 768 HD2 TYR 59 HD2 TYR 59 -11.102 9.125 1.705 769 HE1 TYR 59 HE1 TYR 59 -11.351 6.502 5.913 770 HE2 TYR 59 HE2 TYR 59 -11.953 6.789 1.669 771 HH TYR 59 HH TYR 59 -12.169 4.785 4.600 772 H ASN 60 H ASN 60 -13.033 13.299 3.225 773 HA ASN 60 HA ASN 60 -13.110 14.971 1.764 774 HB2 ASN 60 HB2 ASN 60 -11.824 16.884 2.481 775 HB3 ASN 60 HB3 ASN 60 -12.410 15.964 3.877 776 HD21 ASN 60 HD21 ASN 60 -9.505 16.361 1.864 777 HD22 ASN 60 HD22 ASN 60 -8.370 16.011 3.174 778 H ILE 61 H ILE 61 -11.381 12.696 0.751 779 HA ILE 61 HA ILE 61 -9.225 13.793 -0.766 780 HB ILE 61 HB ILE 61 -10.988 11.337 -1.036 781 HG12 ILE 61 HG12 ILE 61 -8.031 11.685 -0.365 782 HG13 ILE 61 HG13 ILE 61 -9.317 11.585 0.852 783 HG21 ILE 61 HG21 ILE 61 -8.569 12.061 -2.748 784 HG22 ILE 61 HG22 ILE 61 -9.412 10.495 -2.750 785 HG23 ILE 61 HG23 ILE 61 -10.249 11.935 -3.321 786 HD11 ILE 61 HD11 ILE 61 -9.952 9.355 -0.010 787 HD12 ILE 61 HD12 ILE 61 -8.586 9.419 -1.153 788 HD13 ILE 61 HD13 ILE 61 -8.281 9.412 0.598 789 H GLN 62 H GLN 62 -9.079 14.613 -2.783 790 HA GLN 62 HA GLN 62 -11.556 15.139 -4.357 791 HB2 GLN 62 HB2 GLN 62 -9.200 17.026 -4.006 792 HB3 GLN 62 HB3 GLN 62 -10.752 17.376 -4.770 793 HG2 GLN 62 HG2 GLN 62 -10.330 16.756 -1.809 794 HG3 GLN 62 HG3 GLN 62 -10.471 18.364 -2.480 795 HE21 GLN 62 HE21 GLN 62 -12.186 16.953 -0.488 796 HE22 GLN 62 HE22 GLN 62 -13.808 17.007 -1.151 797 H LYS 63 H LYS 63 -10.562 16.210 -6.553 798 HA LYS 63 HA LYS 63 -9.198 14.094 -7.903 799 HB2 LYS 63 HB2 LYS 63 -9.210 15.587 -9.747 800 HB3 LYS 63 HB3 LYS 63 -10.753 15.747 -8.905 801 HG2 LYS 63 HG2 LYS 63 -9.912 17.821 -7.785 802 HG3 LYS 63 HG3 LYS 63 -8.370 17.648 -8.655 803 HD2 LYS 63 HD2 LYS 63 -9.744 19.250 -9.827 804 HD3 LYS 63 HD3 LYS 63 -9.600 17.779 -10.813 805 HE2 LYS 63 HE2 LYS 63 -11.824 17.032 -10.034 806 HE3 LYS 63 HE3 LYS 63 -11.958 18.469 -9.005 807 HZ1 LYS 63 HZ1 LYS 63 -11.734 18.495 -11.946 808 HZ2 LYS 63 HZ2 LYS 63 -13.111 18.755 -11.089 809 HZ3 LYS 63 HZ3 LYS 63 -11.864 19.821 -10.986 810 H GLU 64 H GLU 64 -7.187 13.753 -8.464 811 HA GLU 64 HA GLU 64 -4.937 13.798 -8.439 812 HB2 GLU 64 HB2 GLU 64 -5.355 16.813 -8.445 813 HB3 GLU 64 HB3 GLU 64 -3.896 15.943 -8.953 814 HG2 GLU 64 HG2 GLU 64 -5.234 14.794 -10.726 815 HG3 GLU 64 HG3 GLU 64 -6.651 15.735 -10.249 816 H SER 65 H SER 65 -6.362 13.920 -5.727 817 HA SER 65 HA SER 65 -4.821 15.657 -4.074 818 HB2 SER 65 HB2 SER 65 -6.706 13.355 -3.494 819 HB3 SER 65 HB3 SER 65 -5.935 14.338 -2.226 820 HG SER 65 HG SER 65 -6.854 16.180 -3.160 821 H THR 66 H THR 66 -4.151 12.565 -5.357 822 HA THR 66 HA THR 66 -2.501 11.035 -5.126 823 HB THR 66 HB THR 66 -1.205 13.291 -3.599 824 HG1 THR 66 HG1 THR 66 -1.653 13.704 -5.753 825 HG21 THR 66 HG21 THR 66 0.938 12.112 -4.138 826 HG22 THR 66 HG22 THR 66 -0.056 11.211 -2.983 827 HG23 THR 66 HG23 THR 66 -0.004 10.705 -4.689 828 H LEU 67 H LEU 67 -1.821 9.351 -3.840 829 HA LEU 67 HA LEU 67 -2.346 9.364 -0.933 830 HB2 LEU 67 HB2 LEU 67 -3.652 7.457 -2.930 831 HB3 LEU 67 HB3 LEU 67 -3.499 7.128 -1.203 832 HG LEU 67 HG LEU 67 -4.639 9.576 -1.045 833 HD11 LEU 67 HD11 LEU 67 -4.899 9.797 -3.510 834 HD12 LEU 67 HD12 LEU 67 -5.783 8.255 -3.544 835 HD13 LEU 67 HD13 LEU 67 -6.475 9.668 -2.703 836 HD21 LEU 67 HD21 LEU 67 -6.743 8.356 -0.657 837 HD22 LEU 67 HD22 LEU 67 -6.051 6.910 -1.443 838 HD23 LEU 67 HD23 LEU 67 -5.364 7.521 0.080 839 H HIS 68 H HIS 68 -1.777 6.830 -0.283 840 HA HIS 68 HA HIS 68 0.724 6.151 -1.728 841 HB2 HIS 68 HB2 HIS 68 0.493 6.528 1.274 842 HB3 HIS 68 HB3 HIS 68 1.930 5.978 0.396 843 HD2 HIS 68 HD2 HIS 68 2.862 7.864 -1.545 844 HE1 HIS 68 HE1 HIS 68 1.466 11.216 0.667 845 HE2 HIS 68 HE2 HIS 68 2.994 10.459 -1.228 846 H LEU 69 H LEU 69 0.162 4.203 -2.521 847 HA LEU 69 HA LEU 69 -1.157 2.140 -0.949 848 HB2 LEU 69 HB2 LEU 69 -1.378 2.283 -3.400 849 HB3 LEU 69 HB3 LEU 69 0.373 2.153 -3.588 850 HG LEU 69 HG LEU 69 0.300 -0.140 -2.610 851 HD11 LEU 69 HD11 LEU 69 -2.715 0.310 -2.700 852 HD12 LEU 69 HD12 LEU 69 -1.919 -1.259 -2.423 853 HD13 LEU 69 HD13 LEU 69 -1.733 0.052 -1.239 854 HD21 LEU 69 HD21 LEU 69 -1.566 0.350 -4.964 855 HD22 LEU 69 HD22 LEU 69 0.204 0.190 -5.045 856 HD23 LEU 69 HD23 LEU 69 -0.791 -1.201 -4.566 857 H VAL 70 H VAL 70 -0.192 0.683 0.379 858 HA VAL 70 HA VAL 70 2.717 0.216 0.204 859 HB VAL 70 HB VAL 70 1.454 1.019 2.844 860 HG11 VAL 70 HG11 VAL 70 4.327 0.727 1.833 861 HG12 VAL 70 HG12 VAL 70 3.871 1.316 3.441 862 HG13 VAL 70 HG13 VAL 70 3.515 -0.361 2.978 863 HG21 VAL 70 HG21 VAL 70 3.136 2.722 0.959 864 HG22 VAL 70 HG22 VAL 70 1.414 2.990 1.347 865 HG23 VAL 70 HG23 VAL 70 2.630 3.162 2.612 866 H LEU 71 H LEU 71 1.021 -1.528 -0.694 867 HA LEU 71 HA LEU 71 -0.412 -3.261 0.902 868 HB2 LEU 71 HB2 LEU 71 -0.399 -4.715 -0.943 869 HB3 LEU 71 HB3 LEU 71 -0.272 -3.092 -1.630 870 HG LEU 71 HG LEU 71 2.008 -5.092 -1.253 871 HD11 LEU 71 HD11 LEU 71 0.627 -4.015 -3.731 872 HD12 LEU 71 HD12 LEU 71 1.981 -5.171 -3.701 873 HD13 LEU 71 HD13 LEU 71 0.400 -5.645 -3.036 874 HD21 LEU 71 HD21 LEU 71 3.333 -3.507 -2.641 875 HD22 LEU 71 HD22 LEU 71 2.026 -2.310 -2.497 876 HD23 LEU 71 HD23 LEU 71 2.931 -2.839 -1.053 877 H ARG 72 H ARG 72 0.019 -5.635 1.229 878 HA ARG 72 HA ARG 72 2.579 -6.017 2.664 879 HB2 ARG 72 HB2 ARG 72 -0.072 -7.523 2.560 880 HB3 ARG 72 HB3 ARG 72 1.370 -8.194 3.321 881 HG2 ARG 72 HG2 ARG 72 0.029 -7.246 5.030 882 HG3 ARG 72 HG3 ARG 72 1.482 -6.248 4.857 883 HD2 ARG 72 HD2 ARG 72 0.251 -4.527 3.707 884 HD3 ARG 72 HD3 ARG 72 -1.158 -5.592 3.505 885 HE ARG 72 HE ARG 72 -0.213 -4.761 6.218 886 HH11 ARG 72 HH11 ARG 72 -2.778 -4.920 3.779 887 HH12 ARG 72 HH12 ARG 72 -4.026 -4.447 4.905 888 HH21 ARG 72 HH21 ARG 72 -1.867 -4.134 7.647 889 HH22 ARG 72 HH22 ARG 72 -3.509 -3.965 7.073 890 H LEU 73 H LEU 73 3.464 -8.285 2.510 891 HA LEU 73 HA LEU 73 3.385 -9.325 -0.256 892 HB2 LEU 73 HB2 LEU 73 5.769 -9.953 0.203 893 HB3 LEU 73 HB3 LEU 73 5.421 -8.204 0.055 894 HG LEU 73 HG LEU 73 5.648 -7.813 2.370 895 HD11 LEU 73 HD11 LEU 73 6.083 -9.609 4.013 896 HD12 LEU 73 HD12 LEU 73 4.483 -9.766 3.252 897 HD13 LEU 73 HD13 LEU 73 5.818 -10.824 2.730 898 HD21 LEU 73 HD21 LEU 73 7.731 -8.056 1.101 899 HD22 LEU 73 HD22 LEU 73 7.954 -8.607 2.782 900 HD23 LEU 73 HD23 LEU 73 7.771 -9.795 1.466 901 H ARG 74 H ARG 74 1.713 -10.025 1.999 902 HA ARG 74 HA ARG 74 2.462 -12.168 3.512 903 HB2 ARG 74 HB2 ARG 74 0.336 -10.890 3.619 904 HB3 ARG 74 HB3 ARG 74 -0.250 -11.746 2.185 905 HG2 ARG 74 HG2 ARG 74 -1.181 -12.731 4.227 906 HG3 ARG 74 HG3 ARG 74 -0.132 -13.893 3.400 907 HD2 ARG 74 HD2 ARG 74 1.700 -13.390 4.967 908 HD3 ARG 74 HD3 ARG 74 0.703 -12.143 5.747 909 HE ARG 74 HE ARG 74 -0.726 -14.592 5.811 910 HH11 ARG 74 HH11 ARG 74 2.192 -13.155 7.198 911 HH12 ARG 74 HH12 ARG 74 2.123 -14.132 8.646 912 HH21 ARG 74 HH21 ARG 74 -0.793 -15.848 7.705 913 HH22 ARG 74 HH22 ARG 74 0.431 -15.647 8.936 914 H GLY 75 H GLY 75 1.534 -12.185 0.101 915 HA2 GLY 75 HA2 GLY 75 2.674 -14.008 -1.172 916 HA3 GLY 75 HA3 GLY 75 2.008 -15.120 0.054 917 H GLY 76 H GLY 76 -0.480 -13.186 -0.031 918 HA2 GLY 76 HA2 GLY 76 -1.786 -13.333 -2.493 919 HA3 GLY 76 HA3 GLY 76 -2.090 -14.883 -1.684 Start of MODEL 15 1 H LEU 491 H LEU 491 14.775 6.870 10.769 2 HA LEU 491 HA LEU 491 17.453 6.251 10.653 3 HB2 LEU 491 HB2 LEU 491 16.253 3.852 9.982 4 HB3 LEU 491 HB3 LEU 491 16.590 4.471 11.578 5 HG LEU 491 HG LEU 491 14.272 5.486 11.638 6 HD11 LEU 491 HD11 LEU 491 13.901 5.600 9.184 7 HD12 LEU 491 HD12 LEU 491 13.948 3.826 9.105 8 HD13 LEU 491 HD13 LEU 491 12.639 4.643 9.996 9 HD21 LEU 491 HD21 LEU 491 13.202 3.338 12.043 10 HD22 LEU 491 HD22 LEU 491 14.515 2.502 11.182 11 HD23 LEU 491 HD23 LEU 491 14.862 3.384 12.691 12 HA PRO 492 HA PRO 492 18.325 6.197 6.266 13 HB2 PRO 492 HB2 PRO 492 20.927 5.465 6.439 14 HB3 PRO 492 HB3 PRO 492 20.361 7.058 7.041 15 HG2 PRO 492 HG2 PRO 492 20.895 4.554 8.643 16 HG3 PRO 492 HG3 PRO 492 21.403 6.234 9.006 17 HD2 PRO 492 HD2 PRO 492 19.157 5.031 10.082 18 HD3 PRO 492 HD3 PRO 492 19.247 6.792 9.816 19 H LEU 493 H LEU 493 19.892 4.305 5.035 20 HA LEU 493 HA LEU 493 18.197 2.033 5.021 21 HB2 LEU 493 HB2 LEU 493 19.541 1.253 3.227 22 HB3 LEU 493 HB3 LEU 493 19.422 3.012 3.068 23 HG LEU 493 HG LEU 493 21.822 1.427 4.091 24 HD11 LEU 493 HD11 LEU 493 22.892 2.313 2.068 25 HD12 LEU 493 HD12 LEU 493 21.444 1.371 1.656 26 HD13 LEU 493 HD13 LEU 493 21.379 3.149 1.626 27 HD21 LEU 493 HD21 LEU 493 21.411 4.433 3.830 28 HD22 LEU 493 HD22 LEU 493 21.747 3.515 5.326 29 HD23 LEU 493 HD23 LEU 493 22.989 3.638 4.072 30 H GLN 494 H GLN 494 19.401 2.454 7.534 31 HA GLN 494 HA GLN 494 21.326 0.457 8.177 32 HB2 GLN 494 HB2 GLN 494 20.783 1.030 10.441 33 HB3 GLN 494 HB3 GLN 494 20.770 2.495 9.430 34 HG2 GLN 494 HG2 GLN 494 18.895 2.908 10.599 35 HG3 GLN 494 HG3 GLN 494 18.194 2.024 9.238 36 HE21 GLN 494 HE21 GLN 494 16.585 2.130 11.248 37 HE22 GLN 494 HE22 GLN 494 16.561 0.655 12.202 38 H ALA 495 H ALA 495 17.795 0.397 7.832 39 HA ALA 495 HA ALA 495 17.960 -2.547 7.954 40 HB1 ALA 495 HB1 ALA 495 16.168 -0.900 9.767 41 HB2 ALA 495 HB2 ALA 495 15.994 -2.657 9.498 42 HB3 ALA 495 HB3 ALA 495 17.468 -2.001 10.250 43 H LEU 496 H LEU 496 17.010 0.078 6.203 44 HA LEU 496 HA LEU 496 14.404 -0.788 5.340 45 HB2 LEU 496 HB2 LEU 496 16.538 1.094 4.281 46 HB3 LEU 496 HB3 LEU 496 15.184 0.603 3.271 47 HG LEU 496 HG LEU 496 13.673 1.317 5.291 48 HD11 LEU 496 HD11 LEU 496 15.620 1.734 6.853 49 HD12 LEU 496 HD12 LEU 496 16.146 3.037 5.752 50 HD13 LEU 496 HD13 LEU 496 14.597 3.166 6.606 51 HD21 LEU 496 HD21 LEU 496 15.162 3.283 3.504 52 HD22 LEU 496 HD22 LEU 496 13.665 2.405 3.122 53 HD23 LEU 496 HD23 LEU 496 13.665 3.649 4.391 54 HA PRO 497 HA PRO 497 15.259 -4.069 2.529 55 HB2 PRO 497 HB2 PRO 497 13.852 -2.419 0.440 56 HB3 PRO 497 HB3 PRO 497 13.546 -4.123 0.901 57 HG2 PRO 497 HG2 PRO 497 11.882 -2.165 1.739 58 HG3 PRO 497 HG3 PRO 497 12.396 -3.457 2.878 59 HD2 PRO 497 HD2 PRO 497 13.464 -0.642 2.621 60 HD3 PRO 497 HD3 PRO 497 13.071 -1.572 4.101 61 H GLU 498 H GLU 498 16.591 -4.662 0.708 62 HA GLU 498 HA GLU 498 18.475 -2.573 -0.107 63 HB2 GLU 498 HB2 GLU 498 19.161 -4.897 0.605 64 HB3 GLU 498 HB3 GLU 498 18.431 -5.514 -0.897 65 HG2 GLU 498 HG2 GLU 498 19.963 -4.174 -2.242 66 HG3 GLU 498 HG3 GLU 498 20.522 -3.306 -0.810 67 H GLY 499 H GLY 499 16.368 -1.650 -0.907 68 HA2 GLY 499 HA2 GLY 499 16.413 -1.407 -3.718 69 HA3 GLY 499 HA3 GLY 499 15.177 -2.618 -3.294 70 H VAL 500 H VAL 500 15.913 0.058 -1.100 71 HA VAL 500 HA VAL 500 13.612 1.666 -2.018 72 HB VAL 500 HB VAL 500 13.851 0.362 0.724 73 HG11 VAL 500 HG11 VAL 500 11.866 2.458 -0.264 74 HG12 VAL 500 HG12 VAL 500 11.683 1.519 1.233 75 HG13 VAL 500 HG13 VAL 500 13.031 2.648 1.070 76 HG21 VAL 500 HG21 VAL 500 11.703 0.201 -1.437 77 HG22 VAL 500 HG22 VAL 500 12.817 -1.106 -0.963 78 HG23 VAL 500 HG23 VAL 500 11.587 -0.530 0.178 79 H ASP 501 H ASP 501 13.547 3.752 -0.800 80 HA ASP 501 HA ASP 501 16.096 4.540 0.536 81 HB2 ASP 501 HB2 ASP 501 14.686 5.942 -1.776 82 HB3 ASP 501 HB3 ASP 501 15.887 6.703 -0.728 83 H GLN 502 H GLN 502 15.880 5.953 2.086 84 HA GLN 502 HA GLN 502 13.375 6.090 3.439 85 HB2 GLN 502 HB2 GLN 502 14.691 7.746 4.885 86 HB3 GLN 502 HB3 GLN 502 15.236 6.075 4.816 87 HG2 GLN 502 HG2 GLN 502 16.439 8.287 3.105 88 HG3 GLN 502 HG3 GLN 502 17.036 7.808 4.707 89 HE21 GLN 502 HE21 GLN 502 16.284 4.858 3.950 90 HE22 GLN 502 HE22 GLN 502 17.706 4.370 3.059 91 H GLU 503 H GLU 503 14.863 8.185 1.012 92 HA GLU 503 HA GLU 503 13.324 10.504 1.697 93 HB2 GLU 503 HB2 GLU 503 14.092 11.392 -0.421 94 HB3 GLU 503 HB3 GLU 503 15.422 10.462 0.297 95 HG2 GLU 503 HG2 GLU 503 14.663 8.492 -1.113 96 HG3 GLU 503 HG3 GLU 503 13.542 9.580 -1.931 97 H VAL 504 H VAL 504 12.193 7.553 0.745 98 HA VAL 504 HA VAL 504 9.686 8.756 -0.229 99 HB VAL 504 HB VAL 504 11.059 8.184 -2.167 100 HG11 VAL 504 HG11 VAL 504 10.746 5.306 -1.208 101 HG12 VAL 504 HG12 VAL 504 11.323 5.795 -2.819 102 HG13 VAL 504 HG13 VAL 504 12.269 6.223 -1.386 103 HG21 VAL 504 HG21 VAL 504 8.576 8.192 -2.261 104 HG22 VAL 504 HG22 VAL 504 9.327 7.090 -3.435 105 HG23 VAL 504 HG23 VAL 504 8.579 6.431 -1.969 106 H PHE 505 H PHE 505 11.103 7.134 2.099 107 HA PHE 505 HA PHE 505 8.718 5.399 2.643 108 HB2 PHE 505 HB2 PHE 505 10.312 3.801 2.593 109 HB3 PHE 505 HB3 PHE 505 11.628 4.940 2.813 110 HD1 PHE 505 HD1 PHE 505 12.129 5.857 5.118 111 HD2 PHE 505 HD2 PHE 505 9.542 2.493 4.459 112 HE1 PHE 505 HE1 PHE 505 12.522 5.101 7.443 113 HE2 PHE 505 HE2 PHE 505 9.955 1.724 6.789 114 HZ PHE 505 HZ PHE 505 11.455 3.014 8.269 115 H LYS 506 H LYS 506 10.724 8.081 3.626 116 HA LYS 506 HA LYS 506 9.715 8.225 6.339 117 HB2 LYS 506 HB2 LYS 506 11.051 10.219 4.477 118 HB3 LYS 506 HB3 LYS 506 10.528 10.643 6.124 119 HG2 LYS 506 HG2 LYS 506 11.900 8.808 7.045 120 HG3 LYS 506 HG3 LYS 506 12.473 8.400 5.425 121 HD2 LYS 506 HD2 LYS 506 12.891 11.055 6.857 122 HD3 LYS 506 HD3 LYS 506 14.108 9.779 6.640 123 HE2 LYS 506 HE2 LYS 506 13.982 10.051 4.197 124 HE3 LYS 506 HE3 LYS 506 12.749 11.311 4.395 125 HZ1 LYS 506 HZ1 LYS 506 15.504 11.443 5.438 126 HZ2 LYS 506 HZ2 LYS 506 14.948 12.242 4.116 127 HZ3 LYS 506 HZ3 LYS 506 14.359 12.608 5.610 128 H GLN 507 H GLN 507 7.986 8.319 3.541 129 HA GLN 507 HA GLN 507 6.287 10.625 4.223 130 HB2 GLN 507 HB2 GLN 507 5.515 8.602 2.150 131 HB3 GLN 507 HB3 GLN 507 5.329 10.356 2.139 132 HG2 GLN 507 HG2 GLN 507 7.828 8.715 1.594 133 HG3 GLN 507 HG3 GLN 507 6.944 9.714 0.447 134 HE21 GLN 507 HE21 GLN 507 9.809 9.777 1.233 135 HE22 GLN 507 HE22 GLN 507 10.110 11.393 1.796 136 H LEU 508 H LEU 508 6.680 7.527 5.314 137 HA LEU 508 HA LEU 508 3.867 6.663 5.464 138 HB2 LEU 508 HB2 LEU 508 6.587 5.512 6.168 139 HB3 LEU 508 HB3 LEU 508 5.088 4.682 6.563 140 HG LEU 508 HG LEU 508 4.535 4.311 4.285 141 HD11 LEU 508 HD11 LEU 508 6.832 6.124 3.485 142 HD12 LEU 508 HD12 LEU 508 5.923 5.061 2.388 143 HD13 LEU 508 HD13 LEU 508 5.090 6.395 3.202 144 HD21 LEU 508 HD21 LEU 508 7.545 3.942 4.447 145 HD22 LEU 508 HD22 LEU 508 6.405 2.980 5.408 146 HD23 LEU 508 HD23 LEU 508 6.343 2.906 3.635 147 HA PRO 509 HA PRO 509 3.622 7.681 9.868 148 HB2 PRO 509 HB2 PRO 509 1.925 5.726 10.758 149 HB3 PRO 509 HB3 PRO 509 1.379 7.113 9.777 150 HG2 PRO 509 HG2 PRO 509 2.088 4.307 8.883 151 HG3 PRO 509 HG3 PRO 509 0.640 5.260 8.410 152 HD2 PRO 509 HD2 PRO 509 2.860 5.068 6.816 153 HD3 PRO 509 HD3 PRO 509 1.899 6.575 6.910 154 H ALA 510 H ALA 510 4.049 6.711 11.957 155 HA ALA 510 HA ALA 510 6.372 5.117 12.075 156 HB1 ALA 510 HB1 ALA 510 4.216 5.745 14.124 157 HB2 ALA 510 HB2 ALA 510 5.847 5.126 14.512 158 HB3 ALA 510 HB3 ALA 510 5.649 6.739 13.774 159 H ASP 511 H ASP 511 3.117 4.150 11.515 160 HA ASP 511 HA ASP 511 3.568 1.444 12.646 161 HB2 ASP 511 HB2 ASP 511 1.057 2.767 11.542 162 HB3 ASP 511 HB3 ASP 511 1.136 1.165 12.297 163 H ILE 512 H ILE 512 4.110 3.029 9.752 164 HA ILE 512 HA ILE 512 4.025 0.359 8.424 165 HB ILE 512 HB ILE 512 3.781 3.081 7.112 166 HG12 ILE 512 HG12 ILE 512 1.820 0.779 7.524 167 HG13 ILE 512 HG13 ILE 512 1.736 2.378 8.271 168 HG21 ILE 512 HG21 ILE 512 5.033 1.430 5.700 169 HG22 ILE 512 HG22 ILE 512 3.697 0.278 5.904 170 HG23 ILE 512 HG23 ILE 512 3.457 1.807 5.020 171 HD11 ILE 512 HD11 ILE 512 1.376 1.717 5.325 172 HD12 ILE 512 HD12 ILE 512 0.171 2.334 6.461 173 HD13 ILE 512 HD13 ILE 512 1.518 3.380 5.967 174 H GLN 513 H GLN 513 5.972 2.975 9.639 175 HA GLN 513 HA GLN 513 8.395 2.557 8.277 176 HB2 GLN 513 HB2 GLN 513 7.482 3.531 10.909 177 HB3 GLN 513 HB3 GLN 513 9.001 2.633 11.038 178 HG2 GLN 513 HG2 GLN 513 9.419 5.019 10.746 179 HG3 GLN 513 HG3 GLN 513 10.083 4.052 9.430 180 HE21 GLN 513 HE21 GLN 513 9.436 4.450 7.333 181 HE22 GLN 513 HE22 GLN 513 8.238 5.642 6.898 182 H GLU 514 H GLU 514 6.821 0.680 10.882 183 HA GLU 514 HA GLU 514 8.972 -1.224 11.115 184 HB2 GLU 514 HB2 GLU 514 7.448 -2.351 12.660 185 HB3 GLU 514 HB3 GLU 514 7.449 -0.605 12.974 186 HG2 GLU 514 HG2 GLU 514 5.355 -0.354 11.711 187 HG3 GLU 514 HG3 GLU 514 5.346 -2.087 11.345 188 H GLU 515 H GLU 515 6.706 -0.847 8.618 189 HA GLU 515 HA GLU 515 6.403 -3.783 8.251 190 HB2 GLU 515 HB2 GLU 515 5.163 -1.421 6.791 191 HB3 GLU 515 HB3 GLU 515 4.810 -3.121 6.474 192 HG2 GLU 515 HG2 GLU 515 4.338 -1.742 9.158 193 HG3 GLU 515 HG3 GLU 515 3.114 -1.915 7.903 194 H ILE 516 H ILE 516 8.181 -1.016 7.039 195 HA ILE 516 HA ILE 516 8.984 -2.527 4.596 196 HB ILE 516 HB ILE 516 9.116 0.363 5.478 197 HG12 ILE 516 HG12 ILE 516 8.005 0.836 3.437 198 HG13 ILE 516 HG13 ILE 516 8.230 -0.814 2.816 199 HG21 ILE 516 HG21 ILE 516 10.430 0.820 3.388 200 HG22 ILE 516 HG22 ILE 516 11.347 -0.094 4.601 201 HG23 ILE 516 HG23 ILE 516 10.653 -0.928 3.188 202 HD11 ILE 516 HD11 ILE 516 6.532 -0.080 5.225 203 HD12 ILE 516 HD12 ILE 516 5.907 -0.301 3.575 204 HD13 ILE 516 HD13 ILE 516 6.626 -1.680 4.422 205 H LEU 517 H LEU 517 10.203 -1.130 7.648 206 HA LEU 517 HA LEU 517 12.954 -1.822 7.257 207 HB2 LEU 517 HB2 LEU 517 11.207 -1.476 9.722 208 HB3 LEU 517 HB3 LEU 517 12.944 -1.743 9.809 209 HG LEU 517 HG LEU 517 11.637 0.580 8.316 210 HD11 LEU 517 HD11 LEU 517 12.377 1.956 10.214 211 HD12 LEU 517 HD12 LEU 517 11.264 0.688 10.773 212 HD13 LEU 517 HD13 LEU 517 13.016 0.506 11.026 213 HD21 LEU 517 HD21 LEU 517 13.899 1.563 8.366 214 HD22 LEU 517 HD22 LEU 517 14.539 0.110 9.140 215 HD23 LEU 517 HD23 LEU 517 13.905 0.028 7.474 216 H SER 518 H SER 518 10.268 -3.798 7.338 217 HA SER 518 HA SER 518 11.968 -6.146 7.960 218 HB2 SER 518 HB2 SER 518 9.130 -5.746 8.975 219 HB3 SER 518 HB3 SER 518 10.128 -7.201 9.191 220 HG SER 518 HG SER 518 10.203 -5.781 11.000 221 H GLY 519 H GLY 519 10.711 -4.704 5.481 222 HA2 GLY 519 HA2 GLY 519 9.050 -6.917 4.394 223 HA3 GLY 519 HA3 GLY 519 9.373 -5.345 3.631 224 H LYS 520 H LYS 520 12.102 -5.195 3.927 225 HA LYS 520 HA LYS 520 14.080 -5.658 3.061 226 HB2 LYS 520 HB2 LYS 520 13.313 -8.416 4.027 227 HB3 LYS 520 HB3 LYS 520 14.968 -7.803 3.775 228 HG2 LYS 520 HG2 LYS 520 14.786 -6.253 5.583 229 HG3 LYS 520 HG3 LYS 520 13.023 -6.389 5.641 230 HD2 LYS 520 HD2 LYS 520 13.870 -7.650 7.479 231 HD3 LYS 520 HD3 LYS 520 13.221 -8.770 6.276 232 HE2 LYS 520 HE2 LYS 520 15.324 -9.635 7.136 233 HE3 LYS 520 HE3 LYS 520 15.515 -9.202 5.428 234 HZ1 LYS 520 HZ1 LYS 520 16.354 -7.554 7.722 235 HZ2 LYS 520 HZ2 LYS 520 17.354 -8.443 6.764 236 HZ3 LYS 520 HZ3 LYS 520 16.550 -7.153 6.140 237 H SER 521 H SER 521 11.592 -6.767 1.190 238 HA SER 521 HA SER 521 13.303 -7.396 -1.056 239 HB2 SER 521 HB2 SER 521 13.383 -9.516 0.321 240 HB3 SER 521 HB3 SER 521 11.622 -9.653 0.119 241 HG SER 521 HG SER 521 12.869 -10.823 -1.454 242 H ARG 522 H ARG 522 11.642 -8.632 -2.719 243 HA ARG 522 HA ARG 522 9.869 -8.541 -4.036 244 HB2 ARG 522 HB2 ARG 522 8.833 -8.921 -1.577 245 HB3 ARG 522 HB3 ARG 522 8.066 -7.374 -1.958 246 HG2 ARG 522 HG2 ARG 522 6.614 -9.163 -2.692 247 HG3 ARG 522 HG3 ARG 522 7.301 -8.341 -4.120 248 HD2 ARG 522 HD2 ARG 522 7.215 -10.903 -4.207 249 HD3 ARG 522 HD3 ARG 522 8.738 -10.119 -4.631 250 HE ARG 522 HE ARG 522 9.763 -11.186 -2.905 251 HH11 ARG 522 HH11 ARG 522 6.297 -11.153 -2.160 252 HH12 ARG 522 HH12 ARG 522 6.509 -12.134 -0.722 253 HH21 ARG 522 HH21 ARG 522 9.967 -12.479 -1.081 254 HH22 ARG 522 HH22 ARG 522 8.556 -12.892 -0.130 255 H GLU 523 H GLU 523 11.519 -5.947 -3.289 256 HA GLU 523 HA GLU 523 10.089 -4.311 -5.242 257 HB2 GLU 523 HB2 GLU 523 9.966 -2.338 -3.771 258 HB3 GLU 523 HB3 GLU 523 8.977 -3.682 -3.184 259 HG2 GLU 523 HG2 GLU 523 10.992 -4.295 -1.687 260 HG3 GLU 523 HG3 GLU 523 11.624 -2.695 -2.082 261 H ASN 524 H ASN 524 11.361 -2.545 -6.035 262 HA ASN 524 HA ASN 524 14.240 -2.503 -5.418 263 HB2 ASN 524 HB2 ASN 524 13.041 -3.501 -8.049 264 HB3 ASN 524 HB3 ASN 524 14.708 -2.955 -7.894 265 HD21 ASN 524 HD21 ASN 524 12.429 -5.537 -7.243 266 HD22 ASN 524 HD22 ASN 524 13.600 -6.672 -6.601 267 H LEU 525 H LEU 525 12.525 -0.541 -4.919 268 HA LEU 525 HA LEU 525 11.827 1.533 -5.344 269 HB2 LEU 525 HB2 LEU 525 13.521 3.128 -5.890 270 HB3 LEU 525 HB3 LEU 525 13.997 1.996 -4.630 271 HG LEU 525 HG LEU 525 14.800 1.394 -7.481 272 HD11 LEU 525 HD11 LEU 525 15.304 3.786 -7.181 273 HD12 LEU 525 HD12 LEU 525 16.136 3.425 -5.651 274 HD13 LEU 525 HD13 LEU 525 16.801 2.818 -7.191 275 HD21 LEU 525 HD21 LEU 525 16.713 0.402 -6.305 276 HD22 LEU 525 HD22 LEU 525 16.236 1.201 -4.785 277 HD23 LEU 525 HD23 LEU 525 15.224 -0.092 -5.450 278 H LYS 526 H LYS 526 11.431 -0.376 -7.628 279 HA LYS 526 HA LYS 526 10.713 1.613 -9.709 280 HB2 LYS 526 HB2 LYS 526 12.237 -1.003 -9.972 281 HB3 LYS 526 HB3 LYS 526 11.539 -0.152 -11.376 282 HG2 LYS 526 HG2 LYS 526 12.945 1.777 -10.978 283 HG3 LYS 526 HG3 LYS 526 13.611 1.070 -9.486 284 HD2 LYS 526 HD2 LYS 526 13.780 -0.311 -12.169 285 HD3 LYS 526 HD3 LYS 526 15.043 0.806 -11.578 286 HE2 LYS 526 HE2 LYS 526 15.334 -0.608 -9.561 287 HE3 LYS 526 HE3 LYS 526 14.118 -1.734 -10.160 288 HZ1 LYS 526 HZ1 LYS 526 15.521 -2.135 -12.073 289 HZ2 LYS 526 HZ2 LYS 526 16.655 -1.090 -11.503 290 HZ3 LYS 526 HZ3 LYS 526 16.324 -2.475 -10.680 291 H1 MET 1 H1 MET 1 -12.032 12.352 -13.958 292 H2 MET 1 H2 MET 1 -13.438 13.078 -13.512 293 H3 MET 1 H3 MET 1 -13.344 11.436 -13.590 294 HA MET 1 HA MET 1 -11.842 13.134 -11.722 295 HB2 MET 1 HB2 MET 1 -14.191 13.100 -11.082 296 HB3 MET 1 HB3 MET 1 -14.264 11.336 -11.279 297 HG2 MET 1 HG2 MET 1 -12.680 11.002 -9.478 298 HG3 MET 1 HG3 MET 1 -12.409 12.746 -9.334 299 HE1 MET 1 HE1 MET 1 -12.920 10.999 -6.850 300 HE2 MET 1 HE2 MET 1 -12.766 12.765 -6.773 301 HE3 MET 1 HE3 MET 1 -14.119 11.959 -5.948 302 H GLN 2 H GLN 2 -10.117 12.273 -10.829 303 HA GLN 2 HA GLN 2 -9.907 9.415 -10.388 304 HB2 GLN 2 HB2 GLN 2 -7.955 9.071 -11.801 305 HB3 GLN 2 HB3 GLN 2 -9.234 9.783 -12.810 306 HG2 GLN 2 HG2 GLN 2 -8.102 12.051 -12.000 307 HG3 GLN 2 HG3 GLN 2 -6.710 11.024 -11.712 308 HE21 GLN 2 HE21 GLN 2 -5.416 11.938 -13.352 309 HE22 GLN 2 HE22 GLN 2 -5.784 11.765 -15.059 310 H ILE 3 H ILE 3 -7.624 8.977 -9.456 311 HA ILE 3 HA ILE 3 -6.523 11.340 -8.043 312 HB ILE 3 HB ILE 3 -6.507 10.333 -5.939 313 HG12 ILE 3 HG12 ILE 3 -6.958 7.715 -7.372 314 HG13 ILE 3 HG13 ILE 3 -5.770 8.183 -6.168 315 HG21 ILE 3 HG21 ILE 3 -9.204 9.606 -7.122 316 HG22 ILE 3 HG22 ILE 3 -8.845 9.988 -5.424 317 HG23 ILE 3 HG23 ILE 3 -8.681 11.247 -6.660 318 HD11 ILE 3 HD11 ILE 3 -7.573 8.251 -4.435 319 HD12 ILE 3 HD12 ILE 3 -8.726 7.677 -5.667 320 HD13 ILE 3 HD13 ILE 3 -7.363 6.648 -5.177 321 H PHE 4 H PHE 4 -4.414 10.398 -6.774 322 HA PHE 4 HA PHE 4 -2.959 8.648 -8.696 323 HB2 PHE 4 HB2 PHE 4 -1.906 11.242 -7.522 324 HB3 PHE 4 HB3 PHE 4 -1.066 10.178 -8.596 325 HD1 PHE 4 HD1 PHE 4 -2.300 9.729 -10.953 326 HD2 PHE 4 HD2 PHE 4 -3.082 13.088 -8.378 327 HE1 PHE 4 HE1 PHE 4 -3.128 11.023 -12.890 328 HE2 PHE 4 HE2 PHE 4 -3.895 14.388 -10.326 329 HZ PHE 4 HZ PHE 4 -3.919 13.360 -12.584 330 H VAL 5 H VAL 5 -2.629 6.907 -7.405 331 HA VAL 5 HA VAL 5 -1.899 7.392 -4.579 332 HB VAL 5 HB VAL 5 -2.545 5.208 -4.115 333 HG11 VAL 5 HG11 VAL 5 -4.461 6.217 -6.283 334 HG12 VAL 5 HG12 VAL 5 -4.840 5.062 -4.986 335 HG13 VAL 5 HG13 VAL 5 -4.442 6.741 -4.600 336 HG21 VAL 5 HG21 VAL 5 -1.497 3.897 -5.832 337 HG22 VAL 5 HG22 VAL 5 -3.229 3.551 -5.856 338 HG23 VAL 5 HG23 VAL 5 -2.528 4.627 -7.094 339 H LYS 6 H LYS 6 0.224 7.579 -4.108 340 HA LYS 6 HA LYS 6 2.135 6.576 -6.108 341 HB2 LYS 6 HB2 LYS 6 2.142 8.937 -5.207 342 HB3 LYS 6 HB3 LYS 6 2.721 8.277 -3.662 343 HG2 LYS 6 HG2 LYS 6 4.695 7.319 -4.796 344 HG3 LYS 6 HG3 LYS 6 4.058 7.827 -6.370 345 HD2 LYS 6 HD2 LYS 6 5.764 9.398 -5.687 346 HD3 LYS 6 HD3 LYS 6 4.187 10.209 -5.640 347 HE2 LYS 6 HE2 LYS 6 4.073 9.827 -3.190 348 HE3 LYS 6 HE3 LYS 6 5.648 9.007 -3.255 349 HZ1 LYS 6 HZ1 LYS 6 5.858 11.301 -2.591 350 HZ2 LYS 6 HZ2 LYS 6 6.611 11.059 -4.035 351 HZ3 LYS 6 HZ3 LYS 6 5.156 11.819 -3.985 352 H THR 7 H THR 7 3.497 4.919 -5.833 353 HA THR 7 HA THR 7 3.028 3.025 -3.734 354 HB THR 7 HB THR 7 4.840 1.782 -4.911 355 HG1 THR 7 HG1 THR 7 5.871 2.776 -6.594 356 HG21 THR 7 HG21 THR 7 2.821 3.087 -6.798 357 HG22 THR 7 HG22 THR 7 3.715 1.585 -7.099 358 HG23 THR 7 HG23 THR 7 2.526 1.659 -5.781 359 H LEU 8 H LEU 8 4.967 1.934 -2.698 360 HA LEU 8 HA LEU 8 6.415 3.700 -1.004 361 HB2 LEU 8 HB2 LEU 8 5.627 1.290 -0.689 362 HB3 LEU 8 HB3 LEU 8 6.997 0.769 -1.646 363 HG LEU 8 HG LEU 8 7.086 0.662 0.915 364 HD11 LEU 8 HD11 LEU 8 9.397 0.867 1.041 365 HD12 LEU 8 HD12 LEU 8 9.098 0.483 -0.667 366 HD13 LEU 8 HD13 LEU 8 9.480 2.151 -0.171 367 HD21 LEU 8 HD21 LEU 8 7.726 3.616 0.616 368 HD22 LEU 8 HD22 LEU 8 6.247 2.938 1.342 369 HD23 LEU 8 HD23 LEU 8 7.836 2.659 2.101 370 H THR 9 H THR 9 6.831 3.128 -4.285 371 HA THR 9 HA THR 9 9.795 3.342 -4.142 372 HB THR 9 HB THR 9 9.791 2.353 -6.406 373 HG1 THR 9 HG1 THR 9 7.846 1.460 -7.156 374 HG21 THR 9 HG21 THR 9 8.212 0.695 -4.385 375 HG22 THR 9 HG22 THR 9 9.210 0.068 -5.715 376 HG23 THR 9 HG23 THR 9 9.973 0.917 -4.351 377 H GLY 10 H GLY 10 7.097 5.249 -4.593 378 HA2 GLY 10 HA2 GLY 10 7.206 7.508 -5.027 379 HA3 GLY 10 HA3 GLY 10 8.814 7.318 -5.747 380 H LYS 11 H LYS 11 6.096 5.313 -6.790 381 HA LYS 11 HA LYS 11 5.801 6.989 -9.247 382 HB2 LYS 11 HB2 LYS 11 7.097 4.919 -9.522 383 HB3 LYS 11 HB3 LYS 11 5.731 3.955 -8.943 384 HG2 LYS 11 HG2 LYS 11 5.220 5.867 -11.205 385 HG3 LYS 11 HG3 LYS 11 6.166 4.399 -11.548 386 HD2 LYS 11 HD2 LYS 11 4.360 2.978 -10.694 387 HD3 LYS 11 HD3 LYS 11 3.409 4.401 -10.250 388 HE2 LYS 11 HE2 LYS 11 2.594 3.506 -12.355 389 HE3 LYS 11 HE3 LYS 11 3.329 5.090 -12.628 390 HZ1 LYS 11 HZ1 LYS 11 4.629 2.491 -13.130 391 HZ2 LYS 11 HZ2 LYS 11 4.010 3.492 -14.277 392 HZ3 LYS 11 HZ3 LYS 11 5.310 3.964 -13.398 393 H THR 12 H THR 12 3.628 7.187 -10.051 394 HA THR 12 HA THR 12 1.634 6.318 -8.006 395 HB THR 12 HB THR 12 2.380 8.863 -8.415 396 HG1 THR 12 HG1 THR 12 0.460 9.327 -7.386 397 HG21 THR 12 HG21 THR 12 1.497 8.889 -10.777 398 HG22 THR 12 HG22 THR 12 -0.128 8.545 -10.114 399 HG23 THR 12 HG23 THR 12 0.697 10.054 -9.693 400 H ILE 13 H ILE 13 -0.585 6.085 -8.738 401 HA ILE 13 HA ILE 13 -0.750 5.190 -11.582 402 HB ILE 13 HB ILE 13 -1.887 3.757 -9.148 403 HG12 ILE 13 HG12 ILE 13 0.508 3.042 -10.900 404 HG13 ILE 13 HG13 ILE 13 0.567 3.557 -9.207 405 HG21 ILE 13 HG21 ILE 13 -1.758 2.939 -12.082 406 HG22 ILE 13 HG22 ILE 13 -2.498 2.006 -10.761 407 HG23 ILE 13 HG23 ILE 13 -3.208 3.546 -11.254 408 HD11 ILE 13 HD11 ILE 13 0.785 1.156 -9.290 409 HD12 ILE 13 HD12 ILE 13 -0.783 1.563 -8.564 410 HD13 ILE 13 HD13 ILE 13 -0.697 0.996 -10.252 411 H THR 14 H THR 14 -2.429 6.052 -12.630 412 HA THR 14 HA THR 14 -4.196 7.880 -11.237 413 HB THR 14 HB THR 14 -4.284 6.908 -14.124 414 HG1 THR 14 HG1 THR 14 -2.967 8.715 -14.505 415 HG21 THR 14 HG21 THR 14 -5.314 9.133 -14.490 416 HG22 THR 14 HG22 THR 14 -6.271 8.168 -13.352 417 HG23 THR 14 HG23 THR 14 -5.208 9.459 -12.740 418 H LEU 15 H LEU 15 -6.285 7.452 -10.549 419 HA LEU 15 HA LEU 15 -7.556 4.898 -11.405 420 HB2 LEU 15 HB2 LEU 15 -7.223 5.821 -8.531 421 HB3 LEU 15 HB3 LEU 15 -8.069 4.366 -9.071 422 HG LEU 15 HG LEU 15 -5.108 4.903 -9.501 423 HD11 LEU 15 HD11 LEU 15 -6.495 3.121 -7.447 424 HD12 LEU 15 HD12 LEU 15 -4.738 3.352 -7.632 425 HD13 LEU 15 HD13 LEU 15 -5.761 4.703 -7.092 426 HD21 LEU 15 HD21 LEU 15 -6.086 3.258 -11.093 427 HD22 LEU 15 HD22 LEU 15 -4.957 2.505 -9.937 428 HD23 LEU 15 HD23 LEU 15 -6.711 2.320 -9.724 429 H GLU 16 H GLU 16 -9.647 5.124 -11.758 430 HA GLU 16 HA GLU 16 -10.970 7.709 -11.224 431 HB2 GLU 16 HB2 GLU 16 -11.179 6.766 -13.446 432 HB3 GLU 16 HB3 GLU 16 -11.667 5.192 -12.794 433 HG2 GLU 16 HG2 GLU 16 -13.710 6.149 -11.890 434 HG3 GLU 16 HG3 GLU 16 -13.253 7.766 -12.460 435 H VAL 17 H VAL 17 -12.290 8.043 -9.614 436 HA VAL 17 HA VAL 17 -13.726 5.840 -8.272 437 HB VAL 17 HB VAL 17 -12.990 6.603 -6.048 438 HG11 VAL 17 HG11 VAL 17 -10.732 5.689 -6.057 439 HG12 VAL 17 HG12 VAL 17 -11.769 4.744 -7.149 440 HG13 VAL 17 HG13 VAL 17 -10.601 5.917 -7.809 441 HG21 VAL 17 HG21 VAL 17 -11.035 8.369 -7.579 442 HG22 VAL 17 HG22 VAL 17 -12.414 8.935 -6.604 443 HG23 VAL 17 HG23 VAL 17 -11.051 8.112 -5.823 444 H GLU 18 H GLU 18 -15.075 6.970 -6.396 445 HA GLU 18 HA GLU 18 -15.962 9.689 -7.164 446 HB2 GLU 18 HB2 GLU 18 -17.862 7.353 -6.683 447 HB3 GLU 18 HB3 GLU 18 -18.308 9.026 -7.060 448 HG2 GLU 18 HG2 GLU 18 -17.084 8.768 -9.257 449 HG3 GLU 18 HG3 GLU 18 -16.878 7.048 -8.836 450 HA PRO 19 HA PRO 19 -16.175 10.321 -2.805 451 HB2 PRO 19 HB2 PRO 19 -19.022 11.227 -3.066 452 HB3 PRO 19 HB3 PRO 19 -17.628 12.072 -2.332 453 HG2 PRO 19 HG2 PRO 19 -18.561 12.794 -4.781 454 HG3 PRO 19 HG3 PRO 19 -16.797 12.751 -4.430 455 HD2 PRO 19 HD2 PRO 19 -18.472 10.699 -5.886 456 HD3 PRO 19 HD3 PRO 19 -16.842 11.329 -6.282 457 H SER 20 H SER 20 -17.936 7.837 -4.253 458 HA SER 20 HA SER 20 -18.945 6.893 -1.617 459 HB2 SER 20 HB2 SER 20 -20.264 6.680 -4.347 460 HB3 SER 20 HB3 SER 20 -20.822 5.872 -2.866 461 HG SER 20 HG SER 20 -21.889 7.873 -3.263 462 H ASP 21 H ASP 21 -16.867 6.400 -4.248 463 HA ASP 21 HA ASP 21 -16.832 3.469 -4.115 464 HB2 ASP 21 HB2 ASP 21 -14.987 5.524 -5.337 465 HB3 ASP 21 HB3 ASP 21 -14.768 3.782 -5.501 466 H THR 22 H THR 22 -16.745 3.704 -1.778 467 HA THR 22 HA THR 22 -14.587 4.904 -0.350 468 HB THR 22 HB THR 22 -16.706 4.493 0.673 469 HG1 THR 22 HG1 THR 22 -15.913 3.649 2.575 470 HG21 THR 22 HG21 THR 22 -17.469 2.305 1.360 471 HG22 THR 22 HG22 THR 22 -17.383 2.416 -0.406 472 HG23 THR 22 HG23 THR 22 -16.111 1.532 0.492 473 H ILE 23 H ILE 23 -13.415 3.283 1.369 474 HA ILE 23 HA ILE 23 -11.187 2.570 -0.155 475 HB ILE 23 HB ILE 23 -11.734 1.646 2.676 476 HG12 ILE 23 HG12 ILE 23 -12.380 3.968 2.642 477 HG13 ILE 23 HG13 ILE 23 -10.814 3.810 3.416 478 HG21 ILE 23 HG21 ILE 23 -9.641 0.818 1.764 479 HG22 ILE 23 HG22 ILE 23 -9.207 2.430 1.160 480 HG23 ILE 23 HG23 ILE 23 -9.281 2.120 2.912 481 HD11 ILE 23 HD11 ILE 23 -11.275 4.714 0.535 482 HD12 ILE 23 HD12 ILE 23 -10.901 5.762 1.922 483 HD13 ILE 23 HD13 ILE 23 -9.697 4.586 1.342 484 H GLU 24 H GLU 24 -13.988 0.548 0.380 485 HA GLU 24 HA GLU 24 -12.370 -1.894 -0.051 486 HB2 GLU 24 HB2 GLU 24 -14.401 -3.103 0.180 487 HB3 GLU 24 HB3 GLU 24 -14.405 -1.852 1.441 488 HG2 GLU 24 HG2 GLU 24 -15.860 -0.437 -0.020 489 HG3 GLU 24 HG3 GLU 24 -15.885 -1.733 -1.226 490 H ASN 25 H ASN 25 -13.981 0.540 -1.883 491 HA ASN 25 HA ASN 25 -14.287 -1.056 -4.302 492 HB2 ASN 25 HB2 ASN 25 -14.536 1.910 -3.738 493 HB3 ASN 25 HB3 ASN 25 -14.867 1.188 -5.296 494 HD21 ASN 25 HD21 ASN 25 -15.983 1.704 -2.133 495 HD22 ASN 25 HD22 ASN 25 -17.542 0.867 -2.256 496 H VAL 26 H VAL 26 -12.078 1.435 -2.932 497 HA VAL 26 HA VAL 26 -10.544 1.952 -5.278 498 HB VAL 26 HB VAL 26 -9.006 3.050 -3.732 499 HG11 VAL 26 HG11 VAL 26 -10.557 4.602 -2.730 500 HG12 VAL 26 HG12 VAL 26 -11.216 4.084 -4.302 501 HG13 VAL 26 HG13 VAL 26 -11.877 3.410 -2.800 502 HG21 VAL 26 HG21 VAL 26 -10.511 1.522 -1.633 503 HG22 VAL 26 HG22 VAL 26 -8.781 1.420 -2.012 504 HG23 VAL 26 HG23 VAL 26 -9.423 2.910 -1.290 505 H LYS 27 H LYS 27 -10.331 -0.488 -2.704 506 HA LYS 27 HA LYS 27 -7.809 -1.572 -3.383 507 HB2 LYS 27 HB2 LYS 27 -10.337 -2.704 -2.138 508 HB3 LYS 27 HB3 LYS 27 -8.866 -3.670 -2.338 509 HG2 LYS 27 HG2 LYS 27 -7.552 -2.099 -1.041 510 HG3 LYS 27 HG3 LYS 27 -8.911 -0.965 -0.946 511 HD2 LYS 27 HD2 LYS 27 -10.226 -2.652 0.319 512 HD3 LYS 27 HD3 LYS 27 -8.846 -3.773 0.249 513 HE2 LYS 27 HE2 LYS 27 -7.444 -2.126 1.421 514 HE3 LYS 27 HE3 LYS 27 -8.784 -0.978 1.467 515 HZ1 LYS 27 HZ1 LYS 27 -8.600 -2.194 3.536 516 HZ2 LYS 27 HZ2 LYS 27 -10.020 -2.524 2.800 517 HZ3 LYS 27 HZ3 LYS 27 -8.799 -3.629 2.756 518 H ALA 28 H ALA 28 -10.928 -1.814 -5.048 519 HA ALA 28 HA ALA 28 -9.972 -4.017 -6.734 520 HB1 ALA 28 HB1 ALA 28 -12.394 -2.202 -7.034 521 HB2 ALA 28 HB2 ALA 28 -12.075 -3.699 -7.927 522 HB3 ALA 28 HB3 ALA 28 -12.378 -3.765 -6.174 523 H LYS 29 H LYS 29 -9.973 -0.460 -6.778 524 HA LYS 29 HA LYS 29 -9.502 -0.198 -9.612 525 HB2 LYS 29 HB2 LYS 29 -9.101 1.612 -7.214 526 HB3 LYS 29 HB3 LYS 29 -8.475 2.053 -8.799 527 HG2 LYS 29 HG2 LYS 29 -10.583 3.096 -8.524 528 HG3 LYS 29 HG3 LYS 29 -10.747 1.845 -9.777 529 HD2 LYS 29 HD2 LYS 29 -11.886 0.356 -8.251 530 HD3 LYS 29 HD3 LYS 29 -11.430 1.361 -6.871 531 HE2 LYS 29 HE2 LYS 29 -13.793 1.637 -7.463 532 HE3 LYS 29 HE3 LYS 29 -12.886 3.152 -7.575 533 HZ1 LYS 29 HZ1 LYS 29 -12.791 2.896 -9.935 534 HZ2 LYS 29 HZ2 LYS 29 -13.561 1.441 -9.876 535 HZ3 LYS 29 HZ3 LYS 29 -14.355 2.819 -9.449 536 H ILE 30 H ILE 30 -7.392 -0.635 -6.742 537 HA ILE 30 HA ILE 30 -4.956 -0.208 -8.311 538 HB ILE 30 HB ILE 30 -5.544 -1.155 -5.479 539 HG12 ILE 30 HG12 ILE 30 -4.414 1.461 -6.541 540 HG13 ILE 30 HG13 ILE 30 -6.100 1.216 -6.050 541 HG21 ILE 30 HG21 ILE 30 -2.852 -0.472 -6.757 542 HG22 ILE 30 HG22 ILE 30 -3.114 -0.845 -5.040 543 HG23 ILE 30 HG23 ILE 30 -3.381 -2.093 -6.259 544 HD11 ILE 30 HD11 ILE 30 -5.386 0.751 -3.727 545 HD12 ILE 30 HD12 ILE 30 -3.684 0.973 -4.203 546 HD13 ILE 30 HD13 ILE 30 -4.814 2.332 -4.283 547 H GLN 31 H GLN 31 -6.982 -2.899 -7.196 548 HA GLN 31 HA GLN 31 -5.141 -5.008 -7.823 549 HB2 GLN 31 HB2 GLN 31 -7.095 -5.416 -6.408 550 HB3 GLN 31 HB3 GLN 31 -8.187 -4.860 -7.694 551 HG2 GLN 31 HG2 GLN 31 -7.546 -6.691 -9.142 552 HG3 GLN 31 HG3 GLN 31 -6.302 -7.220 -8.022 553 HE21 GLN 31 HE21 GLN 31 -7.127 -9.293 -7.577 554 HE22 GLN 31 HE22 GLN 31 -8.643 -9.546 -6.739 555 H ASP 32 H ASP 32 -7.635 -3.225 -9.687 556 HA ASP 32 HA ASP 32 -7.627 -5.005 -11.904 557 HB2 ASP 32 HB2 ASP 32 -9.398 -3.347 -11.350 558 HB3 ASP 32 HB3 ASP 32 -8.267 -2.041 -11.593 559 H LYS 33 H LYS 33 -5.662 -2.301 -10.955 560 HA LYS 33 HA LYS 33 -4.506 -1.795 -13.572 561 HB2 LYS 33 HB2 LYS 33 -4.157 -0.802 -10.739 562 HB3 LYS 33 HB3 LYS 33 -3.067 -0.248 -12.032 563 HG2 LYS 33 HG2 LYS 33 -6.103 -0.086 -12.274 564 HG3 LYS 33 HG3 LYS 33 -5.125 1.206 -11.550 565 HD2 LYS 33 HD2 LYS 33 -3.785 1.393 -13.591 566 HD3 LYS 33 HD3 LYS 33 -4.769 0.141 -14.376 567 HE2 LYS 33 HE2 LYS 33 -5.836 2.771 -13.264 568 HE3 LYS 33 HE3 LYS 33 -5.439 2.488 -14.963 569 HZ1 LYS 33 HZ1 LYS 33 -7.089 0.731 -14.992 570 HZ2 LYS 33 HZ2 LYS 33 -7.463 1.001 -13.418 571 HZ3 LYS 33 HZ3 LYS 33 -7.777 2.155 -14.549 572 H GLU 34 H GLU 34 -3.619 -3.797 -10.794 573 HA GLU 34 HA GLU 34 -1.062 -4.405 -12.209 574 HB2 GLU 34 HB2 GLU 34 -1.420 -3.837 -9.243 575 HB3 GLU 34 HB3 GLU 34 0.062 -4.470 -9.965 576 HG2 GLU 34 HG2 GLU 34 -1.235 -1.798 -10.657 577 HG3 GLU 34 HG3 GLU 34 0.117 -2.019 -9.552 578 H GLY 35 H GLY 35 -3.565 -5.476 -9.891 579 HA2 GLY 35 HA2 GLY 35 -4.426 -7.729 -10.199 580 HA3 GLY 35 HA3 GLY 35 -2.769 -8.300 -10.460 581 H ILE 36 H ILE 36 -2.983 -5.850 -8.087 582 HA ILE 36 HA ILE 36 -2.041 -7.673 -6.043 583 HB ILE 36 HB ILE 36 -2.695 -4.697 -6.055 584 HG12 ILE 36 HG12 ILE 36 -0.015 -6.152 -6.168 585 HG13 ILE 36 HG13 ILE 36 -0.854 -5.515 -7.588 586 HG21 ILE 36 HG21 ILE 36 -1.113 -6.326 -4.020 587 HG22 ILE 36 HG22 ILE 36 -1.416 -4.577 -3.969 588 HG23 ILE 36 HG23 ILE 36 -2.765 -5.717 -3.772 589 HD11 ILE 36 HD11 ILE 36 -0.787 -3.226 -6.580 590 HD12 ILE 36 HD12 ILE 36 0.162 -3.881 -5.223 591 HD13 ILE 36 HD13 ILE 36 0.828 -3.910 -6.866 592 HA PRO 37 HA PRO 37 -6.155 -8.544 -4.667 593 HB2 PRO 37 HB2 PRO 37 -5.622 -9.837 -2.299 594 HB3 PRO 37 HB3 PRO 37 -5.279 -10.556 -3.902 595 HG2 PRO 37 HG2 PRO 37 -3.374 -9.112 -2.059 596 HG3 PRO 37 HG3 PRO 37 -3.107 -10.667 -2.909 597 HD2 PRO 37 HD2 PRO 37 -2.154 -8.311 -3.887 598 HD3 PRO 37 HD3 PRO 37 -2.762 -9.578 -4.987 599 HA PRO 38 HA PRO 38 -7.332 -5.297 -1.890 600 HB2 PRO 38 HB2 PRO 38 -9.622 -6.333 -0.788 601 HB3 PRO 38 HB3 PRO 38 -9.506 -5.766 -2.485 602 HG2 PRO 38 HG2 PRO 38 -9.287 -8.608 -1.449 603 HG3 PRO 38 HG3 PRO 38 -10.253 -8.001 -2.833 604 HD2 PRO 38 HD2 PRO 38 -7.819 -9.149 -3.191 605 HD3 PRO 38 HD3 PRO 38 -8.343 -7.761 -4.188 606 H ASP 39 H ASP 39 -6.489 -8.483 -0.863 607 HA ASP 39 HA ASP 39 -6.810 -7.880 1.979 608 HB2 ASP 39 HB2 ASP 39 -5.737 -10.328 0.531 609 HB3 ASP 39 HB3 ASP 39 -6.023 -10.221 2.273 610 H GLN 40 H GLN 40 -4.410 -7.158 -0.318 611 HA GLN 40 HA GLN 40 -2.314 -7.246 1.813 612 HB2 GLN 40 HB2 GLN 40 -2.079 -7.733 -1.170 613 HB3 GLN 40 HB3 GLN 40 -0.699 -7.435 -0.112 614 HG2 GLN 40 HG2 GLN 40 -1.274 -9.387 1.263 615 HG3 GLN 40 HG3 GLN 40 -2.715 -9.692 0.275 616 HE21 GLN 40 HE21 GLN 40 0.609 -8.744 -0.776 617 HE22 GLN 40 HE22 GLN 40 0.881 -10.186 -1.733 618 H GLN 41 H GLN 41 -4.121 -5.148 -0.302 619 HA GLN 41 HA GLN 41 -2.065 -3.119 -0.535 620 HB2 GLN 41 HB2 GLN 41 -5.091 -3.027 -0.751 621 HB3 GLN 41 HB3 GLN 41 -4.009 -1.686 -1.176 622 HG2 GLN 41 HG2 GLN 41 -2.996 -2.987 -2.963 623 HG3 GLN 41 HG3 GLN 41 -3.881 -4.441 -2.450 624 HE21 GLN 41 HE21 GLN 41 -5.095 -4.702 -4.405 625 HE22 GLN 41 HE22 GLN 41 -6.393 -3.593 -4.784 626 H ARG 42 H ARG 42 -2.320 -0.948 0.325 627 HA ARG 42 HA ARG 42 -4.056 -0.418 2.598 628 HB2 ARG 42 HB2 ARG 42 -2.131 -1.546 3.679 629 HB3 ARG 42 HB3 ARG 42 -1.024 -0.377 2.926 630 HG2 ARG 42 HG2 ARG 42 -2.044 1.461 4.143 631 HG3 ARG 42 HG3 ARG 42 -3.327 0.404 4.771 632 HD2 ARG 42 HD2 ARG 42 -0.363 0.004 5.346 633 HD3 ARG 42 HD3 ARG 42 -1.469 0.904 6.402 634 HE ARG 42 HE ARG 42 -2.420 -1.771 5.759 635 HH11 ARG 42 HH11 ARG 42 -0.363 0.116 7.923 636 HH12 ARG 42 HH12 ARG 42 -0.478 -1.036 9.232 637 HH21 ARG 42 HH21 ARG 42 -2.593 -3.240 7.500 638 HH22 ARG 42 HH22 ARG 42 -1.756 -2.915 9.001 639 H LEU 43 H LEU 43 -4.585 1.753 2.558 640 HA LEU 43 HA LEU 43 -2.967 3.506 0.755 641 HB2 LEU 43 HB2 LEU 43 -5.927 2.921 0.831 642 HB3 LEU 43 HB3 LEU 43 -5.381 4.546 0.380 643 HG LEU 43 HG LEU 43 -4.580 1.959 -1.006 644 HD11 LEU 43 HD11 LEU 43 -6.975 2.521 -1.191 645 HD12 LEU 43 HD12 LEU 43 -6.561 4.167 -1.722 646 HD13 LEU 43 HD13 LEU 43 -6.154 2.775 -2.749 647 HD21 LEU 43 HD21 LEU 43 -4.149 4.906 -1.713 648 HD22 LEU 43 HD22 LEU 43 -2.880 3.721 -1.295 649 HD23 LEU 43 HD23 LEU 43 -3.807 3.537 -2.794 650 H ILE 44 H ILE 44 -2.665 5.577 1.373 651 HA ILE 44 HA ILE 44 -3.873 6.463 3.941 652 HB ILE 44 HB ILE 44 -0.946 6.607 3.095 653 HG12 ILE 44 HG12 ILE 44 -0.645 5.753 5.489 654 HG13 ILE 44 HG13 ILE 44 -2.372 5.420 5.509 655 HG21 ILE 44 HG21 ILE 44 -2.319 8.010 5.429 656 HG22 ILE 44 HG22 ILE 44 -0.574 7.954 5.143 657 HG23 ILE 44 HG23 ILE 44 -1.600 8.813 4.003 658 HD11 ILE 44 HD11 ILE 44 -2.124 3.747 3.759 659 HD12 ILE 44 HD12 ILE 44 -0.435 4.246 3.467 660 HD13 ILE 44 HD13 ILE 44 -0.903 3.449 4.990 661 H PHE 45 H PHE 45 -4.239 8.683 4.094 662 HA PHE 45 HA PHE 45 -3.604 10.446 1.807 663 HB2 PHE 45 HB2 PHE 45 -5.806 9.375 1.286 664 HB3 PHE 45 HB3 PHE 45 -6.410 9.895 2.856 665 HD1 PHE 45 HD1 PHE 45 -4.715 11.417 -0.144 666 HD2 PHE 45 HD2 PHE 45 -7.727 11.800 2.897 667 HE1 PHE 45 HE1 PHE 45 -5.490 13.512 -1.190 668 HE2 PHE 45 HE2 PHE 45 -8.508 13.905 1.865 669 HZ PHE 45 HZ PHE 45 -7.388 14.785 -0.172 670 H ALA 46 H ALA 46 -3.212 12.500 2.510 671 HA ALA 46 HA ALA 46 -2.587 14.074 3.987 672 HB1 ALA 46 HB1 ALA 46 -4.393 14.991 5.368 673 HB2 ALA 46 HB2 ALA 46 -5.009 14.519 3.771 674 HB3 ALA 46 HB3 ALA 46 -5.320 13.484 5.184 675 H GLY 47 H GLY 47 -2.026 11.165 4.752 676 HA2 GLY 47 HA2 GLY 47 -0.720 10.258 6.425 677 HA3 GLY 47 HA3 GLY 47 -0.942 11.727 7.429 678 H LYS 48 H LYS 48 -3.671 10.016 5.998 679 HA LYS 48 HA LYS 48 -4.169 8.664 8.571 680 HB2 LYS 48 HB2 LYS 48 -5.616 10.733 7.630 681 HB3 LYS 48 HB3 LYS 48 -6.335 9.433 6.622 682 HG2 LYS 48 HG2 LYS 48 -6.172 8.103 8.869 683 HG3 LYS 48 HG3 LYS 48 -6.109 9.729 9.578 684 HD2 LYS 48 HD2 LYS 48 -8.300 8.590 7.728 685 HD3 LYS 48 HD3 LYS 48 -8.515 8.813 9.458 686 HE2 LYS 48 HE2 LYS 48 -7.988 11.029 7.427 687 HE3 LYS 48 HE3 LYS 48 -9.565 10.604 8.100 688 HZ1 LYS 48 HZ1 LYS 48 -8.717 11.162 10.283 689 HZ2 LYS 48 HZ2 LYS 48 -7.257 11.577 9.654 690 HZ3 LYS 48 HZ3 LYS 48 -8.598 12.448 9.265 691 H GLN 49 H GLN 49 -4.172 6.495 8.369 692 HA GLN 49 HA GLN 49 -4.446 5.188 5.767 693 HB2 GLN 49 HB2 GLN 49 -3.052 4.208 7.527 694 HB3 GLN 49 HB3 GLN 49 -4.444 4.118 8.620 695 HG2 GLN 49 HG2 GLN 49 -5.585 2.598 6.997 696 HG3 GLN 49 HG3 GLN 49 -4.163 2.654 5.952 697 HE21 GLN 49 HE21 GLN 49 -5.287 0.271 7.081 698 HE22 GLN 49 HE22 GLN 49 -4.121 -0.408 8.199 699 H LEU 50 H LEU 50 -6.385 5.187 4.768 700 HA LEU 50 HA LEU 50 -8.784 5.908 6.179 701 HB2 LEU 50 HB2 LEU 50 -8.564 4.690 3.405 702 HB3 LEU 50 HB3 LEU 50 -9.898 5.624 4.077 703 HG LEU 50 HG LEU 50 -8.923 7.163 2.712 704 HD11 LEU 50 HD11 LEU 50 -7.888 8.876 4.021 705 HD12 LEU 50 HD12 LEU 50 -9.021 8.027 5.088 706 HD13 LEU 50 HD13 LEU 50 -7.286 7.703 5.214 707 HD21 LEU 50 HD21 LEU 50 -6.125 6.344 3.572 708 HD22 LEU 50 HD22 LEU 50 -6.957 5.789 2.092 709 HD23 LEU 50 HD23 LEU 50 -6.577 7.508 2.316 710 H GLU 51 H GLU 51 -10.885 4.491 5.846 711 HA GLU 51 HA GLU 51 -10.228 1.631 6.410 712 HB2 GLU 51 HB2 GLU 51 -11.892 3.564 8.032 713 HB3 GLU 51 HB3 GLU 51 -12.162 1.807 8.111 714 HG2 GLU 51 HG2 GLU 51 -9.835 1.441 8.760 715 HG3 GLU 51 HG3 GLU 51 -9.500 3.174 8.615 716 H ASP 52 H ASP 52 -11.865 0.146 6.062 717 HA ASP 52 HA ASP 52 -13.323 0.619 3.637 718 HB2 ASP 52 HB2 ASP 52 -13.364 -1.717 5.593 719 HB3 ASP 52 HB3 ASP 52 -14.003 -1.734 3.946 720 H GLY 53 H GLY 53 -14.086 1.535 6.744 721 HA2 GLY 53 HA2 GLY 53 -16.995 0.986 6.431 722 HA3 GLY 53 HA3 GLY 53 -16.158 1.305 7.963 723 H ARG 54 H ARG 54 -15.091 3.253 5.320 724 HA ARG 54 HA ARG 54 -16.671 5.585 6.291 725 HB2 ARG 54 HB2 ARG 54 -13.928 5.643 5.003 726 HB3 ARG 54 HB3 ARG 54 -14.720 6.908 5.932 727 HG2 ARG 54 HG2 ARG 54 -13.789 4.240 7.100 728 HG3 ARG 54 HG3 ARG 54 -12.868 5.741 7.166 729 HD2 ARG 54 HD2 ARG 54 -14.614 6.828 8.446 730 HD3 ARG 54 HD3 ARG 54 -15.654 5.385 8.330 731 HE ARG 54 HE ARG 54 -13.265 4.474 9.430 732 HH11 ARG 54 HH11 ARG 54 -15.685 6.887 10.327 733 HH12 ARG 54 HH12 ARG 54 -15.388 6.710 12.044 734 HH21 ARG 54 HH21 ARG 54 -12.880 4.285 11.623 735 HH22 ARG 54 HH22 ARG 54 -13.790 5.225 12.790 736 H THR 55 H THR 55 -15.622 7.253 4.210 737 HA THR 55 HA THR 55 -16.139 6.034 1.601 738 HB THR 55 HB THR 55 -17.626 8.135 1.093 739 HG1 THR 55 HG1 THR 55 -18.672 8.956 2.814 740 HG21 THR 55 HG21 THR 55 -18.384 5.704 1.184 741 HG22 THR 55 HG22 THR 55 -18.776 5.972 2.900 742 HG23 THR 55 HG23 THR 55 -19.637 6.883 1.631 743 H LEU 56 H LEU 56 -15.369 7.494 -0.136 744 HA LEU 56 HA LEU 56 -12.955 8.851 0.617 745 HB2 LEU 56 HB2 LEU 56 -14.652 9.013 -1.913 746 HB3 LEU 56 HB3 LEU 56 -13.035 9.697 -1.734 747 HG LEU 56 HG LEU 56 -13.839 6.766 -1.694 748 HD11 LEU 56 HD11 LEU 56 -12.239 6.643 -3.572 749 HD12 LEU 56 HD12 LEU 56 -13.494 7.862 -3.905 750 HD13 LEU 56 HD13 LEU 56 -11.873 8.371 -3.393 751 HD21 LEU 56 HD21 LEU 56 -11.430 6.250 -1.346 752 HD22 LEU 56 HD22 LEU 56 -11.112 7.975 -1.078 753 HD23 LEU 56 HD23 LEU 56 -12.133 7.061 0.065 754 H SER 57 H SER 57 -16.318 9.795 0.339 755 HA SER 57 HA SER 57 -15.960 12.629 0.377 756 HB2 SER 57 HB2 SER 57 -18.387 12.555 0.848 757 HB3 SER 57 HB3 SER 57 -17.961 11.399 -0.429 758 HG SER 57 HG SER 57 -19.341 10.507 1.156 759 H ASP 58 H ASP 58 -15.948 10.128 2.863 760 HA ASP 58 HA ASP 58 -16.530 11.858 5.091 761 HB2 ASP 58 HB2 ASP 58 -16.659 9.272 4.912 762 HB3 ASP 58 HB3 ASP 58 -14.914 9.284 5.162 763 H TYR 59 H TYR 59 -13.757 11.363 3.110 764 HA TYR 59 HA TYR 59 -12.039 12.789 5.076 765 HB2 TYR 59 HB2 TYR 59 -11.287 10.447 3.283 766 HB3 TYR 59 HB3 TYR 59 -10.142 11.411 4.218 767 HD1 TYR 59 HD1 TYR 59 -11.607 11.742 6.805 768 HD2 TYR 59 HD2 TYR 59 -11.157 8.327 4.229 769 HE1 TYR 59 HE1 TYR 59 -11.871 10.239 8.762 770 HE2 TYR 59 HE2 TYR 59 -11.331 6.821 6.189 771 HH TYR 59 HH TYR 59 -11.629 6.679 8.480 772 H ASN 60 H ASN 60 -13.746 13.638 2.808 773 HA ASN 60 HA ASN 60 -13.697 15.010 1.053 774 HB2 ASN 60 HB2 ASN 60 -12.541 17.020 1.479 775 HB3 ASN 60 HB3 ASN 60 -13.078 16.347 3.015 776 HD21 ASN 60 HD21 ASN 60 -11.593 15.656 4.569 777 HD22 ASN 60 HD22 ASN 60 -9.876 16.001 4.438 778 H ILE 61 H ILE 61 -12.035 12.583 0.552 779 HA ILE 61 HA ILE 61 -9.862 13.431 -1.165 780 HB ILE 61 HB ILE 61 -11.496 10.891 -0.899 781 HG12 ILE 61 HG12 ILE 61 -8.571 11.527 -0.352 782 HG13 ILE 61 HG13 ILE 61 -9.845 11.555 0.885 783 HG21 ILE 61 HG21 ILE 61 -9.119 11.402 -2.747 784 HG22 ILE 61 HG22 ILE 61 -9.900 9.829 -2.476 785 HG23 ILE 61 HG23 ILE 61 -10.796 11.120 -3.277 786 HD11 ILE 61 HD11 ILE 61 -9.029 9.110 -0.722 787 HD12 ILE 61 HD12 ILE 61 -8.601 9.461 0.968 788 HD13 ILE 61 HD13 ILE 61 -10.301 9.191 0.531 789 H GLN 62 H GLN 62 -9.882 14.115 -3.213 790 HA GLN 62 HA GLN 62 -12.360 13.996 -4.848 791 HB2 GLN 62 HB2 GLN 62 -10.777 16.545 -4.352 792 HB3 GLN 62 HB3 GLN 62 -12.242 16.341 -5.341 793 HG2 GLN 62 HG2 GLN 62 -13.384 15.487 -3.213 794 HG3 GLN 62 HG3 GLN 62 -11.965 16.061 -2.330 795 HE21 GLN 62 HE21 GLN 62 -13.930 17.208 -1.316 796 HE22 GLN 62 HE22 GLN 62 -14.261 18.822 -1.923 797 H LYS 63 H LYS 63 -11.611 15.344 -7.016 798 HA LYS 63 HA LYS 63 -9.812 13.631 -8.347 799 HB2 LYS 63 HB2 LYS 63 -10.020 15.149 -10.146 800 HB3 LYS 63 HB3 LYS 63 -11.591 15.067 -9.338 801 HG2 LYS 63 HG2 LYS 63 -11.091 17.207 -8.155 802 HG3 LYS 63 HG3 LYS 63 -9.517 17.274 -8.973 803 HD2 LYS 63 HD2 LYS 63 -11.070 18.697 -10.163 804 HD3 LYS 63 HD3 LYS 63 -10.668 17.297 -11.171 805 HE2 LYS 63 HE2 LYS 63 -12.788 16.200 -10.524 806 HE3 LYS 63 HE3 LYS 63 -13.172 17.560 -9.455 807 HZ1 LYS 63 HZ1 LYS 63 -14.280 17.744 -11.569 808 HZ2 LYS 63 HZ2 LYS 63 -13.214 18.984 -11.384 809 HZ3 LYS 63 HZ3 LYS 63 -12.856 17.724 -12.377 810 H GLU 64 H GLU 64 -7.757 13.646 -8.868 811 HA GLU 64 HA GLU 64 -5.537 14.007 -8.688 812 HB2 GLU 64 HB2 GLU 64 -6.371 16.932 -8.709 813 HB3 GLU 64 HB3 GLU 64 -4.803 16.247 -9.191 814 HG2 GLU 64 HG2 GLU 64 -5.957 14.959 -10.999 815 HG3 GLU 64 HG3 GLU 64 -7.482 15.738 -10.552 816 H SER 65 H SER 65 -7.000 13.742 -6.106 817 HA SER 65 HA SER 65 -6.056 15.667 -4.238 818 HB2 SER 65 HB2 SER 65 -6.879 13.990 -2.586 819 HB3 SER 65 HB3 SER 65 -8.064 14.384 -3.835 820 HG SER 65 HG SER 65 -7.787 12.458 -4.751 821 H THR 66 H THR 66 -4.641 12.813 -5.580 822 HA THR 66 HA THR 66 -2.777 11.594 -5.279 823 HB THR 66 HB THR 66 -1.854 14.105 -3.887 824 HG1 THR 66 HG1 THR 66 -0.847 14.392 -5.894 825 HG21 THR 66 HG21 THR 66 -0.434 12.225 -3.132 826 HG22 THR 66 HG22 THR 66 -0.269 11.658 -4.813 827 HG23 THR 66 HG23 THR 66 0.454 13.200 -4.313 828 H LEU 67 H LEU 67 -2.405 9.892 -4.092 829 HA LEU 67 HA LEU 67 -2.768 9.933 -1.127 830 HB2 LEU 67 HB2 LEU 67 -4.006 8.138 -3.235 831 HB3 LEU 67 HB3 LEU 67 -3.649 7.507 -1.628 832 HG LEU 67 HG LEU 67 -5.032 9.388 -0.661 833 HD11 LEU 67 HD11 LEU 67 -5.964 9.565 -3.564 834 HD12 LEU 67 HD12 LEU 67 -6.846 10.236 -2.169 835 HD13 LEU 67 HD13 LEU 67 -5.261 10.883 -2.595 836 HD21 LEU 67 HD21 LEU 67 -5.747 7.032 -0.804 837 HD22 LEU 67 HD22 LEU 67 -7.117 8.129 -1.065 838 HD23 LEU 67 HD23 LEU 67 -6.352 7.308 -2.451 839 H HIS 68 H HIS 68 -1.997 7.494 -0.452 840 HA HIS 68 HA HIS 68 0.519 6.904 -1.928 841 HB2 HIS 68 HB2 HIS 68 0.285 7.197 1.086 842 HB3 HIS 68 HB3 HIS 68 1.752 6.851 0.162 843 HD2 HIS 68 HD2 HIS 68 2.531 8.931 -1.603 844 HE1 HIS 68 HE1 HIS 68 0.629 11.996 0.645 845 HE2 HIS 68 HE2 HIS 68 2.327 11.505 -1.194 846 H LEU 69 H LEU 69 0.980 4.785 -2.104 847 HA LEU 69 HA LEU 69 -0.899 2.835 -0.864 848 HB2 LEU 69 HB2 LEU 69 -1.331 3.301 -3.218 849 HB3 LEU 69 HB3 LEU 69 0.346 2.988 -3.641 850 HG LEU 69 HG LEU 69 -1.331 1.222 -4.246 851 HD11 LEU 69 HD11 LEU 69 0.909 0.216 -2.458 852 HD12 LEU 69 HD12 LEU 69 0.103 -0.643 -3.783 853 HD13 LEU 69 HD13 LEU 69 1.102 0.784 -4.133 854 HD21 LEU 69 HD21 LEU 69 -2.100 -0.356 -2.588 855 HD22 LEU 69 HD22 LEU 69 -1.249 0.501 -1.295 856 HD23 LEU 69 HD23 LEU 69 -2.635 1.271 -2.114 857 H VAL 70 H VAL 70 -0.045 1.143 0.134 858 HA VAL 70 HA VAL 70 2.763 0.320 -0.332 859 HB VAL 70 HB VAL 70 1.497 0.855 2.394 860 HG11 VAL 70 HG11 VAL 70 4.236 -0.255 1.630 861 HG12 VAL 70 HG12 VAL 70 3.766 0.269 3.263 862 HG13 VAL 70 HG13 VAL 70 2.950 -1.111 2.519 863 HG21 VAL 70 HG21 VAL 70 3.828 2.181 0.935 864 HG22 VAL 70 HG22 VAL 70 2.262 2.931 1.310 865 HG23 VAL 70 HG23 VAL 70 3.376 2.488 2.625 866 H LEU 71 H LEU 71 3.047 -2.000 0.496 867 HA LEU 71 HA LEU 71 0.484 -3.419 0.795 868 HB2 LEU 71 HB2 LEU 71 0.667 -4.744 -1.120 869 HB3 LEU 71 HB3 LEU 71 0.959 -3.094 -1.666 870 HG LEU 71 HG LEU 71 3.025 -5.294 -1.203 871 HD11 LEU 71 HD11 LEU 71 1.663 -5.476 -3.250 872 HD12 LEU 71 HD12 LEU 71 2.121 -3.818 -3.708 873 HD13 LEU 71 HD13 LEU 71 3.359 -5.097 -3.629 874 HD21 LEU 71 HD21 LEU 71 4.093 -3.199 -0.582 875 HD22 LEU 71 HD22 LEU 71 4.671 -3.693 -2.177 876 HD23 LEU 71 HD23 LEU 71 3.455 -2.398 -2.044 877 H ARG 72 H ARG 72 0.871 -5.856 0.878 878 HA ARG 72 HA ARG 72 2.917 -6.312 2.942 879 HB2 ARG 72 HB2 ARG 72 0.324 -7.516 2.064 880 HB3 ARG 72 HB3 ARG 72 1.495 -8.642 2.774 881 HG2 ARG 72 HG2 ARG 72 -0.117 -7.577 4.410 882 HG3 ARG 72 HG3 ARG 72 1.605 -7.453 4.810 883 HD2 ARG 72 HD2 ARG 72 1.665 -5.145 3.944 884 HD3 ARG 72 HD3 ARG 72 -0.046 -5.258 3.501 885 HE ARG 72 HE ARG 72 -0.641 -4.984 5.730 886 HH11 ARG 72 HH11 ARG 72 2.839 -5.599 5.490 887 HH12 ARG 72 HH12 ARG 72 3.132 -5.229 7.174 888 HH21 ARG 72 HH21 ARG 72 -0.210 -4.501 7.924 889 HH22 ARG 72 HH22 ARG 72 1.428 -4.582 8.529 890 H LEU 73 H LEU 73 3.475 -8.872 2.900 891 HA LEU 73 HA LEU 73 5.332 -8.943 0.597 892 HB2 LEU 73 HB2 LEU 73 5.978 -8.538 3.165 893 HB3 LEU 73 HB3 LEU 73 5.788 -10.287 3.282 894 HG LEU 73 HG LEU 73 7.498 -10.487 1.395 895 HD11 LEU 73 HD11 LEU 73 8.898 -8.457 1.008 896 HD12 LEU 73 HD12 LEU 73 7.224 -8.198 0.468 897 HD13 LEU 73 HD13 LEU 73 7.769 -7.507 2.008 898 HD21 LEU 73 HD21 LEU 73 8.315 -9.003 3.937 899 HD22 LEU 73 HD22 LEU 73 8.067 -10.757 3.794 900 HD23 LEU 73 HD23 LEU 73 9.396 -9.977 2.909 901 H ARG 74 H ARG 74 2.660 -10.105 0.828 902 HA ARG 74 HA ARG 74 1.445 -11.941 0.316 903 HB2 ARG 74 HB2 ARG 74 3.173 -12.093 -1.480 904 HB3 ARG 74 HB3 ARG 74 4.096 -13.210 -0.464 905 HG2 ARG 74 HG2 ARG 74 2.780 -14.426 -2.134 906 HG3 ARG 74 HG3 ARG 74 2.267 -14.835 -0.491 907 HD2 ARG 74 HD2 ARG 74 0.329 -13.337 -0.697 908 HD3 ARG 74 HD3 ARG 74 0.884 -12.815 -2.305 909 HE ARG 74 HE ARG 74 0.678 -15.601 -2.425 910 HH11 ARG 74 HH11 ARG 74 -1.517 -12.890 -1.818 911 HH12 ARG 74 HH12 ARG 74 -2.913 -13.732 -2.451 912 HH21 ARG 74 HH21 ARG 74 -1.147 -16.658 -3.259 913 HH22 ARG 74 HH22 ARG 74 -2.704 -15.863 -3.265 914 H GLY 75 H GLY 75 4.158 -12.371 2.428 915 HA2 GLY 75 HA2 GLY 75 3.098 -13.483 4.577 916 HA3 GLY 75 HA3 GLY 75 3.109 -14.903 3.487 917 H GLY 76 H GLY 76 5.608 -13.419 2.263 918 HA2 GLY 76 HA2 GLY 76 7.740 -13.371 4.078 919 HA3 GLY 76 HA3 GLY 76 7.588 -15.055 3.541 Start of MODEL 16 1 H LEU 491 H LEU 491 14.811 7.423 10.004 2 HA LEU 491 HA LEU 491 17.366 6.735 9.853 3 HB2 LEU 491 HB2 LEU 491 15.851 4.375 9.253 4 HB3 LEU 491 HB3 LEU 491 16.644 4.914 10.738 5 HG LEU 491 HG LEU 491 14.568 6.252 11.289 6 HD11 LEU 491 HD11 LEU 491 12.479 5.545 10.165 7 HD12 LEU 491 HD12 LEU 491 13.563 6.275 8.968 8 HD13 LEU 491 HD13 LEU 491 13.410 4.510 9.054 9 HD21 LEU 491 HD21 LEU 491 14.359 3.239 10.950 10 HD22 LEU 491 HD22 LEU 491 15.125 4.103 12.305 11 HD23 LEU 491 HD23 LEU 491 13.370 4.233 12.055 12 HA PRO 492 HA PRO 492 18.288 6.198 5.484 13 HB2 PRO 492 HB2 PRO 492 20.876 5.429 5.760 14 HB3 PRO 492 HB3 PRO 492 20.340 7.084 6.186 15 HG2 PRO 492 HG2 PRO 492 20.779 4.736 8.035 16 HG3 PRO 492 HG3 PRO 492 21.355 6.423 8.231 17 HD2 PRO 492 HD2 PRO 492 19.058 5.444 9.419 18 HD3 PRO 492 HD3 PRO 492 19.207 7.154 8.936 19 H LEU 493 H LEU 493 19.888 4.186 4.494 20 HA LEU 493 HA LEU 493 18.181 1.913 4.733 21 HB2 LEU 493 HB2 LEU 493 19.496 0.965 2.986 22 HB3 LEU 493 HB3 LEU 493 19.287 2.687 2.633 23 HG LEU 493 HG LEU 493 21.806 1.344 3.722 24 HD11 LEU 493 HD11 LEU 493 21.158 2.698 1.074 25 HD12 LEU 493 HD12 LEU 493 22.725 2.003 1.529 26 HD13 LEU 493 HD13 LEU 493 21.309 0.945 1.337 27 HD21 LEU 493 HD21 LEU 493 22.849 3.595 3.332 28 HD22 LEU 493 HD22 LEU 493 21.217 4.267 3.094 29 HD23 LEU 493 HD23 LEU 493 21.689 3.571 4.672 30 H GLN 494 H GLN 494 19.453 2.630 7.148 31 HA GLN 494 HA GLN 494 21.444 0.751 7.922 32 HB2 GLN 494 HB2 GLN 494 20.869 1.430 10.169 33 HB3 GLN 494 HB3 GLN 494 20.980 2.811 9.055 34 HG2 GLN 494 HG2 GLN 494 19.141 3.386 10.293 35 HG3 GLN 494 HG3 GLN 494 18.443 2.673 8.834 36 HE21 GLN 494 HE21 GLN 494 16.500 2.484 10.169 37 HE22 GLN 494 HE22 GLN 494 16.320 1.100 11.228 38 H ALA 495 H ALA 495 17.968 0.523 7.590 39 HA ALA 495 HA ALA 495 18.197 -2.389 8.002 40 HB1 ALA 495 HB1 ALA 495 17.660 -1.532 10.252 41 HB2 ALA 495 HB2 ALA 495 16.267 -0.653 9.591 42 HB3 ALA 495 HB3 ALA 495 16.280 -2.433 9.584 43 H LEU 496 H LEU 496 17.178 0.062 6.053 44 HA LEU 496 HA LEU 496 14.557 -0.871 5.324 45 HB2 LEU 496 HB2 LEU 496 16.668 0.848 3.958 46 HB3 LEU 496 HB3 LEU 496 15.055 0.595 3.299 47 HG LEU 496 HG LEU 496 15.595 1.773 6.059 48 HD11 LEU 496 HD11 LEU 496 14.818 3.122 3.443 49 HD12 LEU 496 HD12 LEU 496 14.935 3.911 5.036 50 HD13 LEU 496 HD13 LEU 496 16.395 3.242 4.267 51 HD21 LEU 496 HD21 LEU 496 13.365 0.680 5.840 52 HD22 LEU 496 HD22 LEU 496 13.227 2.445 5.933 53 HD23 LEU 496 HD23 LEU 496 13.061 1.626 4.364 54 HA PRO 497 HA PRO 497 15.231 -4.238 2.616 55 HB2 PRO 497 HB2 PRO 497 13.935 -2.596 0.449 56 HB3 PRO 497 HB3 PRO 497 13.545 -4.269 0.961 57 HG2 PRO 497 HG2 PRO 497 11.953 -2.240 1.747 58 HG3 PRO 497 HG3 PRO 497 12.457 -3.483 2.948 59 HD2 PRO 497 HD2 PRO 497 13.629 -0.735 2.497 60 HD3 PRO 497 HD3 PRO 497 13.189 -1.530 4.042 61 H GLU 498 H GLU 498 16.612 -4.993 0.924 62 HA GLU 498 HA GLU 498 18.665 -3.087 0.089 63 HB2 GLU 498 HB2 GLU 498 19.110 -5.436 0.913 64 HB3 GLU 498 HB3 GLU 498 18.415 -6.037 -0.615 65 HG2 GLU 498 HG2 GLU 498 20.135 -4.878 -1.897 66 HG3 GLU 498 HG3 GLU 498 20.669 -4.001 -0.458 67 H GLY 499 H GLY 499 16.668 -2.030 -0.888 68 HA2 GLY 499 HA2 GLY 499 16.913 -1.830 -3.657 69 HA3 GLY 499 HA3 GLY 499 15.674 -3.076 -3.366 70 H VAL 500 H VAL 500 16.180 -0.293 -1.198 71 HA VAL 500 HA VAL 500 13.807 1.109 -2.283 72 HB VAL 500 HB VAL 500 14.080 -0.069 0.502 73 HG11 VAL 500 HG11 VAL 500 12.110 2.075 -0.417 74 HG12 VAL 500 HG12 VAL 500 11.960 1.122 1.071 75 HG13 VAL 500 HG13 VAL 500 13.323 2.223 0.883 76 HG21 VAL 500 HG21 VAL 500 11.911 -0.161 -1.637 77 HG22 VAL 500 HG22 VAL 500 13.010 -1.490 -1.207 78 HG23 VAL 500 HG23 VAL 500 11.802 -0.917 -0.036 79 H ASP 501 H ASP 501 13.537 3.237 -1.199 80 HA ASP 501 HA ASP 501 16.090 4.457 -0.230 81 HB2 ASP 501 HB2 ASP 501 14.453 5.051 -2.688 82 HB3 ASP 501 HB3 ASP 501 15.075 6.421 -1.776 83 H GLN 502 H GLN 502 15.867 6.005 1.223 84 HA GLN 502 HA GLN 502 13.512 5.985 2.823 85 HB2 GLN 502 HB2 GLN 502 14.763 8.057 3.847 86 HB3 GLN 502 HB3 GLN 502 15.345 6.420 4.098 87 HG2 GLN 502 HG2 GLN 502 16.383 8.157 1.820 88 HG3 GLN 502 HG3 GLN 502 17.046 8.218 3.460 89 HE21 GLN 502 HE21 GLN 502 16.190 5.078 3.311 90 HE22 GLN 502 HE22 GLN 502 17.667 4.390 2.669 91 H GLU 503 H GLU 503 14.648 8.215 0.262 92 HA GLU 503 HA GLU 503 12.675 10.217 0.905 93 HB2 GLU 503 HB2 GLU 503 13.358 11.297 -1.126 94 HB3 GLU 503 HB3 GLU 503 14.810 10.660 -0.316 95 HG2 GLU 503 HG2 GLU 503 14.519 8.587 -1.822 96 HG3 GLU 503 HG3 GLU 503 13.361 9.552 -2.746 97 H VAL 504 H VAL 504 12.164 7.143 -0.086 98 HA VAL 504 HA VAL 504 9.556 7.918 -1.250 99 HB VAL 504 HB VAL 504 9.567 6.222 -2.852 100 HG11 VAL 504 HG11 VAL 504 12.149 7.797 -3.132 101 HG12 VAL 504 HG12 VAL 504 11.205 7.075 -4.447 102 HG13 VAL 504 HG13 VAL 504 10.519 8.412 -3.499 103 HG21 VAL 504 HG21 VAL 504 11.542 4.858 -3.423 104 HG22 VAL 504 HG22 VAL 504 12.448 5.588 -2.085 105 HG23 VAL 504 HG23 VAL 504 11.048 4.539 -1.747 106 H PHE 505 H PHE 505 10.969 6.743 1.352 107 HA PHE 505 HA PHE 505 8.864 4.685 1.845 108 HB2 PHE 505 HB2 PHE 505 10.698 3.378 2.128 109 HB3 PHE 505 HB3 PHE 505 11.778 4.749 2.316 110 HD1 PHE 505 HD1 PHE 505 12.184 5.815 4.454 111 HD2 PHE 505 HD2 PHE 505 9.670 2.345 4.129 112 HE1 PHE 505 HE1 PHE 505 12.430 5.414 6.886 113 HE2 PHE 505 HE2 PHE 505 9.938 1.925 6.570 114 HZ PHE 505 HZ PHE 505 11.311 3.463 7.945 115 H LYS 506 H LYS 506 10.171 7.757 2.619 116 HA LYS 506 HA LYS 506 8.937 7.921 5.269 117 HB2 LYS 506 HB2 LYS 506 10.313 9.927 3.453 118 HB3 LYS 506 HB3 LYS 506 9.613 10.352 5.033 119 HG2 LYS 506 HG2 LYS 506 11.014 8.656 6.144 120 HG3 LYS 506 HG3 LYS 506 11.788 8.246 4.608 121 HD2 LYS 506 HD2 LYS 506 11.806 10.993 5.923 122 HD3 LYS 506 HD3 LYS 506 13.141 9.817 5.954 123 HE2 LYS 506 HE2 LYS 506 13.344 9.934 3.519 124 HE3 LYS 506 HE3 LYS 506 11.976 11.064 3.435 125 HZ1 LYS 506 HZ1 LYS 506 13.229 12.637 4.688 126 HZ2 LYS 506 HZ2 LYS 506 14.465 11.588 4.908 127 HZ3 LYS 506 HZ3 LYS 506 14.142 12.168 3.402 128 H GLN 507 H GLN 507 7.326 7.337 2.713 129 HA GLN 507 HA GLN 507 5.579 9.713 2.552 130 HB2 GLN 507 HB2 GLN 507 5.135 7.137 1.047 131 HB3 GLN 507 HB3 GLN 507 4.777 8.798 0.561 132 HG2 GLN 507 HG2 GLN 507 7.507 7.451 0.738 133 HG3 GLN 507 HG3 GLN 507 6.651 7.882 -0.733 134 HE21 GLN 507 HE21 GLN 507 9.387 8.712 0.334 135 HE22 GLN 507 HE22 GLN 507 9.325 10.439 0.287 136 H LEU 508 H LEU 508 5.803 7.414 4.746 137 HA LEU 508 HA LEU 508 2.890 6.901 5.072 138 HB2 LEU 508 HB2 LEU 508 3.678 4.509 5.714 139 HB3 LEU 508 HB3 LEU 508 3.447 4.906 4.009 140 HG LEU 508 HG LEU 508 6.191 5.352 5.136 141 HD11 LEU 508 HD11 LEU 508 5.075 2.596 4.489 142 HD12 LEU 508 HD12 LEU 508 6.791 2.988 4.745 143 HD13 LEU 508 HD13 LEU 508 5.648 3.165 6.086 144 HD21 LEU 508 HD21 LEU 508 5.091 4.140 2.553 145 HD22 LEU 508 HD22 LEU 508 5.661 5.809 2.732 146 HD23 LEU 508 HD23 LEU 508 6.804 4.456 2.892 147 HA PRO 509 HA PRO 509 3.567 7.805 9.268 148 HB2 PRO 509 HB2 PRO 509 1.942 5.946 10.558 149 HB3 PRO 509 HB3 PRO 509 1.379 7.435 9.751 150 HG2 PRO 509 HG2 PRO 509 1.426 4.608 8.700 151 HG3 PRO 509 HG3 PRO 509 0.135 5.841 8.518 152 HD2 PRO 509 HD2 PRO 509 1.914 5.296 6.529 153 HD3 PRO 509 HD3 PRO 509 1.321 6.956 6.819 154 H ALA 510 H ALA 510 4.283 7.029 11.370 155 HA ALA 510 HA ALA 510 6.564 5.391 11.252 156 HB1 ALA 510 HB1 ALA 510 4.826 6.190 13.612 157 HB2 ALA 510 HB2 ALA 510 6.504 5.600 13.709 158 HB3 ALA 510 HB3 ALA 510 6.150 7.156 12.920 159 H ASP 511 H ASP 511 3.174 4.569 11.765 160 HA ASP 511 HA ASP 511 3.713 1.937 12.871 161 HB2 ASP 511 HB2 ASP 511 1.212 3.106 11.573 162 HB3 ASP 511 HB3 ASP 511 1.280 1.596 12.491 163 H ILE 512 H ILE 512 4.052 3.237 9.735 164 HA ILE 512 HA ILE 512 4.128 0.423 8.751 165 HB ILE 512 HB ILE 512 3.743 2.876 7.022 166 HG12 ILE 512 HG12 ILE 512 1.703 0.891 8.108 167 HG13 ILE 512 HG13 ILE 512 1.809 2.625 8.477 168 HG21 ILE 512 HG21 ILE 512 3.357 -0.105 6.465 169 HG22 ILE 512 HG22 ILE 512 3.145 1.219 5.297 170 HG23 ILE 512 HG23 ILE 512 4.750 0.855 5.919 171 HD11 ILE 512 HD11 ILE 512 1.121 1.397 5.776 172 HD12 ILE 512 HD12 ILE 512 0.052 2.286 6.870 173 HD13 ILE 512 HD13 ILE 512 1.396 3.134 6.070 174 H GLN 513 H GLN 513 6.005 3.242 9.549 175 HA GLN 513 HA GLN 513 8.285 2.755 7.899 176 HB2 GLN 513 HB2 GLN 513 8.140 3.580 10.833 177 HB3 GLN 513 HB3 GLN 513 9.593 3.664 9.836 178 HG2 GLN 513 HG2 GLN 513 7.031 5.203 9.243 179 HG3 GLN 513 HG3 GLN 513 8.420 5.854 10.133 180 HE21 GLN 513 HE21 GLN 513 7.251 4.698 6.993 181 HE22 GLN 513 HE22 GLN 513 8.534 5.419 6.044 182 H GLU 514 H GLU 514 7.054 1.241 10.875 183 HA GLU 514 HA GLU 514 9.310 -0.488 11.281 184 HB2 GLU 514 HB2 GLU 514 7.894 -1.516 12.986 185 HB3 GLU 514 HB3 GLU 514 7.775 0.254 13.076 186 HG2 GLU 514 HG2 GLU 514 5.647 0.188 11.834 187 HG3 GLU 514 HG3 GLU 514 5.761 -1.577 11.714 188 H GLU 515 H GLU 515 6.801 -0.605 8.935 189 HA GLU 515 HA GLU 515 6.745 -3.563 8.883 190 HB2 GLU 515 HB2 GLU 515 5.344 -1.460 7.187 191 HB3 GLU 515 HB3 GLU 515 5.103 -3.206 7.056 192 HG2 GLU 515 HG2 GLU 515 4.587 -1.619 9.608 193 HG3 GLU 515 HG3 GLU 515 3.361 -1.919 8.379 194 H ILE 516 H ILE 516 8.430 -0.922 7.371 195 HA ILE 516 HA ILE 516 9.235 -2.672 5.093 196 HB ILE 516 HB ILE 516 9.133 0.314 5.510 197 HG12 ILE 516 HG12 ILE 516 7.870 0.371 3.519 198 HG13 ILE 516 HG13 ILE 516 8.256 -1.315 3.105 199 HG21 ILE 516 HG21 ILE 516 10.658 -1.215 3.357 200 HG22 ILE 516 HG22 ILE 516 10.289 0.515 3.281 201 HG23 ILE 516 HG23 ILE 516 11.350 -0.093 4.562 202 HD11 ILE 516 HD11 ILE 516 6.546 -0.458 5.469 203 HD12 ILE 516 HD12 ILE 516 5.923 -0.962 3.879 204 HD13 ILE 516 HD13 ILE 516 6.811 -2.124 4.879 205 H LEU 517 H LEU 517 10.405 -0.908 7.954 206 HA LEU 517 HA LEU 517 13.197 -1.432 7.526 207 HB2 LEU 517 HB2 LEU 517 11.483 -1.068 10.008 208 HB3 LEU 517 HB3 LEU 517 13.241 -1.250 10.078 209 HG LEU 517 HG LEU 517 11.894 0.897 8.389 210 HD11 LEU 517 HD11 LEU 517 11.252 1.162 10.782 211 HD12 LEU 517 HD12 LEU 517 12.968 1.124 11.235 212 HD13 LEU 517 HD13 LEU 517 12.340 2.455 10.229 213 HD21 LEU 517 HD21 LEU 517 14.693 0.715 9.578 214 HD22 LEU 517 HD22 LEU 517 14.295 0.344 7.885 215 HD23 LEU 517 HD23 LEU 517 14.078 1.992 8.511 216 H SER 518 H SER 518 10.627 -3.504 7.741 217 HA SER 518 HA SER 518 12.442 -5.810 8.182 218 HB2 SER 518 HB2 SER 518 9.644 -5.536 9.360 219 HB3 SER 518 HB3 SER 518 10.678 -6.980 9.436 220 HG SER 518 HG SER 518 10.802 -5.663 11.323 221 H GLY 519 H GLY 519 11.173 -4.303 5.867 222 HA2 GLY 519 HA2 GLY 519 9.390 -6.391 4.720 223 HA3 GLY 519 HA3 GLY 519 9.428 -4.679 4.251 224 H LYS 520 H LYS 520 12.002 -7.098 4.734 225 HA LYS 520 HA LYS 520 13.782 -6.179 2.822 226 HB2 LYS 520 HB2 LYS 520 14.970 -8.210 3.274 227 HB3 LYS 520 HB3 LYS 520 14.258 -7.529 4.760 228 HG2 LYS 520 HG2 LYS 520 12.326 -9.089 4.526 229 HG3 LYS 520 HG3 LYS 520 13.120 -9.821 3.112 230 HD2 LYS 520 HD2 LYS 520 15.065 -10.412 4.510 231 HD3 LYS 520 HD3 LYS 520 14.270 -9.644 5.923 232 HE2 LYS 520 HE2 LYS 520 12.316 -11.097 5.603 233 HE3 LYS 520 HE3 LYS 520 13.093 -11.854 4.213 234 HZ1 LYS 520 HZ1 LYS 520 13.358 -13.201 6.205 235 HZ2 LYS 520 HZ2 LYS 520 14.825 -12.661 5.702 236 HZ3 LYS 520 HZ3 LYS 520 14.094 -11.963 6.994 237 H SER 521 H SER 521 10.882 -7.425 1.875 238 HA SER 521 HA SER 521 11.958 -8.266 -0.742 239 HB2 SER 521 HB2 SER 521 11.868 -10.302 0.754 240 HB3 SER 521 HB3 SER 521 10.103 -10.101 0.818 241 HG SER 521 HG SER 521 10.827 -11.522 -0.845 242 H ARG 522 H ARG 522 9.877 -9.141 -1.981 243 HA ARG 522 HA ARG 522 8.075 -8.597 -3.180 244 HB2 ARG 522 HB2 ARG 522 7.244 -8.329 -0.464 245 HB3 ARG 522 HB3 ARG 522 6.527 -6.983 -1.354 246 HG2 ARG 522 HG2 ARG 522 5.030 -8.902 -1.430 247 HG3 ARG 522 HG3 ARG 522 5.668 -8.576 -3.058 248 HD2 ARG 522 HD2 ARG 522 5.647 -10.996 -2.522 249 HD3 ARG 522 HD3 ARG 522 7.296 -10.411 -2.812 250 HE ARG 522 HE ARG 522 6.804 -10.187 -0.041 251 HH11 ARG 522 HH11 ARG 522 7.162 -12.733 -2.470 252 HH12 ARG 522 HH12 ARG 522 7.724 -13.911 -1.308 253 HH21 ARG 522 HH21 ARG 522 7.507 -11.735 1.440 254 HH22 ARG 522 HH22 ARG 522 7.947 -13.335 0.911 255 H GLU 523 H GLU 523 10.264 -6.274 -2.431 256 HA GLU 523 HA GLU 523 9.152 -4.608 -4.558 257 HB2 GLU 523 HB2 GLU 523 9.275 -2.516 -3.249 258 HB3 GLU 523 HB3 GLU 523 8.046 -3.640 -2.648 259 HG2 GLU 523 HG2 GLU 523 9.719 -4.421 -0.909 260 HG3 GLU 523 HG3 GLU 523 10.782 -3.102 -1.431 261 H ASN 524 H ASN 524 10.682 -3.274 -5.565 262 HA ASN 524 HA ASN 524 13.477 -3.282 -4.638 263 HB2 ASN 524 HB2 ASN 524 12.420 -4.731 -7.095 264 HB3 ASN 524 HB3 ASN 524 14.056 -4.081 -7.075 265 HD21 ASN 524 HD21 ASN 524 11.935 -6.594 -5.808 266 HD22 ASN 524 HD22 ASN 524 13.200 -7.497 -5.002 267 H LEU 525 H LEU 525 11.772 -1.186 -4.661 268 HA LEU 525 HA LEU 525 11.329 0.863 -5.446 269 HB2 LEU 525 HB2 LEU 525 13.225 2.245 -5.858 270 HB3 LEU 525 HB3 LEU 525 13.439 1.150 -4.498 271 HG LEU 525 HG LEU 525 14.813 -0.341 -5.999 272 HD11 LEU 525 HD11 LEU 525 13.981 0.475 -8.150 273 HD12 LEU 525 HD12 LEU 525 14.575 2.109 -7.798 274 HD13 LEU 525 HD13 LEU 525 15.737 0.775 -8.053 275 HD21 LEU 525 HD21 LEU 525 15.704 2.547 -5.610 276 HD22 LEU 525 HD22 LEU 525 15.796 1.253 -4.389 277 HD23 LEU 525 HD23 LEU 525 16.793 1.154 -5.854 278 H LYS 526 H LYS 526 11.415 -1.441 -7.491 279 HA LYS 526 HA LYS 526 10.456 0.200 -9.789 280 HB2 LYS 526 HB2 LYS 526 11.867 -2.472 -9.538 281 HB3 LYS 526 HB3 LYS 526 11.034 -2.018 -11.043 282 HG2 LYS 526 HG2 LYS 526 12.506 -0.177 -11.421 283 HG3 LYS 526 HG3 LYS 526 13.217 -0.295 -9.805 284 HD2 LYS 526 HD2 LYS 526 13.371 -2.548 -11.831 285 HD3 LYS 526 HD3 LYS 526 14.620 -1.289 -11.679 286 HE2 LYS 526 HE2 LYS 526 14.933 -1.900 -9.292 287 HE3 LYS 526 HE3 LYS 526 13.730 -3.182 -9.447 288 HZ1 LYS 526 HZ1 LYS 526 15.967 -4.013 -9.696 289 HZ2 LYS 526 HZ2 LYS 526 15.128 -4.221 -11.097 290 HZ3 LYS 526 HZ3 LYS 526 16.244 -3.018 -10.968 291 H1 MET 1 H1 MET 1 -14.287 12.599 -13.322 292 H2 MET 1 H2 MET 1 -14.184 11.202 -12.454 293 H3 MET 1 H3 MET 1 -13.386 11.341 -13.883 294 HA MET 1 HA MET 1 -11.947 13.029 -13.004 295 HB2 MET 1 HB2 MET 1 -12.055 13.754 -10.767 296 HB3 MET 1 HB3 MET 1 -13.723 13.843 -11.352 297 HG2 MET 1 HG2 MET 1 -14.215 11.672 -10.251 298 HG3 MET 1 HG3 MET 1 -12.541 11.547 -9.725 299 HE1 MET 1 HE1 MET 1 -14.198 12.164 -6.296 300 HE2 MET 1 HE2 MET 1 -14.663 11.094 -7.642 301 HE3 MET 1 HE3 MET 1 -12.946 11.275 -7.193 302 H GLN 2 H GLN 2 -10.234 12.570 -11.153 303 HA GLN 2 HA GLN 2 -9.965 9.744 -10.525 304 HB2 GLN 2 HB2 GLN 2 -7.982 9.359 -11.869 305 HB3 GLN 2 HB3 GLN 2 -9.242 9.995 -12.942 306 HG2 GLN 2 HG2 GLN 2 -8.131 12.329 -12.224 307 HG3 GLN 2 HG3 GLN 2 -6.755 11.325 -11.859 308 HE21 GLN 2 HE21 GLN 2 -5.596 12.499 -13.560 309 HE22 GLN 2 HE22 GLN 2 -5.867 12.105 -15.246 310 H ILE 3 H ILE 3 -7.744 9.402 -9.505 311 HA ILE 3 HA ILE 3 -6.695 11.830 -8.147 312 HB ILE 3 HB ILE 3 -6.696 10.840 -6.018 313 HG12 ILE 3 HG12 ILE 3 -7.135 8.229 -7.439 314 HG13 ILE 3 HG13 ILE 3 -6.044 8.672 -6.148 315 HG21 ILE 3 HG21 ILE 3 -9.407 10.193 -7.222 316 HG22 ILE 3 HG22 ILE 3 -9.046 10.593 -5.522 317 HG23 ILE 3 HG23 ILE 3 -8.827 11.817 -6.776 318 HD11 ILE 3 HD11 ILE 3 -9.041 8.216 -5.879 319 HD12 ILE 3 HD12 ILE 3 -7.737 7.169 -5.286 320 HD13 ILE 3 HD13 ILE 3 -7.985 8.774 -4.559 321 H PHE 4 H PHE 4 -4.665 10.874 -6.760 322 HA PHE 4 HA PHE 4 -3.146 9.048 -8.579 323 HB2 PHE 4 HB2 PHE 4 -2.061 11.609 -7.305 324 HB3 PHE 4 HB3 PHE 4 -1.213 10.471 -8.262 325 HD1 PHE 4 HD1 PHE 4 -1.634 10.148 -10.658 326 HD2 PHE 4 HD2 PHE 4 -3.558 13.277 -8.413 327 HE1 PHE 4 HE1 PHE 4 -2.099 11.349 -12.751 328 HE2 PHE 4 HE2 PHE 4 -4.059 14.475 -10.529 329 HZ PHE 4 HZ PHE 4 -3.321 13.525 -12.704 330 H VAL 5 H VAL 5 -2.285 7.384 -7.504 331 HA VAL 5 HA VAL 5 -1.960 7.708 -4.552 332 HB VAL 5 HB VAL 5 -2.873 5.209 -6.026 333 HG11 VAL 5 HG11 VAL 5 -2.747 5.984 -3.077 334 HG12 VAL 5 HG12 VAL 5 -3.398 4.461 -3.727 335 HG13 VAL 5 HG13 VAL 5 -1.669 4.832 -3.907 336 HG21 VAL 5 HG21 VAL 5 -4.474 7.290 -4.465 337 HG22 VAL 5 HG22 VAL 5 -4.668 6.912 -6.179 338 HG23 VAL 5 HG23 VAL 5 -5.095 5.704 -4.960 339 H LYS 6 H LYS 6 0.088 7.444 -3.899 340 HA LYS 6 HA LYS 6 1.990 6.360 -5.904 341 HB2 LYS 6 HB2 LYS 6 2.327 8.686 -5.296 342 HB3 LYS 6 HB3 LYS 6 2.335 8.274 -3.572 343 HG2 LYS 6 HG2 LYS 6 4.380 6.948 -3.860 344 HG3 LYS 6 HG3 LYS 6 4.382 7.275 -5.608 345 HD2 LYS 6 HD2 LYS 6 4.403 9.474 -3.523 346 HD3 LYS 6 HD3 LYS 6 5.903 8.703 -4.124 347 HE2 LYS 6 HE2 LYS 6 5.340 9.336 -6.412 348 HE3 LYS 6 HE3 LYS 6 3.833 10.104 -5.849 349 HZ1 LYS 6 HZ1 LYS 6 5.173 11.616 -4.556 350 HZ2 LYS 6 HZ2 LYS 6 6.560 10.918 -5.092 351 HZ3 LYS 6 HZ3 LYS 6 5.578 11.710 -6.145 352 H THR 7 H THR 7 3.560 4.916 -5.445 353 HA THR 7 HA THR 7 2.885 2.958 -3.373 354 HB THR 7 HB THR 7 4.555 1.604 -4.646 355 HG1 THR 7 HG1 THR 7 5.580 2.538 -6.357 356 HG21 THR 7 HG21 THR 7 3.321 1.489 -6.769 357 HG22 THR 7 HG22 THR 7 2.198 1.656 -5.401 358 HG23 THR 7 HG23 THR 7 2.552 3.060 -6.434 359 H LEU 8 H LEU 8 4.870 1.708 -2.537 360 HA LEU 8 HA LEU 8 6.538 3.360 -0.898 361 HB2 LEU 8 HB2 LEU 8 5.552 0.967 -0.606 362 HB3 LEU 8 HB3 LEU 8 6.941 0.416 -1.535 363 HG LEU 8 HG LEU 8 7.078 0.180 0.951 364 HD11 LEU 8 HD11 LEU 8 9.178 0.405 -0.508 365 HD12 LEU 8 HD12 LEU 8 9.283 2.073 0.123 366 HD13 LEU 8 HD13 LEU 8 9.342 0.700 1.232 367 HD21 LEU 8 HD21 LEU 8 7.346 3.204 0.956 368 HD22 LEU 8 HD22 LEU 8 5.937 2.279 1.541 369 HD23 LEU 8 HD23 LEU 8 7.514 2.121 2.349 370 H THR 9 H THR 9 6.699 3.126 -4.149 371 HA THR 9 HA THR 9 9.672 2.926 -4.210 372 HB THR 9 HB THR 9 9.510 1.870 -6.398 373 HG1 THR 9 HG1 THR 9 7.480 1.227 -7.157 374 HG21 THR 9 HG21 THR 9 9.489 0.467 -4.312 375 HG22 THR 9 HG22 THR 9 7.720 0.440 -4.386 376 HG23 THR 9 HG23 THR 9 8.670 -0.310 -5.688 377 H GLY 10 H GLY 10 7.333 5.149 -4.316 378 HA2 GLY 10 HA2 GLY 10 7.434 7.322 -4.969 379 HA3 GLY 10 HA3 GLY 10 9.026 7.048 -5.704 380 H LYS 11 H LYS 11 6.138 5.181 -6.558 381 HA LYS 11 HA LYS 11 5.892 6.736 -9.108 382 HB2 LYS 11 HB2 LYS 11 6.829 4.425 -9.319 383 HB3 LYS 11 HB3 LYS 11 5.369 3.785 -8.540 384 HG2 LYS 11 HG2 LYS 11 3.967 4.882 -10.342 385 HG3 LYS 11 HG3 LYS 11 5.469 5.327 -11.172 386 HD2 LYS 11 HD2 LYS 11 4.537 3.323 -12.156 387 HD3 LYS 11 HD3 LYS 11 6.047 2.906 -11.296 388 HE2 LYS 11 HE2 LYS 11 4.716 2.098 -9.378 389 HE3 LYS 11 HE3 LYS 11 3.221 2.596 -10.196 390 HZ1 LYS 11 HZ1 LYS 11 3.762 1.020 -11.947 391 HZ2 LYS 11 HZ2 LYS 11 5.089 0.516 -11.121 392 HZ3 LYS 11 HZ3 LYS 11 3.586 0.269 -10.504 393 H THR 12 H THR 12 3.949 7.315 -9.745 394 HA THR 12 HA THR 12 1.780 7.001 -7.711 395 HB THR 12 HB THR 12 2.117 9.308 -9.646 396 HG1 THR 12 HG1 THR 12 3.070 10.358 -7.920 397 HG21 THR 12 HG21 THR 12 -0.066 8.976 -8.727 398 HG22 THR 12 HG22 THR 12 0.591 8.869 -7.067 399 HG23 THR 12 HG23 THR 12 0.725 10.398 -7.979 400 H ILE 13 H ILE 13 -0.282 6.458 -8.477 401 HA ILE 13 HA ILE 13 -0.455 5.744 -11.374 402 HB ILE 13 HB ILE 13 -1.503 4.161 -8.998 403 HG12 ILE 13 HG12 ILE 13 0.875 3.636 -10.850 404 HG13 ILE 13 HG13 ILE 13 0.946 4.031 -9.128 405 HG21 ILE 13 HG21 ILE 13 -1.425 3.519 -11.975 406 HG22 ILE 13 HG22 ILE 13 -2.096 2.485 -10.690 407 HG23 ILE 13 HG23 ILE 13 -2.876 4.024 -11.076 408 HD11 ILE 13 HD11 ILE 13 -0.246 1.509 -10.341 409 HD12 ILE 13 HD12 ILE 13 1.241 1.648 -9.388 410 HD13 ILE 13 HD13 ILE 13 -0.333 1.946 -8.618 411 H THR 14 H THR 14 -2.250 6.394 -12.403 412 HA THR 14 HA THR 14 -3.966 8.261 -10.932 413 HB THR 14 HB THR 14 -4.052 7.534 -13.884 414 HG1 THR 14 HG1 THR 14 -1.940 8.144 -13.369 415 HG21 THR 14 HG21 THR 14 -4.854 9.860 -14.062 416 HG22 THR 14 HG22 THR 14 -5.901 8.910 -12.982 417 HG23 THR 14 HG23 THR 14 -4.705 10.044 -12.294 418 H LEU 15 H LEU 15 -6.143 7.898 -10.470 419 HA LEU 15 HA LEU 15 -7.329 5.321 -11.387 420 HB2 LEU 15 HB2 LEU 15 -7.035 6.230 -8.503 421 HB3 LEU 15 HB3 LEU 15 -7.903 4.786 -9.041 422 HG LEU 15 HG LEU 15 -4.931 5.265 -9.499 423 HD11 LEU 15 HD11 LEU 15 -6.334 3.573 -7.382 424 HD12 LEU 15 HD12 LEU 15 -4.572 3.747 -7.615 425 HD13 LEU 15 HD13 LEU 15 -5.552 5.137 -7.090 426 HD21 LEU 15 HD21 LEU 15 -6.617 2.733 -9.662 427 HD22 LEU 15 HD22 LEU 15 -5.966 3.627 -11.054 428 HD23 LEU 15 HD23 LEU 15 -4.860 2.845 -9.893 429 H GLU 16 H GLU 16 -9.459 5.414 -11.697 430 HA GLU 16 HA GLU 16 -10.879 7.972 -11.230 431 HB2 GLU 16 HB2 GLU 16 -11.006 7.052 -13.456 432 HB3 GLU 16 HB3 GLU 16 -11.419 5.441 -12.835 433 HG2 GLU 16 HG2 GLU 16 -13.542 6.255 -11.985 434 HG3 GLU 16 HG3 GLU 16 -13.162 7.914 -12.487 435 H VAL 17 H VAL 17 -12.339 8.247 -9.723 436 HA VAL 17 HA VAL 17 -13.664 5.968 -8.387 437 HB VAL 17 HB VAL 17 -13.063 6.809 -6.161 438 HG11 VAL 17 HG11 VAL 17 -11.633 5.052 -7.183 439 HG12 VAL 17 HG12 VAL 17 -10.552 6.318 -7.815 440 HG13 VAL 17 HG13 VAL 17 -10.731 6.104 -6.067 441 HG21 VAL 17 HG21 VAL 17 -11.196 8.724 -7.626 442 HG22 VAL 17 HG22 VAL 17 -12.667 9.176 -6.733 443 HG23 VAL 17 HG23 VAL 17 -11.285 8.483 -5.868 444 H GLU 18 H GLU 18 -15.141 6.994 -6.590 445 HA GLU 18 HA GLU 18 -16.151 9.685 -7.295 446 HB2 GLU 18 HB2 GLU 18 -17.948 7.266 -6.839 447 HB3 GLU 18 HB3 GLU 18 -18.465 8.919 -7.202 448 HG2 GLU 18 HG2 GLU 18 -17.258 8.734 -9.409 449 HG3 GLU 18 HG3 GLU 18 -16.934 7.035 -8.999 450 HA PRO 19 HA PRO 19 -16.297 10.162 -2.916 451 HB2 PRO 19 HB2 PRO 19 -19.166 10.997 -3.036 452 HB3 PRO 19 HB3 PRO 19 -17.761 11.871 -2.364 453 HG2 PRO 19 HG2 PRO 19 -18.849 12.601 -4.760 454 HG3 PRO 19 HG3 PRO 19 -17.081 12.647 -4.464 455 HD2 PRO 19 HD2 PRO 19 -18.676 10.548 -5.942 456 HD3 PRO 19 HD3 PRO 19 -17.084 11.265 -6.343 457 H SER 20 H SER 20 -17.984 7.683 -4.405 458 HA SER 20 HA SER 20 -18.956 6.618 -1.800 459 HB2 SER 20 HB2 SER 20 -20.231 6.398 -4.550 460 HB3 SER 20 HB3 SER 20 -20.766 5.533 -3.096 461 HG SER 20 HG SER 20 -21.933 7.482 -3.440 462 H ASP 21 H ASP 21 -16.873 6.284 -4.475 463 HA ASP 21 HA ASP 21 -16.590 3.370 -4.361 464 HB2 ASP 21 HB2 ASP 21 -14.926 5.613 -5.498 465 HB3 ASP 21 HB3 ASP 21 -14.481 3.910 -5.636 466 H THR 22 H THR 22 -16.619 3.623 -1.993 467 HA THR 22 HA THR 22 -14.532 4.850 -0.489 468 HB THR 22 HB THR 22 -16.609 4.277 0.536 469 HG1 THR 22 HG1 THR 22 -15.777 3.328 2.353 470 HG21 THR 22 HG21 THR 22 -15.910 1.396 -0.036 471 HG22 THR 22 HG22 THR 22 -17.193 1.947 1.088 472 HG23 THR 22 HG23 THR 22 -17.317 2.326 -0.638 473 H ILE 23 H ILE 23 -13.193 3.296 1.091 474 HA ILE 23 HA ILE 23 -10.956 2.770 -0.430 475 HB ILE 23 HB ILE 23 -11.543 1.454 2.233 476 HG12 ILE 23 HG12 ILE 23 -12.233 3.745 2.499 477 HG13 ILE 23 HG13 ILE 23 -10.655 3.538 3.260 478 HG21 ILE 23 HG21 ILE 23 -9.120 1.829 2.576 479 HG22 ILE 23 HG22 ILE 23 -9.443 0.809 1.158 480 HG23 ILE 23 HG23 ILE 23 -8.998 2.516 0.939 481 HD11 ILE 23 HD11 ILE 23 -9.577 4.620 1.305 482 HD12 ILE 23 HD12 ILE 23 -11.168 4.775 0.519 483 HD13 ILE 23 HD13 ILE 23 -10.838 5.660 2.018 484 H GLU 24 H GLU 24 -13.511 0.359 0.402 485 HA GLU 24 HA GLU 24 -11.859 -1.851 -0.464 486 HB2 GLU 24 HB2 GLU 24 -13.849 -3.185 -0.301 487 HB3 GLU 24 HB3 GLU 24 -13.808 -2.070 1.080 488 HG2 GLU 24 HG2 GLU 24 -15.401 -0.583 -0.069 489 HG3 GLU 24 HG3 GLU 24 -15.437 -1.675 -1.468 490 H ASN 25 H ASN 25 -13.769 0.531 -2.150 491 HA ASN 25 HA ASN 25 -13.999 -1.002 -4.617 492 HB2 ASN 25 HB2 ASN 25 -14.362 1.945 -4.026 493 HB3 ASN 25 HB3 ASN 25 -14.703 1.198 -5.567 494 HD21 ASN 25 HD21 ASN 25 -15.747 1.669 -2.371 495 HD22 ASN 25 HD22 ASN 25 -17.271 0.764 -2.440 496 H VAL 26 H VAL 26 -11.933 1.463 -3.130 497 HA VAL 26 HA VAL 26 -10.417 2.299 -5.398 498 HB VAL 26 HB VAL 26 -9.733 2.187 -2.440 499 HG11 VAL 26 HG11 VAL 26 -8.434 3.696 -4.727 500 HG12 VAL 26 HG12 VAL 26 -8.107 3.984 -2.998 501 HG13 VAL 26 HG13 VAL 26 -7.717 2.410 -3.720 502 HG21 VAL 26 HG21 VAL 26 -10.881 4.446 -4.140 503 HG22 VAL 26 HG22 VAL 26 -11.772 3.507 -2.920 504 HG23 VAL 26 HG23 VAL 26 -10.435 4.553 -2.417 505 H LYS 27 H LYS 27 -9.946 -0.243 -2.909 506 HA LYS 27 HA LYS 27 -7.378 -1.067 -3.703 507 HB2 LYS 27 HB2 LYS 27 -9.741 -2.498 -2.441 508 HB3 LYS 27 HB3 LYS 27 -8.136 -3.242 -2.662 509 HG2 LYS 27 HG2 LYS 27 -7.068 -1.584 -1.285 510 HG3 LYS 27 HG3 LYS 27 -8.552 -0.622 -1.170 511 HD2 LYS 27 HD2 LYS 27 -9.685 -2.484 0.002 512 HD3 LYS 27 HD3 LYS 27 -8.204 -3.464 -0.124 513 HE2 LYS 27 HE2 LYS 27 -6.965 -1.793 1.174 514 HE3 LYS 27 HE3 LYS 27 -8.406 -0.770 1.281 515 HZ1 LYS 27 HZ1 LYS 27 -9.507 -2.508 2.487 516 HZ2 LYS 27 HZ2 LYS 27 -8.183 -3.487 2.393 517 HZ3 LYS 27 HZ3 LYS 27 -8.126 -2.091 3.262 518 H ALA 28 H ALA 28 -10.542 -1.713 -5.235 519 HA ALA 28 HA ALA 28 -9.475 -3.833 -6.916 520 HB1 ALA 28 HB1 ALA 28 -11.889 -3.654 -6.385 521 HB2 ALA 28 HB2 ALA 28 -11.955 -2.089 -7.230 522 HB3 ALA 28 HB3 ALA 28 -11.591 -3.571 -8.137 523 H LYS 29 H LYS 29 -9.513 -0.331 -6.972 524 HA LYS 29 HA LYS 29 -9.143 0.065 -9.802 525 HB2 LYS 29 HB2 LYS 29 -8.125 1.820 -7.511 526 HB3 LYS 29 HB3 LYS 29 -8.605 2.341 -9.135 527 HG2 LYS 29 HG2 LYS 29 -10.470 1.192 -7.022 528 HG3 LYS 29 HG3 LYS 29 -10.182 2.928 -7.312 529 HD2 LYS 29 HD2 LYS 29 -10.897 2.647 -9.604 530 HD3 LYS 29 HD3 LYS 29 -11.361 0.945 -9.293 531 HE2 LYS 29 HE2 LYS 29 -12.893 1.661 -7.503 532 HE3 LYS 29 HE3 LYS 29 -12.409 3.342 -7.714 533 HZ1 LYS 29 HZ1 LYS 29 -13.811 1.718 -9.730 534 HZ2 LYS 29 HZ2 LYS 29 -14.462 2.929 -8.828 535 HZ3 LYS 29 HZ3 LYS 29 -13.306 3.275 -9.939 536 H ILE 30 H ILE 30 -7.039 -0.185 -6.984 537 HA ILE 30 HA ILE 30 -4.559 0.168 -8.456 538 HB ILE 30 HB ILE 30 -5.274 -0.752 -5.644 539 HG12 ILE 30 HG12 ILE 30 -4.039 1.834 -6.681 540 HG13 ILE 30 HG13 ILE 30 -5.774 1.622 -6.387 541 HG21 ILE 30 HG21 ILE 30 -2.893 -0.454 -5.071 542 HG22 ILE 30 HG22 ILE 30 -3.078 -1.709 -6.297 543 HG23 ILE 30 HG23 ILE 30 -2.517 -0.089 -6.774 544 HD11 ILE 30 HD11 ILE 30 -4.699 2.778 -4.524 545 HD12 ILE 30 HD12 ILE 30 -5.358 1.208 -4.007 546 HD13 ILE 30 HD13 ILE 30 -3.608 1.406 -4.261 547 H GLN 31 H GLN 31 -6.577 -2.581 -7.425 548 HA GLN 31 HA GLN 31 -4.663 -4.631 -8.050 549 HB2 GLN 31 HB2 GLN 31 -6.633 -5.127 -6.695 550 HB3 GLN 31 HB3 GLN 31 -7.711 -4.563 -7.991 551 HG2 GLN 31 HG2 GLN 31 -6.968 -6.344 -9.475 552 HG3 GLN 31 HG3 GLN 31 -5.745 -6.857 -8.328 553 HE21 GLN 31 HE21 GLN 31 -6.530 -8.970 -8.006 554 HE22 GLN 31 HE22 GLN 31 -8.053 -9.297 -7.206 555 H ASP 32 H ASP 32 -7.188 -2.892 -9.921 556 HA ASP 32 HA ASP 32 -7.043 -4.583 -12.200 557 HB2 ASP 32 HB2 ASP 32 -8.904 -3.030 -11.628 558 HB3 ASP 32 HB3 ASP 32 -7.837 -1.668 -11.792 559 H LYS 33 H LYS 33 -5.217 -1.841 -11.096 560 HA LYS 33 HA LYS 33 -4.007 -1.221 -13.675 561 HB2 LYS 33 HB2 LYS 33 -3.869 -0.217 -10.826 562 HB3 LYS 33 HB3 LYS 33 -2.734 0.389 -12.044 563 HG2 LYS 33 HG2 LYS 33 -5.759 0.409 -12.438 564 HG3 LYS 33 HG3 LYS 33 -4.870 1.750 -11.690 565 HD2 LYS 33 HD2 LYS 33 -3.460 1.968 -13.692 566 HD3 LYS 33 HD3 LYS 33 -4.370 0.673 -14.498 567 HE2 LYS 33 HE2 LYS 33 -5.580 3.265 -13.444 568 HE3 LYS 33 HE3 LYS 33 -5.116 2.988 -15.129 569 HZ1 LYS 33 HZ1 LYS 33 -6.696 1.176 -15.197 570 HZ2 LYS 33 HZ2 LYS 33 -7.119 1.423 -13.631 571 HZ3 LYS 33 HZ3 LYS 33 -7.452 2.568 -14.761 572 H GLU 34 H GLU 34 -3.173 -3.285 -10.977 573 HA GLU 34 HA GLU 34 -0.469 -3.640 -12.191 574 HB2 GLU 34 HB2 GLU 34 -1.118 -3.277 -9.240 575 HB3 GLU 34 HB3 GLU 34 0.450 -3.815 -9.845 576 HG2 GLU 34 HG2 GLU 34 -0.771 -1.160 -10.692 577 HG3 GLU 34 HG3 GLU 34 0.180 -1.343 -9.216 578 H GLY 35 H GLY 35 -2.987 -4.937 -9.993 579 HA2 GLY 35 HA2 GLY 35 -3.765 -7.208 -10.465 580 HA3 GLY 35 HA3 GLY 35 -2.076 -7.704 -10.682 581 H ILE 36 H ILE 36 -2.468 -5.372 -8.222 582 HA ILE 36 HA ILE 36 -1.555 -7.275 -6.221 583 HB ILE 36 HB ILE 36 -2.205 -4.302 -6.136 584 HG12 ILE 36 HG12 ILE 36 0.484 -5.738 -6.223 585 HG13 ILE 36 HG13 ILE 36 -0.322 -5.076 -7.650 586 HG21 ILE 36 HG21 ILE 36 -0.708 -6.030 -4.120 587 HG22 ILE 36 HG22 ILE 36 -0.971 -4.271 -4.007 588 HG23 ILE 36 HG23 ILE 36 -2.347 -5.380 -3.892 589 HD11 ILE 36 HD11 ILE 36 0.582 -3.473 -5.219 590 HD12 ILE 36 HD12 ILE 36 1.332 -3.485 -6.828 591 HD13 ILE 36 HD13 ILE 36 -0.300 -2.813 -6.614 592 HA PRO 37 HA PRO 37 -5.708 -8.177 -5.003 593 HB2 PRO 37 HB2 PRO 37 -5.242 -9.582 -2.688 594 HB3 PRO 37 HB3 PRO 37 -4.896 -10.235 -4.317 595 HG2 PRO 37 HG2 PRO 37 -2.977 -8.911 -2.394 596 HG3 PRO 37 HG3 PRO 37 -2.745 -10.436 -3.311 597 HD2 PRO 37 HD2 PRO 37 -1.725 -8.045 -4.161 598 HD3 PRO 37 HD3 PRO 37 -2.353 -9.246 -5.331 599 HA PRO 38 HA PRO 38 -6.790 -5.006 -2.085 600 HB2 PRO 38 HB2 PRO 38 -9.232 -5.923 -1.210 601 HB3 PRO 38 HB3 PRO 38 -8.968 -5.253 -2.851 602 HG2 PRO 38 HG2 PRO 38 -9.019 -8.168 -2.019 603 HG3 PRO 38 HG3 PRO 38 -9.855 -7.391 -3.408 604 HD2 PRO 38 HD2 PRO 38 -7.486 -8.698 -3.702 605 HD3 PRO 38 HD3 PRO 38 -7.846 -7.210 -4.630 606 H ASP 39 H ASP 39 -6.328 -8.342 -1.290 607 HA ASP 39 HA ASP 39 -6.814 -8.038 1.542 608 HB2 ASP 39 HB2 ASP 39 -7.186 -10.145 0.260 609 HB3 ASP 39 HB3 ASP 39 -5.442 -10.256 -0.014 610 H GLN 40 H GLN 40 -4.207 -7.092 -0.490 611 HA GLN 40 HA GLN 40 -2.364 -7.216 1.854 612 HB2 GLN 40 HB2 GLN 40 -1.719 -7.533 -1.091 613 HB3 GLN 40 HB3 GLN 40 -0.528 -7.363 0.212 614 HG2 GLN 40 HG2 GLN 40 -1.591 -9.375 1.337 615 HG3 GLN 40 HG3 GLN 40 -2.540 -9.610 -0.149 616 HE21 GLN 40 HE21 GLN 40 -0.859 -9.216 -2.205 617 HE22 GLN 40 HE22 GLN 40 0.516 -10.299 -2.124 618 H GLN 41 H GLN 41 -3.920 -5.049 -0.448 619 HA GLN 41 HA GLN 41 -1.911 -2.997 -0.346 620 HB2 GLN 41 HB2 GLN 41 -4.919 -2.914 -0.758 621 HB3 GLN 41 HB3 GLN 41 -3.843 -1.529 -0.985 622 HG2 GLN 41 HG2 GLN 41 -2.640 -2.683 -2.782 623 HG3 GLN 41 HG3 GLN 41 -3.603 -4.147 -2.508 624 HE21 GLN 41 HE21 GLN 41 -4.697 -4.221 -4.526 625 HE22 GLN 41 HE22 GLN 41 -5.904 -3.030 -4.924 626 H ARG 42 H ARG 42 -2.163 -0.925 0.684 627 HA ARG 42 HA ARG 42 -4.026 -0.593 2.900 628 HB2 ARG 42 HB2 ARG 42 -1.724 -1.732 3.673 629 HB3 ARG 42 HB3 ARG 42 -1.095 -0.092 3.497 630 HG2 ARG 42 HG2 ARG 42 -1.775 -0.394 5.787 631 HG3 ARG 42 HG3 ARG 42 -2.991 0.672 5.037 632 HD2 ARG 42 HD2 ARG 42 -4.484 -1.270 4.704 633 HD3 ARG 42 HD3 ARG 42 -3.243 -2.347 5.380 634 HE ARG 42 HE ARG 42 -3.782 -0.341 7.300 635 HH11 ARG 42 HH11 ARG 42 -5.398 -3.087 5.761 636 HH12 ARG 42 HH12 ARG 42 -6.451 -3.376 7.127 637 HH21 ARG 42 HH21 ARG 42 -5.185 -0.719 9.033 638 HH22 ARG 42 HH22 ARG 42 -6.323 -2.047 8.988 639 H LEU 43 H LEU 43 -4.398 1.717 3.223 640 HA LEU 43 HA LEU 43 -2.949 3.424 1.267 641 HB2 LEU 43 HB2 LEU 43 -5.369 2.197 0.773 642 HB3 LEU 43 HB3 LEU 43 -5.902 3.771 1.374 643 HG LEU 43 HG LEU 43 -3.791 3.405 -0.785 644 HD11 LEU 43 HD11 LEU 43 -6.800 3.775 -1.103 645 HD12 LEU 43 HD12 LEU 43 -5.608 3.815 -2.424 646 HD13 LEU 43 HD13 LEU 43 -5.876 2.313 -1.516 647 HD21 LEU 43 HD21 LEU 43 -5.653 5.743 -0.148 648 HD22 LEU 43 HD22 LEU 43 -3.926 5.671 0.278 649 HD23 LEU 43 HD23 LEU 43 -4.417 5.698 -1.426 650 H ILE 44 H ILE 44 -2.715 5.538 1.814 651 HA ILE 44 HA ILE 44 -3.941 6.471 4.360 652 HB ILE 44 HB ILE 44 -1.014 6.658 3.536 653 HG12 ILE 44 HG12 ILE 44 -0.779 5.794 5.971 654 HG13 ILE 44 HG13 ILE 44 -2.480 5.355 5.866 655 HG21 ILE 44 HG21 ILE 44 -2.459 8.018 5.859 656 HG22 ILE 44 HG22 ILE 44 -0.709 7.985 5.624 657 HG23 ILE 44 HG23 ILE 44 -1.717 8.837 4.460 658 HD11 ILE 44 HD11 ILE 44 -0.289 4.372 3.974 659 HD12 ILE 44 HD12 ILE 44 -0.917 3.477 5.380 660 HD13 ILE 44 HD13 ILE 44 -1.981 3.800 4.018 661 H PHE 45 H PHE 45 -4.342 8.696 4.457 662 HA PHE 45 HA PHE 45 -3.642 10.447 2.183 663 HB2 PHE 45 HB2 PHE 45 -5.772 9.381 1.527 664 HB3 PHE 45 HB3 PHE 45 -6.482 9.813 3.086 665 HD1 PHE 45 HD1 PHE 45 -4.672 11.545 0.282 666 HD2 PHE 45 HD2 PHE 45 -7.909 11.646 3.111 667 HE1 PHE 45 HE1 PHE 45 -5.508 13.617 -0.764 668 HE2 PHE 45 HE2 PHE 45 -8.732 13.751 2.097 669 HZ PHE 45 HZ PHE 45 -7.528 14.751 0.160 670 H ALA 46 H ALA 46 -3.310 12.500 2.892 671 HA ALA 46 HA ALA 46 -2.780 14.094 4.385 672 HB1 ALA 46 HB1 ALA 46 -5.203 14.501 4.074 673 HB2 ALA 46 HB2 ALA 46 -5.554 13.470 5.478 674 HB3 ALA 46 HB3 ALA 46 -4.651 14.985 5.694 675 H GLY 47 H GLY 47 -2.212 11.189 5.182 676 HA2 GLY 47 HA2 GLY 47 -0.969 10.299 6.902 677 HA3 GLY 47 HA3 GLY 47 -1.237 11.769 7.893 678 H LYS 48 H LYS 48 -3.920 10.070 6.372 679 HA LYS 48 HA LYS 48 -4.496 8.721 8.931 680 HB2 LYS 48 HB2 LYS 48 -5.959 10.727 7.906 681 HB3 LYS 48 HB3 LYS 48 -6.590 9.392 6.875 682 HG2 LYS 48 HG2 LYS 48 -6.465 8.086 9.141 683 HG3 LYS 48 HG3 LYS 48 -6.505 9.718 9.836 684 HD2 LYS 48 HD2 LYS 48 -8.558 8.467 7.905 685 HD3 LYS 48 HD3 LYS 48 -8.853 8.682 9.629 686 HE2 LYS 48 HE2 LYS 48 -8.342 10.917 7.615 687 HE3 LYS 48 HE3 LYS 48 -9.931 10.416 8.212 688 HZ1 LYS 48 HZ1 LYS 48 -9.224 11.026 10.428 689 HZ2 LYS 48 HZ2 LYS 48 -7.748 11.493 9.882 690 HZ3 LYS 48 HZ3 LYS 48 -9.094 12.313 9.416 691 H GLN 49 H GLN 49 -4.421 6.555 8.769 692 HA GLN 49 HA GLN 49 -4.469 5.185 6.188 693 HB2 GLN 49 HB2 GLN 49 -3.146 4.356 8.104 694 HB3 GLN 49 HB3 GLN 49 -4.625 4.171 9.058 695 HG2 GLN 49 HG2 GLN 49 -5.472 2.510 7.408 696 HG3 GLN 49 HG3 GLN 49 -4.005 2.730 6.440 697 HE21 GLN 49 HE21 GLN 49 -1.888 2.193 7.504 698 HE22 GLN 49 HE22 GLN 49 -1.870 0.903 8.689 699 H LEU 50 H LEU 50 -6.324 5.137 5.066 700 HA LEU 50 HA LEU 50 -8.847 5.725 6.297 701 HB2 LEU 50 HB2 LEU 50 -8.359 4.515 3.552 702 HB3 LEU 50 HB3 LEU 50 -9.802 5.342 4.126 703 HG LEU 50 HG LEU 50 -8.859 6.957 2.833 704 HD11 LEU 50 HD11 LEU 50 -7.435 7.590 5.442 705 HD12 LEU 50 HD12 LEU 50 -8.019 8.732 4.210 706 HD13 LEU 50 HD13 LEU 50 -9.177 7.808 5.192 707 HD21 LEU 50 HD21 LEU 50 -6.079 6.325 3.876 708 HD22 LEU 50 HD22 LEU 50 -6.766 5.735 2.339 709 HD23 LEU 50 HD23 LEU 50 -6.519 7.474 2.593 710 H GLU 51 H GLU 51 -10.844 4.227 5.864 711 HA GLU 51 HA GLU 51 -10.105 1.385 6.396 712 HB2 GLU 51 HB2 GLU 51 -11.939 3.209 7.972 713 HB3 GLU 51 HB3 GLU 51 -12.142 1.447 7.982 714 HG2 GLU 51 HG2 GLU 51 -9.838 1.139 8.748 715 HG3 GLU 51 HG3 GLU 51 -9.563 2.886 8.683 716 H ASP 52 H ASP 52 -11.686 -0.134 5.928 717 HA ASP 52 HA ASP 52 -13.021 0.385 3.425 718 HB2 ASP 52 HB2 ASP 52 -12.991 -2.049 5.253 719 HB3 ASP 52 HB3 ASP 52 -13.571 -2.025 3.583 720 H GLY 53 H GLY 53 -13.989 1.238 6.436 721 HA2 GLY 53 HA2 GLY 53 -16.842 0.505 5.984 722 HA3 GLY 53 HA3 GLY 53 -16.100 0.768 7.577 723 H ARG 54 H ARG 54 -15.033 2.903 5.066 724 HA ARG 54 HA ARG 54 -16.724 5.122 6.112 725 HB2 ARG 54 HB2 ARG 54 -13.951 5.326 4.906 726 HB3 ARG 54 HB3 ARG 54 -14.807 6.535 5.858 727 HG2 ARG 54 HG2 ARG 54 -13.856 3.854 6.973 728 HG3 ARG 54 HG3 ARG 54 -12.948 5.365 7.085 729 HD2 ARG 54 HD2 ARG 54 -14.755 6.420 8.313 730 HD3 ARG 54 HD3 ARG 54 -15.750 4.946 8.197 731 HE ARG 54 HE ARG 54 -13.433 4.041 9.354 732 HH11 ARG 54 HH11 ARG 54 -15.655 6.669 10.150 733 HH12 ARG 54 HH12 ARG 54 -15.312 6.590 11.865 734 HH21 ARG 54 HH21 ARG 54 -12.973 3.982 11.537 735 HH22 ARG 54 HH22 ARG 54 -13.797 5.040 12.666 736 H THR 55 H THR 55 -15.700 6.933 4.151 737 HA THR 55 HA THR 55 -16.097 5.812 1.472 738 HB THR 55 HB THR 55 -17.646 7.872 1.009 739 HG1 THR 55 HG1 THR 55 -18.803 8.550 2.749 740 HG21 THR 55 HG21 THR 55 -18.314 5.417 0.969 741 HG22 THR 55 HG22 THR 55 -18.754 5.581 2.684 742 HG23 THR 55 HG23 THR 55 -19.627 6.519 1.446 743 H LEU 56 H LEU 56 -15.352 7.346 -0.186 744 HA LEU 56 HA LEU 56 -13.013 8.786 0.616 745 HB2 LEU 56 HB2 LEU 56 -14.745 8.958 -1.889 746 HB3 LEU 56 HB3 LEU 56 -13.175 9.736 -1.713 747 HG LEU 56 HG LEU 56 -13.777 6.749 -1.750 748 HD11 LEU 56 HD11 LEU 56 -11.995 8.542 -3.456 749 HD12 LEU 56 HD12 LEU 56 -12.259 6.796 -3.689 750 HD13 LEU 56 HD13 LEU 56 -13.598 7.938 -3.934 751 HD21 LEU 56 HD21 LEU 56 -11.334 6.401 -1.498 752 HD22 LEU 56 HD22 LEU 56 -11.130 8.136 -1.183 753 HD23 LEU 56 HD23 LEU 56 -12.042 7.114 -0.038 754 H SER 57 H SER 57 -16.414 9.596 0.385 755 HA SER 57 HA SER 57 -16.154 12.446 0.504 756 HB2 SER 57 HB2 SER 57 -18.594 12.265 0.913 757 HB3 SER 57 HB3 SER 57 -18.089 11.179 -0.398 758 HG SER 57 HG SER 57 -19.470 10.165 1.107 759 H ASP 58 H ASP 58 -16.103 9.860 2.893 760 HA ASP 58 HA ASP 58 -16.782 11.472 5.179 761 HB2 ASP 58 HB2 ASP 58 -16.796 8.886 4.881 762 HB3 ASP 58 HB3 ASP 58 -15.065 8.967 5.201 763 H TYR 59 H TYR 59 -13.954 11.115 3.252 764 HA TYR 59 HA TYR 59 -12.293 12.537 5.277 765 HB2 TYR 59 HB2 TYR 59 -11.472 10.244 3.453 766 HB3 TYR 59 HB3 TYR 59 -10.366 11.198 4.442 767 HD1 TYR 59 HD1 TYR 59 -11.970 11.426 6.988 768 HD2 TYR 59 HD2 TYR 59 -11.256 8.102 4.356 769 HE1 TYR 59 HE1 TYR 59 -12.249 9.866 8.891 770 HE2 TYR 59 HE2 TYR 59 -11.439 6.540 6.272 771 HH TYR 59 HH TYR 59 -11.824 6.328 8.539 772 H ASN 60 H ASN 60 -13.971 13.391 2.968 773 HA ASN 60 HA ASN 60 -13.875 14.786 1.225 774 HB2 ASN 60 HB2 ASN 60 -12.613 16.790 1.728 775 HB3 ASN 60 HB3 ASN 60 -13.391 16.142 3.182 776 HD21 ASN 60 HD21 ASN 60 -10.265 16.273 1.519 777 HD22 ASN 60 HD22 ASN 60 -9.298 16.113 2.990 778 H ILE 61 H ILE 61 -12.215 12.382 0.676 779 HA ILE 61 HA ILE 61 -9.972 13.363 -0.897 780 HB ILE 61 HB ILE 61 -11.472 10.712 -0.857 781 HG12 ILE 61 HG12 ILE 61 -8.650 11.328 0.068 782 HG13 ILE 61 HG13 ILE 61 -10.046 11.478 1.155 783 HG21 ILE 61 HG21 ILE 61 -9.535 9.863 -2.201 784 HG22 ILE 61 HG22 ILE 61 -10.460 11.095 -3.082 785 HG23 ILE 61 HG23 ILE 61 -8.917 11.530 -2.320 786 HD11 ILE 61 HD11 ILE 61 -9.235 8.919 -0.278 787 HD12 ILE 61 HD12 ILE 61 -8.949 9.303 1.432 788 HD13 ILE 61 HD13 ILE 61 -10.613 9.123 0.838 789 H GLN 62 H GLN 62 -10.074 14.299 -2.806 790 HA GLN 62 HA GLN 62 -12.473 13.980 -4.561 791 HB2 GLN 62 HB2 GLN 62 -10.902 16.506 -3.952 792 HB3 GLN 62 HB3 GLN 62 -12.324 16.389 -5.000 793 HG2 GLN 62 HG2 GLN 62 -12.339 15.718 -2.020 794 HG3 GLN 62 HG3 GLN 62 -12.705 17.306 -2.657 795 HE21 GLN 62 HE21 GLN 62 -14.601 16.038 -1.122 796 HE22 GLN 62 HE22 GLN 62 -15.932 15.490 -2.121 797 H LYS 63 H LYS 63 -11.717 15.353 -6.703 798 HA LYS 63 HA LYS 63 -9.870 13.682 -7.996 799 HB2 LYS 63 HB2 LYS 63 -10.102 15.146 -9.814 800 HB3 LYS 63 HB3 LYS 63 -11.664 15.126 -8.985 801 HG2 LYS 63 HG2 LYS 63 -11.078 17.271 -7.851 802 HG3 LYS 63 HG3 LYS 63 -9.532 17.297 -8.741 803 HD2 LYS 63 HD2 LYS 63 -11.107 18.724 -9.887 804 HD3 LYS 63 HD3 LYS 63 -10.800 17.288 -10.884 805 HE2 LYS 63 HE2 LYS 63 -12.904 16.270 -10.078 806 HE3 LYS 63 HE3 LYS 63 -13.189 17.670 -9.035 807 HZ1 LYS 63 HZ1 LYS 63 -13.302 19.041 -10.995 808 HZ2 LYS 63 HZ2 LYS 63 -13.034 17.747 -11.975 809 HZ3 LYS 63 HZ3 LYS 63 -14.411 17.829 -11.089 810 H GLU 64 H GLU 64 -7.822 13.698 -8.465 811 HA GLU 64 HA GLU 64 -5.608 14.056 -8.279 812 HB2 GLU 64 HB2 GLU 64 -6.380 16.992 -8.351 813 HB3 GLU 64 HB3 GLU 64 -4.864 16.244 -8.894 814 HG2 GLU 64 HG2 GLU 64 -6.176 14.942 -10.600 815 HG3 GLU 64 HG3 GLU 64 -7.622 15.837 -10.116 816 H SER 65 H SER 65 -7.094 13.928 -5.630 817 HA SER 65 HA SER 65 -5.998 15.942 -3.936 818 HB2 SER 65 HB2 SER 65 -7.351 13.285 -3.392 819 HB3 SER 65 HB3 SER 65 -6.827 14.405 -2.116 820 HG SER 65 HG SER 65 -8.598 14.997 -4.234 821 H THR 66 H THR 66 -4.644 13.089 -5.209 822 HA THR 66 HA THR 66 -2.823 11.822 -4.896 823 HB THR 66 HB THR 66 -1.847 14.245 -3.408 824 HG1 THR 66 HG1 THR 66 -0.828 14.595 -5.397 825 HG21 THR 66 HG21 THR 66 -0.489 12.289 -2.745 826 HG22 THR 66 HG22 THR 66 -0.363 11.768 -4.441 827 HG23 THR 66 HG23 THR 66 0.433 13.262 -3.903 828 H LEU 67 H LEU 67 -2.417 10.088 -3.726 829 HA LEU 67 HA LEU 67 -2.769 10.109 -0.782 830 HB2 LEU 67 HB2 LEU 67 -3.982 7.992 -2.597 831 HB3 LEU 67 HB3 LEU 67 -4.090 8.101 -0.847 832 HG LEU 67 HG LEU 67 -5.304 10.384 -1.275 833 HD11 LEU 67 HD11 LEU 67 -5.798 8.932 -3.911 834 HD12 LEU 67 HD12 LEU 67 -6.675 10.368 -3.334 835 HD13 LEU 67 HD13 LEU 67 -4.959 10.485 -3.764 836 HD21 LEU 67 HD21 LEU 67 -7.437 9.179 -1.400 837 HD22 LEU 67 HD22 LEU 67 -6.597 7.711 -1.959 838 HD23 LEU 67 HD23 LEU 67 -6.310 8.332 -0.319 839 H HIS 68 H HIS 68 -2.186 7.586 -0.121 840 HA HIS 68 HA HIS 68 0.286 6.890 -1.627 841 HB2 HIS 68 HB2 HIS 68 0.096 7.221 1.380 842 HB3 HIS 68 HB3 HIS 68 1.538 6.778 0.457 843 HD2 HIS 68 HD2 HIS 68 2.348 8.801 -1.416 844 HE1 HIS 68 HE1 HIS 68 0.796 11.971 0.954 845 HE2 HIS 68 HE2 HIS 68 2.338 11.380 -0.984 846 H LEU 69 H LEU 69 0.972 4.776 -1.453 847 HA LEU 69 HA LEU 69 -0.959 2.800 -0.345 848 HB2 LEU 69 HB2 LEU 69 -1.487 3.036 -2.679 849 HB3 LEU 69 HB3 LEU 69 0.225 3.133 -3.113 850 HG LEU 69 HG LEU 69 0.499 0.730 -2.425 851 HD11 LEU 69 HD11 LEU 69 -2.547 0.834 -2.283 852 HD12 LEU 69 HD12 LEU 69 -1.557 -0.645 -2.258 853 HD13 LEU 69 HD13 LEU 69 -1.446 0.512 -0.921 854 HD21 LEU 69 HD21 LEU 69 -1.561 1.375 -4.568 855 HD22 LEU 69 HD22 LEU 69 0.202 1.407 -4.761 856 HD23 LEU 69 HD23 LEU 69 -0.621 -0.138 -4.445 857 H VAL 70 H VAL 70 -0.040 1.089 0.589 858 HA VAL 70 HA VAL 70 2.745 0.303 0.009 859 HB VAL 70 HB VAL 70 1.718 0.762 2.845 860 HG11 VAL 70 HG11 VAL 70 4.427 -0.072 1.713 861 HG12 VAL 70 HG12 VAL 70 4.141 0.396 3.402 862 HG13 VAL 70 HG13 VAL 70 3.358 -1.053 2.753 863 HG21 VAL 70 HG21 VAL 70 2.166 2.928 1.772 864 HG22 VAL 70 HG22 VAL 70 3.448 2.549 2.929 865 HG23 VAL 70 HG23 VAL 70 3.738 2.335 1.184 866 H LEU 71 H LEU 71 3.061 -2.015 1.027 867 HA LEU 71 HA LEU 71 0.468 -3.380 1.344 868 HB2 LEU 71 HB2 LEU 71 1.082 -5.026 -0.465 869 HB3 LEU 71 HB3 LEU 71 0.600 -3.415 -0.976 870 HG LEU 71 HG LEU 71 2.996 -2.800 -1.316 871 HD11 LEU 71 HD11 LEU 71 3.468 -5.769 -0.814 872 HD12 LEU 71 HD12 LEU 71 4.649 -4.642 -1.514 873 HD13 LEU 71 HD13 LEU 71 4.125 -4.422 0.159 874 HD21 LEU 71 HD21 LEU 71 3.222 -4.124 -3.381 875 HD22 LEU 71 HD22 LEU 71 2.009 -5.281 -2.781 876 HD23 LEU 71 HD23 LEU 71 1.538 -3.603 -3.138 877 H ARG 72 H ARG 72 0.782 -5.796 1.603 878 HA ARG 72 HA ARG 72 2.479 -6.132 3.931 879 HB2 ARG 72 HB2 ARG 72 0.296 -7.618 2.522 880 HB3 ARG 72 HB3 ARG 72 1.421 -8.590 3.483 881 HG2 ARG 72 HG2 ARG 72 -0.555 -7.827 4.799 882 HG3 ARG 72 HG3 ARG 72 1.003 -7.297 5.466 883 HD2 ARG 72 HD2 ARG 72 0.685 -5.071 4.382 884 HD3 ARG 72 HD3 ARG 72 -0.911 -5.601 3.821 885 HE ARG 72 HE ARG 72 -1.742 -5.371 5.989 886 HH11 ARG 72 HH11 ARG 72 1.787 -5.032 6.008 887 HH12 ARG 72 HH12 ARG 72 1.837 -4.508 7.673 888 HH21 ARG 72 HH21 ARG 72 -1.632 -4.642 8.150 889 HH22 ARG 72 HH22 ARG 72 -0.081 -4.261 8.863 890 H LEU 73 H LEU 73 3.475 -8.486 4.079 891 HA LEU 73 HA LEU 73 5.534 -8.481 1.952 892 HB2 LEU 73 HB2 LEU 73 5.745 -7.902 4.664 893 HB3 LEU 73 HB3 LEU 73 6.181 -9.608 4.645 894 HG LEU 73 HG LEU 73 8.160 -8.199 4.487 895 HD11 LEU 73 HD11 LEU 73 7.617 -9.460 1.774 896 HD12 LEU 73 HD12 LEU 73 9.205 -9.080 2.482 897 HD13 LEU 73 HD13 LEU 73 8.178 -10.325 3.228 898 HD21 LEU 73 HD21 LEU 73 6.929 -7.051 1.939 899 HD22 LEU 73 HD22 LEU 73 7.061 -6.211 3.496 900 HD23 LEU 73 HD23 LEU 73 8.527 -6.675 2.595 901 H ARG 74 H ARG 74 3.027 -9.939 2.132 902 HA ARG 74 HA ARG 74 2.078 -11.932 1.686 903 HB2 ARG 74 HB2 ARG 74 3.842 -11.970 -0.048 904 HB3 ARG 74 HB3 ARG 74 4.911 -12.844 1.055 905 HG2 ARG 74 HG2 ARG 74 3.826 -14.372 -0.542 906 HG3 ARG 74 HG3 ARG 74 3.396 -14.747 1.130 907 HD2 ARG 74 HD2 ARG 74 1.235 -13.530 0.831 908 HD3 ARG 74 HD3 ARG 74 1.690 -13.172 -0.844 909 HE ARG 74 HE ARG 74 1.165 -15.350 -1.448 910 HH11 ARG 74 HH11 ARG 74 1.321 -15.119 2.090 911 HH12 ARG 74 HH12 ARG 74 0.644 -16.709 2.333 912 HH21 ARG 74 HH21 ARG 74 0.292 -17.421 -1.083 913 HH22 ARG 74 HH22 ARG 74 0.055 -18.004 0.548 914 H GLY 75 H GLY 75 4.810 -12.069 3.880 915 HA2 GLY 75 HA2 GLY 75 3.899 -13.072 6.087 916 HA3 GLY 75 HA3 GLY 75 3.738 -14.544 5.080 917 H GLY 76 H GLY 76 6.259 -13.305 3.624 918 HA2 GLY 76 HA2 GLY 76 8.492 -13.356 5.320 919 HA3 GLY 76 HA3 GLY 76 8.176 -15.043 4.872 Start of MODEL 17 1 H LEU 491 H LEU 491 13.952 6.780 12.081 2 HA LEU 491 HA LEU 491 16.616 6.333 11.802 3 HB2 LEU 491 HB2 LEU 491 15.513 4.123 10.553 4 HB3 LEU 491 HB3 LEU 491 15.822 4.340 12.261 5 HG LEU 491 HG LEU 491 13.470 5.225 12.546 6 HD11 LEU 491 HD11 LEU 491 11.871 4.773 10.700 7 HD12 LEU 491 HD12 LEU 491 13.093 5.954 10.181 8 HD13 LEU 491 HD13 LEU 491 13.219 4.262 9.652 9 HD21 LEU 491 HD21 LEU 491 14.119 2.945 13.014 10 HD22 LEU 491 HD22 LEU 491 12.463 3.018 12.369 11 HD23 LEU 491 HD23 LEU 491 13.801 2.481 11.319 12 HA PRO 492 HA PRO 492 17.551 7.026 7.435 13 HB2 PRO 492 HB2 PRO 492 20.141 6.287 7.540 14 HB3 PRO 492 HB3 PRO 492 19.556 7.758 8.384 15 HG2 PRO 492 HG2 PRO 492 20.132 5.038 9.550 16 HG3 PRO 492 HG3 PRO 492 20.563 6.645 10.212 17 HD2 PRO 492 HD2 PRO 492 18.324 5.150 10.960 18 HD3 PRO 492 HD3 PRO 492 18.410 6.919 11.131 19 H LEU 493 H LEU 493 19.099 5.455 5.945 20 HA LEU 493 HA LEU 493 17.623 3.095 5.450 21 HB2 LEU 493 HB2 LEU 493 19.305 4.837 4.161 22 HB3 LEU 493 HB3 LEU 493 20.415 3.508 4.405 23 HG LEU 493 HG LEU 493 17.659 3.343 3.111 24 HD11 LEU 493 HD11 LEU 493 20.421 3.365 1.813 25 HD12 LEU 493 HD12 LEU 493 18.872 3.164 0.958 26 HD13 LEU 493 HD13 LEU 493 19.242 4.695 1.777 27 HD21 LEU 493 HD21 LEU 493 19.926 1.296 3.132 28 HD22 LEU 493 HD22 LEU 493 18.390 1.140 4.012 29 HD23 LEU 493 HD23 LEU 493 18.400 1.130 2.239 30 H GLN 494 H GLN 494 18.547 3.067 8.119 31 HA GLN 494 HA GLN 494 20.810 1.317 8.294 32 HB2 GLN 494 HB2 GLN 494 20.375 1.405 10.663 33 HB3 GLN 494 HB3 GLN 494 20.223 3.019 9.928 34 HG2 GLN 494 HG2 GLN 494 18.434 3.053 11.334 35 HG3 GLN 494 HG3 GLN 494 17.689 2.525 9.821 36 HE21 GLN 494 HE21 GLN 494 15.999 1.896 11.449 37 HE22 GLN 494 HE22 GLN 494 16.108 0.277 12.130 38 H ALA 495 H ALA 495 17.332 0.899 8.061 39 HA ALA 495 HA ALA 495 17.795 -2.023 7.948 40 HB1 ALA 495 HB1 ALA 495 15.705 -0.739 9.752 41 HB2 ALA 495 HB2 ALA 495 15.858 -2.479 9.424 42 HB3 ALA 495 HB3 ALA 495 17.157 -1.620 10.279 43 H LEU 496 H LEU 496 16.666 0.595 6.341 44 HA LEU 496 HA LEU 496 14.201 -0.372 5.256 45 HB2 LEU 496 HB2 LEU 496 16.355 1.574 4.440 46 HB3 LEU 496 HB3 LEU 496 15.235 1.003 3.211 47 HG LEU 496 HG LEU 496 13.328 1.703 4.768 48 HD11 LEU 496 HD11 LEU 496 15.613 3.233 6.083 49 HD12 LEU 496 HD12 LEU 496 13.885 3.479 6.395 50 HD13 LEU 496 HD13 LEU 496 14.654 1.942 6.849 51 HD21 LEU 496 HD21 LEU 496 13.633 4.117 4.074 52 HD22 LEU 496 HD22 LEU 496 15.293 3.693 3.567 53 HD23 LEU 496 HD23 LEU 496 13.900 2.942 2.771 54 HA PRO 497 HA PRO 497 15.354 -3.661 2.550 55 HB2 PRO 497 HB2 PRO 497 14.109 -2.085 0.318 56 HB3 PRO 497 HB3 PRO 497 13.793 -3.786 0.792 57 HG2 PRO 497 HG2 PRO 497 12.008 -1.868 1.457 58 HG3 PRO 497 HG3 PRO 497 12.479 -3.101 2.674 59 HD2 PRO 497 HD2 PRO 497 13.510 -0.276 2.393 60 HD3 PRO 497 HD3 PRO 497 12.990 -1.142 3.869 61 H GLU 498 H GLU 498 16.833 -4.214 0.798 62 HA GLU 498 HA GLU 498 18.938 -2.225 0.598 63 HB2 GLU 498 HB2 GLU 498 19.293 -4.653 1.118 64 HB3 GLU 498 HB3 GLU 498 18.848 -5.031 -0.563 65 HG2 GLU 498 HG2 GLU 498 20.743 -3.659 -1.380 66 HG3 GLU 498 HG3 GLU 498 21.085 -3.131 0.268 67 H GLY 499 H GLY 499 17.402 -0.840 -0.583 68 HA2 GLY 499 HA2 GLY 499 18.416 -0.235 -3.078 69 HA3 GLY 499 HA3 GLY 499 17.058 -1.327 -3.419 70 H VAL 500 H VAL 500 15.621 -0.283 -0.950 71 HA VAL 500 HA VAL 500 14.101 1.790 -2.230 72 HB VAL 500 HB VAL 500 14.159 0.627 0.573 73 HG11 VAL 500 HG11 VAL 500 12.109 2.526 -0.668 74 HG12 VAL 500 HG12 VAL 500 11.866 1.593 0.826 75 HG13 VAL 500 HG13 VAL 500 13.103 2.849 0.776 76 HG21 VAL 500 HG21 VAL 500 12.259 0.333 -1.796 77 HG22 VAL 500 HG22 VAL 500 13.475 -0.866 -1.323 78 HG23 VAL 500 HG23 VAL 500 12.111 -0.504 -0.238 79 H ASP 501 H ASP 501 13.602 3.888 -0.982 80 HA ASP 501 HA ASP 501 16.107 5.167 -0.007 81 HB2 ASP 501 HB2 ASP 501 14.650 5.608 -2.540 82 HB3 ASP 501 HB3 ASP 501 14.814 7.076 -1.586 83 H GLN 502 H GLN 502 15.780 7.102 1.182 84 HA GLN 502 HA GLN 502 13.631 6.922 3.041 85 HB2 GLN 502 HB2 GLN 502 15.448 9.274 2.361 86 HB3 GLN 502 HB3 GLN 502 14.516 9.072 3.863 87 HG2 GLN 502 HG2 GLN 502 16.616 7.073 2.967 88 HG3 GLN 502 HG3 GLN 502 17.013 8.509 3.916 89 HE21 GLN 502 HE21 GLN 502 15.592 5.338 3.987 90 HE22 GLN 502 HE22 GLN 502 15.330 5.275 5.721 91 H GLU 503 H GLU 503 14.235 9.069 0.243 92 HA GLU 503 HA GLU 503 11.982 10.759 0.755 93 HB2 GLU 503 HB2 GLU 503 12.527 11.789 -1.356 94 HB3 GLU 503 HB3 GLU 503 14.031 11.424 -0.484 95 HG2 GLU 503 HG2 GLU 503 14.102 9.238 -1.834 96 HG3 GLU 503 HG3 GLU 503 12.817 9.916 -2.834 97 H VAL 504 H VAL 504 11.822 7.608 0.026 98 HA VAL 504 HA VAL 504 9.174 7.991 -1.241 99 HB VAL 504 HB VAL 504 9.430 6.162 -2.687 100 HG11 VAL 504 HG11 VAL 504 11.799 8.020 -3.082 101 HG12 VAL 504 HG12 VAL 504 10.985 7.068 -4.338 102 HG13 VAL 504 HG13 VAL 504 10.105 8.378 -3.517 103 HG21 VAL 504 HG21 VAL 504 12.346 5.971 -1.813 104 HG22 VAL 504 HG22 VAL 504 11.074 4.797 -1.390 105 HG23 VAL 504 HG23 VAL 504 11.571 4.995 -3.081 106 H PHE 505 H PHE 505 10.689 7.125 1.479 107 HA PHE 505 HA PHE 505 8.784 4.902 2.045 108 HB2 PHE 505 HB2 PHE 505 10.799 3.831 2.229 109 HB3 PHE 505 HB3 PHE 505 11.685 5.321 2.537 110 HD1 PHE 505 HD1 PHE 505 11.949 6.270 4.697 111 HD2 PHE 505 HD2 PHE 505 9.803 2.604 4.131 112 HE1 PHE 505 HE1 PHE 505 12.192 5.757 7.128 113 HE2 PHE 505 HE2 PHE 505 10.020 2.086 6.558 114 HZ PHE 505 HZ PHE 505 11.266 3.628 8.039 115 H LYS 506 H LYS 506 10.030 8.077 2.858 116 HA LYS 506 HA LYS 506 8.825 8.223 5.478 117 HB2 LYS 506 HB2 LYS 506 9.867 10.301 3.524 118 HB3 LYS 506 HB3 LYS 506 9.237 10.696 5.141 119 HG2 LYS 506 HG2 LYS 506 10.894 9.207 6.187 120 HG3 LYS 506 HG3 LYS 506 11.548 8.777 4.604 121 HD2 LYS 506 HD2 LYS 506 11.464 11.618 5.708 122 HD3 LYS 506 HD3 LYS 506 12.872 10.536 5.807 123 HE2 LYS 506 HE2 LYS 506 12.955 10.389 3.355 124 HE3 LYS 506 HE3 LYS 506 11.526 11.425 3.223 125 HZ1 LYS 506 HZ1 LYS 506 14.092 12.236 4.420 126 HZ2 LYS 506 HZ2 LYS 506 13.561 12.668 2.930 127 HZ3 LYS 506 HZ3 LYS 506 12.756 13.188 4.259 128 H GLN 507 H GLN 507 7.280 7.636 2.737 129 HA GLN 507 HA GLN 507 5.206 9.698 2.783 130 HB2 GLN 507 HB2 GLN 507 4.913 7.079 1.335 131 HB3 GLN 507 HB3 GLN 507 4.445 8.703 0.819 132 HG2 GLN 507 HG2 GLN 507 7.228 7.468 0.896 133 HG3 GLN 507 HG3 GLN 507 6.282 7.853 -0.535 134 HE21 GLN 507 HE21 GLN 507 9.027 8.754 0.376 135 HE22 GLN 507 HE22 GLN 507 8.951 10.483 0.336 136 H LEU 508 H LEU 508 5.798 7.508 5.017 137 HA LEU 508 HA LEU 508 3.071 6.260 5.100 138 HB2 LEU 508 HB2 LEU 508 5.707 5.115 6.075 139 HB3 LEU 508 HB3 LEU 508 4.167 4.262 5.934 140 HG LEU 508 HG LEU 508 5.781 5.372 3.590 141 HD11 LEU 508 HD11 LEU 508 5.462 2.534 4.640 142 HD12 LEU 508 HD12 LEU 508 6.336 3.008 3.167 143 HD13 LEU 508 HD13 LEU 508 6.935 3.522 4.758 144 HD21 LEU 508 HD21 LEU 508 3.329 3.565 3.719 145 HD22 LEU 508 HD22 LEU 508 3.363 5.240 3.128 146 HD23 LEU 508 HD23 LEU 508 4.247 3.978 2.243 147 HA PRO 509 HA PRO 509 3.043 7.438 9.470 148 HB2 PRO 509 HB2 PRO 509 1.401 5.500 10.495 149 HB3 PRO 509 HB3 PRO 509 0.792 6.852 9.501 150 HG2 PRO 509 HG2 PRO 509 1.464 4.020 8.659 151 HG3 PRO 509 HG3 PRO 509 0.000 4.972 8.227 152 HD2 PRO 509 HD2 PRO 509 2.161 4.715 6.550 153 HD3 PRO 509 HD3 PRO 509 1.180 6.211 6.616 154 H ALA 510 H ALA 510 3.630 6.515 11.549 155 HA ALA 510 HA ALA 510 5.945 4.922 11.522 156 HB1 ALA 510 HB1 ALA 510 3.913 5.527 13.703 157 HB2 ALA 510 HB2 ALA 510 5.576 4.930 13.995 158 HB3 ALA 510 HB3 ALA 510 5.304 6.538 13.272 159 H ASP 511 H ASP 511 2.573 3.977 11.447 160 HA ASP 511 HA ASP 511 3.071 1.306 12.535 161 HB2 ASP 511 HB2 ASP 511 0.962 2.600 12.946 162 HB3 ASP 511 HB3 ASP 511 0.613 2.551 11.213 163 H ILE 512 H ILE 512 3.555 2.770 9.507 164 HA ILE 512 HA ILE 512 3.606 0.026 8.334 165 HB ILE 512 HB ILE 512 3.204 2.640 6.851 166 HG12 ILE 512 HG12 ILE 512 1.325 0.340 7.550 167 HG13 ILE 512 HG13 ILE 512 1.221 2.009 8.131 168 HG21 ILE 512 HG21 ILE 512 3.135 -0.245 5.859 169 HG22 ILE 512 HG22 ILE 512 2.853 1.212 4.877 170 HG23 ILE 512 HG23 ILE 512 4.453 0.907 5.540 171 HD11 ILE 512 HD11 ILE 512 0.892 2.773 5.771 172 HD12 ILE 512 HD12 ILE 512 0.807 1.066 5.266 173 HD13 ILE 512 HD13 ILE 512 -0.406 1.719 6.382 174 H GLN 513 H GLN 513 5.471 2.825 9.297 175 HA GLN 513 HA GLN 513 7.827 2.423 7.812 176 HB2 GLN 513 HB2 GLN 513 7.025 3.513 10.447 177 HB3 GLN 513 HB3 GLN 513 8.604 2.714 10.520 178 HG2 GLN 513 HG2 GLN 513 8.831 5.107 10.082 179 HG3 GLN 513 HG3 GLN 513 9.505 4.081 8.807 180 HE21 GLN 513 HE21 GLN 513 8.939 4.472 6.732 181 HE22 GLN 513 HE22 GLN 513 7.599 5.481 6.242 182 H GLU 514 H GLU 514 6.484 0.627 10.592 183 HA GLU 514 HA GLU 514 8.717 -1.116 10.950 184 HB2 GLU 514 HB2 GLU 514 7.168 -2.401 12.345 185 HB3 GLU 514 HB3 GLU 514 7.019 -0.660 12.669 186 HG2 GLU 514 HG2 GLU 514 5.008 -0.557 11.244 187 HG3 GLU 514 HG3 GLU 514 5.151 -2.291 10.904 188 H GLU 515 H GLU 515 6.189 -1.049 8.554 189 HA GLU 515 HA GLU 515 6.457 -3.899 7.902 190 HB2 GLU 515 HB2 GLU 515 5.023 -1.631 6.467 191 HB3 GLU 515 HB3 GLU 515 4.925 -3.343 6.040 192 HG2 GLU 515 HG2 GLU 515 4.087 -2.188 8.736 193 HG3 GLU 515 HG3 GLU 515 2.991 -2.543 7.397 194 H ILE 516 H ILE 516 8.035 -0.880 6.940 195 HA ILE 516 HA ILE 516 9.080 -2.233 4.506 196 HB ILE 516 HB ILE 516 9.899 0.536 5.289 197 HG12 ILE 516 HG12 ILE 516 7.536 0.779 5.599 198 HG13 ILE 516 HG13 ILE 516 7.992 1.515 4.064 199 HG21 ILE 516 HG21 ILE 516 10.909 -0.542 3.348 200 HG22 ILE 516 HG22 ILE 516 9.307 -0.862 2.650 201 HG23 ILE 516 HG23 ILE 516 9.892 0.807 2.817 202 HD11 ILE 516 HD11 ILE 516 7.147 -0.440 2.831 203 HD12 ILE 516 HD12 ILE 516 6.688 -1.218 4.370 204 HD13 ILE 516 HD13 ILE 516 5.897 0.289 3.868 205 H LEU 517 H LEU 517 10.017 -0.973 7.686 206 HA LEU 517 HA LEU 517 12.834 -1.462 7.493 207 HB2 LEU 517 HB2 LEU 517 10.864 -1.374 9.814 208 HB3 LEU 517 HB3 LEU 517 12.615 -1.529 10.026 209 HG LEU 517 HG LEU 517 11.364 0.757 8.443 210 HD11 LEU 517 HD11 LEU 517 12.138 0.706 11.391 211 HD12 LEU 517 HD12 LEU 517 11.559 2.118 10.469 212 HD13 LEU 517 HD13 LEU 517 10.474 0.744 10.767 213 HD21 LEU 517 HD21 LEU 517 13.490 1.874 8.891 214 HD22 LEU 517 HD22 LEU 517 14.040 0.511 9.884 215 HD23 LEU 517 HD23 LEU 517 13.807 0.299 8.134 216 H SER 518 H SER 518 10.316 -3.522 7.155 217 HA SER 518 HA SER 518 11.984 -5.884 7.827 218 HB2 SER 518 HB2 SER 518 10.248 -5.459 9.607 219 HB3 SER 518 HB3 SER 518 8.997 -5.725 8.370 220 HG SER 518 HG SER 518 9.529 -7.631 9.545 221 H GLY 519 H GLY 519 11.055 -4.208 5.375 222 HA2 GLY 519 HA2 GLY 519 9.754 -6.343 3.781 223 HA3 GLY 519 HA3 GLY 519 9.882 -4.618 3.351 224 H LYS 520 H LYS 520 12.432 -6.773 4.593 225 HA LYS 520 HA LYS 520 14.437 -5.757 2.963 226 HB2 LYS 520 HB2 LYS 520 15.812 -7.382 3.946 227 HB3 LYS 520 HB3 LYS 520 14.612 -6.968 5.174 228 HG2 LYS 520 HG2 LYS 520 14.448 -9.419 3.359 229 HG3 LYS 520 HG3 LYS 520 15.210 -9.424 4.948 230 HD2 LYS 520 HD2 LYS 520 12.273 -8.770 4.456 231 HD3 LYS 520 HD3 LYS 520 12.909 -10.330 4.986 232 HE2 LYS 520 HE2 LYS 520 13.913 -9.256 6.989 233 HE3 LYS 520 HE3 LYS 520 13.200 -7.707 6.506 234 HZ1 LYS 520 HZ1 LYS 520 11.032 -8.727 6.681 235 HZ2 LYS 520 HZ2 LYS 520 11.701 -10.164 7.134 236 HZ3 LYS 520 HZ3 LYS 520 11.835 -8.844 8.103 237 H SER 521 H SER 521 11.984 -7.589 1.739 238 HA SER 521 HA SER 521 13.568 -8.327 -0.615 239 HB2 SER 521 HB2 SER 521 13.731 -10.284 0.922 240 HB3 SER 521 HB3 SER 521 11.961 -10.390 0.943 241 HG SER 521 HG SER 521 12.961 -11.771 -0.617 242 H ARG 522 H ARG 522 11.984 -9.419 -2.195 243 HA ARG 522 HA ARG 522 10.246 -9.240 -3.618 244 HB2 ARG 522 HB2 ARG 522 9.077 -9.763 -1.231 245 HB3 ARG 522 HB3 ARG 522 8.359 -8.186 -1.553 246 HG2 ARG 522 HG2 ARG 522 6.826 -9.503 -2.652 247 HG3 ARG 522 HG3 ARG 522 7.971 -9.289 -3.985 248 HD2 ARG 522 HD2 ARG 522 7.822 -11.635 -2.044 249 HD3 ARG 522 HD3 ARG 522 7.317 -11.643 -3.745 250 HE ARG 522 HE ARG 522 10.146 -10.981 -3.185 251 HH11 ARG 522 HH11 ARG 522 7.790 -13.437 -4.174 252 HH12 ARG 522 HH12 ARG 522 9.005 -14.476 -4.877 253 HH21 ARG 522 HH21 ARG 522 11.702 -12.377 -4.095 254 HH22 ARG 522 HH22 ARG 522 11.200 -13.884 -4.830 255 H GLU 523 H GLU 523 11.709 -6.590 -2.372 256 HA GLU 523 HA GLU 523 10.539 -4.882 -4.437 257 HB2 GLU 523 HB2 GLU 523 10.018 -3.042 -2.886 258 HB3 GLU 523 HB3 GLU 523 9.019 -4.469 -2.573 259 HG2 GLU 523 HG2 GLU 523 10.615 -5.113 -0.725 260 HG3 GLU 523 HG3 GLU 523 11.466 -3.586 -0.991 261 H ASN 524 H ASN 524 11.811 -2.923 -4.809 262 HA ASN 524 HA ASN 524 14.420 -2.646 -3.546 263 HB2 ASN 524 HB2 ASN 524 14.063 -3.658 -6.418 264 HB3 ASN 524 HB3 ASN 524 15.564 -2.957 -5.806 265 HD21 ASN 524 HD21 ASN 524 13.607 -5.811 -6.004 266 HD22 ASN 524 HD22 ASN 524 14.664 -6.848 -5.060 267 H LEU 525 H LEU 525 11.941 -1.137 -3.999 268 HA LEU 525 HA LEU 525 11.201 0.869 -4.658 269 HB2 LEU 525 HB2 LEU 525 12.773 2.261 -3.884 270 HB3 LEU 525 HB3 LEU 525 14.065 1.168 -4.349 271 HG LEU 525 HG LEU 525 13.669 2.087 -6.760 272 HD11 LEU 525 HD11 LEU 525 12.954 4.450 -6.779 273 HD12 LEU 525 HD12 LEU 525 11.652 3.505 -6.019 274 HD13 LEU 525 HD13 LEU 525 12.769 4.441 -5.012 275 HD21 LEU 525 HD21 LEU 525 15.039 3.669 -4.554 276 HD22 LEU 525 HD22 LEU 525 15.740 2.353 -5.532 277 HD23 LEU 525 HD23 LEU 525 15.308 3.894 -6.297 278 H LYS 526 H LYS 526 12.196 -1.416 -6.706 279 HA LYS 526 HA LYS 526 11.727 0.182 -9.182 280 HB2 LYS 526 HB2 LYS 526 13.725 -1.940 -8.402 281 HB3 LYS 526 HB3 LYS 526 13.355 -1.633 -10.126 282 HG2 LYS 526 HG2 LYS 526 14.004 0.734 -9.835 283 HG3 LYS 526 HG3 LYS 526 14.403 0.433 -8.130 284 HD2 LYS 526 HD2 LYS 526 15.581 -1.160 -10.416 285 HD3 LYS 526 HD3 LYS 526 16.346 0.334 -9.820 286 HE2 LYS 526 HE2 LYS 526 15.776 -2.121 -8.100 287 HE3 LYS 526 HE3 LYS 526 17.336 -1.759 -8.851 288 HZ1 LYS 526 HZ1 LYS 526 17.352 0.322 -7.622 289 HZ2 LYS 526 HZ2 LYS 526 15.961 -0.106 -6.849 290 HZ3 LYS 526 HZ3 LYS 526 17.328 -0.982 -6.627 291 H1 MET 1 H1 MET 1 -13.527 12.218 -13.464 292 H2 MET 1 H2 MET 1 -14.275 13.507 -12.761 293 H3 MET 1 H3 MET 1 -14.203 12.062 -11.975 294 HA MET 1 HA MET 1 -11.895 13.760 -12.656 295 HB2 MET 1 HB2 MET 1 -11.726 14.306 -10.351 296 HB3 MET 1 HB3 MET 1 -13.414 14.614 -10.796 297 HG2 MET 1 HG2 MET 1 -14.067 12.436 -9.825 298 HG3 MET 1 HG3 MET 1 -12.379 12.092 -9.431 299 HE1 MET 1 HE1 MET 1 -13.708 12.568 -5.859 300 HE2 MET 1 HE2 MET 1 -14.426 11.689 -7.227 301 HE3 MET 1 HE3 MET 1 -12.670 11.622 -6.946 302 H GLN 2 H GLN 2 -10.055 13.067 -10.976 303 HA GLN 2 HA GLN 2 -9.983 10.192 -10.545 304 HB2 GLN 2 HB2 GLN 2 -8.074 9.761 -12.002 305 HB3 GLN 2 HB3 GLN 2 -9.356 10.532 -12.963 306 HG2 GLN 2 HG2 GLN 2 -8.101 12.749 -12.247 307 HG3 GLN 2 HG3 GLN 2 -6.760 11.685 -11.909 308 HE21 GLN 2 HE21 GLN 2 -5.418 12.495 -13.572 309 HE22 GLN 2 HE22 GLN 2 -5.772 12.261 -15.272 310 H ILE 3 H ILE 3 -7.722 9.620 -9.702 311 HA ILE 3 HA ILE 3 -6.459 11.837 -8.178 312 HB ILE 3 HB ILE 3 -6.454 10.639 -6.134 313 HG12 ILE 3 HG12 ILE 3 -7.393 8.283 -7.769 314 HG13 ILE 3 HG13 ILE 3 -6.105 8.417 -6.588 315 HG21 ILE 3 HG21 ILE 3 -9.267 10.484 -7.261 316 HG22 ILE 3 HG22 ILE 3 -8.789 10.662 -5.556 317 HG23 ILE 3 HG23 ILE 3 -8.444 11.965 -6.698 318 HD11 ILE 3 HD11 ILE 3 -7.835 8.635 -4.767 319 HD12 ILE 3 HD12 ILE 3 -9.090 8.379 -5.999 320 HD13 ILE 3 HD13 ILE 3 -7.916 7.094 -5.650 321 H PHE 4 H PHE 4 -4.450 10.635 -6.915 322 HA PHE 4 HA PHE 4 -3.079 8.966 -8.964 323 HB2 PHE 4 HB2 PHE 4 -1.838 11.335 -7.552 324 HB3 PHE 4 HB3 PHE 4 -1.095 10.324 -8.730 325 HD1 PHE 4 HD1 PHE 4 -2.384 10.149 -11.082 326 HD2 PHE 4 HD2 PHE 4 -2.860 13.373 -8.270 327 HE1 PHE 4 HE1 PHE 4 -3.135 11.634 -12.914 328 HE2 PHE 4 HE2 PHE 4 -3.559 14.869 -10.122 329 HZ PHE 4 HZ PHE 4 -3.713 14.004 -12.433 330 H VAL 5 H VAL 5 -3.430 7.197 -7.649 331 HA VAL 5 HA VAL 5 -2.525 7.187 -4.876 332 HB VAL 5 HB VAL 5 -3.396 4.873 -6.660 333 HG11 VAL 5 HG11 VAL 5 -3.898 3.841 -4.449 334 HG12 VAL 5 HG12 VAL 5 -2.177 4.239 -4.621 335 HG13 VAL 5 HG13 VAL 5 -3.240 5.283 -3.639 336 HG21 VAL 5 HG21 VAL 5 -5.028 6.693 -4.828 337 HG22 VAL 5 HG22 VAL 5 -5.195 6.563 -6.591 338 HG23 VAL 5 HG23 VAL 5 -5.621 5.188 -5.562 339 H LYS 6 H LYS 6 -0.348 7.410 -4.638 340 HA LYS 6 HA LYS 6 1.489 6.197 -6.577 341 HB2 LYS 6 HB2 LYS 6 1.843 8.477 -5.784 342 HB3 LYS 6 HB3 LYS 6 1.910 7.920 -4.102 343 HG2 LYS 6 HG2 LYS 6 3.956 6.747 -4.452 344 HG3 LYS 6 HG3 LYS 6 3.841 6.904 -6.218 345 HD2 LYS 6 HD2 LYS 6 3.980 9.333 -4.404 346 HD3 LYS 6 HD3 LYS 6 5.447 8.514 -4.981 347 HE2 LYS 6 HE2 LYS 6 4.759 8.831 -7.304 348 HE3 LYS 6 HE3 LYS 6 3.246 9.599 -6.783 349 HZ1 LYS 6 HZ1 LYS 6 4.562 11.338 -5.773 350 HZ2 LYS 6 HZ2 LYS 6 5.961 10.626 -6.265 351 HZ3 LYS 6 HZ3 LYS 6 4.905 11.223 -7.371 352 H THR 7 H THR 7 2.898 4.578 -6.243 353 HA THR 7 HA THR 7 2.243 2.659 -4.124 354 HB THR 7 HB THR 7 3.851 1.242 -5.374 355 HG1 THR 7 HG1 THR 7 4.853 2.106 -7.162 356 HG21 THR 7 HG21 THR 7 2.574 1.074 -7.462 357 HG22 THR 7 HG22 THR 7 1.474 1.354 -6.096 358 HG23 THR 7 HG23 THR 7 1.880 2.689 -7.200 359 H LEU 8 H LEU 8 4.154 1.446 -3.154 360 HA LEU 8 HA LEU 8 5.709 3.141 -1.497 361 HB2 LEU 8 HB2 LEU 8 4.881 0.809 -1.113 362 HB3 LEU 8 HB3 LEU 8 6.102 0.200 -2.216 363 HG LEU 8 HG LEU 8 6.439 0.083 0.346 364 HD11 LEU 8 HD11 LEU 8 8.173 -0.517 -1.290 365 HD12 LEU 8 HD12 LEU 8 8.741 1.169 -1.311 366 HD13 LEU 8 HD13 LEU 8 8.836 0.223 0.179 367 HD21 LEU 8 HD21 LEU 8 7.378 2.943 -0.071 368 HD22 LEU 8 HD22 LEU 8 5.924 2.445 0.830 369 HD23 LEU 8 HD23 LEU 8 7.537 1.967 1.404 370 H THR 9 H THR 9 6.170 2.230 -4.805 371 HA THR 9 HA THR 9 9.113 2.480 -4.647 372 HB THR 9 HB THR 9 9.017 1.708 -7.014 373 HG1 THR 9 HG1 THR 9 7.024 0.956 -7.761 374 HG21 THR 9 HG21 THR 9 8.374 -0.600 -6.496 375 HG22 THR 9 HG22 THR 9 9.237 0.100 -5.108 376 HG23 THR 9 HG23 THR 9 7.467 -0.056 -5.066 377 H GLY 10 H GLY 10 6.463 4.506 -4.974 378 HA2 GLY 10 HA2 GLY 10 6.673 6.798 -5.238 379 HA3 GLY 10 HA3 GLY 10 8.256 6.569 -6.020 380 H LYS 11 H LYS 11 5.390 4.765 -7.072 381 HA LYS 11 HA LYS 11 5.339 6.432 -9.551 382 HB2 LYS 11 HB2 LYS 11 6.418 4.301 -9.809 383 HB3 LYS 11 HB3 LYS 11 5.025 3.437 -9.146 384 HG2 LYS 11 HG2 LYS 11 4.461 5.250 -11.459 385 HG3 LYS 11 HG3 LYS 11 5.432 3.810 -11.803 386 HD2 LYS 11 HD2 LYS 11 3.736 2.337 -10.893 387 HD3 LYS 11 HD3 LYS 11 2.744 3.720 -10.366 388 HE2 LYS 11 HE2 LYS 11 2.376 4.420 -12.629 389 HE3 LYS 11 HE3 LYS 11 3.553 3.243 -13.251 390 HZ1 LYS 11 HZ1 LYS 11 1.015 2.563 -11.919 391 HZ2 LYS 11 HZ2 LYS 11 1.302 2.482 -13.537 392 HZ3 LYS 11 HZ3 LYS 11 2.106 1.486 -12.509 393 H THR 12 H THR 12 3.528 7.500 -9.837 394 HA THR 12 HA THR 12 1.162 6.943 -8.235 395 HB THR 12 HB THR 12 2.185 9.135 -9.896 396 HG1 THR 12 HG1 THR 12 1.040 10.237 -8.336 397 HG21 THR 12 HG21 THR 12 0.272 8.531 -11.358 398 HG22 THR 12 HG22 THR 12 -0.809 8.627 -9.944 399 HG23 THR 12 HG23 THR 12 0.046 10.076 -10.516 400 H ILE 13 H ILE 13 -0.927 6.545 -9.001 401 HA ILE 13 HA ILE 13 -1.128 5.251 -11.669 402 HB ILE 13 HB ILE 13 -2.323 4.204 -9.065 403 HG12 ILE 13 HG12 ILE 13 -0.025 3.117 -10.745 404 HG13 ILE 13 HG13 ILE 13 0.130 3.858 -9.145 405 HG21 ILE 13 HG21 ILE 13 -3.051 2.316 -10.455 406 HG22 ILE 13 HG22 ILE 13 -3.666 3.824 -11.137 407 HG23 ILE 13 HG23 ILE 13 -2.259 3.036 -11.883 408 HD11 ILE 13 HD11 ILE 13 0.186 1.453 -8.895 409 HD12 ILE 13 HD12 ILE 13 -1.320 2.078 -8.186 410 HD13 ILE 13 HD13 ILE 13 -1.346 1.271 -9.775 411 H THR 14 H THR 14 -2.515 6.524 -12.773 412 HA THR 14 HA THR 14 -4.323 8.322 -11.439 413 HB THR 14 HB THR 14 -4.294 7.468 -14.362 414 HG1 THR 14 HG1 THR 14 -2.905 9.238 -14.599 415 HG21 THR 14 HG21 THR 14 -5.241 9.744 -14.681 416 HG22 THR 14 HG22 THR 14 -6.296 8.736 -13.674 417 HG23 THR 14 HG23 THR 14 -5.266 9.968 -12.915 418 H LEU 15 H LEU 15 -6.487 8.066 -10.996 419 HA LEU 15 HA LEU 15 -7.904 5.628 -11.911 420 HB2 LEU 15 HB2 LEU 15 -7.164 6.317 -9.039 421 HB3 LEU 15 HB3 LEU 15 -8.486 5.225 -9.441 422 HG LEU 15 HG LEU 15 -5.589 4.767 -10.285 423 HD11 LEU 15 HD11 LEU 15 -7.258 3.597 -8.024 424 HD12 LEU 15 HD12 LEU 15 -5.679 2.969 -8.560 425 HD13 LEU 15 HD13 LEU 15 -5.807 4.608 -7.880 426 HD21 LEU 15 HD21 LEU 15 -6.623 2.425 -10.662 427 HD22 LEU 15 HD22 LEU 15 -8.202 3.248 -10.603 428 HD23 LEU 15 HD23 LEU 15 -7.022 3.691 -11.849 429 H GLU 16 H GLU 16 -10.026 5.932 -12.065 430 HA GLU 16 HA GLU 16 -11.166 8.551 -11.245 431 HB2 GLU 16 HB2 GLU 16 -11.467 7.993 -13.563 432 HB3 GLU 16 HB3 GLU 16 -11.993 6.341 -13.164 433 HG2 GLU 16 HG2 GLU 16 -14.002 7.178 -12.104 434 HG3 GLU 16 HG3 GLU 16 -13.493 8.856 -12.341 435 H VAL 17 H VAL 17 -12.432 8.694 -9.533 436 HA VAL 17 HA VAL 17 -13.925 6.326 -8.555 437 HB VAL 17 HB VAL 17 -13.135 6.677 -6.270 438 HG11 VAL 17 HG11 VAL 17 -10.867 5.827 -6.480 439 HG12 VAL 17 HG12 VAL 17 -11.899 5.074 -7.717 440 HG13 VAL 17 HG13 VAL 17 -10.771 6.374 -8.165 441 HG21 VAL 17 HG21 VAL 17 -12.618 9.097 -6.424 442 HG22 VAL 17 HG22 VAL 17 -11.274 8.160 -5.758 443 HG23 VAL 17 HG23 VAL 17 -11.210 8.721 -7.449 444 H GLU 18 H GLU 18 -15.223 7.118 -6.511 445 HA GLU 18 HA GLU 18 -16.218 9.904 -6.896 446 HB2 GLU 18 HB2 GLU 18 -17.830 7.386 -6.314 447 HB3 GLU 18 HB3 GLU 18 -18.484 9.022 -6.398 448 HG2 GLU 18 HG2 GLU 18 -17.165 7.526 -8.707 449 HG3 GLU 18 HG3 GLU 18 -18.903 7.671 -8.415 450 HA PRO 19 HA PRO 19 -15.727 10.305 -2.537 451 HB2 PRO 19 HB2 PRO 19 -18.561 11.268 -2.330 452 HB3 PRO 19 HB3 PRO 19 -17.059 12.053 -1.764 453 HG2 PRO 19 HG2 PRO 19 -18.313 12.916 -4.022 454 HG3 PRO 19 HG3 PRO 19 -16.519 12.816 -3.939 455 HD2 PRO 19 HD2 PRO 19 -18.454 10.871 -5.195 456 HD3 PRO 19 HD3 PRO 19 -16.898 11.487 -5.829 457 H SER 20 H SER 20 -17.769 7.954 -3.829 458 HA SER 20 HA SER 20 -18.517 6.928 -1.137 459 HB2 SER 20 HB2 SER 20 -20.071 6.816 -3.751 460 HB3 SER 20 HB3 SER 20 -20.518 5.986 -2.246 461 HG SER 20 HG SER 20 -21.570 8.018 -2.489 462 H ASP 21 H ASP 21 -16.648 6.499 -3.910 463 HA ASP 21 HA ASP 21 -16.657 3.571 -3.934 464 HB2 ASP 21 HB2 ASP 21 -14.820 5.675 -5.083 465 HB3 ASP 21 HB3 ASP 21 -14.629 3.941 -5.373 466 H THR 22 H THR 22 -16.500 3.746 -1.561 467 HA THR 22 HA THR 22 -14.266 4.799 -0.162 468 HB THR 22 HB THR 22 -16.367 4.404 0.900 469 HG1 THR 22 HG1 THR 22 -15.522 3.498 2.756 470 HG21 THR 22 HG21 THR 22 -17.141 2.216 1.568 471 HG22 THR 22 HG22 THR 22 -17.108 2.364 -0.202 472 HG23 THR 22 HG23 THR 22 -15.829 1.441 0.632 473 H ILE 23 H ILE 23 -13.059 3.102 1.430 474 HA ILE 23 HA ILE 23 -10.876 2.394 -0.134 475 HB ILE 23 HB ILE 23 -11.478 1.274 2.598 476 HG12 ILE 23 HG12 ILE 23 -11.965 3.625 2.737 477 HG13 ILE 23 HG13 ILE 23 -10.370 3.352 3.433 478 HG21 ILE 23 HG21 ILE 23 -9.462 0.376 1.564 479 HG22 ILE 23 HG22 ILE 23 -8.911 2.002 1.117 480 HG23 ILE 23 HG23 ILE 23 -9.003 1.521 2.834 481 HD11 ILE 23 HD11 ILE 23 -10.468 5.380 2.028 482 HD12 ILE 23 HD12 ILE 23 -9.296 4.203 1.383 483 HD13 ILE 23 HD13 ILE 23 -10.887 4.405 0.613 484 H GLU 24 H GLU 24 -13.706 0.321 0.513 485 HA GLU 24 HA GLU 24 -12.207 -2.072 -0.244 486 HB2 GLU 24 HB2 GLU 24 -14.290 -3.228 -0.073 487 HB3 GLU 24 HB3 GLU 24 -14.212 -2.075 1.279 488 HG2 GLU 24 HG2 GLU 24 -15.646 -0.509 -0.021 489 HG3 GLU 24 HG3 GLU 24 -15.732 -1.694 -1.335 490 H ASN 25 H ASN 25 -13.804 0.495 -1.923 491 HA ASN 25 HA ASN 25 -14.233 -0.984 -4.396 492 HB2 ASN 25 HB2 ASN 25 -14.380 1.977 -3.769 493 HB3 ASN 25 HB3 ASN 25 -14.899 1.251 -5.268 494 HD21 ASN 25 HD21 ASN 25 -15.614 1.719 -1.975 495 HD22 ASN 25 HD22 ASN 25 -17.207 0.935 -1.933 496 H VAL 26 H VAL 26 -11.967 1.515 -3.090 497 HA VAL 26 HA VAL 26 -10.539 1.947 -5.534 498 HB VAL 26 HB VAL 26 -8.759 2.788 -3.759 499 HG11 VAL 26 HG11 VAL 26 -11.516 4.043 -4.120 500 HG12 VAL 26 HG12 VAL 26 -10.043 4.903 -3.604 501 HG13 VAL 26 HG13 VAL 26 -10.145 4.206 -5.239 502 HG21 VAL 26 HG21 VAL 26 -11.230 2.685 -2.067 503 HG22 VAL 26 HG22 VAL 26 -9.777 1.650 -1.866 504 HG23 VAL 26 HG23 VAL 26 -9.659 3.414 -1.662 505 H LYS 27 H LYS 27 -10.264 -0.489 -2.960 506 HA LYS 27 HA LYS 27 -7.737 -1.523 -3.698 507 HB2 LYS 27 HB2 LYS 27 -10.274 -2.674 -2.499 508 HB3 LYS 27 HB3 LYS 27 -8.848 -3.687 -2.800 509 HG2 LYS 27 HG2 LYS 27 -7.449 -2.304 -1.399 510 HG3 LYS 27 HG3 LYS 27 -8.723 -1.083 -1.226 511 HD2 LYS 27 HD2 LYS 27 -10.151 -2.767 -0.060 512 HD3 LYS 27 HD3 LYS 27 -8.852 -3.965 -0.221 513 HE2 LYS 27 HE2 LYS 27 -7.327 -2.462 1.021 514 HE3 LYS 27 HE3 LYS 27 -8.633 -1.282 1.200 515 HZ1 LYS 27 HZ1 LYS 27 -8.438 -2.665 3.158 516 HZ2 LYS 27 HZ2 LYS 27 -9.882 -2.917 2.426 517 HZ3 LYS 27 HZ3 LYS 27 -8.686 -4.030 2.269 518 H ALA 28 H ALA 28 -10.936 -1.846 -5.271 519 HA ALA 28 HA ALA 28 -9.996 -3.936 -7.068 520 HB1 ALA 28 HB1 ALA 28 -12.107 -3.521 -8.242 521 HB2 ALA 28 HB2 ALA 28 -12.390 -3.662 -6.491 522 HB3 ALA 28 HB3 ALA 28 -12.390 -2.061 -7.273 523 H LYS 29 H LYS 29 -10.080 -0.372 -7.048 524 HA LYS 29 HA LYS 29 -9.541 -0.002 -9.853 525 HB2 LYS 29 HB2 LYS 29 -9.169 1.688 -7.369 526 HB3 LYS 29 HB3 LYS 29 -8.478 2.171 -8.921 527 HG2 LYS 29 HG2 LYS 29 -10.582 3.269 -8.615 528 HG3 LYS 29 HG3 LYS 29 -10.713 2.140 -9.972 529 HD2 LYS 29 HD2 LYS 29 -12.039 0.620 -8.723 530 HD3 LYS 29 HD3 LYS 29 -11.488 1.303 -7.179 531 HE2 LYS 29 HE2 LYS 29 -13.792 1.938 -7.588 532 HE3 LYS 29 HE3 LYS 29 -12.742 3.353 -7.566 533 HZ1 LYS 29 HZ1 LYS 29 -12.772 3.373 -9.958 534 HZ2 LYS 29 HZ2 LYS 29 -13.717 2.028 -10.014 535 HZ3 LYS 29 HZ3 LYS 29 -14.307 3.431 -9.385 536 H ILE 30 H ILE 30 -7.480 -0.589 -6.979 537 HA ILE 30 HA ILE 30 -5.041 -0.027 -8.497 538 HB ILE 30 HB ILE 30 -5.611 -0.997 -5.675 539 HG12 ILE 30 HG12 ILE 30 -4.650 1.727 -6.662 540 HG13 ILE 30 HG13 ILE 30 -6.348 1.348 -6.352 541 HG21 ILE 30 HG21 ILE 30 -2.975 -0.067 -6.907 542 HG22 ILE 30 HG22 ILE 30 -3.242 -0.462 -5.192 543 HG23 ILE 30 HG23 ILE 30 -3.366 -1.732 -6.410 544 HD11 ILE 30 HD11 ILE 30 -5.778 0.795 -3.982 545 HD12 ILE 30 HD12 ILE 30 -4.110 1.338 -4.294 546 HD13 ILE 30 HD13 ILE 30 -5.468 2.477 -4.433 547 H GLN 31 H GLN 31 -6.993 -2.791 -7.418 548 HA GLN 31 HA GLN 31 -5.109 -4.847 -8.076 549 HB2 GLN 31 HB2 GLN 31 -7.107 -5.336 -6.755 550 HB3 GLN 31 HB3 GLN 31 -8.157 -4.720 -8.051 551 HG2 GLN 31 HG2 GLN 31 -7.447 -6.492 -9.562 552 HG3 GLN 31 HG3 GLN 31 -6.243 -7.054 -8.419 553 HE21 GLN 31 HE21 GLN 31 -7.078 -9.150 -8.161 554 HE22 GLN 31 HE22 GLN 31 -8.622 -9.475 -7.394 555 H ASP 32 H ASP 32 -7.554 -3.005 -9.935 556 HA ASP 32 HA ASP 32 -7.442 -4.645 -12.256 557 HB2 ASP 32 HB2 ASP 32 -9.261 -3.063 -11.696 558 HB3 ASP 32 HB3 ASP 32 -8.150 -1.728 -11.733 559 H LYS 33 H LYS 33 -5.573 -1.934 -11.104 560 HA LYS 33 HA LYS 33 -4.304 -1.343 -13.658 561 HB2 LYS 33 HB2 LYS 33 -4.118 -0.400 -10.789 562 HB3 LYS 33 HB3 LYS 33 -2.980 0.193 -12.012 563 HG2 LYS 33 HG2 LYS 33 -6.013 0.348 -12.312 564 HG3 LYS 33 HG3 LYS 33 -5.011 1.652 -11.630 565 HD2 LYS 33 HD2 LYS 33 -3.707 1.765 -13.711 566 HD3 LYS 33 HD3 LYS 33 -4.716 0.497 -14.433 567 HE2 LYS 33 HE2 LYS 33 -5.747 3.169 -13.393 568 HE3 LYS 33 HE3 LYS 33 -5.404 2.823 -15.089 569 HZ1 LYS 33 HZ1 LYS 33 -7.725 2.509 -14.603 570 HZ2 LYS 33 HZ2 LYS 33 -7.047 1.067 -15.002 571 HZ3 LYS 33 HZ3 LYS 33 -7.384 1.407 -13.432 572 H GLU 34 H GLU 34 -3.533 -3.451 -10.945 573 HA GLU 34 HA GLU 34 -0.869 -3.881 -12.210 574 HB2 GLU 34 HB2 GLU 34 -1.402 -3.526 -9.238 575 HB3 GLU 34 HB3 GLU 34 0.152 -3.989 -9.941 576 HG2 GLU 34 HG2 GLU 34 -1.297 -1.365 -10.491 577 HG3 GLU 34 HG3 GLU 34 0.003 -1.585 -9.324 578 H GLY 35 H GLY 35 -3.458 -5.145 -10.076 579 HA2 GLY 35 HA2 GLY 35 -4.246 -7.388 -10.570 580 HA3 GLY 35 HA3 GLY 35 -2.568 -7.912 -10.786 581 H ILE 36 H ILE 36 -2.934 -5.634 -8.280 582 HA ILE 36 HA ILE 36 -2.060 -7.573 -6.307 583 HB ILE 36 HB ILE 36 -2.738 -4.606 -6.171 584 HG12 ILE 36 HG12 ILE 36 -0.039 -6.013 -6.241 585 HG13 ILE 36 HG13 ILE 36 -0.830 -5.328 -7.671 586 HG21 ILE 36 HG21 ILE 36 -1.247 -6.350 -4.166 587 HG22 ILE 36 HG22 ILE 36 -1.544 -4.603 -4.026 588 HG23 ILE 36 HG23 ILE 36 -2.904 -5.737 -3.951 589 HD11 ILE 36 HD11 ILE 36 -0.847 -3.090 -6.582 590 HD12 ILE 36 HD12 ILE 36 0.038 -3.774 -5.195 591 HD13 ILE 36 HD13 ILE 36 0.795 -3.730 -6.796 592 HA PRO 37 HA PRO 37 -6.217 -8.530 -5.132 593 HB2 PRO 37 HB2 PRO 37 -5.759 -9.903 -2.792 594 HB3 PRO 37 HB3 PRO 37 -5.383 -10.569 -4.410 595 HG2 PRO 37 HG2 PRO 37 -3.508 -9.202 -2.469 596 HG3 PRO 37 HG3 PRO 37 -3.247 -10.729 -3.378 597 HD2 PRO 37 HD2 PRO 37 -2.243 -8.333 -4.220 598 HD3 PRO 37 HD3 PRO 37 -2.824 -9.551 -5.391 599 HA PRO 38 HA PRO 38 -7.414 -5.379 -2.242 600 HB2 PRO 38 HB2 PRO 38 -9.833 -6.355 -1.378 601 HB3 PRO 38 HB3 PRO 38 -9.586 -5.704 -3.028 602 HG2 PRO 38 HG2 PRO 38 -9.548 -8.601 -2.140 603 HG3 PRO 38 HG3 PRO 38 -10.402 -7.884 -3.543 604 HD2 PRO 38 HD2 PRO 38 -7.990 -9.119 -3.808 605 HD3 PRO 38 HD3 PRO 38 -8.398 -7.652 -4.763 606 H ASP 39 H ASP 39 -6.868 -8.694 -1.407 607 HA ASP 39 HA ASP 39 -7.421 -8.374 1.417 608 HB2 ASP 39 HB2 ASP 39 -6.042 -10.599 -0.126 609 HB3 ASP 39 HB3 ASP 39 -6.568 -10.694 1.563 610 H GLN 40 H GLN 40 -4.758 -7.432 -0.555 611 HA GLN 40 HA GLN 40 -2.987 -7.579 1.842 612 HB2 GLN 40 HB2 GLN 40 -2.243 -7.862 -1.083 613 HB3 GLN 40 HB3 GLN 40 -1.103 -7.752 0.271 614 HG2 GLN 40 HG2 GLN 40 -2.265 -9.767 1.302 615 HG3 GLN 40 HG3 GLN 40 -3.140 -9.951 -0.235 616 HE21 GLN 40 HE21 GLN 40 -1.362 -9.552 -2.192 617 HE22 GLN 40 HE22 GLN 40 -0.002 -10.655 -2.070 618 H GLN 41 H GLN 41 -4.449 -5.393 -0.491 619 HA GLN 41 HA GLN 41 -2.405 -3.374 -0.373 620 HB2 GLN 41 HB2 GLN 41 -5.403 -3.262 -0.862 621 HB3 GLN 41 HB3 GLN 41 -4.311 -1.884 -1.060 622 HG2 GLN 41 HG2 GLN 41 -3.066 -3.077 -2.812 623 HG3 GLN 41 HG3 GLN 41 -4.072 -4.517 -2.563 624 HE21 GLN 41 HE21 GLN 41 -5.225 -4.622 -4.526 625 HE22 GLN 41 HE22 GLN 41 -6.333 -3.363 -5.004 626 H ARG 42 H ARG 42 -2.603 -1.289 0.613 627 HA ARG 42 HA ARG 42 -4.577 -0.811 2.693 628 HB2 ARG 42 HB2 ARG 42 -2.434 -2.016 3.689 629 HB3 ARG 42 HB3 ARG 42 -1.649 -0.453 3.434 630 HG2 ARG 42 HG2 ARG 42 -2.469 -0.544 5.705 631 HG3 ARG 42 HG3 ARG 42 -3.501 0.602 4.825 632 HD2 ARG 42 HD2 ARG 42 -5.215 -1.152 4.533 633 HD3 ARG 42 HD3 ARG 42 -4.153 -2.337 5.318 634 HE ARG 42 HE ARG 42 -4.476 -0.203 7.128 635 HH11 ARG 42 HH11 ARG 42 -6.490 -2.662 5.584 636 HH12 ARG 42 HH12 ARG 42 -7.656 -2.687 6.889 637 HH21 ARG 42 HH21 ARG 42 -5.993 -0.251 8.793 638 HH22 ARG 42 HH22 ARG 42 -7.367 -1.329 8.720 639 H LEU 43 H LEU 43 -4.771 1.542 3.043 640 HA LEU 43 HA LEU 43 -3.297 3.079 0.954 641 HB2 LEU 43 HB2 LEU 43 -5.921 2.173 0.795 642 HB3 LEU 43 HB3 LEU 43 -6.119 3.841 1.343 643 HG LEU 43 HG LEU 43 -4.450 2.966 -1.055 644 HD11 LEU 43 HD11 LEU 43 -7.281 4.080 -0.942 645 HD12 LEU 43 HD12 LEU 43 -6.352 3.736 -2.420 646 HD13 LEU 43 HD13 LEU 43 -6.839 2.407 -1.342 647 HD21 LEU 43 HD21 LEU 43 -4.676 5.347 -1.736 648 HD22 LEU 43 HD22 LEU 43 -5.508 5.692 -0.200 649 HD23 LEU 43 HD23 LEU 43 -3.799 5.183 -0.207 650 H ILE 44 H ILE 44 -2.927 5.230 1.349 651 HA ILE 44 HA ILE 44 -3.599 6.313 4.024 652 HB ILE 44 HB ILE 44 -0.818 6.050 2.800 653 HG12 ILE 44 HG12 ILE 44 -0.533 5.205 5.328 654 HG13 ILE 44 HG13 ILE 44 -2.255 4.891 5.185 655 HG21 ILE 44 HG21 ILE 44 -1.555 7.549 5.351 656 HG22 ILE 44 HG22 ILE 44 0.052 7.346 4.667 657 HG23 ILE 44 HG23 ILE 44 -1.121 8.346 3.815 658 HD11 ILE 44 HD11 ILE 44 -1.696 3.544 3.057 659 HD12 ILE 44 HD12 ILE 44 0.009 3.728 3.526 660 HD13 ILE 44 HD13 ILE 44 -1.139 2.872 4.594 661 H PHE 45 H PHE 45 -3.659 8.592 4.070 662 HA PHE 45 HA PHE 45 -3.254 10.132 1.585 663 HB2 PHE 45 HB2 PHE 45 -5.569 9.218 1.495 664 HB3 PHE 45 HB3 PHE 45 -5.898 9.898 3.087 665 HD1 PHE 45 HD1 PHE 45 -4.259 11.320 0.013 666 HD2 PHE 45 HD2 PHE 45 -7.406 11.655 2.927 667 HE1 PHE 45 HE1 PHE 45 -5.039 13.390 -1.076 668 HE2 PHE 45 HE2 PHE 45 -8.165 13.757 1.866 669 HZ PHE 45 HZ PHE 45 -6.991 14.636 -0.141 670 H ALA 46 H ALA 46 -2.778 12.260 2.023 671 HA ALA 46 HA ALA 46 -1.760 13.854 3.231 672 HB1 ALA 46 HB1 ALA 46 -4.190 13.472 5.023 673 HB2 ALA 46 HB2 ALA 46 -3.167 14.925 4.937 674 HB3 ALA 46 HB3 ALA 46 -4.133 14.435 3.528 675 H GLY 47 H GLY 47 -1.416 10.855 4.162 676 HA2 GLY 47 HA2 GLY 47 0.436 10.117 5.388 677 HA3 GLY 47 HA3 GLY 47 0.384 11.548 6.411 678 H LYS 48 H LYS 48 -2.751 10.044 5.942 679 HA LYS 48 HA LYS 48 -2.289 8.307 8.307 680 HB2 LYS 48 HB2 LYS 48 -4.495 8.840 9.202 681 HB3 LYS 48 HB3 LYS 48 -3.441 10.253 9.134 682 HG2 LYS 48 HG2 LYS 48 -5.509 11.031 8.462 683 HG3 LYS 48 HG3 LYS 48 -4.570 10.869 6.967 684 HD2 LYS 48 HD2 LYS 48 -5.818 8.749 6.454 685 HD3 LYS 48 HD3 LYS 48 -6.788 8.970 7.917 686 HE2 LYS 48 HE2 LYS 48 -6.577 10.883 5.559 687 HE3 LYS 48 HE3 LYS 48 -7.944 9.820 5.922 688 HZ1 LYS 48 HZ1 LYS 48 -6.999 12.030 7.628 689 HZ2 LYS 48 HZ2 LYS 48 -8.337 12.059 6.683 690 HZ3 LYS 48 HZ3 LYS 48 -8.264 11.031 7.967 691 H GLN 49 H GLN 49 -3.913 6.643 8.523 692 HA GLN 49 HA GLN 49 -4.083 5.315 5.893 693 HB2 GLN 49 HB2 GLN 49 -2.864 4.297 7.775 694 HB3 GLN 49 HB3 GLN 49 -4.335 4.326 8.754 695 HG2 GLN 49 HG2 GLN 49 -5.426 2.800 7.095 696 HG3 GLN 49 HG3 GLN 49 -3.908 2.765 6.168 697 HE21 GLN 49 HE21 GLN 49 -1.907 2.067 7.487 698 HE22 GLN 49 HE22 GLN 49 -2.151 0.779 8.646 699 H LEU 50 H LEU 50 -5.974 4.169 5.280 700 HA LEU 50 HA LEU 50 -8.476 5.413 6.343 701 HB2 LEU 50 HB2 LEU 50 -7.857 4.560 3.482 702 HB3 LEU 50 HB3 LEU 50 -9.379 5.233 4.083 703 HG LEU 50 HG LEU 50 -8.054 7.314 4.774 704 HD11 LEU 50 HD11 LEU 50 -5.730 6.512 4.564 705 HD12 LEU 50 HD12 LEU 50 -6.034 6.051 2.866 706 HD13 LEU 50 HD13 LEU 50 -6.044 7.756 3.355 707 HD21 LEU 50 HD21 LEU 50 -8.139 6.630 1.803 708 HD22 LEU 50 HD22 LEU 50 -9.543 7.164 2.746 709 HD23 LEU 50 HD23 LEU 50 -8.156 8.253 2.532 710 H GLU 51 H GLU 51 -10.484 4.013 5.805 711 HA GLU 51 HA GLU 51 -9.817 1.135 6.203 712 HB2 GLU 51 HB2 GLU 51 -11.326 2.997 8.048 713 HB3 GLU 51 HB3 GLU 51 -11.697 1.267 8.010 714 HG2 GLU 51 HG2 GLU 51 -9.355 0.723 8.510 715 HG3 GLU 51 HG3 GLU 51 -8.936 2.441 8.498 716 H ASP 52 H ASP 52 -11.497 -0.313 5.864 717 HA ASP 52 HA ASP 52 -13.090 0.292 3.552 718 HB2 ASP 52 HB2 ASP 52 -13.084 -2.118 5.415 719 HB3 ASP 52 HB3 ASP 52 -13.792 -2.050 3.802 720 H GLY 53 H GLY 53 -13.636 1.097 6.740 721 HA2 GLY 53 HA2 GLY 53 -16.568 0.652 6.570 722 HA3 GLY 53 HA3 GLY 53 -15.637 0.919 8.057 723 H ARG 54 H ARG 54 -14.448 2.945 5.617 724 HA ARG 54 HA ARG 54 -16.018 5.268 6.617 725 HB2 ARG 54 HB2 ARG 54 -13.347 5.318 5.188 726 HB3 ARG 54 HB3 ARG 54 -14.071 6.573 6.189 727 HG2 ARG 54 HG2 ARG 54 -13.082 3.880 7.222 728 HG3 ARG 54 HG3 ARG 54 -12.173 5.393 7.291 729 HD2 ARG 54 HD2 ARG 54 -13.906 6.415 8.677 730 HD3 ARG 54 HD3 ARG 54 -14.866 4.917 8.618 731 HE ARG 54 HE ARG 54 -12.560 3.947 9.578 732 HH11 ARG 54 HH11 ARG 54 -14.308 6.878 10.523 733 HH12 ARG 54 HH12 ARG 54 -13.711 6.835 12.164 734 HH21 ARG 54 HH21 ARG 54 -11.763 3.952 11.667 735 HH22 ARG 54 HH22 ARG 54 -12.270 5.163 12.825 736 H THR 55 H THR 55 -15.033 6.959 4.543 737 HA THR 55 HA THR 55 -15.728 5.853 1.925 738 HB THR 55 HB THR 55 -17.189 8.000 1.579 739 HG1 THR 55 HG1 THR 55 -18.108 8.798 3.383 740 HG21 THR 55 HG21 THR 55 -18.000 5.578 1.647 741 HG22 THR 55 HG22 THR 55 -18.300 5.814 3.383 742 HG23 THR 55 HG23 THR 55 -19.193 6.781 2.180 743 H LEU 56 H LEU 56 -15.016 7.382 0.199 744 HA LEU 56 HA LEU 56 -12.521 8.606 0.881 745 HB2 LEU 56 HB2 LEU 56 -14.334 9.066 -1.530 746 HB3 LEU 56 HB3 LEU 56 -12.644 9.537 -1.407 747 HG LEU 56 HG LEU 56 -13.833 6.751 -1.586 748 HD11 LEU 56 HD11 LEU 56 -12.315 6.576 -3.512 749 HD12 LEU 56 HD12 LEU 56 -13.327 8.027 -3.672 750 HD13 LEU 56 HD13 LEU 56 -11.639 8.181 -3.149 751 HD21 LEU 56 HD21 LEU 56 -12.100 6.626 0.181 752 HD22 LEU 56 HD22 LEU 56 -11.588 5.805 -1.303 753 HD23 LEU 56 HD23 LEU 56 -10.937 7.410 -0.927 754 H SER 57 H SER 57 -15.839 9.675 0.832 755 HA SER 57 HA SER 57 -15.416 12.496 1.013 756 HB2 SER 57 HB2 SER 57 -17.810 12.453 1.606 757 HB3 SER 57 HB3 SER 57 -17.479 11.378 0.233 758 HG SER 57 HG SER 57 -18.809 10.409 1.800 759 H ASP 58 H ASP 58 -15.383 9.847 3.364 760 HA ASP 58 HA ASP 58 -15.771 11.486 5.702 761 HB2 ASP 58 HB2 ASP 58 -16.062 8.937 5.464 762 HB3 ASP 58 HB3 ASP 58 -14.306 8.827 5.542 763 H TYR 59 H TYR 59 -13.152 11.007 3.554 764 HA TYR 59 HA TYR 59 -11.266 12.301 5.460 765 HB2 TYR 59 HB2 TYR 59 -10.713 10.052 3.494 766 HB3 TYR 59 HB3 TYR 59 -9.459 10.985 4.313 767 HD1 TYR 59 HD1 TYR 59 -10.574 11.248 7.064 768 HD2 TYR 59 HD2 TYR 59 -10.518 7.912 4.364 769 HE1 TYR 59 HE1 TYR 59 -10.582 9.698 8.997 770 HE2 TYR 59 HE2 TYR 59 -10.482 6.337 6.305 771 HH TYR 59 HH TYR 59 -10.477 6.137 8.587 772 H ASN 60 H ASN 60 -13.169 13.305 3.441 773 HA ASN 60 HA ASN 60 -13.274 14.872 1.863 774 HB2 ASN 60 HB2 ASN 60 -11.974 16.822 2.455 775 HB3 ASN 60 HB3 ASN 60 -12.549 15.992 3.907 776 HD21 ASN 60 HD21 ASN 60 -9.665 16.387 1.878 777 HD22 ASN 60 HD22 ASN 60 -8.515 16.066 3.182 778 H ILE 61 H ILE 61 -11.589 12.571 0.875 779 HA ILE 61 HA ILE 61 -9.456 13.627 -0.691 780 HB ILE 61 HB ILE 61 -11.294 11.238 -1.081 781 HG12 ILE 61 HG12 ILE 61 -8.394 11.345 -0.173 782 HG13 ILE 61 HG13 ILE 61 -9.746 11.361 0.975 783 HG21 ILE 61 HG21 ILE 61 -8.687 11.954 -2.506 784 HG22 ILE 61 HG22 ILE 61 -9.551 10.409 -2.672 785 HG23 ILE 61 HG23 ILE 61 -10.302 11.898 -3.250 786 HD11 ILE 61 HD11 ILE 61 -10.529 9.213 0.197 787 HD12 ILE 61 HD12 ILE 61 -9.259 9.153 -1.055 788 HD13 ILE 61 HD13 ILE 61 -8.819 9.099 0.664 789 H GLN 62 H GLN 62 -9.382 14.542 -2.694 790 HA GLN 62 HA GLN 62 -11.917 15.027 -4.202 791 HB2 GLN 62 HB2 GLN 62 -9.608 16.967 -3.874 792 HB3 GLN 62 HB3 GLN 62 -11.186 17.291 -4.601 793 HG2 GLN 62 HG2 GLN 62 -10.696 16.630 -1.659 794 HG3 GLN 62 HG3 GLN 62 -10.862 18.245 -2.306 795 HE21 GLN 62 HE21 GLN 62 -12.517 16.847 -0.294 796 HE22 GLN 62 HE22 GLN 62 -14.156 16.856 -0.922 797 H LYS 63 H LYS 63 -11.069 16.143 -6.404 798 HA LYS 63 HA LYS 63 -9.625 14.151 -7.850 799 HB2 LYS 63 HB2 LYS 63 -9.826 15.647 -9.660 800 HB3 LYS 63 HB3 LYS 63 -11.323 15.787 -8.722 801 HG2 LYS 63 HG2 LYS 63 -10.450 17.856 -7.644 802 HG3 LYS 63 HG3 LYS 63 -8.963 17.714 -8.617 803 HD2 LYS 63 HD2 LYS 63 -10.435 19.305 -9.680 804 HD3 LYS 63 HD3 LYS 63 -10.328 17.846 -10.685 805 HE2 LYS 63 HE2 LYS 63 -12.493 17.053 -9.777 806 HE3 LYS 63 HE3 LYS 63 -12.576 18.474 -8.723 807 HZ1 LYS 63 HZ1 LYS 63 -12.636 19.848 -10.684 808 HZ2 LYS 63 HZ2 LYS 63 -12.547 18.530 -11.667 809 HZ3 LYS 63 HZ3 LYS 63 -13.869 18.767 -10.715 810 H GLU 64 H GLU 64 -7.602 13.997 -8.541 811 HA GLU 64 HA GLU 64 -5.353 14.205 -8.566 812 HB2 GLU 64 HB2 GLU 64 -6.042 17.172 -8.469 813 HB3 GLU 64 HB3 GLU 64 -4.521 16.460 -9.039 814 HG2 GLU 64 HG2 GLU 64 -5.790 15.229 -10.805 815 HG3 GLU 64 HG3 GLU 64 -7.277 16.024 -10.270 816 H SER 65 H SER 65 -6.676 14.108 -5.819 817 HA SER 65 HA SER 65 -5.247 15.937 -4.144 818 HB2 SER 65 HB2 SER 65 -6.951 13.485 -3.621 819 HB3 SER 65 HB3 SER 65 -6.204 14.444 -2.321 820 HG SER 65 HG SER 65 -7.264 16.275 -3.139 821 H THR 66 H THR 66 -4.368 12.943 -5.533 822 HA THR 66 HA THR 66 -2.655 11.485 -5.342 823 HB THR 66 HB THR 66 -1.420 13.776 -3.811 824 HG1 THR 66 HG1 THR 66 -1.910 14.199 -5.955 825 HG21 THR 66 HG21 THR 66 -0.209 11.699 -3.244 826 HG22 THR 66 HG22 THR 66 -0.134 11.253 -4.962 827 HG23 THR 66 HG23 THR 66 0.754 12.674 -4.365 828 H LEU 67 H LEU 67 -2.095 9.727 -4.161 829 HA LEU 67 HA LEU 67 -2.540 9.735 -1.225 830 HB2 LEU 67 HB2 LEU 67 -3.856 7.741 -3.118 831 HB3 LEU 67 HB3 LEU 67 -3.839 7.670 -1.357 832 HG LEU 67 HG LEU 67 -4.955 10.057 -1.501 833 HD11 LEU 67 HD11 LEU 67 -5.740 8.755 -4.147 834 HD12 LEU 67 HD12 LEU 67 -6.535 10.175 -3.420 835 HD13 LEU 67 HD13 LEU 67 -4.854 10.279 -3.983 836 HD21 LEU 67 HD21 LEU 67 -6.434 7.478 -2.133 837 HD22 LEU 67 HD22 LEU 67 -5.943 8.033 -0.510 838 HD23 LEU 67 HD23 LEU 67 -7.142 8.954 -1.438 839 H HIS 68 H HIS 68 -2.003 7.272 -0.493 840 HA HIS 68 HA HIS 68 0.425 6.412 -1.978 841 HB2 HIS 68 HB2 HIS 68 0.264 6.874 1.021 842 HB3 HIS 68 HB3 HIS 68 1.677 6.307 0.116 843 HD2 HIS 68 HD2 HIS 68 2.544 8.187 -1.888 844 HE1 HIS 68 HE1 HIS 68 1.290 11.543 0.404 845 HE2 HIS 68 HE2 HIS 68 2.721 10.779 -1.559 846 H LEU 69 H LEU 69 0.832 4.251 -1.934 847 HA LEU 69 HA LEU 69 -1.191 2.476 -0.640 848 HB2 LEU 69 HB2 LEU 69 -1.816 2.966 -2.908 849 HB3 LEU 69 HB3 LEU 69 -0.198 2.636 -3.508 850 HG LEU 69 HG LEU 69 -1.929 0.946 -4.047 851 HD11 LEU 69 HD11 LEU 69 0.506 0.397 -4.017 852 HD12 LEU 69 HD12 LEU 69 0.302 -0.277 -2.382 853 HD13 LEU 69 HD13 LEU 69 -0.573 -0.986 -3.747 854 HD21 LEU 69 HD21 LEU 69 -3.133 1.006 -1.857 855 HD22 LEU 69 HD22 LEU 69 -2.721 -0.632 -2.412 856 HD23 LEU 69 HD23 LEU 69 -1.760 0.128 -1.131 857 H VAL 70 H VAL 70 -0.400 0.713 0.279 858 HA VAL 70 HA VAL 70 2.279 -0.341 -0.393 859 HB VAL 70 HB VAL 70 1.371 0.369 2.438 860 HG11 VAL 70 HG11 VAL 70 3.919 -0.933 1.390 861 HG12 VAL 70 HG12 VAL 70 3.729 -0.267 3.025 862 HG13 VAL 70 HG13 VAL 70 2.738 -1.639 2.531 863 HG21 VAL 70 HG21 VAL 70 3.544 1.520 0.642 864 HG22 VAL 70 HG22 VAL 70 2.092 2.365 1.235 865 HG23 VAL 70 HG23 VAL 70 3.361 1.869 2.375 866 H LEU 71 H LEU 71 2.482 -2.588 0.747 867 HA LEU 71 HA LEU 71 -0.146 -3.792 1.302 868 HB2 LEU 71 HB2 LEU 71 0.448 -5.691 -0.305 869 HB3 LEU 71 HB3 LEU 71 -0.135 -4.176 -0.981 870 HG LEU 71 HG LEU 71 2.188 -3.515 -1.556 871 HD11 LEU 71 HD11 LEU 71 2.882 -6.332 -0.633 872 HD12 LEU 71 HD12 LEU 71 3.955 -5.263 -1.559 873 HD13 LEU 71 HD13 LEU 71 3.482 -4.814 0.088 874 HD21 LEU 71 HD21 LEU 71 1.313 -6.244 -2.570 875 HD22 LEU 71 HD22 LEU 71 0.712 -4.671 -3.152 876 HD23 LEU 71 HD23 LEU 71 2.414 -5.121 -3.403 877 H ARG 72 H ARG 72 0.123 -6.185 1.890 878 HA ARG 72 HA ARG 72 1.827 -6.287 4.198 879 HB2 ARG 72 HB2 ARG 72 -0.055 -8.166 2.768 880 HB3 ARG 72 HB3 ARG 72 1.036 -8.810 3.999 881 HG2 ARG 72 HG2 ARG 72 -1.159 -8.207 4.953 882 HG3 ARG 72 HG3 ARG 72 0.176 -7.303 5.685 883 HD2 ARG 72 HD2 ARG 72 -0.353 -5.347 4.293 884 HD3 ARG 72 HD3 ARG 72 -1.671 -6.242 3.514 885 HE ARG 72 HE ARG 72 -1.648 -5.040 6.188 886 HH11 ARG 72 HH11 ARG 72 -3.245 -7.377 4.056 887 HH12 ARG 72 HH12 ARG 72 -4.740 -7.342 4.954 888 HH21 ARG 72 HH21 ARG 72 -3.604 -5.032 7.344 889 HH22 ARG 72 HH22 ARG 72 -4.942 -6.022 6.813 890 H LEU 73 H LEU 73 3.248 -8.247 4.627 891 HA LEU 73 HA LEU 73 5.162 -8.397 2.384 892 HB2 LEU 73 HB2 LEU 73 5.380 -7.600 5.098 893 HB3 LEU 73 HB3 LEU 73 6.114 -9.193 5.058 894 HG LEU 73 HG LEU 73 7.782 -7.438 4.718 895 HD11 LEU 73 HD11 LEU 73 7.271 -8.876 2.079 896 HD12 LEU 73 HD12 LEU 73 8.810 -8.173 2.627 897 HD13 LEU 73 HD13 LEU 73 8.116 -9.563 3.485 898 HD21 LEU 73 HD21 LEU 73 6.173 -6.629 2.257 899 HD22 LEU 73 HD22 LEU 73 6.253 -5.728 3.781 900 HD23 LEU 73 HD23 LEU 73 7.712 -5.928 2.781 901 H ARG 74 H ARG 74 2.771 -9.995 2.980 902 HA ARG 74 HA ARG 74 1.939 -12.076 2.823 903 HB2 ARG 74 HB2 ARG 74 3.468 -12.081 0.908 904 HB3 ARG 74 HB3 ARG 74 4.736 -12.817 1.894 905 HG2 ARG 74 HG2 ARG 74 3.574 -14.514 0.522 906 HG3 ARG 74 HG3 ARG 74 3.405 -14.825 2.255 907 HD2 ARG 74 HD2 ARG 74 1.136 -13.778 2.201 908 HD3 ARG 74 HD3 ARG 74 1.330 -13.499 0.464 909 HE ARG 74 HE ARG 74 0.900 -15.751 0.070 910 HH11 ARG 74 HH11 ARG 74 1.526 -15.278 3.528 911 HH12 ARG 74 HH12 ARG 74 0.994 -16.886 3.954 912 HH21 ARG 74 HH21 ARG 74 0.210 -17.837 0.669 913 HH22 ARG 74 HH22 ARG 74 0.264 -18.330 2.345 914 H GLY 75 H GLY 75 4.955 -11.907 4.639 915 HA2 GLY 75 HA2 GLY 75 4.144 -14.262 6.239 916 HA3 GLY 75 HA3 GLY 75 5.720 -13.428 6.290 917 H GLY 76 H GLY 76 3.316 -11.132 6.048 918 HA2 GLY 76 HA2 GLY 76 2.293 -10.929 8.709 919 HA3 GLY 76 HA3 GLY 76 3.734 -9.906 8.533 Start of MODEL 18 1 H LEU 491 H LEU 491 15.365 8.288 9.585 2 HA LEU 491 HA LEU 491 17.741 7.178 9.530 3 HB2 LEU 491 HB2 LEU 491 16.730 5.011 8.906 4 HB3 LEU 491 HB3 LEU 491 16.087 5.746 10.320 5 HG LEU 491 HG LEU 491 14.701 6.128 7.631 6 HD11 LEU 491 HD11 LEU 491 13.297 4.205 8.321 7 HD12 LEU 491 HD12 LEU 491 14.997 3.717 8.121 8 HD13 LEU 491 HD13 LEU 491 14.324 3.967 9.754 9 HD21 LEU 491 HD21 LEU 491 12.711 6.361 9.170 10 HD22 LEU 491 HD22 LEU 491 13.820 6.280 10.554 11 HD23 LEU 491 HD23 LEU 491 13.906 7.643 9.415 12 HA PRO 492 HA PRO 492 19.042 6.631 5.165 13 HB2 PRO 492 HB2 PRO 492 21.438 5.537 5.719 14 HB3 PRO 492 HB3 PRO 492 21.125 7.265 6.060 15 HG2 PRO 492 HG2 PRO 492 21.125 4.952 7.986 16 HG3 PRO 492 HG3 PRO 492 21.824 6.587 8.204 17 HD2 PRO 492 HD2 PRO 492 19.325 5.765 9.143 18 HD3 PRO 492 HD3 PRO 492 19.727 7.469 8.828 19 H LEU 493 H LEU 493 20.265 4.453 4.306 20 HA LEU 493 HA LEU 493 18.392 2.354 4.444 21 HB2 LEU 493 HB2 LEU 493 20.663 3.359 2.990 22 HB3 LEU 493 HB3 LEU 493 21.148 1.782 3.511 23 HG LEU 493 HG LEU 493 20.176 1.920 1.258 24 HD11 LEU 493 HD11 LEU 493 18.573 0.015 1.441 25 HD12 LEU 493 HD12 LEU 493 19.960 -0.212 2.530 26 HD13 LEU 493 HD13 LEU 493 18.406 0.333 3.186 27 HD21 LEU 493 HD21 LEU 493 18.574 3.735 1.645 28 HD22 LEU 493 HD22 LEU 493 17.797 2.340 0.873 29 HD23 LEU 493 HD23 LEU 493 17.543 2.650 2.608 30 H GLN 494 H GLN 494 19.283 2.991 7.056 31 HA GLN 494 HA GLN 494 21.202 1.103 8.004 32 HB2 GLN 494 HB2 GLN 494 20.507 1.892 10.175 33 HB3 GLN 494 HB3 GLN 494 20.664 3.240 9.032 34 HG2 GLN 494 HG2 GLN 494 18.739 3.889 9.969 35 HG3 GLN 494 HG3 GLN 494 18.082 2.891 8.670 36 HE21 GLN 494 HE21 GLN 494 16.348 3.338 10.537 37 HE22 GLN 494 HE22 GLN 494 16.157 1.986 11.646 38 H ALA 495 H ALA 495 17.662 1.036 7.644 39 HA ALA 495 HA ALA 495 17.806 -1.879 8.079 40 HB1 ALA 495 HB1 ALA 495 16.042 0.014 9.677 41 HB2 ALA 495 HB2 ALA 495 15.769 -1.750 9.596 42 HB3 ALA 495 HB3 ALA 495 17.268 -1.099 10.296 43 H LEU 496 H LEU 496 16.841 0.606 6.098 44 HA LEU 496 HA LEU 496 14.271 -0.399 5.283 45 HB2 LEU 496 HB2 LEU 496 16.396 1.414 4.087 46 HB3 LEU 496 HB3 LEU 496 14.909 1.012 3.212 47 HG LEU 496 HG LEU 496 14.943 2.231 6.009 48 HD11 LEU 496 HD11 LEU 496 15.980 3.758 4.415 49 HD12 LEU 496 HD12 LEU 496 14.591 3.571 3.305 50 HD13 LEU 496 HD13 LEU 496 14.369 4.351 4.890 51 HD21 LEU 496 HD21 LEU 496 12.842 1.054 5.424 52 HD22 LEU 496 HD22 LEU 496 12.589 2.808 5.429 53 HD23 LEU 496 HD23 LEU 496 12.766 1.949 3.886 54 HA PRO 497 HA PRO 497 15.441 -3.888 2.830 55 HB2 PRO 497 HB2 PRO 497 13.549 -2.760 0.780 56 HB3 PRO 497 HB3 PRO 497 13.593 -4.417 1.459 57 HG2 PRO 497 HG2 PRO 497 11.715 -2.647 2.288 58 HG3 PRO 497 HG3 PRO 497 12.553 -3.697 3.480 59 HD2 PRO 497 HD2 PRO 497 13.113 -0.801 2.805 60 HD3 PRO 497 HD3 PRO 497 13.018 -1.598 4.407 61 H GLU 498 H GLU 498 16.556 -4.458 0.823 62 HA GLU 498 HA GLU 498 18.096 -2.256 -0.309 63 HB2 GLU 498 HB2 GLU 498 19.039 -4.527 0.296 64 HB3 GLU 498 HB3 GLU 498 18.137 -5.203 -1.081 65 HG2 GLU 498 HG2 GLU 498 19.380 -3.764 -2.632 66 HG3 GLU 498 HG3 GLU 498 20.062 -2.855 -1.285 67 H GLY 499 H GLY 499 15.830 -1.484 -0.827 68 HA2 GLY 499 HA2 GLY 499 15.480 -1.344 -3.631 69 HA3 GLY 499 HA3 GLY 499 14.377 -2.586 -2.991 70 H VAL 500 H VAL 500 15.285 0.206 -1.033 71 HA VAL 500 HA VAL 500 12.734 1.596 -1.606 72 HB VAL 500 HB VAL 500 13.625 0.597 1.129 73 HG11 VAL 500 HG11 VAL 500 11.289 2.392 0.337 74 HG12 VAL 500 HG12 VAL 500 11.421 1.563 1.900 75 HG13 VAL 500 HG13 VAL 500 12.616 2.788 1.462 76 HG21 VAL 500 HG21 VAL 500 11.439 -0.593 1.068 77 HG22 VAL 500 HG22 VAL 500 11.194 -0.012 -0.596 78 HG23 VAL 500 HG23 VAL 500 12.527 -1.128 -0.225 79 H ASP 501 H ASP 501 12.687 3.725 -0.472 80 HA ASP 501 HA ASP 501 15.282 4.977 0.209 81 HB2 ASP 501 HB2 ASP 501 13.551 5.501 -2.216 82 HB3 ASP 501 HB3 ASP 501 14.188 6.892 -1.350 83 H GLN 502 H GLN 502 15.056 6.499 1.670 84 HA GLN 502 HA GLN 502 12.671 6.477 3.237 85 HB2 GLN 502 HB2 GLN 502 13.902 8.424 4.405 86 HB3 GLN 502 HB3 GLN 502 14.580 6.804 4.474 87 HG2 GLN 502 HG2 GLN 502 15.469 8.900 2.450 88 HG3 GLN 502 HG3 GLN 502 16.211 8.647 4.044 89 HE21 GLN 502 HE21 GLN 502 15.766 5.620 3.788 90 HE22 GLN 502 HE22 GLN 502 17.119 5.121 2.808 91 H GLU 503 H GLU 503 13.761 8.612 0.602 92 HA GLU 503 HA GLU 503 11.890 10.696 1.271 93 HB2 GLU 503 HB2 GLU 503 12.607 11.727 -0.763 94 HB3 GLU 503 HB3 GLU 503 14.031 10.887 -0.121 95 HG2 GLU 503 HG2 GLU 503 13.138 8.890 -1.585 96 HG3 GLU 503 HG3 GLU 503 12.232 10.139 -2.439 97 H VAL 504 H VAL 504 11.265 7.599 0.415 98 HA VAL 504 HA VAL 504 8.615 8.315 -0.676 99 HB VAL 504 HB VAL 504 8.684 6.361 -2.194 100 HG11 VAL 504 HG11 VAL 504 10.044 7.409 -3.934 101 HG12 VAL 504 HG12 VAL 504 9.160 8.652 -3.026 102 HG13 VAL 504 HG13 VAL 504 10.892 8.392 -2.724 103 HG21 VAL 504 HG21 VAL 504 10.818 5.348 -2.824 104 HG22 VAL 504 HG22 VAL 504 11.660 6.318 -1.600 105 HG23 VAL 504 HG23 VAL 504 10.488 5.065 -1.107 106 H PHE 505 H PHE 505 10.005 7.386 1.955 107 HA PHE 505 HA PHE 505 7.871 5.426 2.607 108 HB2 PHE 505 HB2 PHE 505 9.568 3.900 2.546 109 HB3 PHE 505 HB3 PHE 505 10.817 5.121 2.687 110 HD1 PHE 505 HD1 PHE 505 11.303 6.173 4.929 111 HD2 PHE 505 HD2 PHE 505 9.005 2.574 4.467 112 HE1 PHE 505 HE1 PHE 505 11.814 5.545 7.277 113 HE2 PHE 505 HE2 PHE 505 9.550 1.925 6.811 114 HZ PHE 505 HZ PHE 505 10.947 3.407 8.207 115 H LYS 506 H LYS 506 9.765 8.247 3.468 116 HA LYS 506 HA LYS 506 9.068 8.267 6.271 117 HB2 LYS 506 HB2 LYS 506 10.051 10.364 4.312 118 HB3 LYS 506 HB3 LYS 506 9.686 10.745 5.999 119 HG2 LYS 506 HG2 LYS 506 11.292 9.067 6.778 120 HG3 LYS 506 HG3 LYS 506 11.715 8.659 5.107 121 HD2 LYS 506 HD2 LYS 506 12.040 11.391 6.421 122 HD3 LYS 506 HD3 LYS 506 13.347 10.232 6.101 123 HE2 LYS 506 HE2 LYS 506 12.971 10.411 3.693 124 HE3 LYS 506 HE3 LYS 506 11.599 11.504 3.960 125 HZ1 LYS 506 HZ1 LYS 506 13.067 13.086 4.909 126 HZ2 LYS 506 HZ2 LYS 506 14.350 12.080 4.807 127 HZ3 LYS 506 HZ3 LYS 506 13.659 12.668 3.431 128 H GLN 507 H GLN 507 6.963 8.463 3.680 129 HA GLN 507 HA GLN 507 5.383 10.680 4.838 130 HB2 GLN 507 HB2 GLN 507 4.648 9.095 2.365 131 HB3 GLN 507 HB3 GLN 507 4.176 10.731 2.826 132 HG2 GLN 507 HG2 GLN 507 5.792 11.023 1.102 133 HG3 GLN 507 HG3 GLN 507 6.668 11.357 2.604 134 HE21 GLN 507 HE21 GLN 507 8.741 10.779 1.423 135 HE22 GLN 507 HE22 GLN 507 9.092 9.094 1.183 136 H LEU 508 H LEU 508 5.765 7.385 5.103 137 HA LEU 508 HA LEU 508 3.041 6.458 5.518 138 HB2 LEU 508 HB2 LEU 508 5.842 5.461 6.145 139 HB3 LEU 508 HB3 LEU 508 4.402 4.548 6.563 140 HG LEU 508 HG LEU 508 3.815 4.161 4.302 141 HD11 LEU 508 HD11 LEU 508 5.983 6.115 3.452 142 HD12 LEU 508 HD12 LEU 508 5.112 5.008 2.366 143 HD13 LEU 508 HD13 LEU 508 4.226 6.280 3.219 144 HD21 LEU 508 HD21 LEU 508 6.850 3.966 4.440 145 HD22 LEU 508 HD22 LEU 508 5.761 2.888 5.320 146 HD23 LEU 508 HD23 LEU 508 5.734 2.908 3.542 147 HA PRO 509 HA PRO 509 2.819 7.543 9.883 148 HB2 PRO 509 HB2 PRO 509 1.340 5.462 10.886 149 HB3 PRO 509 HB3 PRO 509 0.640 6.775 9.902 150 HG2 PRO 509 HG2 PRO 509 1.537 4.015 9.048 151 HG3 PRO 509 HG3 PRO 509 0.012 4.858 8.597 152 HD2 PRO 509 HD2 PRO 509 2.206 4.765 6.946 153 HD3 PRO 509 HD3 PRO 509 1.136 6.201 7.021 154 H ALA 510 H ALA 510 3.424 6.749 11.986 155 HA ALA 510 HA ALA 510 5.891 5.399 12.091 156 HB1 ALA 510 HB1 ALA 510 5.064 7.027 13.734 157 HB2 ALA 510 HB2 ALA 510 3.760 5.918 14.193 158 HB3 ALA 510 HB3 ALA 510 5.458 5.484 14.545 159 H ASP 511 H ASP 511 2.698 4.094 11.788 160 HA ASP 511 HA ASP 511 3.440 1.525 13.050 161 HB2 ASP 511 HB2 ASP 511 0.812 2.528 11.873 162 HB3 ASP 511 HB3 ASP 511 1.041 0.996 12.736 163 H ILE 512 H ILE 512 3.745 2.952 10.016 164 HA ILE 512 HA ILE 512 3.890 0.205 8.845 165 HB ILE 512 HB ILE 512 3.500 2.837 7.399 166 HG12 ILE 512 HG12 ILE 512 1.657 0.449 7.861 167 HG13 ILE 512 HG13 ILE 512 1.472 2.070 8.558 168 HG21 ILE 512 HG21 ILE 512 3.596 -0.017 6.330 169 HG22 ILE 512 HG22 ILE 512 3.284 1.453 5.374 170 HG23 ILE 512 HG23 ILE 512 4.869 1.207 6.099 171 HD11 ILE 512 HD11 ILE 512 1.298 2.964 6.184 172 HD12 ILE 512 HD12 ILE 512 1.203 1.272 5.635 173 HD13 ILE 512 HD13 ILE 512 -0.040 1.934 6.718 174 H GLN 513 H GLN 513 5.655 3.058 9.860 175 HA GLN 513 HA GLN 513 8.063 2.731 8.449 176 HB2 GLN 513 HB2 GLN 513 7.142 3.851 11.023 177 HB3 GLN 513 HB3 GLN 513 8.748 3.123 11.163 178 HG2 GLN 513 HG2 GLN 513 8.905 5.508 10.640 179 HG3 GLN 513 HG3 GLN 513 9.621 4.494 9.381 180 HE21 GLN 513 HE21 GLN 513 8.816 4.565 7.296 181 HE22 GLN 513 HE22 GLN 513 7.499 5.600 6.806 182 H GLU 514 H GLU 514 6.720 0.926 11.214 183 HA GLU 514 HA GLU 514 9.079 -0.732 11.523 184 HB2 GLU 514 HB2 GLU 514 7.759 -1.826 13.258 185 HB3 GLU 514 HB3 GLU 514 7.556 -0.062 13.387 186 HG2 GLU 514 HG2 GLU 514 5.395 -0.204 12.223 187 HG3 GLU 514 HG3 GLU 514 5.588 -1.961 12.055 188 H GLU 515 H GLU 515 6.658 -0.775 9.152 189 HA GLU 515 HA GLU 515 6.532 -3.739 9.050 190 HB2 GLU 515 HB2 GLU 515 5.091 -1.572 7.466 191 HB3 GLU 515 HB3 GLU 515 4.830 -3.315 7.279 192 HG2 GLU 515 HG2 GLU 515 4.372 -1.759 9.860 193 HG3 GLU 515 HG3 GLU 515 3.108 -2.198 8.706 194 H ILE 516 H ILE 516 8.045 -0.977 7.494 195 HA ILE 516 HA ILE 516 8.858 -2.651 5.169 196 HB ILE 516 HB ILE 516 8.808 0.314 5.779 197 HG12 ILE 516 HG12 ILE 516 7.543 0.496 3.770 198 HG13 ILE 516 HG13 ILE 516 7.863 -1.192 3.312 199 HG21 ILE 516 HG21 ILE 516 10.282 -1.054 3.489 200 HG22 ILE 516 HG22 ILE 516 9.975 0.693 3.614 201 HG23 ILE 516 HG23 ILE 516 11.024 -0.104 4.798 202 HD11 ILE 516 HD11 ILE 516 6.278 -0.342 5.757 203 HD12 ILE 516 HD12 ILE 516 5.552 -0.757 4.182 204 HD13 ILE 516 HD13 ILE 516 6.430 -1.993 5.094 205 H LEU 517 H LEU 517 10.111 -0.845 7.997 206 HA LEU 517 HA LEU 517 12.879 -1.417 7.490 207 HB2 LEU 517 HB2 LEU 517 11.293 -0.818 10.022 208 HB3 LEU 517 HB3 LEU 517 13.045 -0.977 10.006 209 HG LEU 517 HG LEU 517 11.478 1.040 8.339 210 HD11 LEU 517 HD11 LEU 517 11.347 1.475 10.787 211 HD12 LEU 517 HD12 LEU 517 13.124 1.431 10.873 212 HD13 LEU 517 HD13 LEU 517 12.304 2.707 9.942 213 HD21 LEU 517 HD21 LEU 517 13.754 0.356 7.430 214 HD22 LEU 517 HD22 LEU 517 13.574 2.067 7.828 215 HD23 LEU 517 HD23 LEU 517 14.461 1.004 8.935 216 H SER 518 H SER 518 10.290 -3.457 8.151 217 HA SER 518 HA SER 518 11.591 -5.409 9.840 218 HB2 SER 518 HB2 SER 518 9.078 -5.123 9.414 219 HB3 SER 518 HB3 SER 518 9.374 -5.818 7.799 220 HG SER 518 HG SER 518 8.756 -7.402 9.346 221 H GLY 519 H GLY 519 10.939 -5.187 6.286 222 HA2 GLY 519 HA2 GLY 519 12.994 -6.146 5.016 223 HA3 GLY 519 HA3 GLY 519 12.468 -7.659 5.798 224 H LYS 520 H LYS 520 12.379 -6.697 2.920 225 HA LYS 520 HA LYS 520 9.565 -7.316 2.310 226 HB2 LYS 520 HB2 LYS 520 11.054 -4.746 1.627 227 HB3 LYS 520 HB3 LYS 520 9.608 -5.276 0.768 228 HG2 LYS 520 HG2 LYS 520 9.651 -4.686 3.750 229 HG3 LYS 520 HG3 LYS 520 9.145 -3.562 2.480 230 HD2 LYS 520 HD2 LYS 520 7.429 -5.210 1.720 231 HD3 LYS 520 HD3 LYS 520 7.862 -6.259 3.092 232 HE2 LYS 520 HE2 LYS 520 7.297 -4.430 4.655 233 HE3 LYS 520 HE3 LYS 520 6.875 -3.384 3.283 234 HZ1 LYS 520 HZ1 LYS 520 5.132 -4.933 2.721 235 HZ2 LYS 520 HZ2 LYS 520 5.564 -5.926 3.958 236 HZ3 LYS 520 HZ3 LYS 520 4.949 -4.435 4.278 237 H SER 521 H SER 521 9.407 -7.173 -0.164 238 HA SER 521 HA SER 521 11.761 -7.940 -1.728 239 HB2 SER 521 HB2 SER 521 11.142 -10.029 -0.472 240 HB3 SER 521 HB3 SER 521 9.531 -9.949 -1.214 241 HG SER 521 HG SER 521 11.042 -11.275 -2.369 242 H ARG 522 H ARG 522 10.808 -8.779 -3.929 243 HA ARG 522 HA ARG 522 9.761 -8.251 -5.842 244 HB2 ARG 522 HB2 ARG 522 7.828 -9.102 -4.166 245 HB3 ARG 522 HB3 ARG 522 7.238 -7.453 -4.425 246 HG2 ARG 522 HG2 ARG 522 6.189 -8.494 -6.181 247 HG3 ARG 522 HG3 ARG 522 7.723 -8.125 -6.996 248 HD2 ARG 522 HD2 ARG 522 6.939 -10.741 -5.652 249 HD3 ARG 522 HD3 ARG 522 7.041 -10.452 -7.397 250 HE ARG 522 HE ARG 522 9.579 -9.849 -6.495 251 HH11 ARG 522 HH11 ARG 522 7.453 -12.646 -6.115 252 HH12 ARG 522 HH12 ARG 522 8.784 -13.777 -6.011 253 HH21 ARG 522 HH21 ARG 522 11.284 -11.350 -6.375 254 HH22 ARG 522 HH22 ARG 522 10.940 -13.046 -6.138 255 H GLU 523 H GLU 523 11.086 -6.049 -4.236 256 HA GLU 523 HA GLU 523 10.130 -3.879 -5.981 257 HB2 GLU 523 HB2 GLU 523 9.998 -2.289 -4.111 258 HB3 GLU 523 HB3 GLU 523 8.818 -3.604 -3.942 259 HG2 GLU 523 HG2 GLU 523 10.415 -4.751 -2.368 260 HG3 GLU 523 HG3 GLU 523 11.474 -3.334 -2.472 261 H ASN 524 H ASN 524 11.710 -2.312 -6.416 262 HA ASN 524 HA ASN 524 14.398 -2.598 -5.251 263 HB2 ASN 524 HB2 ASN 524 13.683 -3.199 -8.158 264 HB3 ASN 524 HB3 ASN 524 15.326 -2.806 -7.628 265 HD21 ASN 524 HD21 ASN 524 12.830 -5.279 -7.699 266 HD22 ASN 524 HD22 ASN 524 13.805 -6.545 -6.985 267 H LEU 525 H LEU 525 12.556 -0.577 -4.987 268 HA LEU 525 HA LEU 525 12.128 1.614 -5.296 269 HB2 LEU 525 HB2 LEU 525 14.031 3.037 -4.903 270 HB3 LEU 525 HB3 LEU 525 13.970 1.624 -3.861 271 HG LEU 525 HG LEU 525 15.648 0.531 -5.491 272 HD11 LEU 525 HD11 LEU 525 17.022 2.162 -6.761 273 HD12 LEU 525 HD12 LEU 525 15.320 2.169 -7.302 274 HD13 LEU 525 HD13 LEU 525 15.915 3.471 -6.253 275 HD21 LEU 525 HD21 LEU 525 16.419 2.983 -3.867 276 HD22 LEU 525 HD22 LEU 525 16.185 1.339 -3.231 277 HD23 LEU 525 HD23 LEU 525 17.525 1.674 -4.362 278 H LYS 526 H LYS 526 12.566 -0.002 -7.814 279 HA LYS 526 HA LYS 526 12.320 2.293 -9.707 280 HB2 LYS 526 HB2 LYS 526 13.556 -0.465 -9.961 281 HB3 LYS 526 HB3 LYS 526 13.190 0.536 -11.388 282 HG2 LYS 526 HG2 LYS 526 14.734 2.249 -10.675 283 HG3 LYS 526 HG3 LYS 526 15.010 1.433 -9.115 284 HD2 LYS 526 HD2 LYS 526 15.567 0.105 -11.779 285 HD3 LYS 526 HD3 LYS 526 16.785 1.065 -10.897 286 HE2 LYS 526 HE2 LYS 526 16.522 -0.423 -8.928 287 HE3 LYS 526 HE3 LYS 526 15.344 -1.398 -9.808 288 HZ1 LYS 526 HZ1 LYS 526 17.543 -2.354 -9.921 289 HZ2 LYS 526 HZ2 LYS 526 17.061 -1.892 -11.423 290 HZ3 LYS 526 HZ3 LYS 526 18.155 -0.991 -10.592 291 H1 MET 1 H1 MET 1 -14.124 11.126 -11.432 292 H2 MET 1 H2 MET 1 -13.637 11.185 -13.003 293 H3 MET 1 H3 MET 1 -14.380 12.485 -12.328 294 HA MET 1 HA MET 1 -12.002 12.863 -12.511 295 HB2 MET 1 HB2 MET 1 -11.629 13.603 -10.266 296 HB3 MET 1 HB3 MET 1 -13.364 13.817 -10.587 297 HG2 MET 1 HG2 MET 1 -13.844 11.712 -9.384 298 HG3 MET 1 HG3 MET 1 -12.123 11.423 -9.155 299 HE1 MET 1 HE1 MET 1 -13.989 11.173 -6.743 300 HE2 MET 1 HE2 MET 1 -12.215 11.112 -6.590 301 HE3 MET 1 HE3 MET 1 -13.169 12.140 -5.499 302 H GLN 2 H GLN 2 -10.022 12.401 -10.829 303 HA GLN 2 HA GLN 2 -9.782 9.566 -10.240 304 HB2 GLN 2 HB2 GLN 2 -7.911 9.150 -11.747 305 HB3 GLN 2 HB3 GLN 2 -9.256 9.808 -12.706 306 HG2 GLN 2 HG2 GLN 2 -8.115 12.114 -12.174 307 HG3 GLN 2 HG3 GLN 2 -6.704 11.153 -11.795 308 HE21 GLN 2 HE21 GLN 2 -5.546 12.143 -13.583 309 HE22 GLN 2 HE22 GLN 2 -5.892 11.697 -15.237 310 H ILE 3 H ILE 3 -7.415 9.186 -9.488 311 HA ILE 3 HA ILE 3 -6.298 11.556 -8.096 312 HB ILE 3 HB ILE 3 -6.185 10.479 -5.995 313 HG12 ILE 3 HG12 ILE 3 -6.767 7.974 -7.516 314 HG13 ILE 3 HG13 ILE 3 -5.678 8.290 -6.187 315 HG21 ILE 3 HG21 ILE 3 -8.986 10.049 -7.077 316 HG22 ILE 3 HG22 ILE 3 -8.511 10.315 -5.377 317 HG23 ILE 3 HG23 ILE 3 -8.283 11.602 -6.565 318 HD11 ILE 3 HD11 ILE 3 -8.696 7.938 -6.003 319 HD12 ILE 3 HD12 ILE 3 -7.445 6.807 -5.445 320 HD13 ILE 3 HD13 ILE 3 -7.652 8.364 -4.624 321 H PHE 4 H PHE 4 -4.186 10.536 -6.830 322 HA PHE 4 HA PHE 4 -2.793 8.752 -8.762 323 HB2 PHE 4 HB2 PHE 4 -1.655 11.365 -7.693 324 HB3 PHE 4 HB3 PHE 4 -0.848 10.208 -8.660 325 HD1 PHE 4 HD1 PHE 4 -1.382 9.734 -10.969 326 HD2 PHE 4 HD2 PHE 4 -3.256 12.961 -8.834 327 HE1 PHE 4 HE1 PHE 4 -1.944 10.798 -13.108 328 HE2 PHE 4 HE2 PHE 4 -3.839 14.038 -10.997 329 HZ PHE 4 HZ PHE 4 -3.190 12.971 -13.137 330 H VAL 5 H VAL 5 -2.657 7.042 -7.410 331 HA VAL 5 HA VAL 5 -1.750 7.500 -4.630 332 HB VAL 5 HB VAL 5 -2.481 5.317 -4.163 333 HG11 VAL 5 HG11 VAL 5 -4.413 6.378 -6.301 334 HG12 VAL 5 HG12 VAL 5 -4.796 5.262 -4.981 335 HG13 VAL 5 HG13 VAL 5 -4.335 6.938 -4.631 336 HG21 VAL 5 HG21 VAL 5 -2.577 4.763 -7.147 337 HG22 VAL 5 HG22 VAL 5 -1.456 4.057 -5.947 338 HG23 VAL 5 HG23 VAL 5 -3.178 3.674 -5.871 339 H LYS 6 H LYS 6 0.317 6.916 -3.917 340 HA LYS 6 HA LYS 6 2.130 5.955 -6.089 341 HB2 LYS 6 HB2 LYS 6 2.489 8.298 -5.604 342 HB3 LYS 6 HB3 LYS 6 2.604 7.959 -3.863 343 HG2 LYS 6 HG2 LYS 6 4.613 6.610 -4.212 344 HG3 LYS 6 HG3 LYS 6 4.521 6.873 -5.972 345 HD2 LYS 6 HD2 LYS 6 4.624 9.185 -4.029 346 HD3 LYS 6 HD3 LYS 6 6.112 8.355 -4.563 347 HE2 LYS 6 HE2 LYS 6 5.553 8.822 -6.907 348 HE3 LYS 6 HE3 LYS 6 4.067 9.652 -6.395 349 HZ1 LYS 6 HZ1 LYS 6 6.809 10.476 -5.716 350 HZ2 LYS 6 HZ2 LYS 6 5.831 11.201 -6.817 351 HZ3 LYS 6 HZ3 LYS 6 5.442 11.236 -5.220 352 H THR 7 H THR 7 3.552 4.416 -5.728 353 HA THR 7 HA THR 7 2.989 2.534 -3.627 354 HB THR 7 HB THR 7 4.798 1.242 -4.735 355 HG1 THR 7 HG1 THR 7 5.907 2.184 -6.402 356 HG21 THR 7 HG21 THR 7 2.495 1.201 -5.666 357 HG22 THR 7 HG22 THR 7 2.914 2.562 -6.735 358 HG23 THR 7 HG23 THR 7 3.737 0.994 -6.919 359 H LEU 8 H LEU 8 4.875 1.417 -2.537 360 HA LEU 8 HA LEU 8 6.274 3.212 -0.815 361 HB2 LEU 8 HB2 LEU 8 5.332 0.878 -0.421 362 HB3 LEU 8 HB3 LEU 8 6.720 0.225 -1.273 363 HG LEU 8 HG LEU 8 6.547 0.397 1.361 364 HD11 LEU 8 HD11 LEU 8 8.949 0.324 1.576 365 HD12 LEU 8 HD12 LEU 8 8.434 -0.588 0.142 366 HD13 LEU 8 HD13 LEU 8 9.168 1.023 -0.036 367 HD21 LEU 8 HD21 LEU 8 7.657 2.330 2.319 368 HD22 LEU 8 HD22 LEU 8 7.872 3.056 0.716 369 HD23 LEU 8 HD23 LEU 8 6.232 2.853 1.393 370 H THR 9 H THR 9 6.844 2.655 -4.011 371 HA THR 9 HA THR 9 9.817 2.695 -3.704 372 HB THR 9 HB THR 9 9.882 1.667 -5.962 373 HG1 THR 9 HG1 THR 9 7.953 0.779 -6.742 374 HG21 THR 9 HG21 THR 9 10.043 0.248 -3.937 375 HG22 THR 9 HG22 THR 9 8.274 0.095 -3.897 376 HG23 THR 9 HG23 THR 9 9.195 -0.592 -5.254 377 H GLY 10 H GLY 10 7.180 4.648 -4.559 378 HA2 GLY 10 HA2 GLY 10 7.585 6.930 -5.007 379 HA3 GLY 10 HA3 GLY 10 9.118 6.535 -5.796 380 H LYS 11 H LYS 11 6.260 4.657 -6.651 381 HA LYS 11 HA LYS 11 6.051 6.232 -9.190 382 HB2 LYS 11 HB2 LYS 11 7.214 4.053 -9.314 383 HB3 LYS 11 HB3 LYS 11 5.763 3.225 -8.730 384 HG2 LYS 11 HG2 LYS 11 5.507 5.041 -11.127 385 HG3 LYS 11 HG3 LYS 11 6.268 3.447 -11.329 386 HD2 LYS 11 HD2 LYS 11 4.283 2.330 -10.418 387 HD3 LYS 11 HD3 LYS 11 3.502 3.894 -10.122 388 HE2 LYS 11 HE2 LYS 11 2.635 2.954 -12.178 389 HE3 LYS 11 HE3 LYS 11 3.593 4.396 -12.549 390 HZ1 LYS 11 HZ1 LYS 11 4.085 2.591 -14.042 391 HZ2 LYS 11 HZ2 LYS 11 5.418 2.938 -13.148 392 HZ3 LYS 11 HZ3 LYS 11 4.512 1.607 -12.802 393 H THR 12 H THR 12 4.093 6.678 -9.991 394 HA THR 12 HA THR 12 1.934 6.427 -7.949 395 HB THR 12 HB THR 12 2.240 8.610 -10.029 396 HG1 THR 12 HG1 THR 12 3.259 9.752 -8.415 397 HG21 THR 12 HG21 THR 12 0.733 8.297 -7.424 398 HG22 THR 12 HG22 THR 12 0.996 9.836 -8.287 399 HG23 THR 12 HG23 THR 12 0.084 8.513 -9.076 400 H ILE 13 H ILE 13 -0.245 6.158 -8.709 401 HA ILE 13 HA ILE 13 -0.517 5.186 -11.514 402 HB ILE 13 HB ILE 13 -1.618 3.846 -9.011 403 HG12 ILE 13 HG12 ILE 13 0.623 2.964 -10.885 404 HG13 ILE 13 HG13 ILE 13 0.836 3.537 -9.228 405 HG21 ILE 13 HG21 ILE 13 -1.666 2.984 -11.932 406 HG22 ILE 13 HG22 ILE 13 -2.385 2.104 -10.564 407 HG23 ILE 13 HG23 ILE 13 -3.048 3.669 -11.047 408 HD11 ILE 13 HD11 ILE 13 0.916 1.131 -9.222 409 HD12 ILE 13 HD12 ILE 13 -0.577 1.653 -8.405 410 HD13 ILE 13 HD13 ILE 13 -0.639 1.015 -10.066 411 H THR 14 H THR 14 -2.291 5.978 -12.536 412 HA THR 14 HA THR 14 -3.926 7.906 -11.064 413 HB THR 14 HB THR 14 -4.201 7.120 -13.986 414 HG1 THR 14 HG1 THR 14 -2.604 8.659 -14.396 415 HG21 THR 14 HG21 THR 14 -4.546 9.716 -12.430 416 HG22 THR 14 HG22 THR 14 -4.827 9.498 -14.178 417 HG23 THR 14 HG23 THR 14 -5.869 8.663 -13.005 418 H LEU 15 H LEU 15 -6.132 7.623 -10.578 419 HA LEU 15 HA LEU 15 -7.406 5.072 -11.388 420 HB2 LEU 15 HB2 LEU 15 -6.970 5.966 -8.510 421 HB3 LEU 15 HB3 LEU 15 -7.907 4.559 -9.020 422 HG LEU 15 HG LEU 15 -4.932 4.940 -9.549 423 HD11 LEU 15 HD11 LEU 15 -5.518 4.759 -7.116 424 HD12 LEU 15 HD12 LEU 15 -6.357 3.233 -7.463 425 HD13 LEU 15 HD13 LEU 15 -4.595 3.362 -7.716 426 HD21 LEU 15 HD21 LEU 15 -4.919 2.554 -10.020 427 HD22 LEU 15 HD22 LEU 15 -6.660 2.433 -9.707 428 HD23 LEU 15 HD23 LEU 15 -6.079 3.350 -11.113 429 H GLU 16 H GLU 16 -9.539 5.263 -11.600 430 HA GLU 16 HA GLU 16 -10.807 7.887 -11.020 431 HB2 GLU 16 HB2 GLU 16 -11.046 7.083 -13.279 432 HB3 GLU 16 HB3 GLU 16 -11.505 5.459 -12.725 433 HG2 GLU 16 HG2 GLU 16 -13.574 6.294 -11.798 434 HG3 GLU 16 HG3 GLU 16 -13.150 7.971 -12.209 435 H VAL 17 H VAL 17 -12.074 8.190 -9.376 436 HA VAL 17 HA VAL 17 -13.684 6.003 -8.217 437 HB VAL 17 HB VAL 17 -12.949 6.580 -5.938 438 HG11 VAL 17 HG11 VAL 17 -10.591 5.766 -7.681 439 HG12 VAL 17 HG12 VAL 17 -10.787 5.469 -5.940 440 HG13 VAL 17 HG13 VAL 17 -11.876 4.678 -7.099 441 HG21 VAL 17 HG21 VAL 17 -10.786 8.227 -7.315 442 HG22 VAL 17 HG22 VAL 17 -12.140 8.886 -6.373 443 HG23 VAL 17 HG23 VAL 17 -10.904 7.894 -5.570 444 H GLU 18 H GLU 18 -15.049 7.019 -6.364 445 HA GLU 18 HA GLU 18 -15.800 9.844 -6.946 446 HB2 GLU 18 HB2 GLU 18 -17.639 7.448 -6.570 447 HB3 GLU 18 HB3 GLU 18 -18.183 9.114 -6.728 448 HG2 GLU 18 HG2 GLU 18 -16.645 7.562 -8.848 449 HG3 GLU 18 HG3 GLU 18 -18.397 7.789 -8.787 450 HA PRO 19 HA PRO 19 -15.912 10.310 -2.556 451 HB2 PRO 19 HB2 PRO 19 -18.680 11.428 -2.693 452 HB3 PRO 19 HB3 PRO 19 -17.198 12.144 -2.003 453 HG2 PRO 19 HG2 PRO 19 -18.168 13.000 -4.405 454 HG3 PRO 19 HG3 PRO 19 -16.406 12.843 -4.102 455 HD2 PRO 19 HD2 PRO 19 -18.239 10.941 -5.561 456 HD3 PRO 19 HD3 PRO 19 -16.591 11.487 -6.001 457 H SER 20 H SER 20 -17.849 8.028 -4.089 458 HA SER 20 HA SER 20 -18.988 7.066 -1.512 459 HB2 SER 20 HB2 SER 20 -20.193 7.002 -4.307 460 HB3 SER 20 HB3 SER 20 -20.866 6.196 -2.878 461 HG SER 20 HG SER 20 -21.788 8.281 -3.236 462 H ASP 21 H ASP 21 -16.770 6.526 -3.988 463 HA ASP 21 HA ASP 21 -16.993 3.585 -4.000 464 HB2 ASP 21 HB2 ASP 21 -15.007 5.524 -5.175 465 HB3 ASP 21 HB3 ASP 21 -14.951 3.773 -5.412 466 H THR 22 H THR 22 -16.821 3.499 -1.729 467 HA THR 22 HA THR 22 -14.665 4.590 -0.189 468 HB THR 22 HB THR 22 -16.588 4.096 1.015 469 HG1 THR 22 HG1 THR 22 -15.893 2.661 2.548 470 HG21 THR 22 HG21 THR 22 -17.596 1.851 1.202 471 HG22 THR 22 HG22 THR 22 -17.752 2.594 -0.398 472 HG23 THR 22 HG23 THR 22 -16.546 1.299 -0.132 473 H ILE 23 H ILE 23 -13.217 2.966 1.214 474 HA ILE 23 HA ILE 23 -11.186 2.387 -0.591 475 HB ILE 23 HB ILE 23 -11.451 1.091 2.136 476 HG12 ILE 23 HG12 ILE 23 -12.024 3.385 2.526 477 HG13 ILE 23 HG13 ILE 23 -10.358 3.137 3.047 478 HG21 ILE 23 HG21 ILE 23 -9.052 2.086 0.545 479 HG22 ILE 23 HG22 ILE 23 -9.002 1.396 2.186 480 HG23 ILE 23 HG23 ILE 23 -9.518 0.392 0.819 481 HD11 ILE 23 HD11 ILE 23 -9.544 4.180 0.944 482 HD12 ILE 23 HD12 ILE 23 -11.238 4.419 0.424 483 HD13 ILE 23 HD13 ILE 23 -10.625 5.257 1.854 484 H GLU 24 H GLU 24 -13.770 0.135 0.485 485 HA GLU 24 HA GLU 24 -12.332 -2.209 -0.385 486 HB2 GLU 24 HB2 GLU 24 -14.445 -3.351 -0.242 487 HB3 GLU 24 HB3 GLU 24 -14.314 -2.239 1.137 488 HG2 GLU 24 HG2 GLU 24 -15.723 -0.598 -0.070 489 HG3 GLU 24 HG3 GLU 24 -15.867 -1.718 -1.434 490 H ASN 25 H ASN 25 -13.908 0.359 -2.065 491 HA ASN 25 HA ASN 25 -14.199 -1.088 -4.578 492 HB2 ASN 25 HB2 ASN 25 -14.479 1.859 -3.890 493 HB3 ASN 25 HB3 ASN 25 -14.861 1.167 -5.441 494 HD21 ASN 25 HD21 ASN 25 -15.833 1.509 -2.188 495 HD22 ASN 25 HD22 ASN 25 -17.397 0.684 -2.303 496 H VAL 26 H VAL 26 -12.054 1.455 -3.108 497 HA VAL 26 HA VAL 26 -10.611 2.010 -5.505 498 HB VAL 26 HB VAL 26 -9.252 3.368 -4.201 499 HG11 VAL 26 HG11 VAL 26 -11.685 3.951 -4.338 500 HG12 VAL 26 HG12 VAL 26 -11.883 3.300 -2.692 501 HG13 VAL 26 HG13 VAL 26 -10.809 4.693 -2.980 502 HG21 VAL 26 HG21 VAL 26 -9.935 1.644 -1.840 503 HG22 VAL 26 HG22 VAL 26 -8.350 1.982 -2.561 504 HG23 VAL 26 HG23 VAL 26 -9.214 3.274 -1.695 505 H LYS 27 H LYS 27 -10.083 -0.264 -2.814 506 HA LYS 27 HA LYS 27 -7.554 -1.216 -3.532 507 HB2 LYS 27 HB2 LYS 27 -10.023 -2.487 -2.305 508 HB3 LYS 27 HB3 LYS 27 -8.539 -3.418 -2.543 509 HG2 LYS 27 HG2 LYS 27 -7.252 -1.854 -1.201 510 HG3 LYS 27 HG3 LYS 27 -8.650 -0.770 -1.037 511 HD2 LYS 27 HD2 LYS 27 -9.893 -2.508 0.180 512 HD3 LYS 27 HD3 LYS 27 -8.548 -3.651 -0.053 513 HE2 LYS 27 HE2 LYS 27 -7.053 -2.098 1.167 514 HE3 LYS 27 HE3 LYS 27 -8.420 -1.013 1.467 515 HZ1 LYS 27 HZ1 LYS 27 -9.510 -2.756 2.658 516 HZ2 LYS 27 HZ2 LYS 27 -8.264 -3.803 2.397 517 HZ3 LYS 27 HZ3 LYS 27 -8.045 -2.465 3.335 518 H ALA 28 H ALA 28 -10.751 -1.847 -5.045 519 HA ALA 28 HA ALA 28 -9.697 -3.964 -6.731 520 HB1 ALA 28 HB1 ALA 28 -12.240 -2.311 -7.038 521 HB2 ALA 28 HB2 ALA 28 -11.846 -3.821 -7.870 522 HB3 ALA 28 HB3 ALA 28 -12.092 -3.824 -6.103 523 H LYS 29 H LYS 29 -9.971 -0.418 -6.943 524 HA LYS 29 HA LYS 29 -9.514 -0.233 -9.781 525 HB2 LYS 29 HB2 LYS 29 -9.115 1.665 -7.454 526 HB3 LYS 29 HB3 LYS 29 -8.528 2.059 -9.068 527 HG2 LYS 29 HG2 LYS 29 -10.641 3.069 -8.771 528 HG3 LYS 29 HG3 LYS 29 -10.808 1.791 -9.992 529 HD2 LYS 29 HD2 LYS 29 -11.886 0.313 -8.388 530 HD3 LYS 29 HD3 LYS 29 -11.432 1.382 -7.062 531 HE2 LYS 29 HE2 LYS 29 -13.817 1.584 -7.620 532 HE3 LYS 29 HE3 LYS 29 -12.949 3.110 -7.808 533 HZ1 LYS 29 HZ1 LYS 29 -12.862 2.728 -10.164 534 HZ2 LYS 29 HZ2 LYS 29 -13.630 1.276 -10.017 535 HZ3 LYS 29 HZ3 LYS 29 -14.421 2.674 -9.664 536 H ILE 30 H ILE 30 -7.419 -0.682 -6.940 537 HA ILE 30 HA ILE 30 -4.958 -0.221 -8.477 538 HB ILE 30 HB ILE 30 -5.585 -1.110 -5.636 539 HG12 ILE 30 HG12 ILE 30 -4.383 1.458 -6.738 540 HG13 ILE 30 HG13 ILE 30 -6.102 1.259 -6.350 541 HG21 ILE 30 HG21 ILE 30 -2.871 -0.481 -6.885 542 HG22 ILE 30 HG22 ILE 30 -3.175 -0.819 -5.162 543 HG23 ILE 30 HG23 ILE 30 -3.420 -2.090 -6.361 544 HD11 ILE 30 HD11 ILE 30 -4.969 2.383 -4.518 545 HD12 ILE 30 HD12 ILE 30 -5.527 0.783 -3.996 546 HD13 ILE 30 HD13 ILE 30 -3.804 1.051 -4.366 547 H GLN 31 H GLN 31 -6.952 -2.935 -7.307 548 HA GLN 31 HA GLN 31 -5.096 -5.020 -7.938 549 HB2 GLN 31 HB2 GLN 31 -7.062 -5.444 -6.546 550 HB3 GLN 31 HB3 GLN 31 -8.143 -4.897 -7.843 551 HG2 GLN 31 HG2 GLN 31 -7.463 -6.718 -9.293 552 HG3 GLN 31 HG3 GLN 31 -6.226 -7.230 -8.157 553 HE21 GLN 31 HE21 GLN 31 -7.009 -9.309 -7.717 554 HE22 GLN 31 HE22 GLN 31 -8.541 -9.602 -6.917 555 H ASP 32 H ASP 32 -7.573 -3.238 -9.812 556 HA ASP 32 HA ASP 32 -7.509 -4.985 -12.062 557 HB2 ASP 32 HB2 ASP 32 -9.316 -3.377 -11.512 558 HB3 ASP 32 HB3 ASP 32 -8.209 -2.043 -11.678 559 H LYS 33 H LYS 33 -5.616 -2.250 -11.040 560 HA LYS 33 HA LYS 33 -4.398 -1.735 -13.634 561 HB2 LYS 33 HB2 LYS 33 -4.197 -0.681 -10.808 562 HB3 LYS 33 HB3 LYS 33 -3.060 -0.128 -12.051 563 HG2 LYS 33 HG2 LYS 33 -6.081 -0.035 -12.444 564 HG3 LYS 33 HG3 LYS 33 -5.169 1.291 -11.691 565 HD2 LYS 33 HD2 LYS 33 -3.726 1.457 -13.687 566 HD3 LYS 33 HD3 LYS 33 -4.685 0.201 -14.491 567 HE2 LYS 33 HE2 LYS 33 -5.798 2.832 -13.424 568 HE3 LYS 33 HE3 LYS 33 -5.323 2.565 -15.104 569 HZ1 LYS 33 HZ1 LYS 33 -7.403 1.055 -13.658 570 HZ2 LYS 33 HZ2 LYS 33 -7.680 2.218 -14.785 571 HZ3 LYS 33 HZ3 LYS 33 -6.968 0.807 -15.221 572 H GLU 34 H GLU 34 -3.567 -3.692 -10.823 573 HA GLU 34 HA GLU 34 -0.938 -4.232 -12.137 574 HB2 GLU 34 HB2 GLU 34 -1.440 -3.735 -9.179 575 HB3 GLU 34 HB3 GLU 34 0.086 -4.313 -9.853 576 HG2 GLU 34 HG2 GLU 34 -1.238 -1.651 -10.546 577 HG3 GLU 34 HG3 GLU 34 0.070 -1.868 -9.388 578 H GLY 35 H GLY 35 -3.474 -5.396 -9.882 579 HA2 GLY 35 HA2 GLY 35 -4.295 -7.662 -10.306 580 HA3 GLY 35 HA3 GLY 35 -2.617 -8.189 -10.519 581 H ILE 36 H ILE 36 -2.922 -5.830 -8.092 582 HA ILE 36 HA ILE 36 -2.058 -7.727 -6.073 583 HB ILE 36 HB ILE 36 -2.624 -4.737 -6.025 584 HG12 ILE 36 HG12 ILE 36 0.012 -6.267 -6.117 585 HG13 ILE 36 HG13 ILE 36 -0.776 -5.575 -7.539 586 HG21 ILE 36 HG21 ILE 36 -1.164 -6.478 -3.990 587 HG22 ILE 36 HG22 ILE 36 -1.389 -4.716 -3.904 588 HG23 ILE 36 HG23 ILE 36 -2.791 -5.794 -3.769 589 HD11 ILE 36 HD11 ILE 36 0.219 -4.009 -5.117 590 HD12 ILE 36 HD12 ILE 36 0.936 -4.039 -6.737 591 HD13 ILE 36 HD13 ILE 36 -0.666 -3.311 -6.497 592 HA PRO 37 HA PRO 37 -6.221 -8.505 -4.774 593 HB2 PRO 37 HB2 PRO 37 -5.750 -9.828 -2.413 594 HB3 PRO 37 HB3 PRO 37 -5.444 -10.551 -4.021 595 HG2 PRO 37 HG2 PRO 37 -3.462 -9.205 -2.180 596 HG3 PRO 37 HG3 PRO 37 -3.281 -10.768 -3.050 597 HD2 PRO 37 HD2 PRO 37 -2.219 -8.435 -3.990 598 HD3 PRO 37 HD3 PRO 37 -2.882 -9.659 -5.110 599 HA PRO 38 HA PRO 38 -7.201 -5.213 -1.951 600 HB2 PRO 38 HB2 PRO 38 -9.643 -6.064 -1.002 601 HB3 PRO 38 HB3 PRO 38 -9.397 -5.437 -2.660 602 HG2 PRO 38 HG2 PRO 38 -9.479 -8.324 -1.754 603 HG3 PRO 38 HG3 PRO 38 -10.329 -7.576 -3.149 604 HD2 PRO 38 HD2 PRO 38 -7.992 -8.934 -3.450 605 HD3 PRO 38 HD3 PRO 38 -8.337 -7.461 -4.412 606 H ASP 39 H ASP 39 -6.772 -8.524 -1.053 607 HA ASP 39 HA ASP 39 -7.197 -8.106 1.782 608 HB2 ASP 39 HB2 ASP 39 -5.983 -10.431 0.242 609 HB3 ASP 39 HB3 ASP 39 -6.414 -10.453 1.957 610 H GLN 40 H GLN 40 -4.598 -7.288 -0.303 611 HA GLN 40 HA GLN 40 -2.730 -7.424 2.019 612 HB2 GLN 40 HB2 GLN 40 -2.130 -7.874 -0.918 613 HB3 GLN 40 HB3 GLN 40 -0.918 -7.692 0.357 614 HG2 GLN 40 HG2 GLN 40 -2.058 -9.615 1.588 615 HG3 GLN 40 HG3 GLN 40 -3.001 -9.887 0.107 616 HE21 GLN 40 HE21 GLN 40 -1.350 -9.706 -1.952 617 HE22 GLN 40 HE22 GLN 40 0.018 -10.797 -1.811 618 H GLN 41 H GLN 41 -4.270 -5.270 -0.277 619 HA GLN 41 HA GLN 41 -2.159 -3.297 -0.282 620 HB2 GLN 41 HB2 GLN 41 -5.164 -3.107 -0.706 621 HB3 GLN 41 HB3 GLN 41 -4.021 -1.784 -0.986 622 HG2 GLN 41 HG2 GLN 41 -2.874 -3.068 -2.724 623 HG3 GLN 41 HG3 GLN 41 -3.904 -4.478 -2.393 624 HE21 GLN 41 HE21 GLN 41 -5.029 -4.602 -4.381 625 HE22 GLN 41 HE22 GLN 41 -6.157 -3.356 -4.848 626 H ARG 42 H ARG 42 -2.329 -1.188 0.658 627 HA ARG 42 HA ARG 42 -4.134 -0.680 2.898 628 HB2 ARG 42 HB2 ARG 42 -2.228 -1.862 3.962 629 HB3 ARG 42 HB3 ARG 42 -1.100 -0.696 3.245 630 HG2 ARG 42 HG2 ARG 42 -2.033 1.118 4.536 631 HG3 ARG 42 HG3 ARG 42 -3.398 0.119 5.079 632 HD2 ARG 42 HD2 ARG 42 -0.498 -0.533 5.729 633 HD3 ARG 42 HD3 ARG 42 -1.547 0.438 6.776 634 HE ARG 42 HE ARG 42 -2.721 -2.126 6.042 635 HH11 ARG 42 HH11 ARG 42 -0.558 -0.479 8.305 636 HH12 ARG 42 HH12 ARG 42 -0.833 -1.627 9.593 637 HH21 ARG 42 HH21 ARG 42 -3.064 -3.612 7.734 638 HH22 ARG 42 HH22 ARG 42 -2.255 -3.398 9.268 639 H LEU 43 H LEU 43 -4.392 1.643 3.160 640 HA LEU 43 HA LEU 43 -3.041 3.213 1.028 641 HB2 LEU 43 HB2 LEU 43 -5.155 2.106 0.272 642 HB3 LEU 43 HB3 LEU 43 -6.025 2.937 1.568 643 HG LEU 43 HG LEU 43 -5.444 5.107 0.560 644 HD11 LEU 43 HD11 LEU 43 -4.267 3.388 -1.680 645 HD12 LEU 43 HD12 LEU 43 -4.538 5.143 -1.771 646 HD13 LEU 43 HD13 LEU 43 -3.356 4.492 -0.619 647 HD21 LEU 43 HD21 LEU 43 -6.715 3.066 -1.340 648 HD22 LEU 43 HD22 LEU 43 -7.547 3.918 -0.029 649 HD23 LEU 43 HD23 LEU 43 -6.940 4.831 -1.432 650 H ILE 44 H ILE 44 -2.714 5.343 1.515 651 HA ILE 44 HA ILE 44 -3.698 6.391 4.124 652 HB ILE 44 HB ILE 44 -0.832 6.274 3.109 653 HG12 ILE 44 HG12 ILE 44 -0.623 5.491 5.634 654 HG13 ILE 44 HG13 ILE 44 -2.332 5.107 5.464 655 HG21 ILE 44 HG21 ILE 44 -0.155 7.631 5.010 656 HG22 ILE 44 HG22 ILE 44 -1.309 8.561 4.060 657 HG23 ILE 44 HG23 ILE 44 -1.815 7.760 5.576 658 HD11 ILE 44 HD11 ILE 44 -1.778 3.589 3.561 659 HD12 ILE 44 HD12 ILE 44 -0.063 4.056 3.715 660 HD13 ILE 44 HD13 ILE 44 -0.884 3.162 5.024 661 H PHE 45 H PHE 45 -3.856 8.667 4.193 662 HA PHE 45 HA PHE 45 -3.296 10.270 1.769 663 HB2 PHE 45 HB2 PHE 45 -5.606 9.304 1.542 664 HB3 PHE 45 HB3 PHE 45 -6.031 10.043 3.089 665 HD1 PHE 45 HD1 PHE 45 -4.214 11.361 0.064 666 HD2 PHE 45 HD2 PHE 45 -7.510 11.782 2.788 667 HE1 PHE 45 HE1 PHE 45 -4.965 13.370 -1.168 668 HE2 PHE 45 HE2 PHE 45 -8.233 13.831 1.598 669 HZ PHE 45 HZ PHE 45 -6.956 14.636 -0.380 670 H ALA 46 H ALA 46 -2.891 12.393 2.279 671 HA ALA 46 HA ALA 46 -2.002 13.997 3.581 672 HB1 ALA 46 HB1 ALA 46 -4.537 13.539 5.200 673 HB2 ALA 46 HB2 ALA 46 -3.545 15.015 5.194 674 HB3 ALA 46 HB3 ALA 46 -4.403 14.516 3.721 675 H GLY 47 H GLY 47 -1.702 10.970 4.537 676 HA2 GLY 47 HA2 GLY 47 0.126 10.316 5.875 677 HA3 GLY 47 HA3 GLY 47 -0.105 11.714 6.925 678 H LYS 48 H LYS 48 -3.115 10.123 6.181 679 HA LYS 48 HA LYS 48 -2.773 8.341 8.539 680 HB2 LYS 48 HB2 LYS 48 -5.036 8.793 9.294 681 HB3 LYS 48 HB3 LYS 48 -4.039 10.245 9.299 682 HG2 LYS 48 HG2 LYS 48 -6.098 10.942 8.515 683 HG3 LYS 48 HG3 LYS 48 -5.064 10.847 7.077 684 HD2 LYS 48 HD2 LYS 48 -6.179 8.730 6.418 685 HD3 LYS 48 HD3 LYS 48 -7.198 8.784 7.873 686 HE2 LYS 48 HE2 LYS 48 -7.094 10.911 5.698 687 HE3 LYS 48 HE3 LYS 48 -8.331 9.648 5.842 688 HZ1 LYS 48 HZ1 LYS 48 -9.062 11.710 6.815 689 HZ2 LYS 48 HZ2 LYS 48 -8.925 10.558 7.981 690 HZ3 LYS 48 HZ3 LYS 48 -7.784 11.731 7.847 691 H GLN 49 H GLN 49 -4.356 6.626 8.602 692 HA GLN 49 HA GLN 49 -4.335 5.352 5.924 693 HB2 GLN 49 HB2 GLN 49 -3.115 4.303 7.786 694 HB3 GLN 49 HB3 GLN 49 -4.587 4.282 8.755 695 HG2 GLN 49 HG2 GLN 49 -5.630 2.800 6.962 696 HG3 GLN 49 HG3 GLN 49 -4.036 2.736 6.183 697 HE21 GLN 49 HE21 GLN 49 -2.263 2.441 8.248 698 HE22 GLN 49 HE22 GLN 49 -2.603 0.975 9.147 699 H LEU 50 H LEU 50 -6.128 4.573 4.975 700 HA LEU 50 HA LEU 50 -8.697 5.658 5.985 701 HB2 LEU 50 HB2 LEU 50 -7.792 4.619 3.268 702 HB3 LEU 50 HB3 LEU 50 -9.432 5.159 3.647 703 HG LEU 50 HG LEU 50 -8.561 7.419 4.202 704 HD11 LEU 50 HD11 LEU 50 -6.264 7.069 4.833 705 HD12 LEU 50 HD12 LEU 50 -5.908 6.272 3.266 706 HD13 LEU 50 HD13 LEU 50 -6.272 8.011 3.347 707 HD21 LEU 50 HD21 LEU 50 -7.998 8.096 1.902 708 HD22 LEU 50 HD22 LEU 50 -7.691 6.399 1.460 709 HD23 LEU 50 HD23 LEU 50 -9.333 6.931 1.894 710 H GLU 51 H GLU 51 -10.670 4.282 5.864 711 HA GLU 51 HA GLU 51 -10.015 1.395 6.287 712 HB2 GLU 51 HB2 GLU 51 -11.656 3.335 7.916 713 HB3 GLU 51 HB3 GLU 51 -12.030 1.599 7.939 714 HG2 GLU 51 HG2 GLU 51 -9.716 1.087 8.597 715 HG3 GLU 51 HG3 GLU 51 -9.309 2.806 8.543 716 H ASP 52 H ASP 52 -11.552 -0.111 5.787 717 HA ASP 52 HA ASP 52 -12.974 0.440 3.356 718 HB2 ASP 52 HB2 ASP 52 -12.976 -2.000 5.182 719 HB3 ASP 52 HB3 ASP 52 -13.575 -1.947 3.518 720 H GLY 53 H GLY 53 -13.860 1.216 6.449 721 HA2 GLY 53 HA2 GLY 53 -16.725 0.502 6.048 722 HA3 GLY 53 HA3 GLY 53 -15.948 0.852 7.606 723 H ARG 54 H ARG 54 -14.805 2.986 5.213 724 HA ARG 54 HA ARG 54 -16.636 5.140 6.150 725 HB2 ARG 54 HB2 ARG 54 -13.985 5.439 4.776 726 HB3 ARG 54 HB3 ARG 54 -14.814 6.627 5.783 727 HG2 ARG 54 HG2 ARG 54 -13.570 4.044 6.833 728 HG3 ARG 54 HG3 ARG 54 -12.803 5.640 6.857 729 HD2 ARG 54 HD2 ARG 54 -14.708 6.526 8.157 730 HD3 ARG 54 HD3 ARG 54 -15.390 4.888 8.244 731 HE ARG 54 HE ARG 54 -13.515 4.207 9.608 732 HH11 ARG 54 HH11 ARG 54 -13.596 7.696 8.937 733 HH12 ARG 54 HH12 ARG 54 -12.490 8.071 10.236 734 HH21 ARG 54 HH21 ARG 54 -12.011 4.734 11.191 735 HH22 ARG 54 HH22 ARG 54 -11.627 6.408 11.545 736 H THR 55 H THR 55 -15.485 6.845 4.093 737 HA THR 55 HA THR 55 -16.191 5.859 1.426 738 HB THR 55 HB THR 55 -17.614 8.062 1.194 739 HG1 THR 55 HG1 THR 55 -18.551 8.728 3.058 740 HG21 THR 55 HG21 THR 55 -18.438 5.646 1.099 741 HG22 THR 55 HG22 THR 55 -18.764 5.775 2.842 742 HG23 THR 55 HG23 THR 55 -19.640 6.819 1.696 743 H LEU 56 H LEU 56 -15.369 7.401 -0.218 744 HA LEU 56 HA LEU 56 -12.850 8.469 0.603 745 HB2 LEU 56 HB2 LEU 56 -14.477 9.089 -1.894 746 HB3 LEU 56 HB3 LEU 56 -12.778 9.477 -1.627 747 HG LEU 56 HG LEU 56 -14.101 6.790 -2.039 748 HD11 LEU 56 HD11 LEU 56 -11.609 8.118 -3.199 749 HD12 LEU 56 HD12 LEU 56 -12.306 6.564 -3.715 750 HD13 LEU 56 HD13 LEU 56 -13.212 8.072 -3.974 751 HD21 LEU 56 HD21 LEU 56 -11.319 7.223 -0.870 752 HD22 LEU 56 HD22 LEU 56 -12.699 6.411 -0.074 753 HD23 LEU 56 HD23 LEU 56 -11.947 5.680 -1.495 754 H SER 57 H SER 57 -16.080 9.749 0.445 755 HA SER 57 HA SER 57 -15.565 12.529 0.628 756 HB2 SER 57 HB2 SER 57 -17.950 12.548 1.294 757 HB3 SER 57 HB3 SER 57 -17.680 11.424 -0.049 758 HG SER 57 HG SER 57 -18.967 10.544 1.626 759 H ASP 58 H ASP 58 -15.451 9.916 2.983 760 HA ASP 58 HA ASP 58 -15.655 11.620 5.322 761 HB2 ASP 58 HB2 ASP 58 -16.317 9.205 5.220 762 HB3 ASP 58 HB3 ASP 58 -14.602 8.778 5.096 763 H TYR 59 H TYR 59 -13.111 10.923 3.093 764 HA TYR 59 HA TYR 59 -11.176 12.094 5.049 765 HB2 TYR 59 HB2 TYR 59 -10.061 10.793 2.651 766 HB3 TYR 59 HB3 TYR 59 -9.474 10.798 4.299 767 HD1 TYR 59 HD1 TYR 59 -10.394 9.048 5.925 768 HD2 TYR 59 HD2 TYR 59 -11.398 9.156 1.751 769 HE1 TYR 59 HE1 TYR 59 -11.050 6.612 6.006 770 HE2 TYR 59 HE2 TYR 59 -12.142 6.778 1.863 771 HH TYR 59 HH TYR 59 -11.891 4.843 4.839 772 H ASN 60 H ASN 60 -13.214 13.307 3.127 773 HA ASN 60 HA ASN 60 -13.365 14.946 1.633 774 HB2 ASN 60 HB2 ASN 60 -12.094 16.897 2.270 775 HB3 ASN 60 HB3 ASN 60 -12.638 16.005 3.699 776 HD21 ASN 60 HD21 ASN 60 -9.787 16.415 1.627 777 HD22 ASN 60 HD22 ASN 60 -8.615 16.107 2.917 778 H ILE 61 H ILE 61 -11.683 12.693 0.574 779 HA ILE 61 HA ILE 61 -9.553 13.750 -0.994 780 HB ILE 61 HB ILE 61 -11.422 11.383 -1.386 781 HG12 ILE 61 HG12 ILE 61 -8.505 11.489 -0.515 782 HG13 ILE 61 HG13 ILE 61 -9.866 11.442 0.619 783 HG21 ILE 61 HG21 ILE 61 -8.846 12.063 -2.881 784 HG22 ILE 61 HG22 ILE 61 -9.749 10.540 -3.025 785 HG23 ILE 61 HG23 ILE 61 -10.486 12.040 -3.579 786 HD11 ILE 61 HD11 ILE 61 -9.179 9.304 -1.437 787 HD12 ILE 61 HD12 ILE 61 -9.004 9.199 0.326 788 HD13 ILE 61 HD13 ILE 61 -10.624 9.305 -0.395 789 H GLN 62 H GLN 62 -9.444 14.654 -2.976 790 HA GLN 62 HA GLN 62 -11.943 15.125 -4.544 791 HB2 GLN 62 HB2 GLN 62 -9.611 17.044 -4.270 792 HB3 GLN 62 HB3 GLN 62 -11.191 17.363 -4.989 793 HG2 GLN 62 HG2 GLN 62 -10.691 16.779 -2.029 794 HG3 GLN 62 HG3 GLN 62 -10.830 18.379 -2.711 795 HE21 GLN 62 HE21 GLN 62 -12.509 16.951 -0.676 796 HE22 GLN 62 HE22 GLN 62 -14.148 17.025 -1.296 797 H LYS 63 H LYS 63 -11.065 16.049 -6.819 798 HA LYS 63 HA LYS 63 -9.621 13.929 -8.045 799 HB2 LYS 63 HB2 LYS 63 -9.779 15.225 -9.994 800 HB3 LYS 63 HB3 LYS 63 -11.261 15.539 -9.086 801 HG2 LYS 63 HG2 LYS 63 -10.267 17.669 -8.227 802 HG3 LYS 63 HG3 LYS 63 -8.812 17.347 -9.199 803 HD2 LYS 63 HD2 LYS 63 -10.241 18.896 -10.400 804 HD3 LYS 63 HD3 LYS 63 -10.188 17.337 -11.255 805 HE2 LYS 63 HE2 LYS 63 -12.367 16.713 -10.271 806 HE3 LYS 63 HE3 LYS 63 -12.400 18.232 -9.362 807 HZ1 LYS 63 HZ1 LYS 63 -12.422 19.412 -11.453 808 HZ2 LYS 63 HZ2 LYS 63 -12.389 18.003 -12.300 809 HZ3 LYS 63 HZ3 LYS 63 -13.695 18.373 -11.373 810 H GLU 64 H GLU 64 -7.599 13.636 -8.643 811 HA GLU 64 HA GLU 64 -5.356 13.742 -8.640 812 HB2 GLU 64 HB2 GLU 64 -5.792 16.737 -8.881 813 HB3 GLU 64 HB3 GLU 64 -4.405 15.787 -9.447 814 HG2 GLU 64 HG2 GLU 64 -5.937 14.538 -10.989 815 HG3 GLU 64 HG3 GLU 64 -7.263 15.592 -10.483 816 H SER 65 H SER 65 -6.636 13.920 -5.925 817 HA SER 65 HA SER 65 -5.223 15.895 -4.408 818 HB2 SER 65 HB2 SER 65 -6.824 13.439 -3.635 819 HB3 SER 65 HB3 SER 65 -6.139 14.587 -2.461 820 HG SER 65 HG SER 65 -7.939 15.207 -4.555 821 H THR 66 H THR 66 -4.252 12.872 -5.614 822 HA THR 66 HA THR 66 -2.544 11.457 -5.322 823 HB THR 66 HB THR 66 -1.372 13.823 -3.866 824 HG1 THR 66 HG1 THR 66 -0.289 14.029 -5.845 825 HG21 THR 66 HG21 THR 66 -0.161 11.823 -3.101 826 HG22 THR 66 HG22 THR 66 -0.026 11.229 -4.767 827 HG23 THR 66 HG23 THR 66 0.835 12.705 -4.267 828 H LEU 67 H LEU 67 -1.923 9.773 -4.044 829 HA LEU 67 HA LEU 67 -2.406 9.883 -1.119 830 HB2 LEU 67 HB2 LEU 67 -3.636 7.772 -2.935 831 HB3 LEU 67 HB3 LEU 67 -3.616 7.747 -1.177 832 HG LEU 67 HG LEU 67 -4.853 10.061 -1.364 833 HD11 LEU 67 HD11 LEU 67 -5.600 8.680 -3.978 834 HD12 LEU 67 HD12 LEU 67 -6.433 10.086 -3.273 835 HD13 LEU 67 HD13 LEU 67 -4.769 10.248 -3.861 836 HD21 LEU 67 HD21 LEU 67 -6.215 7.409 -1.985 837 HD22 LEU 67 HD22 LEU 67 -5.719 7.963 -0.368 838 HD23 LEU 67 HD23 LEU 67 -6.973 8.850 -1.261 839 H HIS 68 H HIS 68 -1.828 7.390 -0.353 840 HA HIS 68 HA HIS 68 0.651 6.610 -1.801 841 HB2 HIS 68 HB2 HIS 68 0.423 7.055 1.195 842 HB3 HIS 68 HB3 HIS 68 1.859 6.517 0.321 843 HD2 HIS 68 HD2 HIS 68 2.754 8.414 -1.650 844 HE1 HIS 68 HE1 HIS 68 1.334 11.753 0.565 845 HE2 HIS 68 HE2 HIS 68 2.855 11.007 -1.335 846 H LEU 69 H LEU 69 0.875 4.517 -2.059 847 HA LEU 69 HA LEU 69 -0.996 2.641 -0.700 848 HB2 LEU 69 HB2 LEU 69 -1.389 2.881 -3.090 849 HB3 LEU 69 HB3 LEU 69 0.338 2.737 -3.430 850 HG LEU 69 HG LEU 69 0.306 0.377 -2.635 851 HD11 LEU 69 HD11 LEU 69 -1.625 0.426 -1.134 852 HD12 LEU 69 HD12 LEU 69 -2.698 0.863 -2.483 853 HD13 LEU 69 HD13 LEU 69 -1.922 -0.738 -2.437 854 HD21 LEU 69 HD21 LEU 69 -1.669 1.090 -4.833 855 HD22 LEU 69 HD22 LEU 69 0.096 0.943 -5.007 856 HD23 LEU 69 HD23 LEU 69 -0.880 -0.489 -4.611 857 H VAL 70 H VAL 70 -0.209 0.834 0.231 858 HA VAL 70 HA VAL 70 2.614 0.022 -0.093 859 HB VAL 70 HB VAL 70 1.277 0.561 2.593 860 HG11 VAL 70 HG11 VAL 70 4.025 -0.558 1.878 861 HG12 VAL 70 HG12 VAL 70 3.523 -0.044 3.505 862 HG13 VAL 70 HG13 VAL 70 2.718 -1.418 2.738 863 HG21 VAL 70 HG21 VAL 70 3.651 1.869 1.191 864 HG22 VAL 70 HG22 VAL 70 2.086 2.633 1.546 865 HG23 VAL 70 HG23 VAL 70 3.163 2.179 2.873 866 H LEU 71 H LEU 71 2.842 -2.304 0.759 867 HA LEU 71 HA LEU 71 0.269 -3.708 0.984 868 HB2 LEU 71 HB2 LEU 71 0.510 -5.043 -0.931 869 HB3 LEU 71 HB3 LEU 71 0.774 -3.386 -1.475 870 HG LEU 71 HG LEU 71 2.915 -5.507 -0.964 871 HD11 LEU 71 HD11 LEU 71 1.553 -5.815 -3.000 872 HD12 LEU 71 HD12 LEU 71 1.942 -4.154 -3.508 873 HD13 LEU 71 HD13 LEU 71 3.233 -5.371 -3.388 874 HD21 LEU 71 HD21 LEU 71 3.896 -3.339 -0.424 875 HD22 LEU 71 HD22 LEU 71 4.472 -3.860 -2.013 876 HD23 LEU 71 HD23 LEU 71 3.199 -2.622 -1.902 877 H ARG 72 H ARG 72 0.630 -6.156 1.107 878 HA ARG 72 HA ARG 72 2.871 -6.690 2.973 879 HB2 ARG 72 HB2 ARG 72 0.116 -7.815 2.443 880 HB3 ARG 72 HB3 ARG 72 1.340 -8.856 3.182 881 HG2 ARG 72 HG2 ARG 72 -0.161 -7.649 4.806 882 HG3 ARG 72 HG3 ARG 72 1.577 -7.474 5.078 883 HD2 ARG 72 HD2 ARG 72 1.561 -5.256 4.025 884 HD3 ARG 72 HD3 ARG 72 -0.162 -5.426 3.649 885 HE ARG 72 HE ARG 72 -0.667 -4.821 5.813 886 HH11 ARG 72 HH11 ARG 72 2.719 -5.889 5.732 887 HH12 ARG 72 HH12 ARG 72 2.999 -5.403 7.396 888 HH21 ARG 72 HH21 ARG 72 -0.220 -4.248 7.991 889 HH22 ARG 72 HH22 ARG 72 1.394 -4.513 8.628 890 H LEU 73 H LEU 73 3.573 -9.064 2.844 891 HA LEU 73 HA LEU 73 4.039 -9.808 0.016 892 HB2 LEU 73 HB2 LEU 73 5.891 -8.674 1.785 893 HB3 LEU 73 HB3 LEU 73 6.197 -10.393 1.978 894 HG LEU 73 HG LEU 73 7.657 -9.462 0.270 895 HD11 LEU 73 HD11 LEU 73 6.792 -11.737 -0.187 896 HD12 LEU 73 HD12 LEU 73 5.442 -11.039 -1.107 897 HD13 LEU 73 HD13 LEU 73 7.113 -10.834 -1.681 898 HD21 LEU 73 HD21 LEU 73 6.236 -7.498 -0.271 899 HD22 LEU 73 HD22 LEU 73 6.795 -8.344 -1.735 900 HD23 LEU 73 HD23 LEU 73 5.126 -8.553 -1.171 901 H ARG 74 H ARG 74 2.124 -10.632 1.997 902 HA ARG 74 HA ARG 74 1.030 -12.446 2.740 903 HB2 ARG 74 HB2 ARG 74 1.617 -13.165 0.432 904 HB3 ARG 74 HB3 ARG 74 2.991 -14.065 1.074 905 HG2 ARG 74 HG2 ARG 74 1.040 -15.543 0.689 906 HG3 ARG 74 HG3 ARG 74 1.558 -15.517 2.381 907 HD2 ARG 74 HD2 ARG 74 -0.271 -13.897 2.903 908 HD3 ARG 74 HD3 ARG 74 -0.769 -13.940 1.203 909 HE ARG 74 HE ARG 74 -1.787 -15.998 1.575 910 HH11 ARG 74 HH11 ARG 74 0.350 -15.237 4.300 911 HH12 ARG 74 HH12 ARG 74 -0.250 -16.550 5.282 912 HH21 ARG 74 HH21 ARG 74 -2.541 -17.702 2.884 913 HH22 ARG 74 HH22 ARG 74 -1.872 -17.943 4.482 914 H GLY 75 H GLY 75 4.462 -12.447 3.145 915 HA2 GLY 75 HA2 GLY 75 4.146 -13.825 5.757 916 HA3 GLY 75 HA3 GLY 75 5.514 -14.188 4.661 917 H GLY 76 H GLY 76 4.487 -11.021 4.279 918 HA2 GLY 76 HA2 GLY 76 5.793 -9.687 6.476 919 HA3 GLY 76 HA3 GLY 76 6.827 -9.717 5.031 Start of MODEL 19 1 H LEU 491 H LEU 491 14.788 7.038 9.936 2 HA LEU 491 HA LEU 491 17.345 6.315 9.928 3 HB2 LEU 491 HB2 LEU 491 15.705 4.048 9.124 4 HB3 LEU 491 HB3 LEU 491 16.585 4.409 10.611 5 HG LEU 491 HG LEU 491 14.602 5.882 11.294 6 HD11 LEU 491 HD11 LEU 491 13.307 4.246 9.057 7 HD12 LEU 491 HD12 LEU 491 12.441 5.246 10.246 8 HD13 LEU 491 HD13 LEU 491 13.495 6.010 9.041 9 HD21 LEU 491 HD21 LEU 491 14.331 2.876 10.894 10 HD22 LEU 491 HD22 LEU 491 15.102 3.705 12.264 11 HD23 LEU 491 HD23 LEU 491 13.344 3.846 12.007 12 HA PRO 492 HA PRO 492 18.620 5.841 5.656 13 HB2 PRO 492 HB2 PRO 492 21.065 4.781 6.130 14 HB3 PRO 492 HB3 PRO 492 20.673 6.477 6.550 15 HG2 PRO 492 HG2 PRO 492 20.750 4.076 8.378 16 HG3 PRO 492 HG3 PRO 492 21.408 5.719 8.662 17 HD2 PRO 492 HD2 PRO 492 18.953 4.824 9.588 18 HD3 PRO 492 HD3 PRO 492 19.264 6.546 9.251 19 H LEU 493 H LEU 493 19.932 3.891 4.566 20 HA LEU 493 HA LEU 493 18.089 1.734 4.439 21 HB2 LEU 493 HB2 LEU 493 20.019 3.002 2.875 22 HB3 LEU 493 HB3 LEU 493 20.810 1.477 3.218 23 HG LEU 493 HG LEU 493 17.981 1.792 2.117 24 HD11 LEU 493 HD11 LEU 493 20.582 1.187 0.651 25 HD12 LEU 493 HD12 LEU 493 18.955 1.173 -0.079 26 HD13 LEU 493 HD13 LEU 493 19.631 2.690 0.541 27 HD21 LEU 493 HD21 LEU 493 18.250 -0.602 1.441 28 HD22 LEU 493 HD22 LEU 493 19.832 -0.637 2.242 29 HD23 LEU 493 HD23 LEU 493 18.356 -0.397 3.205 30 H GLN 494 H GLN 494 19.178 1.987 7.035 31 HA GLN 494 HA GLN 494 21.185 -0.011 7.451 32 HB2 GLN 494 HB2 GLN 494 20.862 0.551 9.779 33 HB3 GLN 494 HB3 GLN 494 20.883 2.014 8.766 34 HG2 GLN 494 HG2 GLN 494 19.145 2.569 10.088 35 HG3 GLN 494 HG3 GLN 494 18.275 1.769 8.779 36 HE21 GLN 494 HE21 GLN 494 16.716 1.862 10.762 37 HE22 GLN 494 HE22 GLN 494 16.684 0.415 11.750 38 H ALA 495 H ALA 495 17.682 -0.003 7.374 39 HA ALA 495 HA ALA 495 17.727 -2.938 7.783 40 HB1 ALA 495 HB1 ALA 495 17.254 -2.004 10.003 41 HB2 ALA 495 HB2 ALA 495 15.938 -1.017 9.330 42 HB3 ALA 495 HB3 ALA 495 15.796 -2.785 9.354 43 H LEU 496 H LEU 496 16.863 -0.440 5.823 44 HA LEU 496 HA LEU 496 14.188 -1.234 5.081 45 HB2 LEU 496 HB2 LEU 496 16.347 0.515 3.829 46 HB3 LEU 496 HB3 LEU 496 14.735 0.333 3.133 47 HG LEU 496 HG LEU 496 15.292 1.367 5.952 48 HD11 LEU 496 HD11 LEU 496 14.482 2.828 3.401 49 HD12 LEU 496 HD12 LEU 496 14.635 3.551 5.021 50 HD13 LEU 496 HD13 LEU 496 16.077 2.911 4.198 51 HD21 LEU 496 HD21 LEU 496 13.060 0.307 5.744 52 HD22 LEU 496 HD22 LEU 496 12.918 2.071 5.855 53 HD23 LEU 496 HD23 LEU 496 12.739 1.268 4.283 54 HA PRO 497 HA PRO 497 14.771 -4.457 2.159 55 HB2 PRO 497 HB2 PRO 497 13.568 -2.633 0.088 56 HB3 PRO 497 HB3 PRO 497 13.119 -4.324 0.476 57 HG2 PRO 497 HG2 PRO 497 11.581 -2.293 1.386 58 HG3 PRO 497 HG3 PRO 497 12.006 -3.648 2.485 59 HD2 PRO 497 HD2 PRO 497 13.255 -0.911 2.333 60 HD3 PRO 497 HD3 PRO 497 12.792 -1.869 3.773 61 H GLU 498 H GLU 498 16.051 -5.154 0.359 62 HA GLU 498 HA GLU 498 18.400 -3.518 0.001 63 HB2 GLU 498 HB2 GLU 498 18.351 -6.021 0.377 64 HB3 GLU 498 HB3 GLU 498 17.712 -6.187 -1.279 65 HG2 GLU 498 HG2 GLU 498 20.113 -6.531 -1.323 66 HG3 GLU 498 HG3 GLU 498 19.757 -4.978 -2.107 67 H GLY 499 H GLY 499 17.020 -1.833 -1.010 68 HA2 GLY 499 HA2 GLY 499 17.924 -1.225 -3.514 69 HA3 GLY 499 HA3 GLY 499 16.457 -2.165 -3.850 70 H VAL 500 H VAL 500 15.213 -1.141 -1.279 71 HA VAL 500 HA VAL 500 13.838 1.127 -2.364 72 HB VAL 500 HB VAL 500 13.937 -0.251 0.332 73 HG11 VAL 500 HG11 VAL 500 12.134 2.077 -0.478 74 HG12 VAL 500 HG12 VAL 500 11.865 1.012 0.918 75 HG13 VAL 500 HG13 VAL 500 13.296 2.050 0.875 76 HG21 VAL 500 HG21 VAL 500 11.831 0.003 -1.866 77 HG22 VAL 500 HG22 VAL 500 12.876 -1.409 -1.603 78 HG23 VAL 500 HG23 VAL 500 11.666 -0.954 -0.383 79 H ASP 501 H ASP 501 13.601 3.194 -1.095 80 HA ASP 501 HA ASP 501 16.196 4.266 -0.078 81 HB2 ASP 501 HB2 ASP 501 14.708 4.943 -2.597 82 HB3 ASP 501 HB3 ASP 501 15.298 6.298 -1.639 83 H GLN 502 H GLN 502 16.011 5.875 1.343 84 HA GLN 502 HA GLN 502 13.645 5.937 2.917 85 HB2 GLN 502 HB2 GLN 502 14.932 8.072 3.836 86 HB3 GLN 502 HB3 GLN 502 15.421 6.436 4.230 87 HG2 GLN 502 HG2 GLN 502 16.613 7.894 1.843 88 HG3 GLN 502 HG3 GLN 502 17.232 8.098 3.492 89 HE21 GLN 502 HE21 GLN 502 16.146 4.976 3.484 90 HE22 GLN 502 HE22 GLN 502 17.634 4.168 3.024 91 H GLU 503 H GLU 503 14.810 8.092 0.301 92 HA GLU 503 HA GLU 503 12.814 10.104 0.877 93 HB2 GLU 503 HB2 GLU 503 13.575 11.173 -1.125 94 HB3 GLU 503 HB3 GLU 503 14.997 10.526 -0.278 95 HG2 GLU 503 HG2 GLU 503 14.737 8.454 -1.790 96 HG3 GLU 503 HG3 GLU 503 13.608 9.419 -2.745 97 H VAL 504 H VAL 504 12.358 7.010 -0.135 98 HA VAL 504 HA VAL 504 9.791 7.779 -1.397 99 HB VAL 504 HB VAL 504 9.860 6.086 -2.989 100 HG11 VAL 504 HG11 VAL 504 11.602 6.864 -4.497 101 HG12 VAL 504 HG12 VAL 504 10.924 8.236 -3.589 102 HG13 VAL 504 HG13 VAL 504 12.510 7.561 -3.140 103 HG21 VAL 504 HG21 VAL 504 11.205 4.364 -1.782 104 HG22 VAL 504 HG22 VAL 504 11.812 4.638 -3.424 105 HG23 VAL 504 HG23 VAL 504 12.661 5.355 -2.039 106 H PHE 505 H PHE 505 11.119 6.660 1.260 107 HA PHE 505 HA PHE 505 9.031 4.584 1.758 108 HB2 PHE 505 HB2 PHE 505 10.892 3.364 2.194 109 HB3 PHE 505 HB3 PHE 505 11.917 4.784 2.358 110 HD1 PHE 505 HD1 PHE 505 12.212 5.952 4.460 111 HD2 PHE 505 HD2 PHE 505 9.831 2.394 4.182 112 HE1 PHE 505 HE1 PHE 505 12.347 5.668 6.926 113 HE2 PHE 505 HE2 PHE 505 9.960 2.112 6.664 114 HZ PHE 505 HZ PHE 505 11.217 3.752 8.019 115 H LYS 506 H LYS 506 10.236 7.729 2.455 116 HA LYS 506 HA LYS 506 8.828 7.963 5.021 117 HB2 LYS 506 HB2 LYS 506 10.390 9.906 3.280 118 HB3 LYS 506 HB3 LYS 506 9.579 10.377 4.790 119 HG2 LYS 506 HG2 LYS 506 10.850 8.651 6.031 120 HG3 LYS 506 HG3 LYS 506 11.729 8.211 4.562 121 HD2 LYS 506 HD2 LYS 506 11.724 10.973 5.841 122 HD3 LYS 506 HD3 LYS 506 13.014 9.762 6.001 123 HE2 LYS 506 HE2 LYS 506 13.395 9.826 3.570 124 HE3 LYS 506 HE3 LYS 506 12.098 11.028 3.391 125 HZ1 LYS 506 HZ1 LYS 506 14.301 12.020 3.496 126 HZ2 LYS 506 HZ2 LYS 506 13.354 12.526 4.744 127 HZ3 LYS 506 HZ3 LYS 506 14.519 11.410 5.016 128 H GLN 507 H GLN 507 7.267 7.186 2.663 129 HA GLN 507 HA GLN 507 5.594 9.589 2.157 130 HB2 GLN 507 HB2 GLN 507 5.309 6.932 0.752 131 HB3 GLN 507 HB3 GLN 507 4.915 8.552 0.161 132 HG2 GLN 507 HG2 GLN 507 7.678 7.333 0.562 133 HG3 GLN 507 HG3 GLN 507 6.889 7.646 -0.977 134 HE21 GLN 507 HE21 GLN 507 9.518 8.654 0.124 135 HE22 GLN 507 HE22 GLN 507 9.390 10.375 0.002 136 H LEU 508 H LEU 508 5.702 7.422 4.464 137 HA LEU 508 HA LEU 508 2.775 6.916 4.687 138 HB2 LEU 508 HB2 LEU 508 3.488 4.551 5.432 139 HB3 LEU 508 HB3 LEU 508 3.400 4.883 3.705 140 HG LEU 508 HG LEU 508 6.056 5.360 5.024 141 HD11 LEU 508 HD11 LEU 508 4.971 2.579 4.448 142 HD12 LEU 508 HD12 LEU 508 6.653 2.985 4.867 143 HD13 LEU 508 HD13 LEU 508 5.364 3.246 6.057 144 HD21 LEU 508 HD21 LEU 508 5.764 5.690 2.581 145 HD22 LEU 508 HD22 LEU 508 6.841 4.317 2.899 146 HD23 LEU 508 HD23 LEU 508 5.151 4.033 2.426 147 HA PRO 509 HA PRO 509 3.361 7.952 8.886 148 HB2 PRO 509 HB2 PRO 509 1.645 6.197 10.182 149 HB3 PRO 509 HB3 PRO 509 1.140 7.662 9.300 150 HG2 PRO 509 HG2 PRO 509 1.169 4.795 8.354 151 HG3 PRO 509 HG3 PRO 509 -0.104 6.034 8.100 152 HD2 PRO 509 HD2 PRO 509 1.719 5.403 6.173 153 HD3 PRO 509 HD3 PRO 509 1.146 7.083 6.395 154 H ALA 510 H ALA 510 4.040 7.235 10.994 155 HA ALA 510 HA ALA 510 6.261 5.514 10.969 156 HB1 ALA 510 HB1 ALA 510 4.508 6.483 13.260 157 HB2 ALA 510 HB2 ALA 510 6.146 5.808 13.433 158 HB3 ALA 510 HB3 ALA 510 5.899 7.343 12.566 159 H ASP 511 H ASP 511 2.839 4.807 11.535 160 HA ASP 511 HA ASP 511 3.329 2.219 12.746 161 HB2 ASP 511 HB2 ASP 511 1.258 3.597 13.085 162 HB3 ASP 511 HB3 ASP 511 0.854 3.365 11.375 163 H ILE 512 H ILE 512 3.618 3.381 9.535 164 HA ILE 512 HA ILE 512 3.650 0.533 8.652 165 HB ILE 512 HB ILE 512 3.386 2.965 6.867 166 HG12 ILE 512 HG12 ILE 512 1.276 1.055 7.951 167 HG13 ILE 512 HG13 ILE 512 1.412 2.800 8.247 168 HG21 ILE 512 HG21 ILE 512 2.963 -0.021 6.343 169 HG22 ILE 512 HG22 ILE 512 2.792 1.289 5.153 170 HG23 ILE 512 HG23 ILE 512 4.380 0.908 5.815 171 HD11 ILE 512 HD11 ILE 512 0.750 1.471 5.589 172 HD12 ILE 512 HD12 ILE 512 -0.318 2.442 6.610 173 HD13 ILE 512 HD13 ILE 512 1.072 3.208 5.803 174 H GLN 513 H GLN 513 5.642 3.340 9.343 175 HA GLN 513 HA GLN 513 7.865 2.736 7.680 176 HB2 GLN 513 HB2 GLN 513 7.799 3.674 10.590 177 HB3 GLN 513 HB3 GLN 513 9.236 3.709 9.569 178 HG2 GLN 513 HG2 GLN 513 6.697 5.255 8.925 179 HG3 GLN 513 HG3 GLN 513 8.041 5.908 9.883 180 HE21 GLN 513 HE21 GLN 513 7.128 4.606 6.695 181 HE22 GLN 513 HE22 GLN 513 8.407 5.409 5.813 182 H GLU 514 H GLU 514 6.730 1.366 10.765 183 HA GLU 514 HA GLU 514 8.966 -0.356 11.194 184 HB2 GLU 514 HB2 GLU 514 7.549 -1.376 12.886 185 HB3 GLU 514 HB3 GLU 514 7.362 0.390 12.935 186 HG2 GLU 514 HG2 GLU 514 5.261 0.209 11.637 187 HG3 GLU 514 HG3 GLU 514 5.437 -1.551 11.596 188 H GLU 515 H GLU 515 6.351 -0.495 8.943 189 HA GLU 515 HA GLU 515 6.445 -3.429 8.700 190 HB2 GLU 515 HB2 GLU 515 4.916 -1.336 7.108 191 HB3 GLU 515 HB3 GLU 515 4.691 -3.087 7.006 192 HG2 GLU 515 HG2 GLU 515 4.249 -1.452 9.546 193 HG3 GLU 515 HG3 GLU 515 2.983 -1.883 8.396 194 H ILE 516 H ILE 516 8.245 -0.784 7.445 195 HA ILE 516 HA ILE 516 8.930 -2.371 5.001 196 HB ILE 516 HB ILE 516 9.918 0.410 5.565 197 HG12 ILE 516 HG12 ILE 516 7.549 0.722 5.806 198 HG13 ILE 516 HG13 ILE 516 8.049 1.349 4.238 199 HG21 ILE 516 HG21 ILE 516 10.007 0.508 3.096 200 HG22 ILE 516 HG22 ILE 516 10.930 -0.862 3.734 201 HG23 ILE 516 HG23 ILE 516 9.331 -1.138 3.011 202 HD11 ILE 516 HD11 ILE 516 7.178 -0.671 3.120 203 HD12 ILE 516 HD12 ILE 516 6.690 -1.339 4.703 204 HD13 ILE 516 HD13 ILE 516 5.928 0.141 4.089 205 H LEU 517 H LEU 517 10.208 -0.812 7.938 206 HA LEU 517 HA LEU 517 12.939 -1.635 7.641 207 HB2 LEU 517 HB2 LEU 517 11.179 -1.056 10.057 208 HB3 LEU 517 HB3 LEU 517 12.927 -1.304 10.163 209 HG LEU 517 HG LEU 517 11.672 0.833 8.393 210 HD11 LEU 517 HD11 LEU 517 12.759 1.092 11.225 211 HD12 LEU 517 HD12 LEU 517 12.188 2.424 10.185 212 HD13 LEU 517 HD13 LEU 517 11.043 1.188 10.752 213 HD21 LEU 517 HD21 LEU 517 13.921 1.834 8.486 214 HD22 LEU 517 HD22 LEU 517 14.481 0.536 9.557 215 HD23 LEU 517 HD23 LEU 517 14.037 0.172 7.875 216 H SER 518 H SER 518 10.120 -3.371 7.927 217 HA SER 518 HA SER 518 11.596 -5.866 8.544 218 HB2 SER 518 HB2 SER 518 8.873 -5.144 9.704 219 HB3 SER 518 HB3 SER 518 9.723 -6.694 9.890 220 HG SER 518 HG SER 518 10.573 -4.151 10.816 221 H GLY 519 H GLY 519 10.687 -4.457 6.092 222 HA2 GLY 519 HA2 GLY 519 8.872 -6.531 4.979 223 HA3 GLY 519 HA3 GLY 519 8.648 -4.798 4.620 224 H LYS 520 H LYS 520 11.525 -6.802 4.967 225 HA LYS 520 HA LYS 520 13.116 -5.438 3.090 226 HB2 LYS 520 HB2 LYS 520 13.408 -8.199 4.315 227 HB3 LYS 520 HB3 LYS 520 14.722 -7.219 3.627 228 HG2 LYS 520 HG2 LYS 520 14.522 -5.563 5.370 229 HG3 LYS 520 HG3 LYS 520 12.966 -6.211 5.910 230 HD2 LYS 520 HD2 LYS 520 14.154 -8.390 6.444 231 HD3 LYS 520 HD3 LYS 520 15.683 -7.487 6.276 232 HE2 LYS 520 HE2 LYS 520 13.331 -6.715 8.050 233 HE3 LYS 520 HE3 LYS 520 14.767 -7.578 8.628 234 HZ1 LYS 520 HZ1 LYS 520 14.908 -5.194 9.017 235 HZ2 LYS 520 HZ2 LYS 520 16.097 -5.698 7.999 236 HZ3 LYS 520 HZ3 LYS 520 14.793 -4.885 7.412 237 H SER 521 H SER 521 10.581 -7.213 2.105 238 HA SER 521 HA SER 521 11.884 -7.997 -0.426 239 HB2 SER 521 HB2 SER 521 12.010 -9.980 1.122 240 HB3 SER 521 HB3 SER 521 10.234 -9.961 1.206 241 HG SER 521 HG SER 521 11.090 -11.373 -0.409 242 H ARG 522 H ARG 522 9.971 -9.121 -1.711 243 HA ARG 522 HA ARG 522 8.083 -8.827 -2.914 244 HB2 ARG 522 HB2 ARG 522 7.165 -8.500 -0.337 245 HB3 ARG 522 HB3 ARG 522 6.708 -6.959 -1.072 246 HG2 ARG 522 HG2 ARG 522 4.855 -8.238 -1.601 247 HG3 ARG 522 HG3 ARG 522 5.841 -8.536 -3.043 248 HD2 ARG 522 HD2 ARG 522 5.567 -10.292 -0.571 249 HD3 ARG 522 HD3 ARG 522 4.934 -10.650 -2.182 250 HE ARG 522 HE ARG 522 7.518 -10.533 -2.804 251 HH11 ARG 522 HH11 ARG 522 6.121 -11.867 0.169 252 HH12 ARG 522 HH12 ARG 522 7.358 -13.084 0.326 253 HH21 ARG 522 HH21 ARG 522 9.092 -12.136 -2.575 254 HH22 ARG 522 HH22 ARG 522 9.041 -13.228 -1.205 255 H GLU 523 H GLU 523 10.204 -6.355 -2.191 256 HA GLU 523 HA GLU 523 9.336 -4.876 -4.550 257 HB2 GLU 523 HB2 GLU 523 9.188 -2.707 -3.363 258 HB3 GLU 523 HB3 GLU 523 7.930 -3.849 -2.859 259 HG2 GLU 523 HG2 GLU 523 9.344 -4.448 -0.862 260 HG3 GLU 523 HG3 GLU 523 10.486 -3.182 -1.349 261 H ASN 524 H ASN 524 10.923 -3.426 -5.335 262 HA ASN 524 HA ASN 524 13.586 -3.432 -4.068 263 HB2 ASN 524 HB2 ASN 524 12.863 -4.670 -6.755 264 HB3 ASN 524 HB3 ASN 524 14.485 -4.062 -6.425 265 HD21 ASN 524 HD21 ASN 524 12.015 -6.402 -5.306 266 HD22 ASN 524 HD22 ASN 524 13.153 -7.499 -4.557 267 H LEU 525 H LEU 525 11.636 -1.382 -4.331 268 HA LEU 525 HA LEU 525 11.234 0.671 -5.124 269 HB2 LEU 525 HB2 LEU 525 13.049 1.931 -4.927 270 HB3 LEU 525 HB3 LEU 525 13.990 0.453 -4.886 271 HG LEU 525 HG LEU 525 13.815 0.759 -7.584 272 HD11 LEU 525 HD11 LEU 525 13.960 3.586 -6.432 273 HD12 LEU 525 HD12 LEU 525 14.048 3.127 -8.149 274 HD13 LEU 525 HD13 LEU 525 12.524 2.948 -7.245 275 HD21 LEU 525 HD21 LEU 525 15.883 0.491 -6.268 276 HD22 LEU 525 HD22 LEU 525 16.041 1.803 -7.455 277 HD23 LEU 525 HD23 LEU 525 15.767 2.187 -5.742 278 H LYS 526 H LYS 526 11.296 -1.911 -6.896 279 HA LYS 526 HA LYS 526 10.444 -0.588 -9.422 280 HB2 LYS 526 HB2 LYS 526 12.218 -2.988 -8.877 281 HB3 LYS 526 HB3 LYS 526 11.485 -2.700 -10.481 282 HG2 LYS 526 HG2 LYS 526 12.662 -0.575 -10.664 283 HG3 LYS 526 HG3 LYS 526 13.359 -0.771 -9.035 284 HD2 LYS 526 HD2 LYS 526 13.701 -2.840 -11.219 285 HD3 LYS 526 HD3 LYS 526 14.827 -1.474 -11.044 286 HE2 LYS 526 HE2 LYS 526 14.216 -3.492 -8.828 287 HE3 LYS 526 HE3 LYS 526 15.588 -3.603 -9.938 288 HZ1 LYS 526 HZ1 LYS 526 16.257 -2.544 -7.931 289 HZ2 LYS 526 HZ2 LYS 526 16.288 -1.425 -9.135 290 HZ3 LYS 526 HZ3 LYS 526 15.061 -1.427 -8.036 291 H1 MET 1 H1 MET 1 -12.521 12.463 -13.505 292 H2 MET 1 H2 MET 1 -13.909 13.141 -12.931 293 H3 MET 1 H3 MET 1 -13.745 11.501 -12.975 294 HA MET 1 HA MET 1 -12.149 13.329 -11.318 295 HB2 MET 1 HB2 MET 1 -14.385 13.214 -10.418 296 HB3 MET 1 HB3 MET 1 -14.458 11.458 -10.650 297 HG2 MET 1 HG2 MET 1 -12.708 11.114 -8.995 298 HG3 MET 1 HG3 MET 1 -12.497 12.863 -8.797 299 HE1 MET 1 HE1 MET 1 -12.860 10.879 -6.388 300 HE2 MET 1 HE2 MET 1 -12.685 12.638 -6.186 301 HE3 MET 1 HE3 MET 1 -14.003 11.777 -5.363 302 H GLN 2 H GLN 2 -10.338 12.573 -10.486 303 HA GLN 2 HA GLN 2 -9.968 9.723 -10.080 304 HB2 GLN 2 HB2 GLN 2 -8.063 9.478 -11.564 305 HB3 GLN 2 HB3 GLN 2 -9.386 10.170 -12.525 306 HG2 GLN 2 HG2 GLN 2 -8.299 12.460 -11.741 307 HG3 GLN 2 HG3 GLN 2 -6.888 11.485 -11.417 308 HE21 GLN 2 HE21 GLN 2 -5.604 12.461 -13.056 309 HE22 GLN 2 HE22 GLN 2 -5.935 12.235 -14.761 310 H ILE 3 H ILE 3 -7.658 9.381 -9.213 311 HA ILE 3 HA ILE 3 -6.601 11.768 -7.788 312 HB ILE 3 HB ILE 3 -6.502 10.700 -5.699 313 HG12 ILE 3 HG12 ILE 3 -6.996 8.146 -7.206 314 HG13 ILE 3 HG13 ILE 3 -5.818 8.549 -5.973 315 HG21 ILE 3 HG21 ILE 3 -9.244 10.077 -6.844 316 HG22 ILE 3 HG22 ILE 3 -8.836 10.379 -5.136 317 HG23 ILE 3 HG23 ILE 3 -8.666 11.680 -6.319 318 HD11 ILE 3 HD11 ILE 3 -8.784 8.056 -5.531 319 HD12 ILE 3 HD12 ILE 3 -7.449 6.988 -5.066 320 HD13 ILE 3 HD13 ILE 3 -7.645 8.562 -4.256 321 H PHE 4 H PHE 4 -4.462 10.841 -6.542 322 HA PHE 4 HA PHE 4 -2.989 9.143 -8.501 323 HB2 PHE 4 HB2 PHE 4 -1.963 11.710 -7.256 324 HB3 PHE 4 HB3 PHE 4 -1.113 10.689 -8.377 325 HD1 PHE 4 HD1 PHE 4 -2.397 10.267 -10.710 326 HD2 PHE 4 HD2 PHE 4 -3.043 13.622 -8.093 327 HE1 PHE 4 HE1 PHE 4 -3.251 11.591 -12.621 328 HE2 PHE 4 HE2 PHE 4 -3.866 14.953 -10.020 329 HZ PHE 4 HZ PHE 4 -3.978 13.939 -12.276 330 H VAL 5 H VAL 5 -2.691 7.365 -7.204 331 HA VAL 5 HA VAL 5 -1.938 7.862 -4.383 332 HB VAL 5 HB VAL 5 -2.623 5.712 -3.885 333 HG11 VAL 5 HG11 VAL 5 -4.483 6.632 -6.129 334 HG12 VAL 5 HG12 VAL 5 -4.877 5.457 -4.859 335 HG13 VAL 5 HG13 VAL 5 -4.546 7.138 -4.433 336 HG21 VAL 5 HG21 VAL 5 -2.505 5.008 -6.833 337 HG22 VAL 5 HG22 VAL 5 -1.455 4.393 -5.519 338 HG23 VAL 5 HG23 VAL 5 -3.166 3.958 -5.553 339 H LYS 6 H LYS 6 0.155 7.629 -3.701 340 HA LYS 6 HA LYS 6 2.050 6.726 -5.788 341 HB2 LYS 6 HB2 LYS 6 2.330 9.009 -5.074 342 HB3 LYS 6 HB3 LYS 6 2.421 8.509 -3.370 343 HG2 LYS 6 HG2 LYS 6 4.502 7.387 -3.692 344 HG3 LYS 6 HG3 LYS 6 4.391 7.487 -5.461 345 HD2 LYS 6 HD2 LYS 6 4.434 9.971 -3.749 346 HD3 LYS 6 HD3 LYS 6 5.938 9.163 -4.271 347 HE2 LYS 6 HE2 LYS 6 5.288 9.378 -6.609 348 HE3 LYS 6 HE3 LYS 6 3.750 10.141 -6.138 349 HZ1 LYS 6 HZ1 LYS 6 5.393 11.767 -6.766 350 HZ2 LYS 6 HZ2 LYS 6 5.012 11.936 -5.176 351 HZ3 LYS 6 HZ3 LYS 6 6.439 11.232 -5.618 352 H THR 7 H THR 7 3.462 5.150 -5.529 353 HA THR 7 HA THR 7 2.843 3.144 -3.525 354 HB THR 7 HB THR 7 4.414 1.794 -4.908 355 HG1 THR 7 HG1 THR 7 5.471 2.789 -6.579 356 HG21 THR 7 HG21 THR 7 2.044 2.030 -5.642 357 HG22 THR 7 HG22 THR 7 2.505 3.448 -6.621 358 HG23 THR 7 HG23 THR 7 3.159 1.841 -7.006 359 H LEU 8 H LEU 8 4.811 1.798 -2.784 360 HA LEU 8 HA LEU 8 6.548 3.341 -1.112 361 HB2 LEU 8 HB2 LEU 8 5.496 0.925 -0.944 362 HB3 LEU 8 HB3 LEU 8 6.934 0.422 -1.816 363 HG LEU 8 HG LEU 8 7.072 0.090 0.617 364 HD11 LEU 8 HD11 LEU 8 9.025 2.309 -0.072 365 HD12 LEU 8 HD12 LEU 8 9.218 0.999 1.109 366 HD13 LEU 8 HD13 LEU 8 9.195 0.613 -0.622 367 HD21 LEU 8 HD21 LEU 8 6.939 3.114 0.861 368 HD22 LEU 8 HD22 LEU 8 5.647 1.970 1.315 369 HD23 LEU 8 HD23 LEU 8 7.196 1.948 2.179 370 H THR 9 H THR 9 6.686 3.472 -4.293 371 HA THR 9 HA THR 9 9.638 3.097 -4.430 372 HB THR 9 HB THR 9 9.480 2.201 -6.644 373 HG1 THR 9 HG1 THR 9 7.468 1.838 -7.595 374 HG21 THR 9 HG21 THR 9 9.171 0.614 -4.707 375 HG22 THR 9 HG22 THR 9 7.414 0.760 -4.929 376 HG23 THR 9 HG23 THR 9 8.407 0.063 -6.217 377 H GLY 10 H GLY 10 7.321 5.392 -4.402 378 HA2 GLY 10 HA2 GLY 10 7.528 7.619 -4.865 379 HA3 GLY 10 HA3 GLY 10 9.083 7.335 -5.680 380 H LYS 11 H LYS 11 6.167 5.571 -6.582 381 HA LYS 11 HA LYS 11 5.898 7.288 -9.019 382 HB2 LYS 11 HB2 LYS 11 6.849 5.026 -9.386 383 HB3 LYS 11 HB3 LYS 11 5.412 4.311 -8.634 384 HG2 LYS 11 HG2 LYS 11 3.972 5.527 -10.351 385 HG3 LYS 11 HG3 LYS 11 5.468 6.004 -11.177 386 HD2 LYS 11 HD2 LYS 11 4.498 4.057 -12.243 387 HD3 LYS 11 HD3 LYS 11 6.031 3.606 -11.442 388 HE2 LYS 11 HE2 LYS 11 4.756 2.690 -9.536 389 HE3 LYS 11 HE3 LYS 11 3.242 3.214 -10.286 390 HZ1 LYS 11 HZ1 LYS 11 3.623 0.903 -10.731 391 HZ2 LYS 11 HZ2 LYS 11 3.758 1.734 -12.136 392 HZ3 LYS 11 HZ3 LYS 11 5.110 1.206 -11.360 393 H THR 12 H THR 12 3.784 7.866 -9.572 394 HA THR 12 HA THR 12 1.748 7.039 -7.558 395 HB THR 12 HB THR 12 2.515 9.589 -7.981 396 HG1 THR 12 HG1 THR 12 0.581 10.039 -6.958 397 HG21 THR 12 HG21 THR 12 1.592 9.532 -10.341 398 HG22 THR 12 HG22 THR 12 -0.015 9.224 -9.619 399 HG23 THR 12 HG23 THR 12 0.840 10.745 -9.272 400 H ILE 13 H ILE 13 -0.485 6.739 -8.402 401 HA ILE 13 HA ILE 13 -0.510 6.037 -11.303 402 HB ILE 13 HB ILE 13 -1.544 4.316 -9.017 403 HG12 ILE 13 HG12 ILE 13 0.852 3.947 -10.881 404 HG13 ILE 13 HG13 ILE 13 0.918 4.320 -9.154 405 HG21 ILE 13 HG21 ILE 13 -1.437 3.806 -12.023 406 HG22 ILE 13 HG22 ILE 13 -2.048 2.677 -10.789 407 HG23 ILE 13 HG23 ILE 13 -2.905 4.190 -11.096 408 HD11 ILE 13 HD11 ILE 13 1.323 1.966 -9.468 409 HD12 ILE 13 HD12 ILE 13 -0.243 2.186 -8.654 410 HD13 ILE 13 HD13 ILE 13 -0.180 1.767 -10.388 411 H THR 14 H THR 14 -2.203 6.828 -12.354 412 HA THR 14 HA THR 14 -4.135 8.466 -10.974 413 HB THR 14 HB THR 14 -4.091 7.528 -13.875 414 HG1 THR 14 HG1 THR 14 -2.932 9.446 -14.212 415 HG21 THR 14 HG21 THR 14 -6.207 8.579 -13.164 416 HG22 THR 14 HG22 THR 14 -5.303 9.947 -12.478 417 HG23 THR 14 HG23 THR 14 -5.305 9.667 -14.238 418 H LEU 15 H LEU 15 -6.251 7.947 -10.419 419 HA LEU 15 HA LEU 15 -7.357 5.337 -11.299 420 HB2 LEU 15 HB2 LEU 15 -7.051 6.225 -8.409 421 HB3 LEU 15 HB3 LEU 15 -7.878 4.763 -8.952 422 HG LEU 15 HG LEU 15 -4.929 5.346 -9.413 423 HD11 LEU 15 HD11 LEU 15 -5.606 5.103 -6.990 424 HD12 LEU 15 HD12 LEU 15 -6.259 3.499 -7.374 425 HD13 LEU 15 HD13 LEU 15 -4.513 3.816 -7.557 426 HD21 LEU 15 HD21 LEU 15 -6.475 2.728 -9.621 427 HD22 LEU 15 HD22 LEU 15 -5.918 3.694 -11.004 428 HD23 LEU 15 HD23 LEU 15 -4.736 2.965 -9.889 429 H GLU 16 H GLU 16 -9.489 5.447 -11.594 430 HA GLU 16 HA GLU 16 -10.896 7.968 -10.917 431 HB2 GLU 16 HB2 GLU 16 -11.052 7.256 -13.227 432 HB3 GLU 16 HB3 GLU 16 -11.455 5.595 -12.749 433 HG2 GLU 16 HG2 GLU 16 -13.568 6.325 -11.801 434 HG3 GLU 16 HG3 GLU 16 -13.203 8.019 -12.169 435 H VAL 17 H VAL 17 -12.249 8.101 -9.308 436 HA VAL 17 HA VAL 17 -13.618 5.719 -8.206 437 HB VAL 17 HB VAL 17 -12.938 6.367 -5.911 438 HG11 VAL 17 HG11 VAL 17 -10.717 5.380 -5.952 439 HG12 VAL 17 HG12 VAL 17 -11.775 4.531 -7.095 440 HG13 VAL 17 HG13 VAL 17 -10.565 5.694 -7.695 441 HG21 VAL 17 HG21 VAL 17 -10.896 8.139 -7.321 442 HG22 VAL 17 HG22 VAL 17 -12.285 8.719 -6.370 443 HG23 VAL 17 HG23 VAL 17 -10.981 7.816 -5.577 444 H GLU 18 H GLU 18 -15.045 6.577 -6.265 445 HA GLU 18 HA GLU 18 -16.181 9.248 -6.923 446 HB2 GLU 18 HB2 GLU 18 -17.665 6.623 -6.499 447 HB3 GLU 18 HB3 GLU 18 -18.444 8.194 -6.675 448 HG2 GLU 18 HG2 GLU 18 -16.690 6.873 -8.791 449 HG3 GLU 18 HG3 GLU 18 -18.450 6.807 -8.734 450 HA PRO 19 HA PRO 19 -16.499 9.857 -2.506 451 HB2 PRO 19 HB2 PRO 19 -19.374 10.555 -2.899 452 HB3 PRO 19 HB3 PRO 19 -18.065 11.539 -2.168 453 HG2 PRO 19 HG2 PRO 19 -18.992 12.138 -4.637 454 HG3 PRO 19 HG3 PRO 19 -17.252 12.251 -4.222 455 HD2 PRO 19 HD2 PRO 19 -18.684 10.056 -5.715 456 HD3 PRO 19 HD3 PRO 19 -17.094 10.809 -6.056 457 H SER 20 H SER 20 -18.066 7.291 -4.073 458 HA SER 20 HA SER 20 -19.109 6.236 -1.508 459 HB2 SER 20 HB2 SER 20 -20.808 5.105 -2.983 460 HB3 SER 20 HB3 SER 20 -20.998 6.880 -2.858 461 HG SER 20 HG SER 20 -21.136 6.099 -5.014 462 H ASP 21 H ASP 21 -16.888 5.920 -4.073 463 HA ASP 21 HA ASP 21 -16.754 2.983 -4.002 464 HB2 ASP 21 HB2 ASP 21 -14.995 5.113 -5.210 465 HB3 ASP 21 HB3 ASP 21 -14.717 3.374 -5.392 466 H THR 22 H THR 22 -16.590 3.009 -1.700 467 HA THR 22 HA THR 22 -14.459 4.248 -0.230 468 HB THR 22 HB THR 22 -16.455 3.633 0.898 469 HG1 THR 22 HG1 THR 22 -15.541 2.574 2.612 470 HG21 THR 22 HG21 THR 22 -17.223 1.747 -0.395 471 HG22 THR 22 HG22 THR 22 -15.870 0.744 0.210 472 HG23 THR 22 HG23 THR 22 -17.130 1.336 1.324 473 H ILE 23 H ILE 23 -12.968 2.628 1.213 474 HA ILE 23 HA ILE 23 -10.911 2.130 -0.601 475 HB ILE 23 HB ILE 23 -11.127 0.858 2.147 476 HG12 ILE 23 HG12 ILE 23 -11.801 3.114 2.517 477 HG13 ILE 23 HG13 ILE 23 -10.122 2.958 3.028 478 HG21 ILE 23 HG21 ILE 23 -9.158 0.226 0.855 479 HG22 ILE 23 HG22 ILE 23 -8.777 1.939 0.546 480 HG23 ILE 23 HG23 ILE 23 -8.700 1.290 2.202 481 HD11 ILE 23 HD11 ILE 23 -11.094 4.225 0.429 482 HD12 ILE 23 HD12 ILE 23 -10.462 5.056 1.859 483 HD13 ILE 23 HD13 ILE 23 -9.381 4.024 0.901 484 H GLU 24 H GLU 24 -13.461 -0.173 0.428 485 HA GLU 24 HA GLU 24 -11.913 -2.468 -0.415 486 HB2 GLU 24 HB2 GLU 24 -13.874 -3.733 -0.128 487 HB3 GLU 24 HB3 GLU 24 -13.926 -2.479 1.126 488 HG2 GLU 24 HG2 GLU 24 -15.454 -1.145 -0.335 489 HG3 GLU 24 HG3 GLU 24 -15.432 -2.451 -1.531 490 H ASN 25 H ASN 25 -13.578 0.036 -2.084 491 HA ASN 25 HA ASN 25 -13.861 -1.433 -4.594 492 HB2 ASN 25 HB2 ASN 25 -14.270 1.497 -3.907 493 HB3 ASN 25 HB3 ASN 25 -14.664 0.772 -5.439 494 HD21 ASN 25 HD21 ASN 25 -15.530 1.088 -2.159 495 HD22 ASN 25 HD22 ASN 25 -17.061 0.191 -2.197 496 H VAL 26 H VAL 26 -11.822 1.204 -3.154 497 HA VAL 26 HA VAL 26 -10.420 1.865 -5.539 498 HB VAL 26 HB VAL 26 -9.042 3.173 -4.218 499 HG11 VAL 26 HG11 VAL 26 -11.651 3.011 -2.679 500 HG12 VAL 26 HG12 VAL 26 -10.594 4.422 -2.883 501 HG13 VAL 26 HG13 VAL 26 -11.465 3.747 -4.287 502 HG21 VAL 26 HG21 VAL 26 -8.910 2.983 -1.727 503 HG22 VAL 26 HG22 VAL 26 -9.664 1.372 -1.894 504 HG23 VAL 26 HG23 VAL 26 -8.097 1.701 -2.655 505 H LYS 27 H LYS 27 -9.888 -0.559 -3.021 506 HA LYS 27 HA LYS 27 -7.339 -1.475 -3.755 507 HB2 LYS 27 HB2 LYS 27 -9.819 -2.777 -2.598 508 HB3 LYS 27 HB3 LYS 27 -8.330 -3.704 -2.881 509 HG2 LYS 27 HG2 LYS 27 -7.034 -2.205 -1.494 510 HG3 LYS 27 HG3 LYS 27 -8.405 -1.102 -1.293 511 HD2 LYS 27 HD2 LYS 27 -9.656 -2.829 -0.075 512 HD3 LYS 27 HD3 LYS 27 -8.360 -4.012 -0.384 513 HE2 LYS 27 HE2 LYS 27 -6.767 -2.510 0.818 514 HE3 LYS 27 HE3 LYS 27 -8.109 -1.426 1.216 515 HZ1 LYS 27 HZ1 LYS 27 -9.152 -3.207 2.395 516 HZ2 LYS 27 HZ2 LYS 27 -7.940 -4.260 2.016 517 HZ3 LYS 27 HZ3 LYS 27 -7.642 -2.975 2.998 518 H ALA 28 H ALA 28 -10.492 -2.004 -5.378 519 HA ALA 28 HA ALA 28 -9.370 -3.993 -7.179 520 HB1 ALA 28 HB1 ALA 28 -11.789 -3.897 -6.663 521 HB2 ALA 28 HB2 ALA 28 -11.882 -2.292 -7.426 522 HB3 ALA 28 HB3 ALA 28 -11.469 -3.714 -8.405 523 H LYS 29 H LYS 29 -9.678 -0.438 -7.126 524 HA LYS 29 HA LYS 29 -9.118 -0.074 -9.927 525 HB2 LYS 29 HB2 LYS 29 -8.907 1.740 -7.508 526 HB3 LYS 29 HB3 LYS 29 -8.360 2.242 -9.109 527 HG2 LYS 29 HG2 LYS 29 -10.564 3.056 -8.779 528 HG3 LYS 29 HG3 LYS 29 -10.616 1.801 -10.039 529 HD2 LYS 29 HD2 LYS 29 -11.572 0.198 -8.486 530 HD3 LYS 29 HD3 LYS 29 -11.180 1.234 -7.119 531 HE2 LYS 29 HE2 LYS 29 -13.571 1.288 -7.653 532 HE3 LYS 29 HE3 LYS 29 -12.824 2.888 -7.798 533 HZ1 LYS 29 HZ1 LYS 29 -13.412 1.081 -10.053 534 HZ2 LYS 29 HZ2 LYS 29 -14.287 2.409 -9.645 535 HZ3 LYS 29 HZ3 LYS 29 -12.746 2.582 -10.173 536 H ILE 30 H ILE 30 -7.132 -0.476 -6.988 537 HA ILE 30 HA ILE 30 -4.649 0.261 -8.376 538 HB ILE 30 HB ILE 30 -5.336 -0.777 -5.604 539 HG12 ILE 30 HG12 ILE 30 -4.418 1.985 -6.501 540 HG13 ILE 30 HG13 ILE 30 -6.117 1.539 -6.275 541 HG21 ILE 30 HG21 ILE 30 -2.665 0.257 -6.658 542 HG22 ILE 30 HG22 ILE 30 -3.021 -0.155 -4.963 543 HG23 ILE 30 HG23 ILE 30 -3.019 -1.424 -6.194 544 HD11 ILE 30 HD11 ILE 30 -5.342 2.715 -4.310 545 HD12 ILE 30 HD12 ILE 30 -5.657 1.030 -3.875 546 HD13 ILE 30 HD13 ILE 30 -3.988 1.594 -4.098 547 H GLN 31 H GLN 31 -6.466 -2.630 -7.380 548 HA GLN 31 HA GLN 31 -4.393 -4.538 -7.916 549 HB2 GLN 31 HB2 GLN 31 -6.384 -5.156 -6.629 550 HB3 GLN 31 HB3 GLN 31 -7.442 -4.677 -7.972 551 HG2 GLN 31 HG2 GLN 31 -6.548 -6.412 -9.402 552 HG3 GLN 31 HG3 GLN 31 -5.335 -6.852 -8.206 553 HE21 GLN 31 HE21 GLN 31 -6.042 -9.019 -7.970 554 HE22 GLN 31 HE22 GLN 31 -7.570 -9.424 -7.216 555 H ASP 32 H ASP 32 -6.942 -2.983 -9.904 556 HA ASP 32 HA ASP 32 -6.605 -4.694 -12.145 557 HB2 ASP 32 HB2 ASP 32 -8.569 -3.214 -11.638 558 HB3 ASP 32 HB3 ASP 32 -7.571 -1.811 -11.857 559 H LYS 33 H LYS 33 -5.005 -1.814 -11.020 560 HA LYS 33 HA LYS 33 -3.713 -1.153 -13.542 561 HB2 LYS 33 HB2 LYS 33 -3.721 -0.156 -10.691 562 HB3 LYS 33 HB3 LYS 33 -2.565 0.499 -11.867 563 HG2 LYS 33 HG2 LYS 33 -5.566 0.389 -12.383 564 HG3 LYS 33 HG3 LYS 33 -4.769 1.773 -11.601 565 HD2 LYS 33 HD2 LYS 33 -3.262 1.991 -13.572 566 HD3 LYS 33 HD3 LYS 33 -4.188 0.706 -14.394 567 HE2 LYS 33 HE2 LYS 33 -6.256 2.071 -14.124 568 HE3 LYS 33 HE3 LYS 33 -5.296 3.350 -13.366 569 HZ1 LYS 33 HZ1 LYS 33 -4.035 3.517 -15.417 570 HZ2 LYS 33 HZ2 LYS 33 -4.961 2.356 -16.120 571 HZ3 LYS 33 HZ3 LYS 33 -5.633 3.790 -15.685 572 H GLU 34 H GLU 34 -2.861 -3.143 -10.767 573 HA GLU 34 HA GLU 34 -0.152 -3.440 -11.969 574 HB2 GLU 34 HB2 GLU 34 -0.810 -2.955 -9.039 575 HB3 GLU 34 HB3 GLU 34 0.775 -3.501 -9.608 576 HG2 GLU 34 HG2 GLU 34 -0.496 -0.917 -10.586 577 HG3 GLU 34 HG3 GLU 34 0.482 -1.016 -9.126 578 H GLY 35 H GLY 35 -2.661 -4.805 -9.807 579 HA2 GLY 35 HA2 GLY 35 -3.285 -7.125 -10.260 580 HA3 GLY 35 HA3 GLY 35 -1.565 -7.524 -10.409 581 H ILE 36 H ILE 36 -2.170 -5.193 -7.988 582 HA ILE 36 HA ILE 36 -1.214 -6.997 -5.936 583 HB ILE 36 HB ILE 36 -2.213 -4.121 -5.849 584 HG12 ILE 36 HG12 ILE 36 0.650 -5.153 -5.857 585 HG13 ILE 36 HG13 ILE 36 -0.197 -4.660 -7.329 586 HG21 ILE 36 HG21 ILE 36 -0.532 -5.685 -3.842 587 HG22 ILE 36 HG22 ILE 36 -1.034 -3.981 -3.701 588 HG23 ILE 36 HG23 ILE 36 -2.247 -5.278 -3.632 589 HD11 ILE 36 HD11 ILE 36 0.322 -2.869 -4.916 590 HD12 ILE 36 HD12 ILE 36 1.165 -2.808 -6.482 591 HD13 ILE 36 HD13 ILE 36 -0.560 -2.403 -6.385 592 HA PRO 37 HA PRO 37 -5.312 -8.312 -4.897 593 HB2 PRO 37 HB2 PRO 37 -4.818 -9.638 -2.536 594 HB3 PRO 37 HB3 PRO 37 -4.313 -10.266 -4.135 595 HG2 PRO 37 HG2 PRO 37 -2.654 -8.726 -2.134 596 HG3 PRO 37 HG3 PRO 37 -2.211 -10.225 -3.014 597 HD2 PRO 37 HD2 PRO 37 -1.408 -7.754 -3.837 598 HD3 PRO 37 HD3 PRO 37 -1.829 -9.021 -5.026 599 HA PRO 38 HA PRO 38 -6.896 -5.257 -2.113 600 HB2 PRO 38 HB2 PRO 38 -9.248 -6.428 -1.309 601 HB3 PRO 38 HB3 PRO 38 -8.992 -5.781 -2.963 602 HG2 PRO 38 HG2 PRO 38 -8.739 -8.644 -2.015 603 HG3 PRO 38 HG3 PRO 38 -9.596 -8.030 -3.470 604 HD2 PRO 38 HD2 PRO 38 -7.083 -9.058 -3.614 605 HD3 PRO 38 HD3 PRO 38 -7.564 -7.656 -4.616 606 H ASP 39 H ASP 39 -6.144 -8.521 -1.153 607 HA ASP 39 HA ASP 39 -6.749 -8.094 1.647 608 HB2 ASP 39 HB2 ASP 39 -5.205 -10.303 0.231 609 HB3 ASP 39 HB3 ASP 39 -5.755 -10.355 1.915 610 H GLN 40 H GLN 40 -4.212 -6.980 -0.322 611 HA GLN 40 HA GLN 40 -2.377 -6.965 2.037 612 HB2 GLN 40 HB2 GLN 40 -1.737 -7.247 -0.918 613 HB3 GLN 40 HB3 GLN 40 -0.536 -6.973 0.352 614 HG2 GLN 40 HG2 GLN 40 -1.214 -9.051 1.489 615 HG3 GLN 40 HG3 GLN 40 -2.460 -9.341 0.263 616 HE21 GLN 40 HE21 GLN 40 0.944 -8.205 -0.161 617 HE22 GLN 40 HE22 GLN 40 1.427 -9.559 -1.164 618 H GLN 41 H GLN 41 -4.051 -4.914 -0.302 619 HA GLN 41 HA GLN 41 -2.115 -2.767 -0.182 620 HB2 GLN 41 HB2 GLN 41 -5.078 -2.847 -0.837 621 HB3 GLN 41 HB3 GLN 41 -4.034 -1.436 -1.064 622 HG2 GLN 41 HG2 GLN 41 -2.666 -2.658 -2.696 623 HG3 GLN 41 HG3 GLN 41 -3.627 -4.128 -2.412 624 HE21 GLN 41 HE21 GLN 41 -4.672 -4.343 -4.437 625 HE22 GLN 41 HE22 GLN 41 -5.839 -3.164 -4.977 626 H ARG 42 H ARG 42 -2.466 -0.690 0.704 627 HA ARG 42 HA ARG 42 -4.636 -0.114 2.525 628 HB2 ARG 42 HB2 ARG 42 -2.978 -1.365 3.983 629 HB3 ARG 42 HB3 ARG 42 -1.773 -0.137 3.584 630 HG2 ARG 42 HG2 ARG 42 -2.903 0.218 5.792 631 HG3 ARG 42 HG3 ARG 42 -3.069 1.588 4.683 632 HD2 ARG 42 HD2 ARG 42 -5.182 1.074 5.892 633 HD3 ARG 42 HD3 ARG 42 -5.355 0.959 4.144 634 HE ARG 42 HE ARG 42 -4.704 -1.611 5.284 635 HH11 ARG 42 HH11 ARG 42 -7.392 0.694 4.934 636 HH12 ARG 42 HH12 ARG 42 -8.593 -0.581 4.930 637 HH21 ARG 42 HH21 ARG 42 -6.349 -3.201 5.379 638 HH22 ARG 42 HH22 ARG 42 -8.029 -2.714 5.273 639 H LEU 43 H LEU 43 -4.834 2.218 2.735 640 HA LEU 43 HA LEU 43 -2.740 3.760 1.298 641 HB2 LEU 43 HB2 LEU 43 -5.739 3.809 0.721 642 HB3 LEU 43 HB3 LEU 43 -4.624 5.116 0.296 643 HG LEU 43 HG LEU 43 -3.266 3.037 -0.770 644 HD11 LEU 43 HD11 LEU 43 -6.228 2.295 -0.959 645 HD12 LEU 43 HD12 LEU 43 -4.903 1.503 -1.840 646 HD13 LEU 43 HD13 LEU 43 -4.995 1.372 -0.073 647 HD21 LEU 43 HD21 LEU 43 -4.047 5.145 -1.857 648 HD22 LEU 43 HD22 LEU 43 -4.216 3.723 -2.896 649 HD23 LEU 43 HD23 LEU 43 -5.650 4.409 -2.080 650 H ILE 44 H ILE 44 -2.861 6.059 1.614 651 HA ILE 44 HA ILE 44 -3.953 6.898 4.243 652 HB ILE 44 HB ILE 44 -1.063 7.092 3.288 653 HG12 ILE 44 HG12 ILE 44 -0.900 6.175 5.811 654 HG13 ILE 44 HG13 ILE 44 -2.530 5.616 5.473 655 HG21 ILE 44 HG21 ILE 44 -2.259 8.342 5.797 656 HG22 ILE 44 HG22 ILE 44 -0.572 8.402 5.287 657 HG23 ILE 44 HG23 ILE 44 -1.786 9.266 4.350 658 HD11 ILE 44 HD11 ILE 44 -1.601 4.417 3.419 659 HD12 ILE 44 HD12 ILE 44 0.016 4.895 3.967 660 HD13 ILE 44 HD13 ILE 44 -1.009 3.832 4.976 661 H PHE 45 H PHE 45 -4.333 9.143 4.359 662 HA PHE 45 HA PHE 45 -3.797 10.871 2.039 663 HB2 PHE 45 HB2 PHE 45 -5.935 9.674 1.544 664 HB3 PHE 45 HB3 PHE 45 -6.596 10.266 3.074 665 HD1 PHE 45 HD1 PHE 45 -4.850 11.726 0.077 666 HD2 PHE 45 HD2 PHE 45 -8.014 12.071 2.973 667 HE1 PHE 45 HE1 PHE 45 -5.638 13.775 -1.043 668 HE2 PHE 45 HE2 PHE 45 -8.797 14.138 1.881 669 HZ PHE 45 HZ PHE 45 -7.617 15.012 -0.129 670 H ALA 46 H ALA 46 -3.876 13.060 2.603 671 HA ALA 46 HA ALA 46 -3.272 14.716 4.007 672 HB1 ALA 46 HB1 ALA 46 -5.718 13.751 5.539 673 HB2 ALA 46 HB2 ALA 46 -4.979 15.362 5.662 674 HB3 ALA 46 HB3 ALA 46 -5.725 14.844 4.135 675 H GLY 47 H GLY 47 -2.400 11.793 4.700 676 HA2 GLY 47 HA2 GLY 47 -0.615 11.191 6.058 677 HA3 GLY 47 HA3 GLY 47 -0.927 12.550 7.138 678 H LYS 48 H LYS 48 -3.771 10.634 6.343 679 HA LYS 48 HA LYS 48 -3.218 8.868 8.661 680 HB2 LYS 48 HB2 LYS 48 -5.500 9.029 9.466 681 HB3 LYS 48 HB3 LYS 48 -4.649 10.568 9.545 682 HG2 LYS 48 HG2 LYS 48 -6.803 11.071 8.862 683 HG3 LYS 48 HG3 LYS 48 -5.782 11.228 7.410 684 HD2 LYS 48 HD2 LYS 48 -6.659 9.077 6.561 685 HD3 LYS 48 HD3 LYS 48 -7.644 8.858 8.017 686 HE2 LYS 48 HE2 LYS 48 -7.852 11.187 6.067 687 HE3 LYS 48 HE3 LYS 48 -8.917 9.771 6.096 688 HZ1 LYS 48 HZ1 LYS 48 -8.595 11.710 8.297 689 HZ2 LYS 48 HZ2 LYS 48 -9.880 11.616 7.279 690 HZ3 LYS 48 HZ3 LYS 48 -9.572 10.387 8.324 691 H GLN 49 H GLN 49 -4.547 6.987 8.717 692 HA GLN 49 HA GLN 49 -4.406 5.766 6.042 693 HB2 GLN 49 HB2 GLN 49 -3.269 4.786 8.019 694 HB3 GLN 49 HB3 GLN 49 -4.832 4.609 8.823 695 HG2 GLN 49 HG2 GLN 49 -5.572 3.104 6.946 696 HG3 GLN 49 HG3 GLN 49 -3.965 3.280 6.218 697 HE21 GLN 49 HE21 GLN 49 -2.085 2.453 7.425 698 HE22 GLN 49 HE22 GLN 49 -2.319 1.133 8.553 699 H LEU 50 H LEU 50 -6.075 4.697 5.072 700 HA LEU 50 HA LEU 50 -8.772 5.668 5.889 701 HB2 LEU 50 HB2 LEU 50 -7.990 4.535 3.187 702 HB3 LEU 50 HB3 LEU 50 -9.357 5.570 3.600 703 HG LEU 50 HG LEU 50 -6.415 6.382 3.587 704 HD11 LEU 50 HD11 LEU 50 -7.396 6.100 1.341 705 HD12 LEU 50 HD12 LEU 50 -8.743 7.171 1.795 706 HD13 LEU 50 HD13 LEU 50 -7.088 7.813 1.699 707 HD21 LEU 50 HD21 LEU 50 -7.123 8.616 4.085 708 HD22 LEU 50 HD22 LEU 50 -8.835 8.171 3.987 709 HD23 LEU 50 HD23 LEU 50 -7.820 7.575 5.335 710 H GLU 51 H GLU 51 -10.578 4.195 5.870 711 HA GLU 51 HA GLU 51 -9.722 1.350 6.243 712 HB2 GLU 51 HB2 GLU 51 -11.510 3.163 7.861 713 HB3 GLU 51 HB3 GLU 51 -11.720 1.406 7.911 714 HG2 GLU 51 HG2 GLU 51 -9.387 1.097 8.587 715 HG3 GLU 51 HG3 GLU 51 -9.094 2.834 8.452 716 H ASP 52 H ASP 52 -11.152 -0.263 5.767 717 HA ASP 52 HA ASP 52 -12.651 0.166 3.363 718 HB2 ASP 52 HB2 ASP 52 -12.446 -2.276 5.171 719 HB3 ASP 52 HB3 ASP 52 -13.033 -2.250 3.510 720 H GLY 53 H GLY 53 -13.526 0.959 6.429 721 HA2 GLY 53 HA2 GLY 53 -16.355 0.081 6.106 722 HA3 GLY 53 HA3 GLY 53 -15.543 0.364 7.662 723 H ARG 54 H ARG 54 -14.697 2.577 5.145 724 HA ARG 54 HA ARG 54 -16.503 4.688 6.231 725 HB2 ARG 54 HB2 ARG 54 -13.771 5.054 5.018 726 HB3 ARG 54 HB3 ARG 54 -14.692 6.219 5.979 727 HG2 ARG 54 HG2 ARG 54 -13.501 3.618 7.054 728 HG3 ARG 54 HG3 ARG 54 -12.741 5.205 7.181 729 HD2 ARG 54 HD2 ARG 54 -14.550 6.064 8.506 730 HD3 ARG 54 HD3 ARG 54 -15.493 4.569 8.284 731 HE ARG 54 HE ARG 54 -13.015 3.817 9.374 732 HH11 ARG 54 HH11 ARG 54 -15.825 5.715 10.386 733 HH12 ARG 54 HH12 ARG 54 -15.572 5.383 12.084 734 HH21 ARG 54 HH21 ARG 54 -12.698 3.427 11.542 735 HH22 ARG 54 HH22 ARG 54 -13.792 4.066 12.753 736 H THR 55 H THR 55 -15.374 6.497 4.144 737 HA THR 55 HA THR 55 -15.828 5.280 1.532 738 HB THR 55 HB THR 55 -17.472 7.050 0.871 739 HG1 THR 55 HG1 THR 55 -18.618 8.047 2.573 740 HG21 THR 55 HG21 THR 55 -18.196 4.703 1.466 741 HG22 THR 55 HG22 THR 55 -18.570 5.295 3.100 742 HG23 THR 55 HG23 THR 55 -19.446 5.943 1.698 743 H LEU 56 H LEU 56 -15.217 6.825 -0.214 744 HA LEU 56 HA LEU 56 -12.855 8.239 0.488 745 HB2 LEU 56 HB2 LEU 56 -14.639 8.196 -1.964 746 HB3 LEU 56 HB3 LEU 56 -13.201 9.214 -1.892 747 HG LEU 56 HG LEU 56 -13.217 6.183 -1.476 748 HD11 LEU 56 HD11 LEU 56 -12.042 6.178 -3.680 749 HD12 LEU 56 HD12 LEU 56 -13.715 6.751 -3.789 750 HD13 LEU 56 HD13 LEU 56 -12.369 7.923 -3.826 751 HD21 LEU 56 HD21 LEU 56 -10.762 6.387 -1.739 752 HD22 LEU 56 HD22 LEU 56 -10.916 8.152 -1.806 753 HD23 LEU 56 HD23 LEU 56 -11.314 7.262 -0.304 754 H SER 57 H SER 57 -16.229 9.202 0.378 755 HA SER 57 HA SER 57 -15.765 12.051 0.492 756 HB2 SER 57 HB2 SER 57 -17.823 11.206 -0.324 757 HB3 SER 57 HB3 SER 57 -18.078 10.169 1.060 758 HG SER 57 HG SER 57 -19.325 12.101 1.173 759 H ASP 58 H ASP 58 -15.897 9.412 2.818 760 HA ASP 58 HA ASP 58 -16.232 11.020 5.167 761 HB2 ASP 58 HB2 ASP 58 -16.611 8.525 4.955 762 HB3 ASP 58 HB3 ASP 58 -14.849 8.326 5.006 763 H TYR 59 H TYR 59 -13.535 10.646 3.056 764 HA TYR 59 HA TYR 59 -11.826 11.929 5.136 765 HB2 TYR 59 HB2 TYR 59 -10.458 10.827 2.770 766 HB3 TYR 59 HB3 TYR 59 -9.976 10.823 4.456 767 HD1 TYR 59 HD1 TYR 59 -10.892 8.957 5.962 768 HD2 TYR 59 HD2 TYR 59 -11.462 9.053 1.710 769 HE1 TYR 59 HE1 TYR 59 -11.294 6.471 5.949 770 HE2 TYR 59 HE2 TYR 59 -11.970 6.615 1.713 771 HH TYR 59 HH TYR 59 -11.889 4.656 4.683 772 H ASN 60 H ASN 60 -13.856 13.001 3.157 773 HA ASN 60 HA ASN 60 -14.131 14.624 1.677 774 HB2 ASN 60 HB2 ASN 60 -13.264 16.680 2.369 775 HB3 ASN 60 HB3 ASN 60 -13.474 15.697 3.809 776 HD21 ASN 60 HD21 ASN 60 -11.741 15.185 5.111 777 HD22 ASN 60 HD22 ASN 60 -10.120 15.797 4.834 778 H ILE 61 H ILE 61 -12.095 12.558 0.779 779 HA ILE 61 HA ILE 61 -10.100 13.788 -0.799 780 HB ILE 61 HB ILE 61 -11.652 11.199 -1.028 781 HG12 ILE 61 HG12 ILE 61 -8.747 11.880 -0.407 782 HG13 ILE 61 HG13 ILE 61 -10.000 11.630 0.821 783 HG21 ILE 61 HG21 ILE 61 -10.037 10.476 -2.760 784 HG22 ILE 61 HG22 ILE 61 -11.023 11.821 -3.335 785 HG23 ILE 61 HG23 ILE 61 -9.352 12.116 -2.801 786 HD11 ILE 61 HD11 ILE 61 -10.334 9.312 -0.026 787 HD12 ILE 61 HD12 ILE 61 -9.004 9.562 -1.181 788 HD13 ILE 61 HD13 ILE 61 -8.680 9.600 0.565 789 H GLN 62 H GLN 62 -9.998 14.635 -2.802 790 HA GLN 62 HA GLN 62 -12.473 14.912 -4.454 791 HB2 GLN 62 HB2 GLN 62 -10.313 17.007 -4.074 792 HB3 GLN 62 HB3 GLN 62 -11.883 17.205 -4.861 793 HG2 GLN 62 HG2 GLN 62 -11.450 16.657 -1.892 794 HG3 GLN 62 HG3 GLN 62 -11.709 18.242 -2.590 795 HE21 GLN 62 HE21 GLN 62 -13.349 16.642 -0.608 796 HE22 GLN 62 HE22 GLN 62 -14.957 16.609 -1.295 797 H LYS 63 H LYS 63 -11.573 15.938 -6.684 798 HA LYS 63 HA LYS 63 -9.899 13.937 -7.861 799 HB2 LYS 63 HB2 LYS 63 -10.059 15.333 -9.808 800 HB3 LYS 63 HB3 LYS 63 -11.646 15.240 -9.034 801 HG2 LYS 63 HG2 LYS 63 -11.219 17.452 -7.937 802 HG3 LYS 63 HG3 LYS 63 -9.681 17.566 -8.824 803 HD2 LYS 63 HD2 LYS 63 -12.411 17.232 -10.117 804 HD3 LYS 63 HD3 LYS 63 -11.568 18.793 -9.923 805 HE2 LYS 63 HE2 LYS 63 -9.653 17.887 -11.227 806 HE3 LYS 63 HE3 LYS 63 -10.541 16.372 -11.462 807 HZ1 LYS 63 HZ1 LYS 63 -10.777 17.849 -13.341 808 HZ2 LYS 63 HZ2 LYS 63 -12.239 17.618 -12.622 809 HZ3 LYS 63 HZ3 LYS 63 -11.421 19.025 -12.395 810 H GLU 64 H GLU 64 -7.867 13.954 -8.566 811 HA GLU 64 HA GLU 64 -5.643 14.336 -8.518 812 HB2 GLU 64 HB2 GLU 64 -6.570 17.238 -8.612 813 HB3 GLU 64 HB3 GLU 64 -4.969 16.625 -9.068 814 HG2 GLU 64 HG2 GLU 64 -6.033 15.200 -10.822 815 HG3 GLU 64 HG3 GLU 64 -7.612 15.880 -10.401 816 H SER 65 H SER 65 -6.980 14.151 -5.858 817 HA SER 65 HA SER 65 -5.946 16.148 -4.111 818 HB2 SER 65 HB2 SER 65 -6.857 14.622 -2.393 819 HB3 SER 65 HB3 SER 65 -8.009 14.876 -3.720 820 HG SER 65 HG SER 65 -7.747 12.651 -3.144 821 H THR 66 H THR 66 -4.585 13.262 -5.394 822 HA THR 66 HA THR 66 -2.786 11.978 -5.052 823 HB THR 66 HB THR 66 -1.792 14.408 -3.585 824 HG1 THR 66 HG1 THR 66 -0.703 14.678 -5.565 825 HG21 THR 66 HG21 THR 66 -0.473 12.447 -2.839 826 HG22 THR 66 HG22 THR 66 -0.287 11.903 -4.517 827 HG23 THR 66 HG23 THR 66 0.492 13.400 -3.974 828 H LEU 67 H LEU 67 -2.374 10.280 -3.878 829 HA LEU 67 HA LEU 67 -2.876 10.202 -0.941 830 HB2 LEU 67 HB2 LEU 67 -4.172 8.632 -3.168 831 HB3 LEU 67 HB3 LEU 67 -3.785 7.793 -1.668 832 HG LEU 67 HG LEU 67 -5.075 9.648 -0.452 833 HD11 LEU 67 HD11 LEU 67 -6.181 9.955 -3.285 834 HD12 LEU 67 HD12 LEU 67 -6.942 10.601 -1.810 835 HD13 LEU 67 HD13 LEU 67 -5.377 11.231 -2.335 836 HD21 LEU 67 HD21 LEU 67 -5.778 7.296 -0.706 837 HD22 LEU 67 HD22 LEU 67 -7.165 8.394 -0.814 838 HD23 LEU 67 HD23 LEU 67 -6.486 7.671 -2.296 839 H HIS 68 H HIS 68 -2.233 7.678 -0.396 840 HA HIS 68 HA HIS 68 0.287 7.048 -1.837 841 HB2 HIS 68 HB2 HIS 68 0.032 7.209 1.182 842 HB3 HIS 68 HB3 HIS 68 1.496 6.872 0.251 843 HD2 HIS 68 HD2 HIS 68 2.411 9.025 -1.329 844 HE1 HIS 68 HE1 HIS 68 0.462 12.021 0.969 845 HE2 HIS 68 HE2 HIS 68 2.235 11.579 -0.800 846 H LEU 69 H LEU 69 0.912 4.862 -1.693 847 HA LEU 69 HA LEU 69 -1.090 2.940 -0.620 848 HB2 LEU 69 HB2 LEU 69 -1.559 3.362 -2.977 849 HB3 LEU 69 HB3 LEU 69 0.129 3.136 -3.403 850 HG LEU 69 HG LEU 69 -1.461 1.291 -4.009 851 HD11 LEU 69 HD11 LEU 69 0.066 -0.502 -3.585 852 HD12 LEU 69 HD12 LEU 69 1.016 0.970 -3.867 853 HD13 LEU 69 HD13 LEU 69 0.802 0.338 -2.215 854 HD21 LEU 69 HD21 LEU 69 -2.094 -0.353 -2.326 855 HD22 LEU 69 HD22 LEU 69 -1.378 0.634 -1.041 856 HD23 LEU 69 HD23 LEU 69 -2.796 1.232 -1.946 857 H VAL 70 H VAL 70 -0.194 1.282 0.425 858 HA VAL 70 HA VAL 70 2.576 0.420 -0.154 859 HB VAL 70 HB VAL 70 1.549 1.059 2.646 860 HG11 VAL 70 HG11 VAL 70 4.229 0.052 1.599 861 HG12 VAL 70 HG12 VAL 70 3.956 0.659 3.247 862 HG13 VAL 70 HG13 VAL 70 3.119 -0.802 2.705 863 HG21 VAL 70 HG21 VAL 70 3.615 2.469 0.897 864 HG22 VAL 70 HG22 VAL 70 2.064 3.137 1.451 865 HG23 VAL 70 HG23 VAL 70 3.347 2.786 2.627 866 H LEU 71 H LEU 71 2.912 -1.833 0.924 867 HA LEU 71 HA LEU 71 0.337 -3.213 1.316 868 HB2 LEU 71 HB2 LEU 71 1.051 -4.939 -0.422 869 HB3 LEU 71 HB3 LEU 71 0.437 -3.390 -0.991 870 HG LEU 71 HG LEU 71 2.719 -2.605 -1.467 871 HD11 LEU 71 HD11 LEU 71 3.553 -5.416 -0.638 872 HD12 LEU 71 HD12 LEU 71 4.586 -4.254 -1.499 873 HD13 LEU 71 HD13 LEU 71 4.053 -3.894 0.149 874 HD21 LEU 71 HD21 LEU 71 1.375 -3.767 -3.171 875 HD22 LEU 71 HD22 LEU 71 3.106 -4.102 -3.381 876 HD23 LEU 71 HD23 LEU 71 2.044 -5.330 -2.642 877 H ARG 72 H ARG 72 0.610 -5.549 1.698 878 HA ARG 72 HA ARG 72 2.404 -5.951 3.950 879 HB2 ARG 72 HB2 ARG 72 0.093 -7.352 2.646 880 HB3 ARG 72 HB3 ARG 72 1.179 -8.339 3.629 881 HG2 ARG 72 HG2 ARG 72 -0.737 -7.437 4.932 882 HG3 ARG 72 HG3 ARG 72 0.849 -6.959 5.569 883 HD2 ARG 72 HD2 ARG 72 0.625 -4.751 4.460 884 HD3 ARG 72 HD3 ARG 72 -0.965 -5.231 3.838 885 HE ARG 72 HE ARG 72 -1.880 -4.850 5.935 886 HH11 ARG 72 HH11 ARG 72 1.644 -4.937 6.206 887 HH12 ARG 72 HH12 ARG 72 1.647 -4.430 7.876 888 HH21 ARG 72 HH21 ARG 72 -1.842 -4.145 8.114 889 HH22 ARG 72 HH22 ARG 72 -0.306 -3.954 8.932 890 H LEU 73 H LEU 73 3.129 -8.502 3.990 891 HA LEU 73 HA LEU 73 5.249 -8.507 1.924 892 HB2 LEU 73 HB2 LEU 73 5.352 -8.275 4.716 893 HB3 LEU 73 HB3 LEU 73 5.671 -9.983 4.482 894 HG LEU 73 HG LEU 73 7.721 -8.660 4.630 895 HD11 LEU 73 HD11 LEU 73 7.352 -9.667 1.785 896 HD12 LEU 73 HD12 LEU 73 8.884 -9.442 2.674 897 HD13 LEU 73 HD13 LEU 73 7.720 -10.681 3.199 898 HD21 LEU 73 HD21 LEU 73 6.772 -7.246 2.095 899 HD22 LEU 73 HD22 LEU 73 6.848 -6.538 3.727 900 HD23 LEU 73 HD23 LEU 73 8.336 -7.046 2.889 901 H ARG 74 H ARG 74 2.584 -9.763 1.944 902 HA ARG 74 HA ARG 74 1.488 -11.626 1.270 903 HB2 ARG 74 HB2 ARG 74 3.284 -11.579 -0.457 904 HB3 ARG 74 HB3 ARG 74 4.247 -12.678 0.536 905 HG2 ARG 74 HG2 ARG 74 3.109 -13.928 -1.214 906 HG3 ARG 74 HG3 ARG 74 2.487 -14.413 0.370 907 HD2 ARG 74 HD2 ARG 74 0.518 -12.955 0.061 908 HD3 ARG 74 HD3 ARG 74 1.164 -12.414 -1.503 909 HE ARG 74 HE ARG 74 0.999 -15.260 -1.501 910 HH11 ARG 74 HH11 ARG 74 -1.109 -12.418 -1.545 911 HH12 ARG 74 HH12 ARG 74 -2.406 -13.253 -2.373 912 HH21 ARG 74 HH21 ARG 74 -0.701 -16.306 -2.601 913 HH22 ARG 74 HH22 ARG 74 -2.171 -15.436 -2.977 914 H GLY 75 H GLY 75 4.226 -12.245 3.392 915 HA2 GLY 75 HA2 GLY 75 3.178 -13.525 5.450 916 HA3 GLY 75 HA3 GLY 75 3.068 -14.816 4.221 917 H GLY 76 H GLY 76 5.613 -13.384 3.037 918 HA2 GLY 76 HA2 GLY 76 7.810 -13.632 4.744 919 HA3 GLY 76 HA3 GLY 76 7.515 -15.260 4.114 Start of MODEL 20 1 H LEU 491 H LEU 491 15.592 5.823 10.856 2 HA LEU 491 HA LEU 491 18.241 5.179 11.069 3 HB2 LEU 491 HB2 LEU 491 17.214 2.769 10.327 4 HB3 LEU 491 HB3 LEU 491 17.197 3.478 11.938 5 HG LEU 491 HG LEU 491 14.910 4.364 11.546 6 HD11 LEU 491 HD11 LEU 491 13.649 3.420 9.598 7 HD12 LEU 491 HD12 LEU 491 14.940 4.533 9.081 8 HD13 LEU 491 HD13 LEU 491 15.184 2.782 8.945 9 HD21 LEU 491 HD21 LEU 491 15.294 1.392 11.060 10 HD22 LEU 491 HD22 LEU 491 15.354 2.218 12.636 11 HD23 LEU 491 HD23 LEU 491 13.832 2.181 11.716 12 HA PRO 492 HA PRO 492 19.580 5.421 6.892 13 HB2 PRO 492 HB2 PRO 492 22.211 5.015 7.260 14 HB3 PRO 492 HB3 PRO 492 21.338 6.417 7.970 15 HG2 PRO 492 HG2 PRO 492 22.142 3.814 9.331 16 HG3 PRO 492 HG3 PRO 492 22.294 5.481 9.964 17 HD2 PRO 492 HD2 PRO 492 20.177 3.706 10.484 18 HD3 PRO 492 HD3 PRO 492 20.073 5.479 10.664 19 H LEU 493 H LEU 493 18.679 3.809 5.789 20 HA LEU 493 HA LEU 493 18.023 1.611 5.374 21 HB2 LEU 493 HB2 LEU 493 19.515 3.055 3.803 22 HB3 LEU 493 HB3 LEU 493 20.721 1.825 4.052 23 HG LEU 493 HG LEU 493 17.875 1.474 2.959 24 HD11 LEU 493 HD11 LEU 493 20.563 1.314 1.537 25 HD12 LEU 493 HD12 LEU 493 18.973 1.047 0.786 26 HD13 LEU 493 HD13 LEU 493 19.390 2.654 1.426 27 HD21 LEU 493 HD21 LEU 493 20.103 -0.603 3.130 28 HD22 LEU 493 HD22 LEU 493 18.561 -0.623 4.033 29 HD23 LEU 493 HD23 LEU 493 18.562 -0.819 2.272 30 H GLN 494 H GLN 494 18.763 1.268 7.853 31 HA GLN 494 HA GLN 494 21.006 -0.591 7.932 32 HB2 GLN 494 HB2 GLN 494 20.932 -0.206 10.314 33 HB3 GLN 494 HB3 GLN 494 20.733 1.339 9.450 34 HG2 GLN 494 HG2 GLN 494 19.136 1.633 10.983 35 HG3 GLN 494 HG3 GLN 494 18.170 0.874 9.710 36 HE21 GLN 494 HE21 GLN 494 17.234 0.936 12.259 37 HE22 GLN 494 HE22 GLN 494 17.273 -0.680 12.958 38 H ALA 495 H ALA 495 17.528 -0.565 8.166 39 HA ALA 495 HA ALA 495 17.530 -3.534 8.188 40 HB1 ALA 495 HB1 ALA 495 15.594 -3.511 9.763 41 HB2 ALA 495 HB2 ALA 495 17.108 -2.935 10.495 42 HB3 ALA 495 HB3 ALA 495 15.861 -1.768 10.011 43 H LEU 496 H LEU 496 16.812 -0.801 6.516 44 HA LEU 496 HA LEU 496 14.142 -1.428 5.610 45 HB2 LEU 496 HB2 LEU 496 16.391 0.372 4.609 46 HB3 LEU 496 HB3 LEU 496 14.787 0.337 3.882 47 HG LEU 496 HG LEU 496 15.325 1.000 6.811 48 HD11 LEU 496 HD11 LEU 496 14.665 2.810 4.452 49 HD12 LEU 496 HD12 LEU 496 14.770 3.318 6.152 50 HD13 LEU 496 HD13 LEU 496 16.225 2.731 5.317 51 HD21 LEU 496 HD21 LEU 496 13.043 0.078 6.362 52 HD22 LEU 496 HD22 LEU 496 13.004 1.797 6.800 53 HD23 LEU 496 HD23 LEU 496 12.825 1.314 5.097 54 HA PRO 497 HA PRO 497 14.831 -4.431 2.530 55 HB2 PRO 497 HB2 PRO 497 13.590 -2.580 0.515 56 HB3 PRO 497 HB3 PRO 497 13.146 -4.273 0.897 57 HG2 PRO 497 HG2 PRO 497 11.619 -2.229 1.820 58 HG3 PRO 497 HG3 PRO 497 12.031 -3.600 2.905 59 HD2 PRO 497 HD2 PRO 497 13.346 -0.876 2.740 60 HD3 PRO 497 HD3 PRO 497 12.827 -1.779 4.189 61 H GLU 498 H GLU 498 16.077 -5.028 0.687 62 HA GLU 498 HA GLU 498 18.290 -3.229 0.106 63 HB2 GLU 498 HB2 GLU 498 19.174 -5.189 -1.111 64 HB3 GLU 498 HB3 GLU 498 18.649 -5.627 0.529 65 HG2 GLU 498 HG2 GLU 498 16.526 -6.526 -0.385 66 HG3 GLU 498 HG3 GLU 498 17.028 -6.085 -2.022 67 H GLY 499 H GLY 499 15.879 -2.213 -0.684 68 HA2 GLY 499 HA2 GLY 499 16.396 -1.501 -3.415 69 HA3 GLY 499 HA3 GLY 499 15.104 -2.720 -3.299 70 H VAL 500 H VAL 500 15.822 -0.220 -0.880 71 HA VAL 500 HA VAL 500 13.514 1.456 -1.680 72 HB VAL 500 HB VAL 500 13.826 -0.050 0.927 73 HG11 VAL 500 HG11 VAL 500 12.012 2.350 0.397 74 HG12 VAL 500 HG12 VAL 500 11.822 1.227 1.756 75 HG13 VAL 500 HG13 VAL 500 13.268 2.222 1.654 76 HG21 VAL 500 HG21 VAL 500 11.562 0.289 -1.090 77 HG22 VAL 500 HG22 VAL 500 12.542 -1.174 -0.834 78 HG23 VAL 500 HG23 VAL 500 11.437 -0.616 0.434 79 H ASP 501 H ASP 501 13.456 3.434 -0.248 80 HA ASP 501 HA ASP 501 16.129 4.354 0.695 81 HB2 ASP 501 HB2 ASP 501 14.445 5.359 -1.593 82 HB3 ASP 501 HB3 ASP 501 15.208 6.552 -0.553 83 H GLN 502 H GLN 502 16.015 5.951 2.212 84 HA GLN 502 HA GLN 502 13.611 5.816 3.835 85 HB2 GLN 502 HB2 GLN 502 15.072 7.506 5.219 86 HB3 GLN 502 HB3 GLN 502 15.421 5.787 5.200 87 HG2 GLN 502 HG2 GLN 502 16.819 7.806 3.395 88 HG3 GLN 502 HG3 GLN 502 17.402 7.276 4.982 89 HE21 GLN 502 HE21 GLN 502 16.326 4.447 4.407 90 HE22 GLN 502 HE22 GLN 502 17.607 3.750 3.436 91 H GLU 503 H GLU 503 15.009 8.146 1.530 92 HA GLU 503 HA GLU 503 13.319 10.297 2.410 93 HB2 GLU 503 HB2 GLU 503 14.045 11.455 0.441 94 HB3 GLU 503 HB3 GLU 503 15.440 10.552 1.069 95 HG2 GLU 503 HG2 GLU 503 14.728 8.684 -0.568 96 HG3 GLU 503 HG3 GLU 503 13.680 9.887 -1.319 97 H VAL 504 H VAL 504 12.374 7.400 1.321 98 HA VAL 504 HA VAL 504 9.833 8.516 0.295 99 HB VAL 504 HB VAL 504 9.641 6.698 -1.308 100 HG11 VAL 504 HG11 VAL 504 12.081 8.442 -1.811 101 HG12 VAL 504 HG12 VAL 504 11.065 7.662 -3.041 102 HG13 VAL 504 HG13 VAL 504 10.383 8.941 -2.022 103 HG21 VAL 504 HG21 VAL 504 12.601 6.216 -0.799 104 HG22 VAL 504 HG22 VAL 504 11.277 5.097 -0.374 105 HG23 VAL 504 HG23 VAL 504 11.624 5.457 -2.075 106 H PHE 505 H PHE 505 11.152 7.062 2.836 107 HA PHE 505 HA PHE 505 8.787 5.291 3.241 108 HB2 PHE 505 HB2 PHE 505 10.359 3.648 3.103 109 HB3 PHE 505 HB3 PHE 505 11.694 4.744 3.448 110 HD1 PHE 505 HD1 PHE 505 12.242 5.436 5.741 111 HD2 PHE 505 HD2 PHE 505 9.352 2.371 4.916 112 HE1 PHE 505 HE1 PHE 505 12.451 4.615 8.080 113 HE2 PHE 505 HE2 PHE 505 9.593 1.517 7.238 114 HZ PHE 505 HZ PHE 505 11.133 2.637 8.817 115 H LYS 506 H LYS 506 11.025 7.725 4.505 116 HA LYS 506 HA LYS 506 10.089 7.612 7.237 117 HB2 LYS 506 HB2 LYS 506 11.380 9.831 5.609 118 HB3 LYS 506 HB3 LYS 506 11.114 9.901 7.362 119 HG2 LYS 506 HG2 LYS 506 12.525 7.898 7.675 120 HG3 LYS 506 HG3 LYS 506 12.792 7.796 5.930 121 HD2 LYS 506 HD2 LYS 506 13.616 10.096 7.747 122 HD3 LYS 506 HD3 LYS 506 14.699 8.887 7.023 123 HE2 LYS 506 HE2 LYS 506 14.135 9.692 4.779 124 HE3 LYS 506 HE3 LYS 506 13.031 10.899 5.467 125 HZ1 LYS 506 HZ1 LYS 506 15.197 11.820 4.975 126 HZ2 LYS 506 HZ2 LYS 506 14.888 11.891 6.590 127 HZ3 LYS 506 HZ3 LYS 506 15.919 10.761 6.016 128 H GLN 507 H GLN 507 8.515 8.407 4.414 129 HA GLN 507 HA GLN 507 6.915 10.654 5.402 130 HB2 GLN 507 HB2 GLN 507 7.026 9.018 2.837 131 HB3 GLN 507 HB3 GLN 507 5.857 10.320 3.104 132 HG2 GLN 507 HG2 GLN 507 7.842 11.056 1.806 133 HG3 GLN 507 HG3 GLN 507 7.601 11.972 3.300 134 HE21 GLN 507 HE21 GLN 507 9.685 9.553 1.686 135 HE22 GLN 507 HE22 GLN 507 10.957 9.599 2.857 136 H LEU 508 H LEU 508 6.928 7.355 5.837 137 HA LEU 508 HA LEU 508 4.013 6.872 5.781 138 HB2 LEU 508 HB2 LEU 508 6.373 5.156 6.650 139 HB3 LEU 508 HB3 LEU 508 4.724 4.585 6.371 140 HG LEU 508 HG LEU 508 6.547 5.796 4.243 141 HD11 LEU 508 HD11 LEU 508 7.287 3.585 5.077 142 HD12 LEU 508 HD12 LEU 508 5.667 2.925 4.725 143 HD13 LEU 508 HD13 LEU 508 6.702 3.507 3.400 144 HD21 LEU 508 HD21 LEU 508 3.797 4.493 4.105 145 HD22 LEU 508 HD22 LEU 508 4.180 6.200 3.753 146 HD23 LEU 508 HD23 LEU 508 4.799 4.915 2.692 147 HA PRO 509 HA PRO 509 3.600 7.446 10.217 148 HB2 PRO 509 HB2 PRO 509 1.614 5.683 10.835 149 HB3 PRO 509 HB3 PRO 509 1.319 7.178 9.902 150 HG2 PRO 509 HG2 PRO 509 1.760 4.363 8.879 151 HG3 PRO 509 HG3 PRO 509 0.476 5.515 8.375 152 HD2 PRO 509 HD2 PRO 509 2.785 5.154 6.933 153 HD3 PRO 509 HD3 PRO 509 1.988 6.750 7.063 154 H ALA 510 H ALA 510 3.637 6.243 12.263 155 HA ALA 510 HA ALA 510 5.850 4.524 12.464 156 HB1 ALA 510 HB1 ALA 510 5.071 4.341 14.828 157 HB2 ALA 510 HB2 ALA 510 5.015 6.014 14.227 158 HB3 ALA 510 HB3 ALA 510 3.517 5.069 14.343 159 H ASP 511 H ASP 511 2.464 3.735 11.797 160 HA ASP 511 HA ASP 511 2.898 0.926 12.587 161 HB2 ASP 511 HB2 ASP 511 0.550 0.628 12.162 162 HB3 ASP 511 HB3 ASP 511 0.752 2.100 13.114 163 H ILE 512 H ILE 512 3.609 2.775 9.857 164 HA ILE 512 HA ILE 512 3.614 0.223 8.303 165 HB ILE 512 HB ILE 512 3.665 3.045 7.212 166 HG12 ILE 512 HG12 ILE 512 1.444 0.957 7.344 167 HG13 ILE 512 HG13 ILE 512 1.497 2.502 8.210 168 HG21 ILE 512 HG21 ILE 512 3.347 0.346 5.814 169 HG22 ILE 512 HG22 ILE 512 3.345 1.944 5.032 170 HG23 ILE 512 HG23 ILE 512 4.824 1.340 5.780 171 HD11 ILE 512 HD11 ILE 512 0.047 2.761 6.329 172 HD12 ILE 512 HD12 ILE 512 1.526 3.692 6.003 173 HD13 ILE 512 HD13 ILE 512 1.263 2.126 5.202 174 H GLN 513 H GLN 513 5.580 2.624 9.920 175 HA GLN 513 HA GLN 513 8.055 2.223 8.642 176 HB2 GLN 513 HB2 GLN 513 7.049 3.020 11.295 177 HB3 GLN 513 HB3 GLN 513 8.525 2.047 11.418 178 HG2 GLN 513 HG2 GLN 513 9.050 4.420 11.351 179 HG3 GLN 513 HG3 GLN 513 9.739 3.542 9.985 180 HE21 GLN 513 HE21 GLN 513 9.208 4.138 7.899 181 HE22 GLN 513 HE22 GLN 513 8.090 5.414 7.507 182 H GLU 514 H GLU 514 6.224 0.179 10.910 183 HA GLU 514 HA GLU 514 8.296 -1.812 11.162 184 HB2 GLU 514 HB2 GLU 514 6.600 -3.043 12.432 185 HB3 GLU 514 HB3 GLU 514 6.644 -1.347 12.936 186 HG2 GLU 514 HG2 GLU 514 4.671 -0.860 11.536 187 HG3 GLU 514 HG3 GLU 514 4.626 -2.542 10.990 188 H GLU 515 H GLU 515 6.172 -1.138 8.567 189 HA GLU 515 HA GLU 515 5.842 -4.002 7.859 190 HB2 GLU 515 HB2 GLU 515 4.896 -1.427 6.534 191 HB3 GLU 515 HB3 GLU 515 4.573 -3.061 5.933 192 HG2 GLU 515 HG2 GLU 515 3.719 -2.021 8.667 193 HG3 GLU 515 HG3 GLU 515 2.688 -2.034 7.235 194 H ILE 516 H ILE 516 7.889 -1.248 7.140 195 HA ILE 516 HA ILE 516 8.869 -2.583 4.653 196 HB ILE 516 HB ILE 516 8.945 0.265 5.680 197 HG12 ILE 516 HG12 ILE 516 7.914 0.850 3.624 198 HG13 ILE 516 HG13 ILE 516 8.149 -0.765 2.931 199 HG21 ILE 516 HG21 ILE 516 10.506 -0.923 3.353 200 HG22 ILE 516 HG22 ILE 516 10.336 0.812 3.691 201 HG23 ILE 516 HG23 ILE 516 11.204 -0.229 4.835 202 HD11 ILE 516 HD11 ILE 516 6.346 -0.160 5.302 203 HD12 ILE 516 HD12 ILE 516 5.794 -0.241 3.616 204 HD13 ILE 516 HD13 ILE 516 6.454 -1.693 4.382 205 H LEU 517 H LEU 517 9.817 -1.446 7.917 206 HA LEU 517 HA LEU 517 12.593 -2.167 7.653 207 HB2 LEU 517 HB2 LEU 517 10.669 -1.874 9.982 208 HB3 LEU 517 HB3 LEU 517 12.352 -2.362 10.216 209 HG LEU 517 HG LEU 517 11.560 0.167 8.710 210 HD11 LEU 517 HD11 LEU 517 10.731 0.229 11.054 211 HD12 LEU 517 HD12 LEU 517 12.379 -0.128 11.628 212 HD13 LEU 517 HD13 LEU 517 12.043 1.397 10.771 213 HD21 LEU 517 HD21 LEU 517 14.171 -0.607 10.104 214 HD22 LEU 517 HD22 LEU 517 13.906 -0.727 8.350 215 HD23 LEU 517 HD23 LEU 517 13.882 0.853 9.154 216 H SER 518 H SER 518 9.931 -4.048 7.235 217 HA SER 518 HA SER 518 11.504 -6.512 7.841 218 HB2 SER 518 HB2 SER 518 8.496 -6.140 8.051 219 HB3 SER 518 HB3 SER 518 9.366 -7.671 8.250 220 HG SER 518 HG SER 518 8.903 -6.604 10.254 221 H GLY 519 H GLY 519 10.674 -4.573 5.396 222 HA2 GLY 519 HA2 GLY 519 9.247 -6.427 3.666 223 HA3 GLY 519 HA3 GLY 519 9.904 -4.844 3.224 224 H LYS 520 H LYS 520 10.086 -7.761 2.112 225 HA LYS 520 HA LYS 520 12.978 -7.606 1.538 226 HB2 LYS 520 HB2 LYS 520 13.147 -9.979 1.795 227 HB3 LYS 520 HB3 LYS 520 12.559 -9.274 3.320 228 HG2 LYS 520 HG2 LYS 520 10.655 -10.455 1.260 229 HG3 LYS 520 HG3 LYS 520 11.515 -11.497 2.385 230 HD2 LYS 520 HD2 LYS 520 9.690 -9.208 3.243 231 HD3 LYS 520 HD3 LYS 520 9.219 -10.910 3.150 232 HE2 LYS 520 HE2 LYS 520 11.496 -9.857 4.874 233 HE3 LYS 520 HE3 LYS 520 9.848 -10.164 5.448 234 HZ1 LYS 520 HZ1 LYS 520 10.110 -12.451 4.777 235 HZ2 LYS 520 HZ2 LYS 520 11.662 -12.180 4.303 236 HZ3 LYS 520 HZ3 LYS 520 11.250 -12.031 5.885 237 H SER 521 H SER 521 9.953 -7.469 0.239 238 HA SER 521 HA SER 521 10.899 -8.135 -2.425 239 HB2 SER 521 HB2 SER 521 10.309 -10.382 -1.395 240 HB3 SER 521 HB3 SER 521 8.643 -9.801 -1.246 241 HG SER 521 HG SER 521 10.178 -10.151 -3.611 242 H ARG 522 H ARG 522 8.827 -8.154 -3.900 243 HA ARG 522 HA ARG 522 7.242 -6.956 -4.921 244 HB2 ARG 522 HB2 ARG 522 6.088 -7.927 -2.743 245 HB3 ARG 522 HB3 ARG 522 6.001 -6.222 -2.284 246 HG2 ARG 522 HG2 ARG 522 4.010 -6.389 -3.417 247 HG3 ARG 522 HG3 ARG 522 5.059 -5.999 -4.794 248 HD2 ARG 522 HD2 ARG 522 4.212 -8.784 -3.888 249 HD3 ARG 522 HD3 ARG 522 3.530 -7.894 -5.255 250 HE ARG 522 HE ARG 522 6.442 -8.544 -5.206 251 HH11 ARG 522 HH11 ARG 522 3.253 -9.002 -6.675 252 HH12 ARG 522 HH12 ARG 522 3.902 -9.765 -8.106 253 HH21 ARG 522 HH21 ARG 522 7.250 -9.547 -7.081 254 HH22 ARG 522 HH22 ARG 522 6.143 -10.082 -8.324 255 H GLU 523 H GLU 523 9.672 -5.453 -3.667 256 HA GLU 523 HA GLU 523 8.747 -2.812 -4.577 257 HB2 GLU 523 HB2 GLU 523 9.467 -1.673 -2.548 258 HB3 GLU 523 HB3 GLU 523 8.198 -2.855 -2.167 259 HG2 GLU 523 HG2 GLU 523 10.166 -4.487 -1.648 260 HG3 GLU 523 HG3 GLU 523 11.169 -3.032 -1.592 261 H ASN 524 H ASN 524 10.470 -1.438 -5.243 262 HA ASN 524 HA ASN 524 13.211 -2.428 -5.033 263 HB2 ASN 524 HB2 ASN 524 12.773 -2.017 -7.816 264 HB3 ASN 524 HB3 ASN 524 13.150 -3.567 -7.053 265 HD21 ASN 524 HD21 ASN 524 11.173 -4.905 -6.417 266 HD22 ASN 524 HD22 ASN 524 9.660 -4.634 -7.266 267 H LEU 525 H LEU 525 11.412 -0.002 -4.732 268 HA LEU 525 HA LEU 525 11.507 2.249 -5.032 269 HB2 LEU 525 HB2 LEU 525 13.421 3.188 -4.463 270 HB3 LEU 525 HB3 LEU 525 13.876 1.538 -4.134 271 HG LEU 525 HG LEU 525 14.546 1.909 -6.872 272 HD11 LEU 525 HD11 LEU 525 14.110 4.346 -6.374 273 HD12 LEU 525 HD12 LEU 525 15.423 4.285 -5.189 274 HD13 LEU 525 HD13 LEU 525 15.772 3.986 -6.919 275 HD21 LEU 525 HD21 LEU 525 15.820 0.627 -5.211 276 HD22 LEU 525 HD22 LEU 525 16.857 1.822 -6.028 277 HD23 LEU 525 HD23 LEU 525 16.265 2.137 -4.374 278 H LYS 526 H LYS 526 11.254 0.295 -7.387 279 HA LYS 526 HA LYS 526 11.662 2.257 -9.591 280 HB2 LYS 526 HB2 LYS 526 12.049 -0.736 -9.364 281 HB3 LYS 526 HB3 LYS 526 11.939 0.063 -10.957 282 HG2 LYS 526 HG2 LYS 526 13.910 1.429 -10.407 283 HG3 LYS 526 HG3 LYS 526 14.020 0.668 -8.803 284 HD2 LYS 526 HD2 LYS 526 14.174 -0.794 -11.466 285 HD3 LYS 526 HD3 LYS 526 15.575 -0.343 -10.470 286 HE2 LYS 526 HE2 LYS 526 14.661 -1.782 -8.618 287 HE3 LYS 526 HE3 LYS 526 13.330 -2.256 -9.667 288 HZ1 LYS 526 HZ1 LYS 526 16.180 -2.736 -10.215 289 HZ2 LYS 526 HZ2 LYS 526 15.082 -3.863 -9.721 290 HZ3 LYS 526 HZ3 LYS 526 14.935 -3.169 -11.200 291 H1 MET 1 H1 MET 1 -13.116 11.214 -14.083 292 H2 MET 1 H2 MET 1 -14.491 11.908 -13.502 293 H3 MET 1 H3 MET 1 -14.251 10.290 -13.333 294 HA MET 1 HA MET 1 -12.624 12.390 -12.063 295 HB2 MET 1 HB2 MET 1 -14.794 12.322 -11.004 296 HB3 MET 1 HB3 MET 1 -14.800 10.548 -10.989 297 HG2 MET 1 HG2 MET 1 -12.942 10.495 -9.426 298 HG3 MET 1 HG3 MET 1 -12.785 12.258 -9.491 299 HE1 MET 1 HE1 MET 1 -12.782 12.444 -6.892 300 HE2 MET 1 HE2 MET 1 -13.999 11.682 -5.843 301 HE3 MET 1 HE3 MET 1 -12.886 10.674 -6.795 302 H GLN 2 H GLN 2 -10.767 11.776 -11.146 303 HA GLN 2 HA GLN 2 -10.282 8.987 -10.488 304 HB2 GLN 2 HB2 GLN 2 -8.399 8.683 -11.999 305 HB3 GLN 2 HB3 GLN 2 -9.786 9.223 -12.972 306 HG2 GLN 2 HG2 GLN 2 -8.782 11.624 -12.455 307 HG3 GLN 2 HG3 GLN 2 -7.317 10.746 -12.096 308 HE21 GLN 2 HE21 GLN 2 -6.192 11.702 -13.878 309 HE22 GLN 2 HE22 GLN 2 -6.549 11.272 -15.535 310 H ILE 3 H ILE 3 -7.898 8.826 -9.715 311 HA ILE 3 HA ILE 3 -6.932 11.356 -8.509 312 HB ILE 3 HB ILE 3 -6.707 10.466 -6.339 313 HG12 ILE 3 HG12 ILE 3 -7.183 7.776 -7.606 314 HG13 ILE 3 HG13 ILE 3 -5.963 8.314 -6.465 315 HG21 ILE 3 HG21 ILE 3 -9.461 9.683 -7.337 316 HG22 ILE 3 HG22 ILE 3 -9.015 10.134 -5.673 317 HG23 ILE 3 HG23 ILE 3 -8.909 11.338 -6.957 318 HD11 ILE 3 HD11 ILE 3 -7.709 8.437 -4.676 319 HD12 ILE 3 HD12 ILE 3 -8.893 7.792 -5.843 320 HD13 ILE 3 HD13 ILE 3 -7.504 6.809 -5.351 321 H PHE 4 H PHE 4 -4.756 10.573 -7.197 322 HA PHE 4 HA PHE 4 -3.183 8.875 -9.074 323 HB2 PHE 4 HB2 PHE 4 -2.385 11.629 -8.056 324 HB3 PHE 4 HB3 PHE 4 -1.421 10.615 -9.057 325 HD1 PHE 4 HD1 PHE 4 -2.275 9.843 -11.327 326 HD2 PHE 4 HD2 PHE 4 -3.918 13.186 -9.170 327 HE1 PHE 4 HE1 PHE 4 -3.063 10.792 -13.437 328 HE2 PHE 4 HE2 PHE 4 -4.723 14.153 -11.306 329 HZ PHE 4 HZ PHE 4 -4.302 12.971 -13.447 330 H VAL 5 H VAL 5 -2.857 7.219 -7.662 331 HA VAL 5 HA VAL 5 -2.072 7.861 -4.891 332 HB VAL 5 HB VAL 5 -2.552 5.632 -4.349 333 HG11 VAL 5 HG11 VAL 5 -4.619 6.532 -6.425 334 HG12 VAL 5 HG12 VAL 5 -4.876 5.347 -5.132 335 HG13 VAL 5 HG13 VAL 5 -4.541 7.035 -4.726 336 HG21 VAL 5 HG21 VAL 5 -1.519 4.350 -6.085 337 HG22 VAL 5 HG22 VAL 5 -3.226 3.911 -6.019 338 HG23 VAL 5 HG23 VAL 5 -2.648 4.990 -7.315 339 H LYS 6 H LYS 6 0.050 8.042 -4.369 340 HA LYS 6 HA LYS 6 2.021 7.013 -6.312 341 HB2 LYS 6 HB2 LYS 6 2.036 9.386 -5.473 342 HB3 LYS 6 HB3 LYS 6 2.498 8.770 -3.877 343 HG2 LYS 6 HG2 LYS 6 4.555 7.822 -4.787 344 HG3 LYS 6 HG3 LYS 6 4.027 8.155 -6.444 345 HD2 LYS 6 HD2 LYS 6 5.643 9.839 -5.803 346 HD3 LYS 6 HD3 LYS 6 4.041 10.588 -5.962 347 HE2 LYS 6 HE2 LYS 6 3.744 10.452 -3.506 348 HE3 LYS 6 HE3 LYS 6 5.345 9.684 -3.366 349 HZ1 LYS 6 HZ1 LYS 6 6.308 11.684 -4.275 350 HZ2 LYS 6 HZ2 LYS 6 4.830 12.394 -4.398 351 HZ3 LYS 6 HZ3 LYS 6 5.453 12.037 -2.919 352 H THR 7 H THR 7 3.409 5.405 -5.949 353 HA THR 7 HA THR 7 2.809 3.533 -3.841 354 HB THR 7 HB THR 7 4.564 2.187 -4.979 355 HG1 THR 7 HG1 THR 7 5.663 3.106 -6.680 356 HG21 THR 7 HG21 THR 7 2.266 2.191 -5.916 357 HG22 THR 7 HG22 THR 7 2.687 3.579 -6.943 358 HG23 THR 7 HG23 THR 7 3.494 2.015 -7.183 359 H LEU 8 H LEU 8 4.753 2.362 -2.851 360 HA LEU 8 HA LEU 8 6.187 4.011 -1.052 361 HB2 LEU 8 HB2 LEU 8 5.415 1.639 -0.824 362 HB3 LEU 8 HB3 LEU 8 6.665 1.131 -1.948 363 HG LEU 8 HG LEU 8 6.914 0.871 0.643 364 HD11 LEU 8 HD11 LEU 8 9.294 1.925 -0.923 365 HD12 LEU 8 HD12 LEU 8 9.307 0.890 0.509 366 HD13 LEU 8 HD13 LEU 8 8.642 0.269 -1.017 367 HD21 LEU 8 HD21 LEU 8 7.993 3.695 0.321 368 HD22 LEU 8 HD22 LEU 8 6.491 3.249 1.175 369 HD23 LEU 8 HD23 LEU 8 8.072 2.684 1.772 370 H THR 9 H THR 9 6.659 3.689 -4.372 371 HA THR 9 HA THR 9 9.617 3.936 -4.140 372 HB THR 9 HB THR 9 9.759 2.918 -6.342 373 HG1 THR 9 HG1 THR 9 7.814 3.593 -7.221 374 HG21 THR 9 HG21 THR 9 9.041 0.657 -5.773 375 HG22 THR 9 HG22 THR 9 9.624 1.445 -4.289 376 HG23 THR 9 HG23 THR 9 7.882 1.284 -4.579 377 H GLY 10 H GLY 10 6.954 5.831 -4.557 378 HA2 GLY 10 HA2 GLY 10 6.923 8.051 -5.131 379 HA3 GLY 10 HA3 GLY 10 8.581 7.933 -5.737 380 H LYS 11 H LYS 11 5.994 5.774 -6.832 381 HA LYS 11 HA LYS 11 5.774 7.286 -9.403 382 HB2 LYS 11 HB2 LYS 11 7.147 5.232 -9.484 383 HB3 LYS 11 HB3 LYS 11 5.793 4.272 -8.890 384 HG2 LYS 11 HG2 LYS 11 5.364 5.971 -11.347 385 HG3 LYS 11 HG3 LYS 11 6.323 4.481 -11.485 386 HD2 LYS 11 HD2 LYS 11 4.465 3.139 -10.604 387 HD3 LYS 11 HD3 LYS 11 3.491 4.591 -10.345 388 HE2 LYS 11 HE2 LYS 11 2.796 3.534 -12.410 389 HE3 LYS 11 HE3 LYS 11 3.572 5.074 -12.787 390 HZ1 LYS 11 HZ1 LYS 11 5.573 3.862 -13.329 391 HZ2 LYS 11 HZ2 LYS 11 4.858 2.427 -12.957 392 HZ3 LYS 11 HZ3 LYS 11 4.315 3.307 -14.230 393 H THR 12 H THR 12 3.659 7.246 -10.386 394 HA THR 12 HA THR 12 1.588 6.668 -8.311 395 HB THR 12 HB THR 12 1.729 9.114 -10.127 396 HG1 THR 12 HG1 THR 12 2.208 10.132 -8.189 397 HG21 THR 12 HG21 THR 12 0.052 9.753 -8.214 398 HG22 THR 12 HG22 THR 12 -0.504 8.906 -9.705 399 HG23 THR 12 HG23 THR 12 -0.260 8.007 -8.190 400 H ILE 13 H ILE 13 -0.530 6.259 -9.015 401 HA ILE 13 HA ILE 13 -0.749 5.276 -11.823 402 HB ILE 13 HB ILE 13 -1.769 3.883 -9.312 403 HG12 ILE 13 HG12 ILE 13 0.626 3.179 -11.070 404 HG13 ILE 13 HG13 ILE 13 0.697 3.792 -9.414 405 HG21 ILE 13 HG21 ILE 13 -3.115 3.531 -11.376 406 HG22 ILE 13 HG22 ILE 13 -1.650 2.966 -12.215 407 HG23 ILE 13 HG23 ILE 13 -2.325 2.045 -10.851 408 HD11 ILE 13 HD11 ILE 13 1.002 1.396 -9.367 409 HD12 ILE 13 HD12 ILE 13 -0.567 1.788 -8.629 410 HD13 ILE 13 HD13 ILE 13 -0.489 1.128 -10.286 411 H THR 14 H THR 14 -2.592 5.902 -12.837 412 HA THR 14 HA THR 14 -4.347 7.756 -11.412 413 HB THR 14 HB THR 14 -4.566 6.767 -14.279 414 HG1 THR 14 HG1 THR 14 -3.229 8.530 -14.770 415 HG21 THR 14 HG21 THR 14 -6.458 8.082 -13.378 416 HG22 THR 14 HG22 THR 14 -5.322 9.357 -12.862 417 HG23 THR 14 HG23 THR 14 -5.556 9.006 -14.596 418 H LEU 15 H LEU 15 -6.487 7.314 -10.808 419 HA LEU 15 HA LEU 15 -7.602 4.635 -11.459 420 HB2 LEU 15 HB2 LEU 15 -7.160 5.729 -8.651 421 HB3 LEU 15 HB3 LEU 15 -7.985 4.222 -9.054 422 HG LEU 15 HG LEU 15 -5.072 4.807 -9.716 423 HD11 LEU 15 HD11 LEU 15 -6.275 3.159 -7.448 424 HD12 LEU 15 HD12 LEU 15 -4.539 3.387 -7.796 425 HD13 LEU 15 HD13 LEU 15 -5.538 4.766 -7.268 426 HD21 LEU 15 HD21 LEU 15 -6.603 2.177 -9.639 427 HD22 LEU 15 HD22 LEU 15 -6.125 3.037 -11.121 428 HD23 LEU 15 HD23 LEU 15 -4.882 2.396 -10.015 429 H GLU 16 H GLU 16 -9.734 4.682 -11.654 430 HA GLU 16 HA GLU 16 -11.164 7.232 -11.190 431 HB2 GLU 16 HB2 GLU 16 -11.418 6.256 -13.375 432 HB3 GLU 16 HB3 GLU 16 -11.739 4.650 -12.692 433 HG2 GLU 16 HG2 GLU 16 -13.838 5.401 -11.746 434 HG3 GLU 16 HG3 GLU 16 -13.542 7.062 -12.283 435 H VAL 17 H VAL 17 -12.481 7.558 -9.595 436 HA VAL 17 HA VAL 17 -13.789 5.339 -8.151 437 HB VAL 17 HB VAL 17 -13.054 6.225 -5.969 438 HG11 VAL 17 HG11 VAL 17 -11.782 4.358 -6.990 439 HG12 VAL 17 HG12 VAL 17 -10.676 5.537 -7.738 440 HG13 VAL 17 HG13 VAL 17 -10.760 5.394 -5.973 441 HG21 VAL 17 HG21 VAL 17 -11.171 7.982 -7.593 442 HG22 VAL 17 HG22 VAL 17 -12.566 8.550 -6.641 443 HG23 VAL 17 HG23 VAL 17 -11.176 7.813 -5.825 444 H GLU 18 H GLU 18 -15.131 6.476 -6.275 445 HA GLU 18 HA GLU 18 -16.167 9.130 -7.091 446 HB2 GLU 18 HB2 GLU 18 -17.941 6.729 -6.466 447 HB3 GLU 18 HB3 GLU 18 -18.480 8.362 -6.893 448 HG2 GLU 18 HG2 GLU 18 -17.320 8.083 -9.117 449 HG3 GLU 18 HG3 GLU 18 -17.001 6.398 -8.645 450 HA PRO 19 HA PRO 19 -16.228 9.877 -2.754 451 HB2 PRO 19 HB2 PRO 19 -19.123 10.630 -2.880 452 HB3 PRO 19 HB3 PRO 19 -17.738 11.573 -2.262 453 HG2 PRO 19 HG2 PRO 19 -18.848 12.160 -4.679 454 HG3 PRO 19 HG3 PRO 19 -17.077 12.236 -4.418 455 HD2 PRO 19 HD2 PRO 19 -18.675 10.047 -5.740 456 HD3 PRO 19 HD3 PRO 19 -17.093 10.756 -6.211 457 H SER 20 H SER 20 -17.947 7.281 -4.056 458 HA SER 20 HA SER 20 -18.778 6.360 -1.350 459 HB2 SER 20 HB2 SER 20 -20.236 6.024 -3.995 460 HB3 SER 20 HB3 SER 20 -20.674 5.240 -2.461 461 HG SER 20 HG SER 20 -21.850 7.186 -2.855 462 H ASP 21 H ASP 21 -16.863 5.870 -4.119 463 HA ASP 21 HA ASP 21 -16.628 2.952 -3.865 464 HB2 ASP 21 HB2 ASP 21 -14.954 5.069 -5.217 465 HB3 ASP 21 HB3 ASP 21 -14.639 3.335 -5.324 466 H THR 22 H THR 22 -16.488 3.284 -1.536 467 HA THR 22 HA THR 22 -14.345 4.640 -0.239 468 HB THR 22 HB THR 22 -16.393 4.106 0.898 469 HG1 THR 22 HG1 THR 22 -15.412 3.408 2.776 470 HG21 THR 22 HG21 THR 22 -16.893 1.884 1.718 471 HG22 THR 22 HG22 THR 22 -16.951 1.942 -0.054 472 HG23 THR 22 HG23 THR 22 -15.535 1.208 0.767 473 H ILE 23 H ILE 23 -12.945 3.167 1.412 474 HA ILE 23 HA ILE 23 -10.773 2.560 -0.196 475 HB ILE 23 HB ILE 23 -11.190 1.466 2.594 476 HG12 ILE 23 HG12 ILE 23 -11.912 3.766 2.705 477 HG13 ILE 23 HG13 ILE 23 -10.290 3.652 3.385 478 HG21 ILE 23 HG21 ILE 23 -8.759 1.923 2.771 479 HG22 ILE 23 HG22 ILE 23 -9.137 0.763 1.479 480 HG23 ILE 23 HG23 ILE 23 -8.742 2.450 1.070 481 HD11 ILE 23 HD11 ILE 23 -9.333 4.595 1.339 482 HD12 ILE 23 HD12 ILE 23 -10.928 4.582 0.545 483 HD13 ILE 23 HD13 ILE 23 -10.644 5.643 1.935 484 H GLU 24 H GLU 24 -13.274 0.231 0.931 485 HA GLU 24 HA GLU 24 -11.672 -2.055 0.169 486 HB2 GLU 24 HB2 GLU 24 -13.630 -3.359 0.531 487 HB3 GLU 24 HB3 GLU 24 -13.612 -2.094 1.778 488 HG2 GLU 24 HG2 GLU 24 -15.237 -0.778 0.407 489 HG3 GLU 24 HG3 GLU 24 -15.255 -2.080 -0.792 490 H ASN 25 H ASN 25 -13.651 0.207 -1.614 491 HA ASN 25 HA ASN 25 -13.898 -1.469 -3.975 492 HB2 ASN 25 HB2 ASN 25 -14.327 1.496 -3.521 493 HB3 ASN 25 HB3 ASN 25 -14.676 0.675 -5.028 494 HD21 ASN 25 HD21 ASN 25 -15.683 1.290 -1.861 495 HD22 ASN 25 HD22 ASN 25 -17.185 0.344 -1.852 496 H VAL 26 H VAL 26 -11.875 1.198 -2.738 497 HA VAL 26 HA VAL 26 -10.421 1.873 -5.103 498 HB VAL 26 HB VAL 26 -9.728 2.040 -2.138 499 HG11 VAL 26 HG11 VAL 26 -7.697 2.156 -3.413 500 HG12 VAL 26 HG12 VAL 26 -8.417 3.315 -4.561 501 HG13 VAL 26 HG13 VAL 26 -8.110 3.798 -2.872 502 HG21 VAL 26 HG21 VAL 26 -11.749 3.284 -2.714 503 HG22 VAL 26 HG22 VAL 26 -10.415 4.402 -2.375 504 HG23 VAL 26 HG23 VAL 26 -10.905 4.084 -4.061 505 H LYS 27 H LYS 27 -9.785 -0.423 -2.421 506 HA LYS 27 HA LYS 27 -7.243 -1.265 -3.233 507 HB2 LYS 27 HB2 LYS 27 -9.562 -2.614 -1.821 508 HB3 LYS 27 HB3 LYS 27 -7.985 -3.405 -2.071 509 HG2 LYS 27 HG2 LYS 27 -6.821 -1.721 -0.826 510 HG3 LYS 27 HG3 LYS 27 -8.255 -0.683 -0.736 511 HD2 LYS 27 HD2 LYS 27 -9.423 -2.360 0.633 512 HD3 LYS 27 HD3 LYS 27 -8.042 -3.472 0.482 513 HE2 LYS 27 HE2 LYS 27 -6.588 -1.818 1.582 514 HE3 LYS 27 HE3 LYS 27 -7.951 -0.707 1.755 515 HZ1 LYS 27 HZ1 LYS 27 -7.601 -1.968 3.760 516 HZ2 LYS 27 HZ2 LYS 27 -9.059 -2.336 3.107 517 HZ3 LYS 27 HZ3 LYS 27 -7.805 -3.389 2.959 518 H ALA 28 H ALA 28 -10.417 -1.991 -4.690 519 HA ALA 28 HA ALA 28 -9.330 -4.186 -6.282 520 HB1 ALA 28 HB1 ALA 28 -11.724 -4.104 -5.614 521 HB2 ALA 28 HB2 ALA 28 -11.928 -2.637 -6.604 522 HB3 ALA 28 HB3 ALA 28 -11.504 -4.168 -7.379 523 H LYS 29 H LYS 29 -9.694 -0.668 -6.591 524 HA LYS 29 HA LYS 29 -9.327 -0.523 -9.443 525 HB2 LYS 29 HB2 LYS 29 -8.939 1.414 -7.137 526 HB3 LYS 29 HB3 LYS 29 -8.396 1.823 -8.759 527 HG2 LYS 29 HG2 LYS 29 -10.547 2.759 -8.394 528 HG3 LYS 29 HG3 LYS 29 -10.681 1.504 -9.641 529 HD2 LYS 29 HD2 LYS 29 -11.701 -0.038 -8.099 530 HD3 LYS 29 HD3 LYS 29 -11.252 0.991 -6.717 531 HE2 LYS 29 HE2 LYS 29 -13.641 1.166 -7.242 532 HE3 LYS 29 HE3 LYS 29 -12.806 2.714 -7.408 533 HZ1 LYS 29 HZ1 LYS 29 -12.765 2.427 -9.754 534 HZ2 LYS 29 HZ2 LYS 29 -13.466 0.936 -9.657 535 HZ3 LYS 29 HZ3 LYS 29 -14.311 2.279 -9.232 536 H ILE 30 H ILE 30 -7.130 -0.834 -6.669 537 HA ILE 30 HA ILE 30 -4.764 -0.318 -8.340 538 HB ILE 30 HB ILE 30 -5.170 -1.077 -5.422 539 HG12 ILE 30 HG12 ILE 30 -4.357 1.548 -6.734 540 HG13 ILE 30 HG13 ILE 30 -6.009 1.175 -6.202 541 HG21 ILE 30 HG21 ILE 30 -2.622 -0.226 -6.885 542 HG22 ILE 30 HG22 ILE 30 -2.772 -0.472 -5.130 543 HG23 ILE 30 HG23 ILE 30 -2.945 -1.843 -6.224 544 HD11 ILE 30 HD11 ILE 30 -5.226 0.932 -3.878 545 HD12 ILE 30 HD12 ILE 30 -3.577 1.360 -4.400 546 HD13 ILE 30 HD13 ILE 30 -4.895 2.544 -4.544 547 H GLN 31 H GLN 31 -6.578 -3.041 -6.927 548 HA GLN 31 HA GLN 31 -4.664 -5.080 -7.528 549 HB2 GLN 31 HB2 GLN 31 -6.549 -5.516 -6.038 550 HB3 GLN 31 HB3 GLN 31 -7.703 -5.048 -7.300 551 HG2 GLN 31 HG2 GLN 31 -7.050 -6.915 -8.700 552 HG3 GLN 31 HG3 GLN 31 -5.734 -7.340 -7.615 553 HE21 GLN 31 HE21 GLN 31 -6.368 -9.378 -6.908 554 HE22 GLN 31 HE22 GLN 31 -7.870 -9.687 -6.053 555 H ASP 32 H ASP 32 -7.220 -3.434 -9.410 556 HA ASP 32 HA ASP 32 -7.212 -5.304 -11.560 557 HB2 ASP 32 HB2 ASP 32 -9.042 -3.734 -11.060 558 HB3 ASP 32 HB3 ASP 32 -7.972 -2.369 -11.290 559 H LYS 33 H LYS 33 -5.376 -2.442 -10.775 560 HA LYS 33 HA LYS 33 -4.248 -2.055 -13.427 561 HB2 LYS 33 HB2 LYS 33 -3.946 -0.854 -10.667 562 HB3 LYS 33 HB3 LYS 33 -2.896 -0.328 -12.000 563 HG2 LYS 33 HG2 LYS 33 -5.936 -0.347 -12.205 564 HG3 LYS 33 HG3 LYS 33 -5.017 1.047 -11.595 565 HD2 LYS 33 HD2 LYS 33 -3.718 1.131 -13.690 566 HD3 LYS 33 HD3 LYS 33 -4.690 -0.200 -14.355 567 HE2 LYS 33 HE2 LYS 33 -5.813 2.459 -13.364 568 HE3 LYS 33 HE3 LYS 33 -5.445 2.104 -15.055 569 HZ1 LYS 33 HZ1 LYS 33 -7.374 0.622 -13.390 570 HZ2 LYS 33 HZ2 LYS 33 -7.753 1.723 -14.556 571 HZ3 LYS 33 HZ3 LYS 33 -7.036 0.299 -14.958 572 H GLU 34 H GLU 34 -3.242 -3.790 -10.506 573 HA GLU 34 HA GLU 34 -0.664 -4.364 -11.907 574 HB2 GLU 34 HB2 GLU 34 -1.096 -3.657 -8.984 575 HB3 GLU 34 HB3 GLU 34 0.411 -4.319 -9.611 576 HG2 GLU 34 HG2 GLU 34 -0.872 -1.719 -10.558 577 HG3 GLU 34 HG3 GLU 34 0.447 -1.844 -9.391 578 H GLY 35 H GLY 35 -3.174 -5.507 -9.640 579 HA2 GLY 35 HA2 GLY 35 -3.900 -7.798 -9.844 580 HA3 GLY 35 HA3 GLY 35 -2.226 -8.299 -10.144 581 H ILE 36 H ILE 36 -2.506 -5.831 -7.816 582 HA ILE 36 HA ILE 36 -1.421 -7.564 -5.752 583 HB ILE 36 HB ILE 36 -2.154 -4.610 -5.861 584 HG12 ILE 36 HG12 ILE 36 0.573 -5.972 -5.944 585 HG13 ILE 36 HG13 ILE 36 -0.313 -5.479 -7.392 586 HG21 ILE 36 HG21 ILE 36 -0.524 -6.126 -3.790 587 HG22 ILE 36 HG22 ILE 36 -0.828 -4.369 -3.810 588 HG23 ILE 36 HG23 ILE 36 -2.170 -5.494 -3.542 589 HD11 ILE 36 HD11 ILE 36 -0.326 -3.127 -6.586 590 HD12 ILE 36 HD12 ILE 36 0.616 -3.622 -5.162 591 HD13 ILE 36 HD13 ILE 36 1.327 -3.760 -6.780 592 HA PRO 37 HA PRO 37 -5.474 -8.488 -4.204 593 HB2 PRO 37 HB2 PRO 37 -4.747 -9.603 -1.763 594 HB3 PRO 37 HB3 PRO 37 -4.675 -10.459 -3.332 595 HG2 PRO 37 HG2 PRO 37 -2.460 -9.082 -1.819 596 HG3 PRO 37 HG3 PRO 37 -2.403 -10.647 -2.695 597 HD2 PRO 37 HD2 PRO 37 -1.440 -8.300 -3.739 598 HD3 PRO 37 HD3 PRO 37 -2.184 -9.551 -4.779 599 HA PRO 38 HA PRO 38 -6.498 -5.075 -1.672 600 HB2 PRO 38 HB2 PRO 38 -8.809 -5.931 -0.446 601 HB3 PRO 38 HB3 PRO 38 -8.699 -5.535 -2.190 602 HG2 PRO 38 HG2 PRO 38 -8.537 -8.267 -0.880 603 HG3 PRO 38 HG3 PRO 38 -9.506 -7.778 -2.311 604 HD2 PRO 38 HD2 PRO 38 -7.094 -9.016 -2.559 605 HD3 PRO 38 HD3 PRO 38 -7.607 -7.733 -3.697 606 H ASP 39 H ASP 39 -5.919 -8.238 -0.188 607 HA ASP 39 HA ASP 39 -6.071 -7.114 2.492 608 HB2 ASP 39 HB2 ASP 39 -5.528 -9.407 3.194 609 HB3 ASP 39 HB3 ASP 39 -6.915 -9.343 2.097 610 H GLN 40 H GLN 40 -3.727 -6.941 0.092 611 HA GLN 40 HA GLN 40 -1.543 -6.882 2.137 612 HB2 GLN 40 HB2 GLN 40 -1.506 -7.443 -0.843 613 HB3 GLN 40 HB3 GLN 40 -0.047 -7.073 0.096 614 HG2 GLN 40 HG2 GLN 40 -0.430 -8.960 1.579 615 HG3 GLN 40 HG3 GLN 40 -1.984 -9.312 0.794 616 HE21 GLN 40 HE21 GLN 40 1.227 -8.506 -0.686 617 HE22 GLN 40 HE22 GLN 40 1.336 -10.002 -1.584 618 H GLN 41 H GLN 41 -3.484 -4.857 0.044 619 HA GLN 41 HA GLN 41 -1.496 -2.762 -0.212 620 HB2 GLN 41 HB2 GLN 41 -4.527 -2.780 -0.439 621 HB3 GLN 41 HB3 GLN 41 -3.489 -1.406 -0.870 622 HG2 GLN 41 HG2 GLN 41 -2.401 -2.703 -2.629 623 HG3 GLN 41 HG3 GLN 41 -3.280 -4.165 -2.128 624 HE21 GLN 41 HE21 GLN 41 -4.500 -4.507 -4.025 625 HE22 GLN 41 HE22 GLN 41 -5.773 -3.402 -4.478 626 H ARG 42 H ARG 42 -1.914 -0.578 0.613 627 HA ARG 42 HA ARG 42 -3.562 -0.190 2.994 628 HB2 ARG 42 HB2 ARG 42 -1.308 -1.010 3.845 629 HB3 ARG 42 HB3 ARG 42 -0.550 0.344 3.004 630 HG2 ARG 42 HG2 ARG 42 -0.819 0.908 5.348 631 HG3 ARG 42 HG3 ARG 42 -1.904 1.927 4.387 632 HD2 ARG 42 HD2 ARG 42 -3.091 1.141 6.360 633 HD3 ARG 42 HD3 ARG 42 -3.789 0.365 4.943 634 HE ARG 42 HE ARG 42 -2.987 -1.706 5.676 635 HH11 ARG 42 HH11 ARG 42 -1.594 0.896 7.624 636 HH12 ARG 42 HH12 ARG 42 -0.912 -0.188 8.809 637 HH21 ARG 42 HH21 ARG 42 -2.107 -3.104 7.246 638 HH22 ARG 42 HH22 ARG 42 -1.217 -2.452 8.602 639 H LEU 43 H LEU 43 -4.007 2.189 3.226 640 HA LEU 43 HA LEU 43 -3.089 3.720 0.858 641 HB2 LEU 43 HB2 LEU 43 -5.320 2.397 0.618 642 HB3 LEU 43 HB3 LEU 43 -5.971 3.551 1.793 643 HG LEU 43 HG LEU 43 -5.069 5.377 0.228 644 HD11 LEU 43 HD11 LEU 43 -5.086 3.002 -1.706 645 HD12 LEU 43 HD12 LEU 43 -4.841 4.703 -2.158 646 HD13 LEU 43 HD13 LEU 43 -3.626 3.866 -1.166 647 HD21 LEU 43 HD21 LEU 43 -7.068 5.184 -1.268 648 HD22 LEU 43 HD22 LEU 43 -7.296 3.508 -0.710 649 HD23 LEU 43 HD23 LEU 43 -7.459 4.861 0.435 650 H ILE 44 H ILE 44 -2.866 5.881 1.163 651 HA ILE 44 HA ILE 44 -3.675 7.110 3.749 652 HB ILE 44 HB ILE 44 -0.892 7.053 2.526 653 HG12 ILE 44 HG12 ILE 44 -0.457 6.614 5.107 654 HG13 ILE 44 HG13 ILE 44 -2.142 6.109 5.114 655 HG21 ILE 44 HG21 ILE 44 -1.807 8.789 4.856 656 HG22 ILE 44 HG22 ILE 44 -0.177 8.674 4.196 657 HG23 ILE 44 HG23 ILE 44 -1.441 9.409 3.216 658 HD11 ILE 44 HD11 ILE 44 -1.618 4.388 3.385 659 HD12 ILE 44 HD12 ILE 44 0.066 4.968 3.339 660 HD13 ILE 44 HD13 ILE 44 -0.596 4.219 4.815 661 H PHE 45 H PHE 45 -3.912 9.410 3.589 662 HA PHE 45 HA PHE 45 -3.759 10.711 0.940 663 HB2 PHE 45 HB2 PHE 45 -6.024 9.686 1.063 664 HB3 PHE 45 HB3 PHE 45 -6.288 10.452 2.624 665 HD1 PHE 45 HD1 PHE 45 -4.934 11.797 -0.620 666 HD2 PHE 45 HD2 PHE 45 -7.909 12.087 2.469 667 HE1 PHE 45 HE1 PHE 45 -5.914 13.754 -1.763 668 HE2 PHE 45 HE2 PHE 45 -8.874 14.081 1.350 669 HZ PHE 45 HZ PHE 45 -7.878 14.922 -0.767 670 H ALA 46 H ALA 46 -3.285 12.841 1.145 671 HA ALA 46 HA ALA 46 -2.355 14.634 2.120 672 HB1 ALA 46 HB1 ALA 46 -4.762 15.124 2.384 673 HB2 ALA 46 HB2 ALA 46 -4.734 14.373 3.996 674 HB3 ALA 46 HB3 ALA 46 -3.800 15.853 3.689 675 H GLY 47 H GLY 47 -1.896 11.795 3.498 676 HA2 GLY 47 HA2 GLY 47 0.052 11.396 4.776 677 HA3 GLY 47 HA3 GLY 47 -0.169 12.917 5.643 678 H LYS 48 H LYS 48 -3.155 11.142 5.315 679 HA LYS 48 HA LYS 48 -2.604 9.676 7.841 680 HB2 LYS 48 HB2 LYS 48 -4.829 10.109 8.671 681 HB3 LYS 48 HB3 LYS 48 -3.947 11.618 8.405 682 HG2 LYS 48 HG2 LYS 48 -6.070 12.076 7.648 683 HG3 LYS 48 HG3 LYS 48 -5.128 11.782 6.173 684 HD2 LYS 48 HD2 LYS 48 -6.174 9.489 6.019 685 HD3 LYS 48 HD3 LYS 48 -7.140 9.844 7.458 686 HE2 LYS 48 HE2 LYS 48 -7.147 11.379 4.830 687 HE3 LYS 48 HE3 LYS 48 -8.399 10.261 5.391 688 HZ1 LYS 48 HZ1 LYS 48 -8.814 11.742 7.233 689 HZ2 LYS 48 HZ2 LYS 48 -7.650 12.781 6.730 690 HZ3 LYS 48 HZ3 LYS 48 -8.991 12.544 5.808 691 H GLN 49 H GLN 49 -4.007 7.885 8.189 692 HA GLN 49 HA GLN 49 -4.106 6.319 5.685 693 HB2 GLN 49 HB2 GLN 49 -2.720 5.603 7.587 694 HB3 GLN 49 HB3 GLN 49 -4.129 5.598 8.641 695 HG2 GLN 49 HG2 GLN 49 -5.132 3.784 7.226 696 HG3 GLN 49 HG3 GLN 49 -3.660 3.793 6.226 697 HE21 GLN 49 HE21 GLN 49 -1.536 3.726 7.706 698 HE22 GLN 49 HE22 GLN 49 -1.568 2.511 8.964 699 H LEU 50 H LEU 50 -5.891 4.963 5.242 700 HA LEU 50 HA LEU 50 -8.470 6.116 6.239 701 HB2 LEU 50 HB2 LEU 50 -7.830 5.028 3.467 702 HB3 LEU 50 HB3 LEU 50 -9.393 5.642 4.025 703 HG LEU 50 HG LEU 50 -8.191 7.868 4.520 704 HD11 LEU 50 HD11 LEU 50 -6.264 8.307 2.991 705 HD12 LEU 50 HD12 LEU 50 -5.837 7.210 4.307 706 HD13 LEU 50 HD13 LEU 50 -6.142 6.560 2.676 707 HD21 LEU 50 HD21 LEU 50 -8.423 8.615 2.215 708 HD22 LEU 50 HD22 LEU 50 -8.334 6.937 1.623 709 HD23 LEU 50 HD23 LEU 50 -9.730 7.474 2.585 710 H GLU 51 H GLU 51 -10.389 4.542 5.834 711 HA GLU 51 HA GLU 51 -9.535 1.767 6.523 712 HB2 GLU 51 HB2 GLU 51 -11.221 3.696 8.119 713 HB3 GLU 51 HB3 GLU 51 -11.498 1.951 8.239 714 HG2 GLU 51 HG2 GLU 51 -9.138 1.599 8.854 715 HG3 GLU 51 HG3 GLU 51 -8.841 3.341 8.710 716 H ASP 52 H ASP 52 -11.086 0.180 6.258 717 HA ASP 52 HA ASP 52 -12.618 0.478 3.844 718 HB2 ASP 52 HB2 ASP 52 -12.483 -1.777 5.878 719 HB3 ASP 52 HB3 ASP 52 -13.146 -1.890 4.242 720 H GLY 53 H GLY 53 -13.356 1.461 6.936 721 HA2 GLY 53 HA2 GLY 53 -16.240 0.761 6.710 722 HA3 GLY 53 HA3 GLY 53 -15.392 1.181 8.213 723 H ARG 54 H ARG 54 -14.337 3.145 5.633 724 HA ARG 54 HA ARG 54 -16.098 5.388 6.495 725 HB2 ARG 54 HB2 ARG 54 -13.437 5.562 5.051 726 HB3 ARG 54 HB3 ARG 54 -14.268 6.829 5.949 727 HG2 ARG 54 HG2 ARG 54 -13.079 4.312 7.195 728 HG3 ARG 54 HG3 ARG 54 -12.285 5.894 7.142 729 HD2 ARG 54 HD2 ARG 54 -14.093 6.892 8.430 730 HD3 ARG 54 HD3 ARG 54 -14.947 5.328 8.495 731 HE ARG 54 HE ARG 54 -12.489 4.710 9.514 732 HH11 ARG 54 HH11 ARG 54 -14.817 7.253 10.308 733 HH12 ARG 54 HH12 ARG 54 -14.329 7.326 11.985 734 HH21 ARG 54 HH21 ARG 54 -11.869 4.841 11.654 735 HH22 ARG 54 HH22 ARG 54 -12.650 5.958 12.759 736 H THR 55 H THR 55 -15.316 7.029 4.326 737 HA THR 55 HA THR 55 -15.862 5.691 1.781 738 HB THR 55 HB THR 55 -17.506 7.673 1.286 739 HG1 THR 55 HG1 THR 55 -18.518 8.494 3.036 740 HG21 THR 55 HG21 THR 55 -18.407 5.482 3.207 741 HG22 THR 55 HG22 THR 55 -19.404 6.307 1.983 742 HG23 THR 55 HG23 THR 55 -18.104 5.206 1.477 743 H LEU 56 H LEU 56 -15.286 7.178 -0.028 744 HA LEU 56 HA LEU 56 -12.905 8.657 0.600 745 HB2 LEU 56 HB2 LEU 56 -14.691 8.792 -1.863 746 HB3 LEU 56 HB3 LEU 56 -13.051 9.419 -1.737 747 HG LEU 56 HG LEU 56 -13.994 6.536 -1.764 748 HD11 LEU 56 HD11 LEU 56 -11.841 8.048 -3.312 749 HD12 LEU 56 HD12 LEU 56 -12.347 6.369 -3.586 750 HD13 LEU 56 HD13 LEU 56 -13.478 7.705 -3.912 751 HD21 LEU 56 HD21 LEU 56 -12.343 6.671 0.079 752 HD22 LEU 56 HD22 LEU 56 -11.707 5.791 -1.317 753 HD23 LEU 56 HD23 LEU 56 -11.187 7.462 -1.028 754 H SER 57 H SER 57 -16.308 9.419 0.432 755 HA SER 57 HA SER 57 -16.152 12.271 0.432 756 HB2 SER 57 HB2 SER 57 -18.536 12.037 1.016 757 HB3 SER 57 HB3 SER 57 -18.091 10.902 -0.277 758 HG SER 57 HG SER 57 -19.329 9.916 1.350 759 H ASP 58 H ASP 58 -15.886 9.789 2.950 760 HA ASP 58 HA ASP 58 -16.439 11.521 5.189 761 HB2 ASP 58 HB2 ASP 58 -16.477 8.940 5.080 762 HB3 ASP 58 HB3 ASP 58 -14.720 9.020 5.205 763 H TYR 59 H TYR 59 -13.780 11.175 3.059 764 HA TYR 59 HA TYR 59 -12.029 12.716 4.896 765 HB2 TYR 59 HB2 TYR 59 -11.285 10.425 3.041 766 HB3 TYR 59 HB3 TYR 59 -10.110 11.503 3.792 767 HD1 TYR 59 HD1 TYR 59 -11.246 11.819 6.543 768 HD2 TYR 59 HD2 TYR 59 -10.865 8.348 4.032 769 HE1 TYR 59 HE1 TYR 59 -11.104 10.388 8.558 770 HE2 TYR 59 HE2 TYR 59 -10.673 6.907 6.071 771 HH TYR 59 HH TYR 59 -10.841 8.275 9.366 772 H ASN 60 H ASN 60 -13.999 13.449 2.809 773 HA ASN 60 HA ASN 60 -14.265 14.894 1.160 774 HB2 ASN 60 HB2 ASN 60 -13.280 16.979 1.588 775 HB3 ASN 60 HB3 ASN 60 -13.429 16.151 3.144 776 HD21 ASN 60 HD21 ASN 60 -11.659 15.751 4.398 777 HD22 ASN 60 HD22 ASN 60 -10.028 16.211 3.944 778 H ILE 61 H ILE 61 -12.250 12.678 0.389 779 HA ILE 61 HA ILE 61 -10.339 13.799 -1.376 780 HB ILE 61 HB ILE 61 -11.884 11.179 -1.465 781 HG12 ILE 61 HG12 ILE 61 -9.026 11.764 -0.601 782 HG13 ILE 61 HG13 ILE 61 -10.390 11.672 0.531 783 HG21 ILE 61 HG21 ILE 61 -9.386 12.015 -3.020 784 HG22 ILE 61 HG22 ILE 61 -10.086 10.381 -3.003 785 HG23 ILE 61 HG23 ILE 61 -10.992 11.712 -3.718 786 HD11 ILE 61 HD11 ILE 61 -9.154 9.558 0.448 787 HD12 ILE 61 HD12 ILE 61 -10.826 9.359 -0.109 788 HD13 ILE 61 HD13 ILE 61 -9.488 9.399 -1.289 789 H GLN 62 H GLN 62 -10.369 14.504 -3.432 790 HA GLN 62 HA GLN 62 -12.922 14.492 -4.992 791 HB2 GLN 62 HB2 GLN 62 -10.866 16.721 -4.913 792 HB3 GLN 62 HB3 GLN 62 -12.475 16.762 -5.649 793 HG2 GLN 62 HG2 GLN 62 -11.903 16.517 -2.665 794 HG3 GLN 62 HG3 GLN 62 -12.277 18.014 -3.488 795 HE21 GLN 62 HE21 GLN 62 -13.746 16.571 -1.313 796 HE22 GLN 62 HE22 GLN 62 -15.377 16.348 -1.922 797 H LYS 63 H LYS 63 -12.215 15.346 -7.330 798 HA LYS 63 HA LYS 63 -10.517 13.370 -8.483 799 HB2 LYS 63 HB2 LYS 63 -10.845 14.607 -10.495 800 HB3 LYS 63 HB3 LYS 63 -12.368 14.625 -9.596 801 HG2 LYS 63 HG2 LYS 63 -11.849 16.917 -8.766 802 HG3 LYS 63 HG3 LYS 63 -10.319 16.885 -9.675 803 HD2 LYS 63 HD2 LYS 63 -11.959 18.101 -10.965 804 HD3 LYS 63 HD3 LYS 63 -11.601 16.563 -11.778 805 HE2 LYS 63 HE2 LYS 63 -13.653 15.572 -10.829 806 HE3 LYS 63 HE3 LYS 63 -13.997 17.073 -9.962 807 HZ1 LYS 63 HZ1 LYS 63 -14.192 18.187 -12.070 808 HZ2 LYS 63 HZ2 LYS 63 -13.855 16.807 -12.892 809 HZ3 LYS 63 HZ3 LYS 63 -15.235 16.922 -12.003 810 H GLU 64 H GLU 64 -8.495 13.317 -9.132 811 HA GLU 64 HA GLU 64 -6.281 13.730 -9.186 812 HB2 GLU 64 HB2 GLU 64 -7.191 16.602 -9.593 813 HB3 GLU 64 HB3 GLU 64 -5.651 15.876 -10.096 814 HG2 GLU 64 HG2 GLU 64 -6.928 14.289 -11.560 815 HG3 GLU 64 HG3 GLU 64 -8.422 15.130 -11.118 816 H SER 65 H SER 65 -7.527 13.871 -6.458 817 HA SER 65 HA SER 65 -6.355 16.111 -5.107 818 HB2 SER 65 HB2 SER 65 -7.707 13.566 -4.152 819 HB3 SER 65 HB3 SER 65 -7.121 14.840 -3.057 820 HG SER 65 HG SER 65 -8.972 15.194 -5.168 821 H THR 66 H THR 66 -5.018 13.211 -6.165 822 HA THR 66 HA THR 66 -3.154 12.003 -5.797 823 HB THR 66 HB THR 66 -2.269 14.545 -4.439 824 HG1 THR 66 HG1 THR 66 -1.216 14.786 -6.432 825 HG21 THR 66 HG21 THR 66 -0.870 12.683 -3.612 826 HG22 THR 66 HG22 THR 66 -0.661 12.084 -5.271 827 HG23 THR 66 HG23 THR 66 0.048 13.639 -4.784 828 H LEU 67 H LEU 67 -2.753 10.344 -4.575 829 HA LEU 67 HA LEU 67 -3.205 10.410 -1.629 830 HB2 LEU 67 HB2 LEU 67 -4.549 8.776 -3.758 831 HB3 LEU 67 HB3 LEU 67 -4.036 7.920 -2.305 832 HG LEU 67 HG LEU 67 -5.265 9.751 -0.976 833 HD11 LEU 67 HD11 LEU 67 -7.236 10.688 -2.187 834 HD12 LEU 67 HD12 LEU 67 -5.717 11.325 -2.840 835 HD13 LEU 67 HD13 LEU 67 -6.597 10.048 -3.716 836 HD21 LEU 67 HD21 LEU 67 -7.376 8.492 -1.181 837 HD22 LEU 67 HD22 LEU 67 -6.787 7.748 -2.693 838 HD23 LEU 67 HD23 LEU 67 -5.975 7.408 -1.148 839 H HIS 68 H HIS 68 -2.466 7.944 -0.945 840 HA HIS 68 HA HIS 68 0.081 7.363 -2.358 841 HB2 HIS 68 HB2 HIS 68 -0.174 7.668 0.645 842 HB3 HIS 68 HB3 HIS 68 1.309 7.381 -0.278 843 HD2 HIS 68 HD2 HIS 68 2.128 9.525 -1.898 844 HE1 HIS 68 HE1 HIS 68 -0.072 12.477 0.220 845 HE2 HIS 68 HE2 HIS 68 1.774 12.081 -1.489 846 H LEU 69 H LEU 69 0.770 5.248 -2.210 847 HA LEU 69 HA LEU 69 -1.123 3.281 -1.022 848 HB2 LEU 69 HB2 LEU 69 -1.588 3.638 -3.392 849 HB3 LEU 69 HB3 LEU 69 0.105 3.412 -3.808 850 HG LEU 69 HG LEU 69 -1.460 1.539 -4.360 851 HD11 LEU 69 HD11 LEU 69 0.064 -0.228 -3.852 852 HD12 LEU 69 HD12 LEU 69 0.996 1.241 -4.217 853 HD13 LEU 69 HD13 LEU 69 0.812 0.683 -2.536 854 HD21 LEU 69 HD21 LEU 69 -2.771 1.607 -2.232 855 HD22 LEU 69 HD22 LEU 69 -2.173 -0.013 -2.656 856 HD23 LEU 69 HD23 LEU 69 -1.358 0.922 -1.389 857 H VAL 70 H VAL 70 -0.175 1.594 -0.030 858 HA VAL 70 HA VAL 70 2.702 1.019 -0.470 859 HB VAL 70 HB VAL 70 1.401 1.291 2.274 860 HG11 VAL 70 HG11 VAL 70 3.162 -0.391 2.310 861 HG12 VAL 70 HG12 VAL 70 4.253 0.672 1.379 862 HG13 VAL 70 HG13 VAL 70 3.789 1.086 3.043 863 HG21 VAL 70 HG21 VAL 70 1.768 3.514 1.276 864 HG22 VAL 70 HG22 VAL 70 2.940 3.210 2.567 865 HG23 VAL 70 HG23 VAL 70 3.442 3.064 0.867 866 H LEU 71 H LEU 71 3.196 -1.254 0.428 867 HA LEU 71 HA LEU 71 0.791 -2.947 0.548 868 HB2 LEU 71 HB2 LEU 71 1.593 -4.339 -1.362 869 HB3 LEU 71 HB3 LEU 71 1.050 -2.718 -1.798 870 HG LEU 71 HG LEU 71 3.437 -1.961 -1.908 871 HD11 LEU 71 HD11 LEU 71 5.161 -3.768 -2.167 872 HD12 LEU 71 HD12 LEU 71 4.591 -3.582 -0.509 873 HD13 LEU 71 HD13 LEU 71 3.988 -4.931 -1.509 874 HD21 LEU 71 HD21 LEU 71 2.652 -4.340 -3.635 875 HD22 LEU 71 HD22 LEU 71 2.193 -2.640 -3.901 876 HD23 LEU 71 HD23 LEU 71 3.894 -3.129 -4.037 877 H ARG 72 H ARG 72 1.523 -5.342 0.520 878 HA ARG 72 HA ARG 72 4.033 -5.724 2.083 879 HB2 ARG 72 HB2 ARG 72 1.260 -6.903 2.570 880 HB3 ARG 72 HB3 ARG 72 2.754 -7.602 3.209 881 HG2 ARG 72 HG2 ARG 72 2.102 -6.316 4.974 882 HG3 ARG 72 HG3 ARG 72 3.251 -5.251 4.138 883 HD2 ARG 72 HD2 ARG 72 1.325 -3.947 4.818 884 HD3 ARG 72 HD3 ARG 72 1.280 -4.099 3.058 885 HE ARG 72 HE ARG 72 -0.679 -5.308 3.218 886 HH11 ARG 72 HH11 ARG 72 0.831 -5.144 6.422 887 HH12 ARG 72 HH12 ARG 72 -0.520 -5.901 7.222 888 HH21 ARG 72 HH21 ARG 72 -2.428 -6.329 4.315 889 HH22 ARG 72 HH22 ARG 72 -2.356 -6.535 6.047 890 H LEU 73 H LEU 73 4.685 -8.041 2.067 891 HA LEU 73 HA LEU 73 4.397 -9.056 -0.680 892 HB2 LEU 73 HB2 LEU 73 6.576 -10.181 -0.245 893 HB3 LEU 73 HB3 LEU 73 6.621 -8.413 -0.251 894 HG LEU 73 HG LEU 73 8.020 -9.670 1.475 895 HD11 LEU 73 HD11 LEU 73 6.148 -7.492 2.488 896 HD12 LEU 73 HD12 LEU 73 7.739 -7.920 3.136 897 HD13 LEU 73 HD13 LEU 73 7.597 -7.227 1.498 898 HD21 LEU 73 HD21 LEU 73 5.335 -9.813 2.903 899 HD22 LEU 73 HD22 LEU 73 6.261 -11.209 2.285 900 HD23 LEU 73 HD23 LEU 73 6.918 -10.213 3.597 901 H ARG 74 H ARG 74 2.730 -9.518 1.697 902 HA ARG 74 HA ARG 74 1.078 -11.260 1.542 903 HB2 ARG 74 HB2 ARG 74 2.620 -12.842 0.334 904 HB3 ARG 74 HB3 ARG 74 3.362 -13.237 1.899 905 HG2 ARG 74 HG2 ARG 74 1.683 -14.906 1.258 906 HG3 ARG 74 HG3 ARG 74 1.134 -14.039 2.705 907 HD2 ARG 74 HD2 ARG 74 -0.318 -12.608 1.331 908 HD3 ARG 74 HD3 ARG 74 0.305 -13.369 -0.147 909 HE ARG 74 HE ARG 74 -0.736 -15.436 1.447 910 HH11 ARG 74 HH11 ARG 74 -1.890 -12.521 -0.177 911 HH12 ARG 74 HH12 ARG 74 -3.510 -13.133 -0.411 912 HH21 ARG 74 HH21 ARG 74 -2.858 -16.231 1.121 913 HH22 ARG 74 HH22 ARG 74 -4.051 -15.241 0.316 914 H GLY 75 H GLY 75 3.877 -10.861 3.584 915 HA2 GLY 75 HA2 GLY 75 2.877 -10.121 5.907 916 HA3 GLY 75 HA3 GLY 75 2.387 -11.838 5.929 917 H GLY 76 H GLY 76 4.964 -12.299 4.229 918 HA2 GLY 76 HA2 GLY 76 7.260 -11.716 5.762 919 HA3 GLY 76 HA3 GLY 76 6.607 -13.259 6.347
Contact the webmaster for help, if required. Wednesday, May 29, 2024 8:31:19 AM GMT (wattos1)