USER MOD reduce.3.24.130724 H: found=0, std=0, add=416, rem=0, adj=10 USER MOD reduce.3.24.130724 removed 419 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: C 483 THR OG1 : rot -114:sc= 1.22 USER MOD Set 1.2: C 489 THR OG1 : rot -59:sc= 1.22 USER MOD Set 2.1: C 458 ASN : amide:sc= 1.16 X(o=1.7,f=1.8) USER MOD Set 2.2: C 473 TYR OH : rot 180:sc= 0.527 USER MOD Set 3.1: C 462 HIS : no HD1:sc= -0.326 K(o=-0.94,f=-0.26) USER MOD Set 3.2: C 463 GLN : amide:sc= -0.61 K(o=-0.94,f=-0.26) USER MOD Single : C 453 SER OG : rot -32:sc= 0.236 USER MOD Single : C 454 ASN : amide:sc= 0.83 K(o=0.83,f=-5.7!) USER MOD Single : C 455 SER OG : rot 180:sc= 0 USER MOD Single : C 456 GLN : amide:sc= -0.169 X(o=-0.17,f=-0.3) USER MOD Single : C 460 MET CE :methyl 170:sc= -2.97! (180deg=-3.47!) USER MOD Single : C 465 GLN : amide:sc= -1.89! K(o=-1.9!,f=-0.46) USER MOD Single : C 467 MET CE :methyl -178:sc= -0.727 (180deg=-0.747) USER MOD Single : C 470 GLN : amide:sc= 0 X(o=0,f=-0.44) USER MOD Single : C 474 HIS : no HD1:sc=-0.00364 X(o=-0.0036,f=0) USER MOD Single : C 478 GLN : amide:sc= -1.57! K(o=-1.6!,f=-0.1) USER MOD Single : C 481 GLN : amide:sc= -3.5! K(o=-3.5!,f=-1.7) USER MOD Single : C 485 SER OG : rot 170:sc= -0.123 USER MOD Single : C 490 THR OG1 : rot 93:sc= 1.27 USER MOD Single : C 492 ASN : amide:sc= -3.32! C(o=-3.3!,f=-3!) USER MOD Single : C 499 GLN : amide:sc= -1.05 K(o=-1.1,f=-0.0053) USER MOD Single : C 504 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N SER C 453 -9.407 -2.333 0.459 1.00 0.00 N ATOM 2 CA SER C 453 -10.359 -2.373 1.571 1.00 0.00 C ATOM 3 C SER C 453 -9.788 -1.670 2.796 1.00 0.00 C ATOM 4 O SER C 453 -8.592 -1.783 3.088 1.00 0.00 O ATOM 5 CB SER C 453 -10.718 -3.824 1.902 1.00 0.00 C ATOM 6 OG SER C 453 -9.554 -4.637 1.982 1.00 0.00 O ATOM 0 HA SER C 453 -11.265 -1.847 1.272 1.00 0.00 H new ATOM 0 HB2 SER C 453 -11.256 -3.861 2.849 1.00 0.00 H new ATOM 0 HB3 SER C 453 -11.388 -4.219 1.139 1.00 0.00 H new ATOM 0 HG SER C 453 -8.879 -4.304 1.355 1.00 0.00 H new ATOM 14 N ASN C 454 -10.645 -0.938 3.500 1.00 0.00 N ATOM 15 CA ASN C 454 -10.248 -0.199 4.696 1.00 0.00 C ATOM 16 C ASN C 454 -9.708 -1.151 5.766 1.00 0.00 C ATOM 17 O ASN C 454 -10.143 -2.303 5.861 1.00 0.00 O ATOM 18 CB ASN C 454 -11.443 0.589 5.247 1.00 0.00 C ATOM 19 CG ASN C 454 -11.057 1.538 6.365 1.00 0.00 C ATOM 20 OD1 ASN C 454 -10.998 1.151 7.531 1.00 0.00 O ATOM 21 ND2 ASN C 454 -10.807 2.783 6.021 1.00 0.00 N ATOM 0 H ASN C 454 -11.631 -0.840 3.260 1.00 0.00 H new ATOM 0 HA ASN C 454 -9.455 0.498 4.424 1.00 0.00 H new ATOM 0 HB2 ASN C 454 -11.902 1.156 4.438 1.00 0.00 H new ATOM 0 HB3 ASN C 454 -12.195 -0.110 5.613 1.00 0.00 H new ATOM 0 HD21 ASN C 454 -10.553 3.468 6.733 1.00 0.00 H new ATOM 0 HD22 ASN C 454 -10.867 3.064 5.042 1.00 0.00 H new ATOM 28 N SER C 455 -8.774 -0.659 6.571 1.00 0.00 N ATOM 29 CA SER C 455 -8.136 -1.455 7.616 1.00 0.00 C ATOM 30 C SER C 455 -9.158 -2.016 8.616 1.00 0.00 C ATOM 31 O SER C 455 -8.966 -3.099 9.168 1.00 0.00 O ATOM 32 CB SER C 455 -7.094 -0.608 8.344 1.00 0.00 C ATOM 33 OG SER C 455 -6.226 0.030 7.414 1.00 0.00 O ATOM 0 H SER C 455 -8.437 0.302 6.519 1.00 0.00 H new ATOM 0 HA SER C 455 -7.649 -2.306 7.139 1.00 0.00 H new ATOM 0 HB2 SER C 455 -7.592 0.142 8.958 1.00 0.00 H new ATOM 0 HB3 SER C 455 -6.513 -1.237 9.019 1.00 0.00 H new ATOM 0 HG SER C 455 -5.567 0.569 7.899 1.00 0.00 H new ATOM 39 N GLN C 456 -10.250 -1.281 8.829 1.00 0.00 N ATOM 40 CA GLN C 456 -11.304 -1.720 9.740 1.00 0.00 C ATOM 41 C GLN C 456 -11.943 -3.008 9.246 1.00 0.00 C ATOM 42 O GLN C 456 -12.329 -3.864 10.037 1.00 0.00 O ATOM 43 CB GLN C 456 -12.377 -0.640 9.892 1.00 0.00 C ATOM 44 CG GLN C 456 -11.900 0.607 10.608 1.00 0.00 C ATOM 45 CD GLN C 456 -11.449 0.324 12.025 1.00 0.00 C ATOM 46 OE1 GLN C 456 -10.273 0.045 12.275 1.00 0.00 O ATOM 47 NE2 GLN C 456 -12.376 0.386 12.958 1.00 0.00 N ATOM 0 H GLN C 456 -10.426 -0.381 8.383 1.00 0.00 H new ATOM 0 HA GLN C 456 -10.846 -1.902 10.712 1.00 0.00 H new ATOM 0 HB2 GLN C 456 -12.740 -0.362 8.903 1.00 0.00 H new ATOM 0 HB3 GLN C 456 -13.224 -1.058 10.437 1.00 0.00 H new ATOM 0 HG2 GLN C 456 -11.076 1.050 10.049 1.00 0.00 H new ATOM 0 HG3 GLN C 456 -12.705 1.342 10.626 1.00 0.00 H new ATOM 0 HE21 GLN C 456 -13.337 0.620 12.708 1.00 0.00 H new ATOM 0 HE22 GLN C 456 -12.133 0.200 13.931 1.00 0.00 H new ATOM 56 N LEU C 457 -12.026 -3.150 7.930 1.00 0.00 N ATOM 57 CA LEU C 457 -12.638 -4.322 7.330 1.00 0.00 C ATOM 58 C LEU C 457 -11.793 -5.552 7.577 1.00 0.00 C ATOM 59 O LEU C 457 -12.319 -6.643 7.780 1.00 0.00 O ATOM 60 CB LEU C 457 -12.844 -4.127 5.831 1.00 0.00 C ATOM 61 CG LEU C 457 -13.628 -2.885 5.416 1.00 0.00 C ATOM 62 CD1 LEU C 457 -13.937 -2.936 3.941 1.00 0.00 C ATOM 63 CD2 LEU C 457 -14.905 -2.749 6.228 1.00 0.00 C ATOM 0 H LEU C 457 -11.676 -2.466 7.259 1.00 0.00 H new ATOM 0 HA LEU C 457 -13.612 -4.462 7.798 1.00 0.00 H new ATOM 0 HB2 LEU C 457 -11.865 -4.091 5.352 1.00 0.00 H new ATOM 0 HB3 LEU C 457 -13.358 -5.004 5.439 1.00 0.00 H new ATOM 0 HG LEU C 457 -13.013 -2.008 5.615 1.00 0.00 H new ATOM 0 HD11 LEU C 457 -14.497 -2.045 3.655 1.00 0.00 H new ATOM 0 HD12 LEU C 457 -13.006 -2.977 3.375 1.00 0.00 H new ATOM 0 HD13 LEU C 457 -14.532 -3.823 3.724 1.00 0.00 H new ATOM 0 HD21 LEU C 457 -15.444 -1.856 5.912 1.00 0.00 H new ATOM 0 HD22 LEU C 457 -15.532 -3.626 6.070 1.00 0.00 H new ATOM 0 HD23 LEU C 457 -14.656 -2.667 7.286 1.00 0.00 H new ATOM 75 N ASN C 458 -10.477 -5.366 7.567 1.00 0.00 N ATOM 76 CA ASN C 458 -9.539 -6.460 7.804 1.00 0.00 C ATOM 77 C ASN C 458 -9.795 -7.116 9.144 1.00 0.00 C ATOM 78 O ASN C 458 -9.963 -8.326 9.225 1.00 0.00 O ATOM 79 CB ASN C 458 -8.085 -5.963 7.720 1.00 0.00 C ATOM 80 CG ASN C 458 -7.096 -6.886 8.431 1.00 0.00 C ATOM 81 OD1 ASN C 458 -6.720 -6.644 9.579 1.00 0.00 O ATOM 82 ND2 ASN C 458 -6.692 -7.949 7.772 1.00 0.00 N ATOM 0 H ASN C 458 -10.033 -4.464 7.396 1.00 0.00 H new ATOM 0 HA ASN C 458 -9.695 -7.205 7.024 1.00 0.00 H new ATOM 0 HB2 ASN C 458 -7.798 -5.871 6.672 1.00 0.00 H new ATOM 0 HB3 ASN C 458 -8.022 -4.966 8.157 1.00 0.00 H new ATOM 0 HD21 ASN C 458 -6.046 -8.606 8.210 1.00 0.00 H new ATOM 0 HD22 ASN C 458 -7.024 -8.117 6.822 1.00 0.00 H new ATOM 89 N ALA C 459 -9.849 -6.306 10.189 1.00 0.00 N ATOM 90 CA ALA C 459 -10.078 -6.804 11.536 1.00 0.00 C ATOM 91 C ALA C 459 -11.418 -7.523 11.633 1.00 0.00 C ATOM 92 O ALA C 459 -11.518 -8.587 12.243 1.00 0.00 O ATOM 93 CB ALA C 459 -10.017 -5.660 12.534 1.00 0.00 C ATOM 0 H ALA C 459 -9.737 -5.294 10.129 1.00 0.00 H new ATOM 0 HA ALA C 459 -9.293 -7.522 11.773 1.00 0.00 H new ATOM 0 HB1 ALA C 459 -10.190 -6.044 13.539 1.00 0.00 H new ATOM 0 HB2 ALA C 459 -9.035 -5.190 12.489 1.00 0.00 H new ATOM 0 HB3 ALA C 459 -10.783 -4.924 12.291 1.00 0.00 H new ATOM 99 N MET C 460 -12.440 -6.952 11.004 1.00 0.00 N ATOM 100 CA MET C 460 -13.771 -7.526 11.040 1.00 0.00 C ATOM 101 C MET C 460 -13.835 -8.852 10.286 1.00 0.00 C ATOM 102 O MET C 460 -14.262 -9.872 10.839 1.00 0.00 O ATOM 103 CB MET C 460 -14.797 -6.547 10.474 1.00 0.00 C ATOM 104 CG MET C 460 -14.863 -5.224 11.222 1.00 0.00 C ATOM 105 SD MET C 460 -16.443 -4.384 11.008 1.00 0.00 S ATOM 106 CE MET C 460 -16.453 -4.138 9.245 1.00 0.00 C ATOM 0 H MET C 460 -12.367 -6.090 10.463 1.00 0.00 H new ATOM 0 HA MET C 460 -14.011 -7.724 12.085 1.00 0.00 H new ATOM 0 HB2 MET C 460 -14.559 -6.351 9.428 1.00 0.00 H new ATOM 0 HB3 MET C 460 -15.781 -7.015 10.495 1.00 0.00 H new ATOM 0 HG2 MET C 460 -14.692 -5.402 12.284 1.00 0.00 H new ATOM 0 HG3 MET C 460 -14.060 -4.574 10.874 1.00 0.00 H new ATOM 0 HE1 MET C 460 -17.438 -3.792 8.932 1.00 0.00 H new ATOM 0 HE2 MET C 460 -15.704 -3.393 8.977 1.00 0.00 H new ATOM 0 HE3 MET C 460 -16.223 -5.079 8.745 1.00 0.00 H new ATOM 116 N ALA C 461 -13.402 -8.838 9.033 1.00 0.00 N ATOM 117 CA ALA C 461 -13.420 -10.032 8.201 1.00 0.00 C ATOM 118 C ALA C 461 -12.535 -11.121 8.786 1.00 0.00 C ATOM 119 O ALA C 461 -12.863 -12.303 8.714 1.00 0.00 O ATOM 120 CB ALA C 461 -12.985 -9.699 6.787 1.00 0.00 C ATOM 0 H ALA C 461 -13.032 -8.008 8.569 1.00 0.00 H new ATOM 0 HA ALA C 461 -14.443 -10.408 8.173 1.00 0.00 H new ATOM 0 HB1 ALA C 461 -13.004 -10.603 6.178 1.00 0.00 H new ATOM 0 HB2 ALA C 461 -13.665 -8.961 6.362 1.00 0.00 H new ATOM 0 HB3 ALA C 461 -11.973 -9.294 6.803 1.00 0.00 H new ATOM 126 N HIS C 462 -11.419 -10.710 9.374 1.00 0.00 N ATOM 127 CA HIS C 462 -10.483 -11.641 9.984 1.00 0.00 C ATOM 128 C HIS C 462 -11.159 -12.442 11.085 1.00 0.00 C ATOM 129 O HIS C 462 -11.000 -13.648 11.154 1.00 0.00 O ATOM 130 CB HIS C 462 -9.259 -10.892 10.529 1.00 0.00 C ATOM 131 CG HIS C 462 -8.186 -11.778 11.085 1.00 0.00 C ATOM 132 ND1 HIS C 462 -7.415 -12.610 10.308 1.00 0.00 N ATOM 133 CD2 HIS C 462 -7.757 -11.950 12.353 1.00 0.00 C ATOM 134 CE1 HIS C 462 -6.559 -13.255 11.074 1.00 0.00 C ATOM 135 NE2 HIS C 462 -6.745 -12.874 12.320 1.00 0.00 N ATOM 0 H HIS C 462 -11.140 -9.731 9.441 1.00 0.00 H new ATOM 0 HA HIS C 462 -10.145 -12.339 9.218 1.00 0.00 H new ATOM 0 HB2 HIS C 462 -8.834 -10.286 9.729 1.00 0.00 H new ATOM 0 HB3 HIS C 462 -9.587 -10.205 11.310 1.00 0.00 H new ATOM 0 HD2 HIS C 462 -8.140 -11.452 13.231 1.00 0.00 H new ATOM 0 HE1 HIS C 462 -5.828 -13.975 10.737 1.00 0.00 H new ATOM 0 HE2 HIS C 462 -6.222 -13.211 13.128 1.00 0.00 H new ATOM 144 N GLN C 463 -11.939 -11.767 11.925 1.00 0.00 N ATOM 145 CA GLN C 463 -12.626 -12.442 13.026 1.00 0.00 C ATOM 146 C GLN C 463 -13.634 -13.454 12.504 1.00 0.00 C ATOM 147 O GLN C 463 -13.707 -14.576 13.002 1.00 0.00 O ATOM 148 CB GLN C 463 -13.327 -11.437 13.947 1.00 0.00 C ATOM 149 CG GLN C 463 -12.388 -10.463 14.643 1.00 0.00 C ATOM 150 CD GLN C 463 -11.188 -11.152 15.251 1.00 0.00 C ATOM 151 OE1 GLN C 463 -11.231 -11.619 16.388 1.00 0.00 O ATOM 152 NE2 GLN C 463 -10.105 -11.200 14.506 1.00 0.00 N ATOM 0 H GLN C 463 -12.111 -10.763 11.867 1.00 0.00 H new ATOM 0 HA GLN C 463 -11.867 -12.969 13.604 1.00 0.00 H new ATOM 0 HB2 GLN C 463 -14.051 -10.870 13.362 1.00 0.00 H new ATOM 0 HB3 GLN C 463 -13.888 -11.986 14.703 1.00 0.00 H new ATOM 0 HG2 GLN C 463 -12.049 -9.715 13.926 1.00 0.00 H new ATOM 0 HG3 GLN C 463 -12.933 -9.933 15.424 1.00 0.00 H new ATOM 0 HE21 GLN C 463 -10.113 -10.800 13.568 1.00 0.00 H new ATOM 0 HE22 GLN C 463 -9.257 -11.637 14.867 1.00 0.00 H new ATOM 161 N ILE C 464 -14.402 -13.060 11.498 1.00 0.00 N ATOM 162 CA ILE C 464 -15.382 -13.956 10.914 1.00 0.00 C ATOM 163 C ILE C 464 -14.695 -15.147 10.269 1.00 0.00 C ATOM 164 O ILE C 464 -15.099 -16.273 10.473 1.00 0.00 O ATOM 165 CB ILE C 464 -16.256 -13.260 9.854 1.00 0.00 C ATOM 166 CG1 ILE C 464 -16.969 -12.047 10.442 1.00 0.00 C ATOM 167 CG2 ILE C 464 -17.274 -14.243 9.283 1.00 0.00 C ATOM 168 CD1 ILE C 464 -17.735 -11.261 9.408 1.00 0.00 C ATOM 0 H ILE C 464 -14.364 -12.133 11.074 1.00 0.00 H new ATOM 0 HA ILE C 464 -16.026 -14.284 11.730 1.00 0.00 H new ATOM 0 HB ILE C 464 -15.605 -12.915 9.051 1.00 0.00 H new ATOM 0 HG12 ILE C 464 -17.655 -12.377 11.222 1.00 0.00 H new ATOM 0 HG13 ILE C 464 -16.236 -11.395 10.917 1.00 0.00 H new ATOM 0 HG21 ILE C 464 -17.886 -13.739 8.535 1.00 0.00 H new ATOM 0 HG22 ILE C 464 -16.751 -15.080 8.821 1.00 0.00 H new ATOM 0 HG23 ILE C 464 -17.913 -14.612 10.085 1.00 0.00 H new ATOM 0 HD11 ILE C 464 -18.221 -10.410 9.885 1.00 0.00 H new ATOM 0 HD12 ILE C 464 -17.048 -10.903 8.641 1.00 0.00 H new ATOM 0 HD13 ILE C 464 -18.490 -11.901 8.950 1.00 0.00 H new ATOM 180 N GLN C 465 -13.642 -14.878 9.509 1.00 0.00 N ATOM 181 CA GLN C 465 -12.894 -15.930 8.824 1.00 0.00 C ATOM 182 C GLN C 465 -12.322 -16.926 9.839 1.00 0.00 C ATOM 183 O GLN C 465 -12.294 -18.133 9.596 1.00 0.00 O ATOM 184 CB GLN C 465 -11.775 -15.303 7.973 1.00 0.00 C ATOM 185 CG GLN C 465 -11.216 -16.217 6.880 1.00 0.00 C ATOM 186 CD GLN C 465 -10.271 -17.286 7.397 1.00 0.00 C ATOM 187 OE1 GLN C 465 -10.208 -18.388 6.851 1.00 0.00 O ATOM 188 NE2 GLN C 465 -9.511 -16.962 8.426 1.00 0.00 N ATOM 0 H GLN C 465 -13.283 -13.937 9.349 1.00 0.00 H new ATOM 0 HA GLN C 465 -13.567 -16.476 8.163 1.00 0.00 H new ATOM 0 HB2 GLN C 465 -12.157 -14.394 7.508 1.00 0.00 H new ATOM 0 HB3 GLN C 465 -10.959 -15.006 8.632 1.00 0.00 H new ATOM 0 HG2 GLN C 465 -12.046 -16.699 6.363 1.00 0.00 H new ATOM 0 HG3 GLN C 465 -10.692 -15.608 6.143 1.00 0.00 H new ATOM 0 HE21 GLN C 465 -9.594 -16.038 8.850 1.00 0.00 H new ATOM 0 HE22 GLN C 465 -8.841 -17.635 8.797 1.00 0.00 H new ATOM 197 N GLU C 466 -11.879 -16.412 10.978 1.00 0.00 N ATOM 198 CA GLU C 466 -11.349 -17.247 12.047 1.00 0.00 C ATOM 199 C GLU C 466 -12.434 -18.181 12.600 1.00 0.00 C ATOM 200 O GLU C 466 -12.153 -19.309 13.015 1.00 0.00 O ATOM 201 CB GLU C 466 -10.786 -16.369 13.169 1.00 0.00 C ATOM 202 CG GLU C 466 -9.515 -15.622 12.793 1.00 0.00 C ATOM 203 CD GLU C 466 -8.383 -16.545 12.400 1.00 0.00 C ATOM 204 OE1 GLU C 466 -7.763 -17.150 13.298 1.00 0.00 O ATOM 205 OE2 GLU C 466 -8.103 -16.666 11.195 1.00 0.00 O ATOM 0 H GLU C 466 -11.876 -15.413 11.186 1.00 0.00 H new ATOM 0 HA GLU C 466 -10.547 -17.861 11.638 1.00 0.00 H new ATOM 0 HB2 GLU C 466 -11.546 -15.646 13.466 1.00 0.00 H new ATOM 0 HB3 GLU C 466 -10.584 -16.994 14.039 1.00 0.00 H new ATOM 0 HG2 GLU C 466 -9.729 -14.945 11.966 1.00 0.00 H new ATOM 0 HG3 GLU C 466 -9.199 -15.006 13.635 1.00 0.00 H new ATOM 212 N MET C 467 -13.670 -17.710 12.589 1.00 0.00 N ATOM 213 CA MET C 467 -14.791 -18.487 13.095 1.00 0.00 C ATOM 214 C MET C 467 -15.423 -19.332 11.985 1.00 0.00 C ATOM 215 O MET C 467 -15.947 -20.415 12.241 1.00 0.00 O ATOM 216 CB MET C 467 -15.845 -17.556 13.705 1.00 0.00 C ATOM 217 CG MET C 467 -15.331 -16.704 14.856 1.00 0.00 C ATOM 218 SD MET C 467 -16.625 -15.689 15.614 1.00 0.00 S ATOM 219 CE MET C 467 -17.107 -14.647 14.235 1.00 0.00 C ATOM 0 H MET C 467 -13.924 -16.788 12.233 1.00 0.00 H new ATOM 0 HA MET C 467 -14.415 -19.160 13.865 1.00 0.00 H new ATOM 0 HB2 MET C 467 -16.229 -16.899 12.925 1.00 0.00 H new ATOM 0 HB3 MET C 467 -16.684 -18.156 14.058 1.00 0.00 H new ATOM 0 HG2 MET C 467 -14.894 -17.353 15.615 1.00 0.00 H new ATOM 0 HG3 MET C 467 -14.533 -16.056 14.493 1.00 0.00 H new ATOM 0 HE1 MET C 467 -17.873 -13.944 14.561 1.00 0.00 H new ATOM 0 HE2 MET C 467 -16.238 -14.096 13.874 1.00 0.00 H new ATOM 0 HE3 MET C 467 -17.503 -15.268 13.431 1.00 0.00 H new ATOM 229 N PHE C 468 -15.367 -18.826 10.763 1.00 0.00 N ATOM 230 CA PHE C 468 -15.943 -19.488 9.599 1.00 0.00 C ATOM 231 C PHE C 468 -14.900 -19.635 8.488 1.00 0.00 C ATOM 232 O PHE C 468 -14.825 -18.803 7.590 1.00 0.00 O ATOM 233 CB PHE C 468 -17.157 -18.692 9.068 1.00 0.00 C ATOM 234 CG PHE C 468 -18.388 -18.767 9.936 1.00 0.00 C ATOM 235 CD1 PHE C 468 -18.392 -18.232 11.211 1.00 0.00 C ATOM 236 CD2 PHE C 468 -19.541 -19.373 9.470 1.00 0.00 C ATOM 237 CE1 PHE C 468 -19.514 -18.307 12.007 1.00 0.00 C ATOM 238 CE2 PHE C 468 -20.669 -19.450 10.259 1.00 0.00 C ATOM 239 CZ PHE C 468 -20.656 -18.919 11.530 1.00 0.00 C ATOM 0 H PHE C 468 -14.917 -17.936 10.547 1.00 0.00 H new ATOM 0 HA PHE C 468 -16.274 -20.480 9.907 1.00 0.00 H new ATOM 0 HB2 PHE C 468 -16.869 -17.646 8.959 1.00 0.00 H new ATOM 0 HB3 PHE C 468 -17.408 -19.059 8.073 1.00 0.00 H new ATOM 0 HD1 PHE C 468 -17.503 -17.748 11.588 1.00 0.00 H new ATOM 0 HD2 PHE C 468 -19.558 -19.792 8.475 1.00 0.00 H new ATOM 0 HE1 PHE C 468 -19.500 -17.888 13.002 1.00 0.00 H new ATOM 0 HE2 PHE C 468 -21.562 -19.926 9.881 1.00 0.00 H new ATOM 0 HZ PHE C 468 -21.537 -18.981 12.152 1.00 0.00 H new ATOM 249 N PRO C 469 -14.069 -20.687 8.552 1.00 0.00 N ATOM 250 CA PRO C 469 -13.035 -20.945 7.541 1.00 0.00 C ATOM 251 C PRO C 469 -13.632 -21.261 6.172 1.00 0.00 C ATOM 252 O PRO C 469 -12.957 -21.159 5.146 1.00 0.00 O ATOM 253 CB PRO C 469 -12.300 -22.183 8.076 1.00 0.00 C ATOM 254 CG PRO C 469 -12.681 -22.274 9.509 1.00 0.00 C ATOM 255 CD PRO C 469 -14.046 -21.678 9.623 1.00 0.00 C ATOM 0 HA PRO C 469 -12.395 -20.075 7.396 1.00 0.00 H new ATOM 0 HB2 PRO C 469 -12.594 -23.081 7.533 1.00 0.00 H new ATOM 0 HB3 PRO C 469 -11.221 -22.080 7.961 1.00 0.00 H new ATOM 0 HG2 PRO C 469 -12.681 -23.311 9.845 1.00 0.00 H new ATOM 0 HG3 PRO C 469 -11.969 -21.736 10.135 1.00 0.00 H new ATOM 0 HD2 PRO C 469 -14.825 -22.429 9.493 1.00 0.00 H new ATOM 0 HD3 PRO C 469 -14.205 -21.219 10.599 1.00 0.00 H new ATOM 263 N GLN C 470 -14.904 -21.644 6.174 1.00 0.00 N ATOM 264 CA GLN C 470 -15.607 -22.019 4.948 1.00 0.00 C ATOM 265 C GLN C 470 -15.764 -20.847 3.978 1.00 0.00 C ATOM 266 O GLN C 470 -16.023 -21.051 2.794 1.00 0.00 O ATOM 267 CB GLN C 470 -16.980 -22.616 5.267 1.00 0.00 C ATOM 268 CG GLN C 470 -17.923 -21.665 5.992 1.00 0.00 C ATOM 269 CD GLN C 470 -19.324 -22.233 6.127 1.00 0.00 C ATOM 270 OE1 GLN C 470 -19.513 -23.446 6.178 1.00 0.00 O ATOM 271 NE2 GLN C 470 -20.313 -21.362 6.196 1.00 0.00 N ATOM 0 H GLN C 470 -15.475 -21.704 7.017 1.00 0.00 H new ATOM 0 HA GLN C 470 -14.990 -22.772 4.457 1.00 0.00 H new ATOM 0 HB2 GLN C 470 -17.449 -22.936 4.337 1.00 0.00 H new ATOM 0 HB3 GLN C 470 -16.842 -23.508 5.878 1.00 0.00 H new ATOM 0 HG2 GLN C 470 -17.525 -21.448 6.983 1.00 0.00 H new ATOM 0 HG3 GLN C 470 -17.967 -20.719 5.452 1.00 0.00 H new ATOM 0 HE21 GLN C 470 -20.116 -20.362 6.150 1.00 0.00 H new ATOM 0 HE22 GLN C 470 -21.274 -21.689 6.295 1.00 0.00 H new ATOM 280 N VAL C 471 -15.616 -19.632 4.472 1.00 0.00 N ATOM 281 CA VAL C 471 -15.762 -18.465 3.633 1.00 0.00 C ATOM 282 C VAL C 471 -14.434 -17.702 3.502 1.00 0.00 C ATOM 283 O VAL C 471 -13.835 -17.295 4.498 1.00 0.00 O ATOM 284 CB VAL C 471 -16.898 -17.526 4.144 1.00 0.00 C ATOM 285 CG1 VAL C 471 -16.657 -17.086 5.578 1.00 0.00 C ATOM 286 CG2 VAL C 471 -17.066 -16.324 3.225 1.00 0.00 C ATOM 0 H VAL C 471 -15.395 -19.431 5.447 1.00 0.00 H new ATOM 0 HA VAL C 471 -16.047 -18.815 2.641 1.00 0.00 H new ATOM 0 HB VAL C 471 -17.827 -18.097 4.129 1.00 0.00 H new ATOM 0 HG11 VAL C 471 -17.469 -16.433 5.900 1.00 0.00 H new ATOM 0 HG12 VAL C 471 -16.618 -17.962 6.226 1.00 0.00 H new ATOM 0 HG13 VAL C 471 -15.712 -16.547 5.639 1.00 0.00 H new ATOM 0 HG21 VAL C 471 -17.864 -15.685 3.604 1.00 0.00 H new ATOM 0 HG22 VAL C 471 -16.134 -15.759 3.191 1.00 0.00 H new ATOM 0 HG23 VAL C 471 -17.320 -16.666 2.222 1.00 0.00 H new ATOM 296 N PRO C 472 -13.938 -17.552 2.256 1.00 0.00 N ATOM 297 CA PRO C 472 -12.691 -16.832 1.968 1.00 0.00 C ATOM 298 C PRO C 472 -12.695 -15.408 2.515 1.00 0.00 C ATOM 299 O PRO C 472 -13.681 -14.682 2.379 1.00 0.00 O ATOM 300 CB PRO C 472 -12.640 -16.805 0.438 1.00 0.00 C ATOM 301 CG PRO C 472 -13.442 -17.980 0.022 1.00 0.00 C ATOM 302 CD PRO C 472 -14.544 -18.101 1.034 1.00 0.00 C ATOM 0 HA PRO C 472 -11.832 -17.315 2.434 1.00 0.00 H new ATOM 0 HB2 PRO C 472 -13.057 -15.879 0.043 1.00 0.00 H new ATOM 0 HB3 PRO C 472 -11.615 -16.874 0.073 1.00 0.00 H new ATOM 0 HG2 PRO C 472 -13.846 -17.843 -0.981 1.00 0.00 H new ATOM 0 HG3 PRO C 472 -12.831 -18.882 -0.001 1.00 0.00 H new ATOM 0 HD2 PRO C 472 -15.429 -17.539 0.735 1.00 0.00 H new ATOM 0 HD3 PRO C 472 -14.855 -19.137 1.169 1.00 0.00 H new ATOM 310 N TYR C 473 -11.571 -15.023 3.103 1.00 0.00 N ATOM 311 CA TYR C 473 -11.370 -13.699 3.715 1.00 0.00 C ATOM 312 C TYR C 473 -11.867 -12.546 2.822 1.00 0.00 C ATOM 313 O TYR C 473 -12.533 -11.625 3.297 1.00 0.00 O ATOM 314 CB TYR C 473 -9.877 -13.527 4.046 1.00 0.00 C ATOM 315 CG TYR C 473 -9.458 -12.131 4.456 1.00 0.00 C ATOM 316 CD1 TYR C 473 -9.697 -11.651 5.737 1.00 0.00 C ATOM 317 CD2 TYR C 473 -8.805 -11.299 3.555 1.00 0.00 C ATOM 318 CE1 TYR C 473 -9.301 -10.378 6.105 1.00 0.00 C ATOM 319 CE2 TYR C 473 -8.403 -10.033 3.916 1.00 0.00 C ATOM 320 CZ TYR C 473 -8.652 -9.575 5.187 1.00 0.00 C ATOM 321 OH TYR C 473 -8.246 -8.313 5.544 1.00 0.00 O ATOM 0 H TYR C 473 -10.752 -15.627 3.174 1.00 0.00 H new ATOM 0 HA TYR C 473 -11.967 -13.653 4.626 1.00 0.00 H new ATOM 0 HB2 TYR C 473 -9.619 -14.216 4.850 1.00 0.00 H new ATOM 0 HB3 TYR C 473 -9.293 -13.822 3.174 1.00 0.00 H new ATOM 0 HD1 TYR C 473 -10.199 -12.281 6.456 1.00 0.00 H new ATOM 0 HD2 TYR C 473 -8.609 -11.652 2.553 1.00 0.00 H new ATOM 0 HE1 TYR C 473 -9.498 -10.014 7.103 1.00 0.00 H new ATOM 0 HE2 TYR C 473 -7.894 -9.402 3.203 1.00 0.00 H new ATOM 0 HH TYR C 473 -7.805 -7.883 4.782 1.00 0.00 H new ATOM 331 N HIS C 474 -11.561 -12.611 1.541 1.00 0.00 N ATOM 332 CA HIS C 474 -11.952 -11.557 0.607 1.00 0.00 C ATOM 333 C HIS C 474 -13.458 -11.564 0.360 1.00 0.00 C ATOM 334 O HIS C 474 -14.067 -10.508 0.193 1.00 0.00 O ATOM 335 CB HIS C 474 -11.194 -11.708 -0.704 1.00 0.00 C ATOM 336 CG HIS C 474 -11.386 -10.568 -1.662 1.00 0.00 C ATOM 337 ND1 HIS C 474 -10.508 -9.512 -1.760 1.00 0.00 N ATOM 338 CD2 HIS C 474 -12.363 -10.326 -2.568 1.00 0.00 C ATOM 339 CE1 HIS C 474 -10.938 -8.673 -2.682 1.00 0.00 C ATOM 340 NE2 HIS C 474 -12.059 -9.145 -3.184 1.00 0.00 N ATOM 0 H HIS C 474 -11.043 -13.380 1.117 1.00 0.00 H new ATOM 0 HA HIS C 474 -11.695 -10.597 1.054 1.00 0.00 H new ATOM 0 HB2 HIS C 474 -10.131 -11.809 -0.486 1.00 0.00 H new ATOM 0 HB3 HIS C 474 -11.510 -12.632 -1.189 1.00 0.00 H new ATOM 0 HD2 HIS C 474 -13.222 -10.950 -2.766 1.00 0.00 H new ATOM 0 HE1 HIS C 474 -10.452 -7.754 -2.975 1.00 0.00 H new ATOM 0 HE2 HIS C 474 -12.613 -8.700 -3.916 1.00 0.00 H new ATOM 349 N LEU C 475 -14.058 -12.744 0.339 1.00 0.00 N ATOM 350 CA LEU C 475 -15.495 -12.845 0.148 1.00 0.00 C ATOM 351 C LEU C 475 -16.216 -12.337 1.379 1.00 0.00 C ATOM 352 O LEU C 475 -17.367 -11.907 1.306 1.00 0.00 O ATOM 353 CB LEU C 475 -15.918 -14.278 -0.180 1.00 0.00 C ATOM 354 CG LEU C 475 -15.525 -14.787 -1.572 1.00 0.00 C ATOM 355 CD1 LEU C 475 -16.103 -16.168 -1.821 1.00 0.00 C ATOM 356 CD2 LEU C 475 -15.988 -13.817 -2.650 1.00 0.00 C ATOM 0 H LEU C 475 -13.577 -13.637 0.451 1.00 0.00 H new ATOM 0 HA LEU C 475 -15.771 -12.224 -0.704 1.00 0.00 H new ATOM 0 HB2 LEU C 475 -15.485 -14.945 0.566 1.00 0.00 H new ATOM 0 HB3 LEU C 475 -17.001 -14.349 -0.080 1.00 0.00 H new ATOM 0 HG LEU C 475 -14.438 -14.855 -1.613 1.00 0.00 H new ATOM 0 HD11 LEU C 475 -15.812 -16.510 -2.814 1.00 0.00 H new ATOM 0 HD12 LEU C 475 -15.722 -16.862 -1.072 1.00 0.00 H new ATOM 0 HD13 LEU C 475 -17.190 -16.125 -1.756 1.00 0.00 H new ATOM 0 HD21 LEU C 475 -15.699 -14.197 -3.630 1.00 0.00 H new ATOM 0 HD22 LEU C 475 -17.072 -13.714 -2.606 1.00 0.00 H new ATOM 0 HD23 LEU C 475 -15.525 -12.844 -2.487 1.00 0.00 H new ATOM 368 N VAL C 476 -15.523 -12.376 2.509 1.00 0.00 N ATOM 369 CA VAL C 476 -16.059 -11.838 3.743 1.00 0.00 C ATOM 370 C VAL C 476 -16.023 -10.315 3.659 1.00 0.00 C ATOM 371 O VAL C 476 -17.014 -9.645 3.925 1.00 0.00 O ATOM 372 CB VAL C 476 -15.250 -12.309 4.979 1.00 0.00 C ATOM 373 CG1 VAL C 476 -15.900 -11.834 6.262 1.00 0.00 C ATOM 374 CG2 VAL C 476 -15.110 -13.819 4.993 1.00 0.00 C ATOM 0 H VAL C 476 -14.588 -12.776 2.592 1.00 0.00 H new ATOM 0 HA VAL C 476 -17.080 -12.199 3.865 1.00 0.00 H new ATOM 0 HB VAL C 476 -14.255 -11.870 4.910 1.00 0.00 H new ATOM 0 HG11 VAL C 476 -15.314 -12.177 7.115 1.00 0.00 H new ATOM 0 HG12 VAL C 476 -15.944 -10.745 6.266 1.00 0.00 H new ATOM 0 HG13 VAL C 476 -16.910 -12.238 6.329 1.00 0.00 H new ATOM 0 HG21 VAL C 476 -14.539 -14.123 5.870 1.00 0.00 H new ATOM 0 HG22 VAL C 476 -16.099 -14.276 5.028 1.00 0.00 H new ATOM 0 HG23 VAL C 476 -14.592 -14.145 4.091 1.00 0.00 H new ATOM 384 N LEU C 477 -14.863 -9.788 3.240 1.00 0.00 N ATOM 385 CA LEU C 477 -14.661 -8.345 3.029 1.00 0.00 C ATOM 386 C LEU C 477 -15.778 -7.764 2.166 1.00 0.00 C ATOM 387 O LEU C 477 -16.217 -6.632 2.375 1.00 0.00 O ATOM 388 CB LEU C 477 -13.316 -8.110 2.327 1.00 0.00 C ATOM 389 CG LEU C 477 -12.056 -8.301 3.170 1.00 0.00 C ATOM 390 CD1 LEU C 477 -10.819 -8.117 2.307 1.00 0.00 C ATOM 391 CD2 LEU C 477 -12.032 -7.320 4.327 1.00 0.00 C ATOM 0 H LEU C 477 -14.037 -10.350 3.037 1.00 0.00 H new ATOM 0 HA LEU C 477 -14.669 -7.852 4.001 1.00 0.00 H new ATOM 0 HB2 LEU C 477 -13.257 -8.783 1.471 1.00 0.00 H new ATOM 0 HB3 LEU C 477 -13.311 -7.093 1.934 1.00 0.00 H new ATOM 0 HG LEU C 477 -12.062 -9.313 3.575 1.00 0.00 H new ATOM 0 HD11 LEU C 477 -9.926 -8.255 2.917 1.00 0.00 H new ATOM 0 HD12 LEU C 477 -10.825 -8.851 1.501 1.00 0.00 H new ATOM 0 HD13 LEU C 477 -10.817 -7.113 1.883 1.00 0.00 H new ATOM 0 HD21 LEU C 477 -11.127 -7.473 4.915 1.00 0.00 H new ATOM 0 HD22 LEU C 477 -12.046 -6.301 3.940 1.00 0.00 H new ATOM 0 HD23 LEU C 477 -12.906 -7.481 4.958 1.00 0.00 H new ATOM 403 N GLN C 478 -16.219 -8.558 1.201 1.00 0.00 N ATOM 404 CA GLN C 478 -17.282 -8.186 0.292 1.00 0.00 C ATOM 405 C GLN C 478 -18.536 -7.747 1.050 1.00 0.00 C ATOM 406 O GLN C 478 -19.033 -6.641 0.852 1.00 0.00 O ATOM 407 CB GLN C 478 -17.612 -9.377 -0.600 1.00 0.00 C ATOM 408 CG GLN C 478 -18.714 -9.116 -1.601 1.00 0.00 C ATOM 409 CD GLN C 478 -19.189 -10.380 -2.291 1.00 0.00 C ATOM 410 OE1 GLN C 478 -19.599 -10.352 -3.450 1.00 0.00 O ATOM 411 NE2 GLN C 478 -19.152 -11.496 -1.581 1.00 0.00 N ATOM 0 H GLN C 478 -15.841 -9.490 1.029 1.00 0.00 H new ATOM 0 HA GLN C 478 -16.944 -7.344 -0.311 1.00 0.00 H new ATOM 0 HB2 GLN C 478 -16.712 -9.674 -1.137 1.00 0.00 H new ATOM 0 HB3 GLN C 478 -17.900 -10.219 0.029 1.00 0.00 H new ATOM 0 HG2 GLN C 478 -19.556 -8.645 -1.094 1.00 0.00 H new ATOM 0 HG3 GLN C 478 -18.358 -8.409 -2.351 1.00 0.00 H new ATOM 0 HE21 GLN C 478 -18.805 -11.479 -0.622 1.00 0.00 H new ATOM 0 HE22 GLN C 478 -19.471 -12.373 -1.993 1.00 0.00 H new ATOM 420 N ASP C 479 -19.025 -8.609 1.936 1.00 0.00 N ATOM 421 CA ASP C 479 -20.250 -8.327 2.686 1.00 0.00 C ATOM 422 C ASP C 479 -20.024 -7.225 3.699 1.00 0.00 C ATOM 423 O ASP C 479 -20.941 -6.497 4.054 1.00 0.00 O ATOM 424 CB ASP C 479 -20.754 -9.573 3.388 1.00 0.00 C ATOM 425 CG ASP C 479 -22.170 -9.409 3.917 1.00 0.00 C ATOM 426 OD1 ASP C 479 -22.341 -8.940 5.075 1.00 0.00 O ATOM 427 OD2 ASP C 479 -23.115 -9.749 3.182 1.00 0.00 O ATOM 0 H ASP C 479 -18.595 -9.508 2.154 1.00 0.00 H new ATOM 0 HA ASP C 479 -21.004 -7.997 1.971 1.00 0.00 H new ATOM 0 HB2 ASP C 479 -20.723 -10.414 2.696 1.00 0.00 H new ATOM 0 HB3 ASP C 479 -20.086 -9.816 4.215 1.00 0.00 H new ATOM 432 N LEU C 480 -18.794 -7.081 4.143 1.00 0.00 N ATOM 433 CA LEU C 480 -18.459 -6.043 5.092 1.00 0.00 C ATOM 434 C LEU C 480 -18.499 -4.679 4.429 1.00 0.00 C ATOM 435 O LEU C 480 -18.525 -3.655 5.097 1.00 0.00 O ATOM 436 CB LEU C 480 -17.110 -6.295 5.767 1.00 0.00 C ATOM 437 CG LEU C 480 -17.150 -7.142 7.045 1.00 0.00 C ATOM 438 CD1 LEU C 480 -18.261 -6.684 7.974 1.00 0.00 C ATOM 439 CD2 LEU C 480 -17.325 -8.584 6.713 1.00 0.00 C ATOM 0 H LEU C 480 -18.010 -7.670 3.862 1.00 0.00 H new ATOM 0 HA LEU C 480 -19.212 -6.063 5.879 1.00 0.00 H new ATOM 0 HB2 LEU C 480 -16.452 -6.785 5.049 1.00 0.00 H new ATOM 0 HB3 LEU C 480 -16.659 -5.332 6.006 1.00 0.00 H new ATOM 0 HG LEU C 480 -16.198 -7.010 7.559 1.00 0.00 H new ATOM 0 HD11 LEU C 480 -18.264 -7.303 8.871 1.00 0.00 H new ATOM 0 HD12 LEU C 480 -18.096 -5.643 8.252 1.00 0.00 H new ATOM 0 HD13 LEU C 480 -19.221 -6.776 7.466 1.00 0.00 H new ATOM 0 HD21 LEU C 480 -17.351 -9.169 7.633 1.00 0.00 H new ATOM 0 HD22 LEU C 480 -18.260 -8.721 6.169 1.00 0.00 H new ATOM 0 HD23 LEU C 480 -16.493 -8.918 6.094 1.00 0.00 H new ATOM 451 N GLN C 481 -18.492 -4.674 3.112 1.00 0.00 N ATOM 452 CA GLN C 481 -18.672 -3.458 2.361 1.00 0.00 C ATOM 453 C GLN C 481 -20.147 -3.205 2.154 1.00 0.00 C ATOM 454 O GLN C 481 -20.572 -2.082 1.907 1.00 0.00 O ATOM 455 CB GLN C 481 -17.961 -3.545 1.020 1.00 0.00 C ATOM 456 CG GLN C 481 -16.521 -3.113 1.085 1.00 0.00 C ATOM 457 CD GLN C 481 -16.390 -1.638 1.403 1.00 0.00 C ATOM 458 OE1 GLN C 481 -16.337 -0.795 0.507 1.00 0.00 O ATOM 459 NE2 GLN C 481 -16.363 -1.312 2.676 1.00 0.00 N ATOM 0 H GLN C 481 -18.362 -5.508 2.540 1.00 0.00 H new ATOM 0 HA GLN C 481 -18.239 -2.630 2.922 1.00 0.00 H new ATOM 0 HB2 GLN C 481 -18.010 -4.571 0.656 1.00 0.00 H new ATOM 0 HB3 GLN C 481 -18.488 -2.924 0.295 1.00 0.00 H new ATOM 0 HG2 GLN C 481 -16.001 -3.696 1.845 1.00 0.00 H new ATOM 0 HG3 GLN C 481 -16.035 -3.324 0.133 1.00 0.00 H new ATOM 0 HE21 GLN C 481 -16.409 -2.039 3.390 1.00 0.00 H new ATOM 0 HE22 GLN C 481 -16.296 -0.332 2.950 1.00 0.00 H new ATOM 468 N LEU C 482 -20.923 -4.261 2.280 1.00 0.00 N ATOM 469 CA LEU C 482 -22.346 -4.197 2.078 1.00 0.00 C ATOM 470 C LEU C 482 -23.068 -3.860 3.381 1.00 0.00 C ATOM 471 O LEU C 482 -23.876 -2.933 3.432 1.00 0.00 O ATOM 472 CB LEU C 482 -22.855 -5.541 1.546 1.00 0.00 C ATOM 473 CG LEU C 482 -22.039 -6.177 0.416 1.00 0.00 C ATOM 474 CD1 LEU C 482 -22.731 -7.422 -0.114 1.00 0.00 C ATOM 475 CD2 LEU C 482 -21.782 -5.185 -0.702 1.00 0.00 C ATOM 0 H LEU C 482 -20.578 -5.189 2.526 1.00 0.00 H new ATOM 0 HA LEU C 482 -22.553 -3.410 1.352 1.00 0.00 H new ATOM 0 HB2 LEU C 482 -22.895 -6.245 2.377 1.00 0.00 H new ATOM 0 HB3 LEU C 482 -23.878 -5.405 1.195 1.00 0.00 H new ATOM 0 HG LEU C 482 -21.073 -6.472 0.827 1.00 0.00 H new ATOM 0 HD11 LEU C 482 -22.134 -7.857 -0.915 1.00 0.00 H new ATOM 0 HD12 LEU C 482 -22.841 -8.148 0.692 1.00 0.00 H new ATOM 0 HD13 LEU C 482 -23.715 -7.155 -0.499 1.00 0.00 H new ATOM 0 HD21 LEU C 482 -21.201 -5.666 -1.489 1.00 0.00 H new ATOM 0 HD22 LEU C 482 -22.733 -4.843 -1.111 1.00 0.00 H new ATOM 0 HD23 LEU C 482 -21.227 -4.332 -0.311 1.00 0.00 H new ATOM 487 N THR C 483 -22.767 -4.609 4.433 1.00 0.00 N ATOM 488 CA THR C 483 -23.446 -4.429 5.700 1.00 0.00 C ATOM 489 C THR C 483 -22.571 -3.731 6.729 1.00 0.00 C ATOM 490 O THR C 483 -23.078 -3.017 7.600 1.00 0.00 O ATOM 491 CB THR C 483 -23.905 -5.778 6.270 1.00 0.00 C ATOM 492 OG1 THR C 483 -22.767 -6.637 6.446 1.00 0.00 O ATOM 493 CG2 THR C 483 -24.899 -6.439 5.335 1.00 0.00 C ATOM 0 H THR C 483 -22.059 -5.343 4.430 1.00 0.00 H new ATOM 0 HA THR C 483 -24.311 -3.797 5.498 1.00 0.00 H new ATOM 0 HB THR C 483 -24.389 -5.606 7.231 1.00 0.00 H new ATOM 0 HG1 THR C 483 -22.840 -7.404 5.841 1.00 0.00 H new ATOM 0 HG21 THR C 483 -25.214 -7.394 5.755 1.00 0.00 H new ATOM 0 HG22 THR C 483 -25.768 -5.793 5.212 1.00 0.00 H new ATOM 0 HG23 THR C 483 -24.431 -6.606 4.365 1.00 0.00 H new ATOM 501 N ARG C 484 -21.248 -3.938 6.627 1.00 0.00 N ATOM 502 CA ARG C 484 -20.286 -3.369 7.572 1.00 0.00 C ATOM 503 C ARG C 484 -20.518 -3.900 8.989 1.00 0.00 C ATOM 504 O ARG C 484 -20.012 -3.343 9.968 1.00 0.00 O ATOM 505 CB ARG C 484 -20.363 -1.852 7.556 1.00 0.00 C ATOM 506 CG ARG C 484 -20.178 -1.253 6.182 1.00 0.00 C ATOM 507 CD ARG C 484 -20.331 0.243 6.214 1.00 0.00 C ATOM 508 NE ARG C 484 -21.666 0.651 6.663 1.00 0.00 N ATOM 509 CZ ARG C 484 -21.994 1.894 7.032 1.00 0.00 C ATOM 510 NH1 ARG C 484 -21.092 2.868 6.983 1.00 0.00 N ATOM 511 NH2 ARG C 484 -23.224 2.163 7.440 1.00 0.00 N ATOM 0 H ARG C 484 -20.822 -4.501 5.891 1.00 0.00 H new ATOM 0 HA ARG C 484 -19.288 -3.675 7.259 1.00 0.00 H new ATOM 0 HB2 ARG C 484 -21.330 -1.541 7.952 1.00 0.00 H new ATOM 0 HB3 ARG C 484 -19.601 -1.451 8.224 1.00 0.00 H new ATOM 0 HG2 ARG C 484 -19.191 -1.512 5.800 1.00 0.00 H new ATOM 0 HG3 ARG C 484 -20.908 -1.681 5.495 1.00 0.00 H new ATOM 0 HD2 ARG C 484 -19.579 0.670 6.878 1.00 0.00 H new ATOM 0 HD3 ARG C 484 -20.144 0.648 5.219 1.00 0.00 H new ATOM 0 HE ARG C 484 -22.395 -0.062 6.696 1.00 0.00 H new ATOM 0 HH11 ARG C 484 -20.144 2.670 6.663 1.00 0.00 H new ATOM 0 HH12 ARG C 484 -21.347 3.814 7.266 1.00 0.00 H new ATOM 0 HH21 ARG C 484 -23.924 1.422 7.473 1.00 0.00 H new ATOM 0 HH22 ARG C 484 -23.472 3.112 7.721 1.00 0.00 H new ATOM 525 N SER C 485 -21.259 -4.994 9.084 1.00 0.00 N ATOM 526 CA SER C 485 -21.583 -5.594 10.358 1.00 0.00 C ATOM 527 C SER C 485 -21.282 -7.072 10.326 1.00 0.00 C ATOM 528 O SER C 485 -21.995 -7.835 9.675 1.00 0.00 O ATOM 529 CB SER C 485 -23.061 -5.383 10.680 1.00 0.00 C ATOM 530 OG SER C 485 -23.379 -5.879 11.972 1.00 0.00 O ATOM 0 H SER C 485 -21.649 -5.485 8.280 1.00 0.00 H new ATOM 0 HA SER C 485 -20.977 -5.119 11.129 1.00 0.00 H new ATOM 0 HB2 SER C 485 -23.300 -4.321 10.626 1.00 0.00 H new ATOM 0 HB3 SER C 485 -23.675 -5.886 9.933 1.00 0.00 H new ATOM 0 HG SER C 485 -24.282 -5.591 12.220 1.00 0.00 H new ATOM 536 N VAL C 486 -20.232 -7.483 11.024 1.00 0.00 N ATOM 537 CA VAL C 486 -19.844 -8.882 11.065 1.00 0.00 C ATOM 538 C VAL C 486 -20.972 -9.770 11.585 1.00 0.00 C ATOM 539 O VAL C 486 -21.093 -10.929 11.182 1.00 0.00 O ATOM 540 CB VAL C 486 -18.569 -9.113 11.908 1.00 0.00 C ATOM 541 CG1 VAL C 486 -17.446 -8.233 11.429 1.00 0.00 C ATOM 542 CG2 VAL C 486 -18.821 -8.905 13.385 1.00 0.00 C ATOM 0 H VAL C 486 -19.634 -6.864 11.570 1.00 0.00 H new ATOM 0 HA VAL C 486 -19.626 -9.161 10.034 1.00 0.00 H new ATOM 0 HB VAL C 486 -18.276 -10.154 11.773 1.00 0.00 H new ATOM 0 HG11 VAL C 486 -16.559 -8.412 12.036 1.00 0.00 H new ATOM 0 HG12 VAL C 486 -17.224 -8.461 10.387 1.00 0.00 H new ATOM 0 HG13 VAL C 486 -17.741 -7.187 11.517 1.00 0.00 H new ATOM 0 HG21 VAL C 486 -17.899 -9.078 13.939 1.00 0.00 H new ATOM 0 HG22 VAL C 486 -19.161 -7.884 13.556 1.00 0.00 H new ATOM 0 HG23 VAL C 486 -19.585 -9.604 13.726 1.00 0.00 H new ATOM 552 N GLU C 487 -21.806 -9.220 12.464 1.00 0.00 N ATOM 553 CA GLU C 487 -22.924 -9.960 13.021 1.00 0.00 C ATOM 554 C GLU C 487 -23.912 -10.308 11.922 1.00 0.00 C ATOM 555 O GLU C 487 -24.448 -11.422 11.878 1.00 0.00 O ATOM 556 CB GLU C 487 -23.608 -9.150 14.120 1.00 0.00 C ATOM 557 CG GLU C 487 -22.670 -8.730 15.241 1.00 0.00 C ATOM 558 CD GLU C 487 -22.015 -9.907 15.939 1.00 0.00 C ATOM 559 OE1 GLU C 487 -22.612 -10.440 16.896 1.00 0.00 O ATOM 560 OE2 GLU C 487 -20.890 -10.291 15.545 1.00 0.00 O ATOM 0 H GLU C 487 -21.724 -8.262 12.804 1.00 0.00 H new ATOM 0 HA GLU C 487 -22.550 -10.884 13.463 1.00 0.00 H new ATOM 0 HB2 GLU C 487 -24.055 -8.259 13.678 1.00 0.00 H new ATOM 0 HB3 GLU C 487 -24.422 -9.740 14.541 1.00 0.00 H new ATOM 0 HG2 GLU C 487 -21.896 -8.079 14.835 1.00 0.00 H new ATOM 0 HG3 GLU C 487 -23.227 -8.145 15.973 1.00 0.00 H new ATOM 567 N ILE C 488 -24.133 -9.357 11.020 1.00 0.00 N ATOM 568 CA ILE C 488 -25.008 -9.578 9.892 1.00 0.00 C ATOM 569 C ILE C 488 -24.311 -10.467 8.883 1.00 0.00 C ATOM 570 O ILE C 488 -24.850 -11.454 8.477 1.00 0.00 O ATOM 571 CB ILE C 488 -25.422 -8.259 9.205 1.00 0.00 C ATOM 572 CG1 ILE C 488 -26.018 -7.285 10.229 1.00 0.00 C ATOM 573 CG2 ILE C 488 -26.428 -8.540 8.094 1.00 0.00 C ATOM 574 CD1 ILE C 488 -26.469 -5.964 9.635 1.00 0.00 C ATOM 0 H ILE C 488 -23.714 -8.428 11.055 1.00 0.00 H new ATOM 0 HA ILE C 488 -25.913 -10.055 10.267 1.00 0.00 H new ATOM 0 HB ILE C 488 -24.535 -7.800 8.768 1.00 0.00 H new ATOM 0 HG12 ILE C 488 -26.869 -7.762 10.716 1.00 0.00 H new ATOM 0 HG13 ILE C 488 -25.276 -7.089 11.003 1.00 0.00 H new ATOM 0 HG21 ILE C 488 -26.713 -7.603 7.616 1.00 0.00 H new ATOM 0 HG22 ILE C 488 -25.978 -9.202 7.354 1.00 0.00 H new ATOM 0 HG23 ILE C 488 -27.313 -9.016 8.516 1.00 0.00 H new ATOM 0 HD11 ILE C 488 -26.878 -5.332 10.423 1.00 0.00 H new ATOM 0 HD12 ILE C 488 -25.618 -5.463 9.173 1.00 0.00 H new ATOM 0 HD13 ILE C 488 -27.235 -6.147 8.882 1.00 0.00 H new ATOM 586 N THR C 489 -23.092 -10.088 8.509 1.00 0.00 N ATOM 587 CA THR C 489 -22.254 -10.848 7.586 1.00 0.00 C ATOM 588 C THR C 489 -22.241 -12.352 7.914 1.00 0.00 C ATOM 589 O THR C 489 -22.345 -13.182 7.020 1.00 0.00 O ATOM 590 CB THR C 489 -20.817 -10.299 7.611 1.00 0.00 C ATOM 591 OG1 THR C 489 -20.841 -8.899 7.321 1.00 0.00 O ATOM 592 CG2 THR C 489 -19.933 -11.002 6.596 1.00 0.00 C ATOM 0 H THR C 489 -22.652 -9.231 8.844 1.00 0.00 H new ATOM 0 HA THR C 489 -22.680 -10.733 6.589 1.00 0.00 H new ATOM 0 HB THR C 489 -20.404 -10.477 8.604 1.00 0.00 H new ATOM 0 HG1 THR C 489 -21.251 -8.754 6.443 1.00 0.00 H new ATOM 0 HG21 THR C 489 -18.926 -10.588 6.642 1.00 0.00 H new ATOM 0 HG22 THR C 489 -19.898 -12.068 6.821 1.00 0.00 H new ATOM 0 HG23 THR C 489 -20.340 -10.855 5.596 1.00 0.00 H new ATOM 600 N THR C 490 -22.134 -12.690 9.196 1.00 0.00 N ATOM 601 CA THR C 490 -22.130 -14.085 9.612 1.00 0.00 C ATOM 602 C THR C 490 -23.469 -14.743 9.273 1.00 0.00 C ATOM 603 O THR C 490 -23.512 -15.849 8.730 1.00 0.00 O ATOM 604 CB THR C 490 -21.859 -14.217 11.124 1.00 0.00 C ATOM 605 OG1 THR C 490 -20.652 -13.513 11.466 1.00 0.00 O ATOM 606 CG2 THR C 490 -21.712 -15.673 11.508 1.00 0.00 C ATOM 0 H THR C 490 -22.049 -12.019 9.960 1.00 0.00 H new ATOM 0 HA THR C 490 -21.329 -14.590 9.072 1.00 0.00 H new ATOM 0 HB THR C 490 -22.702 -13.788 11.666 1.00 0.00 H new ATOM 0 HG1 THR C 490 -20.873 -12.598 11.738 1.00 0.00 H new ATOM 0 HG21 THR C 490 -21.521 -15.749 12.578 1.00 0.00 H new ATOM 0 HG22 THR C 490 -22.630 -16.208 11.264 1.00 0.00 H new ATOM 0 HG23 THR C 490 -20.879 -16.112 10.959 1.00 0.00 H new ATOM 614 N ASP C 491 -24.552 -14.038 9.566 1.00 0.00 N ATOM 615 CA ASP C 491 -25.894 -14.536 9.272 1.00 0.00 C ATOM 616 C ASP C 491 -26.116 -14.505 7.772 1.00 0.00 C ATOM 617 O ASP C 491 -26.775 -15.369 7.205 1.00 0.00 O ATOM 618 CB ASP C 491 -26.946 -13.686 9.983 1.00 0.00 C ATOM 619 CG ASP C 491 -28.320 -14.319 9.952 1.00 0.00 C ATOM 620 OD1 ASP C 491 -28.494 -15.396 10.572 1.00 0.00 O ATOM 621 OD2 ASP C 491 -29.233 -13.742 9.325 1.00 0.00 O ATOM 0 H ASP C 491 -24.531 -13.119 10.007 1.00 0.00 H new ATOM 0 HA ASP C 491 -25.987 -15.561 9.632 1.00 0.00 H new ATOM 0 HB2 ASP C 491 -26.644 -13.531 11.019 1.00 0.00 H new ATOM 0 HB3 ASP C 491 -26.992 -12.703 9.514 1.00 0.00 H new ATOM 626 N ASN C 492 -25.531 -13.499 7.144 1.00 0.00 N ATOM 627 CA ASN C 492 -25.556 -13.331 5.711 1.00 0.00 C ATOM 628 C ASN C 492 -24.975 -14.563 5.035 1.00 0.00 C ATOM 629 O ASN C 492 -25.554 -15.100 4.088 1.00 0.00 O ATOM 630 CB ASN C 492 -24.773 -12.068 5.315 1.00 0.00 C ATOM 631 CG ASN C 492 -25.670 -10.869 5.105 1.00 0.00 C ATOM 632 OD1 ASN C 492 -26.849 -11.004 4.772 1.00 0.00 O ATOM 633 ND2 ASN C 492 -25.117 -9.691 5.254 1.00 0.00 N ATOM 0 H ASN C 492 -25.017 -12.765 7.631 1.00 0.00 H new ATOM 0 HA ASN C 492 -26.588 -13.211 5.381 1.00 0.00 H new ATOM 0 HB2 ASN C 492 -24.043 -11.839 6.092 1.00 0.00 H new ATOM 0 HB3 ASN C 492 -24.214 -12.264 4.400 1.00 0.00 H new ATOM 0 HD21 ASN C 492 -25.665 -8.846 5.093 1.00 0.00 H new ATOM 0 HD22 ASN C 492 -24.138 -9.619 5.531 1.00 0.00 H new ATOM 640 N ILE C 493 -23.829 -15.022 5.542 1.00 0.00 N ATOM 641 CA ILE C 493 -23.199 -16.246 5.058 1.00 0.00 C ATOM 642 C ILE C 493 -24.192 -17.398 5.152 1.00 0.00 C ATOM 643 O ILE C 493 -24.388 -18.157 4.203 1.00 0.00 O ATOM 644 CB ILE C 493 -21.964 -16.626 5.924 1.00 0.00 C ATOM 645 CG1 ILE C 493 -20.918 -15.529 5.918 1.00 0.00 C ATOM 646 CG2 ILE C 493 -21.351 -17.931 5.446 1.00 0.00 C ATOM 647 CD1 ILE C 493 -19.847 -15.719 6.974 1.00 0.00 C ATOM 0 H ILE C 493 -23.317 -14.559 6.293 1.00 0.00 H new ATOM 0 HA ILE C 493 -22.885 -16.071 4.029 1.00 0.00 H new ATOM 0 HB ILE C 493 -22.315 -16.753 6.948 1.00 0.00 H new ATOM 0 HG12 ILE C 493 -20.447 -15.490 4.936 1.00 0.00 H new ATOM 0 HG13 ILE C 493 -21.408 -14.568 6.075 1.00 0.00 H new ATOM 0 HG21 ILE C 493 -20.489 -18.177 6.066 1.00 0.00 H new ATOM 0 HG22 ILE C 493 -22.090 -18.729 5.520 1.00 0.00 H new ATOM 0 HG23 ILE C 493 -21.033 -17.825 4.409 1.00 0.00 H new ATOM 0 HD11 ILE C 493 -19.130 -14.900 6.916 1.00 0.00 H new ATOM 0 HD12 ILE C 493 -20.308 -15.729 7.962 1.00 0.00 H new ATOM 0 HD13 ILE C 493 -19.332 -16.665 6.804 1.00 0.00 H new ATOM 659 N LEU C 494 -24.828 -17.488 6.306 1.00 0.00 N ATOM 660 CA LEU C 494 -25.764 -18.551 6.627 1.00 0.00 C ATOM 661 C LEU C 494 -27.027 -18.502 5.760 1.00 0.00 C ATOM 662 O LEU C 494 -27.683 -19.524 5.556 1.00 0.00 O ATOM 663 CB LEU C 494 -26.112 -18.481 8.112 1.00 0.00 C ATOM 664 CG LEU C 494 -24.920 -18.666 9.059 1.00 0.00 C ATOM 665 CD1 LEU C 494 -25.305 -18.346 10.490 1.00 0.00 C ATOM 666 CD2 LEU C 494 -24.369 -20.078 8.956 1.00 0.00 C ATOM 0 H LEU C 494 -24.706 -16.812 7.060 1.00 0.00 H new ATOM 0 HA LEU C 494 -25.284 -19.505 6.408 1.00 0.00 H new ATOM 0 HB2 LEU C 494 -26.575 -17.516 8.318 1.00 0.00 H new ATOM 0 HB3 LEU C 494 -26.856 -19.246 8.333 1.00 0.00 H new ATOM 0 HG LEU C 494 -24.139 -17.968 8.757 1.00 0.00 H new ATOM 0 HD11 LEU C 494 -24.441 -18.486 11.139 1.00 0.00 H new ATOM 0 HD12 LEU C 494 -25.643 -17.312 10.553 1.00 0.00 H new ATOM 0 HD13 LEU C 494 -26.109 -19.010 10.808 1.00 0.00 H new ATOM 0 HD21 LEU C 494 -23.524 -20.189 9.635 1.00 0.00 H new ATOM 0 HD22 LEU C 494 -25.147 -20.793 9.224 1.00 0.00 H new ATOM 0 HD23 LEU C 494 -24.040 -20.267 7.934 1.00 0.00 H new ATOM 678 N GLU C 495 -27.370 -17.326 5.255 1.00 0.00 N ATOM 679 CA GLU C 495 -28.529 -17.191 4.377 1.00 0.00 C ATOM 680 C GLU C 495 -28.152 -17.468 2.934 1.00 0.00 C ATOM 681 O GLU C 495 -29.019 -17.609 2.070 1.00 0.00 O ATOM 682 CB GLU C 495 -29.139 -15.799 4.472 1.00 0.00 C ATOM 683 CG GLU C 495 -29.713 -15.458 5.825 1.00 0.00 C ATOM 684 CD GLU C 495 -30.596 -14.243 5.762 1.00 0.00 C ATOM 685 OE1 GLU C 495 -30.064 -13.117 5.708 1.00 0.00 O ATOM 686 OE2 GLU C 495 -31.835 -14.406 5.738 1.00 0.00 O ATOM 0 H GLU C 495 -26.868 -16.456 5.435 1.00 0.00 H new ATOM 0 HA GLU C 495 -29.265 -17.924 4.707 1.00 0.00 H new ATOM 0 HB2 GLU C 495 -28.375 -15.063 4.220 1.00 0.00 H new ATOM 0 HB3 GLU C 495 -29.927 -15.710 3.724 1.00 0.00 H new ATOM 0 HG2 GLU C 495 -30.286 -16.305 6.202 1.00 0.00 H new ATOM 0 HG3 GLU C 495 -28.902 -15.282 6.531 1.00 0.00 H new ATOM 693 N GLY C 496 -26.864 -17.539 2.673 1.00 0.00 N ATOM 694 CA GLY C 496 -26.400 -17.772 1.326 1.00 0.00 C ATOM 695 C GLY C 496 -26.131 -16.480 0.591 1.00 0.00 C ATOM 696 O GLY C 496 -26.095 -16.451 -0.638 1.00 0.00 O ATOM 0 H GLY C 496 -26.127 -17.439 3.371 1.00 0.00 H new ATOM 0 HA2 GLY C 496 -25.489 -18.370 1.354 1.00 0.00 H new ATOM 0 HA3 GLY C 496 -27.145 -18.352 0.781 1.00 0.00 H new ATOM 700 N ARG C 497 -25.956 -15.401 1.347 1.00 0.00 N ATOM 701 CA ARG C 497 -25.652 -14.098 0.771 1.00 0.00 C ATOM 702 C ARG C 497 -24.285 -14.138 0.119 1.00 0.00 C ATOM 703 O ARG C 497 -24.058 -13.536 -0.927 1.00 0.00 O ATOM 704 CB ARG C 497 -25.671 -13.018 1.859 1.00 0.00 C ATOM 705 CG ARG C 497 -25.378 -11.603 1.353 1.00 0.00 C ATOM 706 CD ARG C 497 -26.593 -10.963 0.676 1.00 0.00 C ATOM 707 NE ARG C 497 -27.161 -11.797 -0.391 1.00 0.00 N ATOM 708 CZ ARG C 497 -26.984 -11.593 -1.700 1.00 0.00 C ATOM 709 NH1 ARG C 497 -26.230 -10.582 -2.131 1.00 0.00 N ATOM 710 NH2 ARG C 497 -27.559 -12.404 -2.578 1.00 0.00 N ATOM 0 H ARG C 497 -26.020 -15.405 2.365 1.00 0.00 H new ATOM 0 HA ARG C 497 -26.407 -13.858 0.023 1.00 0.00 H new ATOM 0 HB2 ARG C 497 -26.649 -13.023 2.341 1.00 0.00 H new ATOM 0 HB3 ARG C 497 -24.938 -13.276 2.623 1.00 0.00 H new ATOM 0 HG2 ARG C 497 -25.061 -10.979 2.189 1.00 0.00 H new ATOM 0 HG3 ARG C 497 -24.548 -11.637 0.647 1.00 0.00 H new ATOM 0 HD2 ARG C 497 -27.360 -10.770 1.426 1.00 0.00 H new ATOM 0 HD3 ARG C 497 -26.304 -9.998 0.260 1.00 0.00 H new ATOM 0 HE ARG C 497 -27.735 -12.593 -0.112 1.00 0.00 H new ATOM 0 HH11 ARG C 497 -25.783 -9.957 -1.460 1.00 0.00 H new ATOM 0 HH12 ARG C 497 -26.100 -10.433 -3.132 1.00 0.00 H new ATOM 0 HH21 ARG C 497 -28.135 -13.181 -2.254 1.00 0.00 H new ATOM 0 HH22 ARG C 497 -27.426 -12.251 -3.578 1.00 0.00 H new ATOM 724 N ILE C 498 -23.389 -14.863 0.748 1.00 0.00 N ATOM 725 CA ILE C 498 -22.043 -15.014 0.269 1.00 0.00 C ATOM 726 C ILE C 498 -21.858 -16.433 -0.234 1.00 0.00 C ATOM 727 O ILE C 498 -22.270 -17.387 0.431 1.00 0.00 O ATOM 728 CB ILE C 498 -21.025 -14.724 1.397 1.00 0.00 C ATOM 729 CG1 ILE C 498 -21.324 -13.362 2.035 1.00 0.00 C ATOM 730 CG2 ILE C 498 -19.603 -14.757 0.856 1.00 0.00 C ATOM 731 CD1 ILE C 498 -20.537 -13.086 3.295 1.00 0.00 C ATOM 0 H ILE C 498 -23.580 -15.367 1.614 1.00 0.00 H new ATOM 0 HA ILE C 498 -21.870 -14.303 -0.539 1.00 0.00 H new ATOM 0 HB ILE C 498 -21.118 -15.498 2.159 1.00 0.00 H new ATOM 0 HG12 ILE C 498 -21.113 -12.578 1.308 1.00 0.00 H new ATOM 0 HG13 ILE C 498 -22.388 -13.306 2.264 1.00 0.00 H new ATOM 0 HG21 ILE C 498 -18.901 -14.551 1.664 1.00 0.00 H new ATOM 0 HG22 ILE C 498 -19.396 -15.742 0.438 1.00 0.00 H new ATOM 0 HG23 ILE C 498 -19.492 -14.002 0.078 1.00 0.00 H new ATOM 0 HD11 ILE C 498 -20.806 -12.104 3.684 1.00 0.00 H new ATOM 0 HD12 ILE C 498 -20.766 -13.847 4.041 1.00 0.00 H new ATOM 0 HD13 ILE C 498 -19.471 -13.108 3.070 1.00 0.00 H new ATOM 743 N GLN C 499 -21.263 -16.572 -1.402 1.00 0.00 N ATOM 744 CA GLN C 499 -21.064 -17.880 -2.002 1.00 0.00 C ATOM 745 C GLN C 499 -19.981 -18.659 -1.267 1.00 0.00 C ATOM 746 O GLN C 499 -18.786 -18.402 -1.440 1.00 0.00 O ATOM 747 CB GLN C 499 -20.695 -17.747 -3.482 1.00 0.00 C ATOM 748 CG GLN C 499 -21.737 -17.022 -4.319 1.00 0.00 C ATOM 749 CD GLN C 499 -21.344 -16.916 -5.784 1.00 0.00 C ATOM 750 OE1 GLN C 499 -22.201 -16.881 -6.668 1.00 0.00 O ATOM 751 NE2 GLN C 499 -20.050 -16.865 -6.052 1.00 0.00 N ATOM 0 H GLN C 499 -20.907 -15.794 -1.957 1.00 0.00 H new ATOM 0 HA GLN C 499 -22.003 -18.428 -1.920 1.00 0.00 H new ATOM 0 HB2 GLN C 499 -19.746 -17.216 -3.563 1.00 0.00 H new ATOM 0 HB3 GLN C 499 -20.539 -18.743 -3.897 1.00 0.00 H new ATOM 0 HG2 GLN C 499 -22.689 -17.546 -4.240 1.00 0.00 H new ATOM 0 HG3 GLN C 499 -21.889 -16.021 -3.915 1.00 0.00 H new ATOM 0 HE21 GLN C 499 -19.370 -16.897 -5.292 1.00 0.00 H new ATOM 0 HE22 GLN C 499 -19.732 -16.794 -7.018 1.00 0.00 H new ATOM 760 N VAL C 500 -20.405 -19.601 -0.446 1.00 0.00 N ATOM 761 CA VAL C 500 -19.489 -20.444 0.293 1.00 0.00 C ATOM 762 C VAL C 500 -18.995 -21.583 -0.597 1.00 0.00 C ATOM 763 O VAL C 500 -19.795 -22.383 -1.085 1.00 0.00 O ATOM 764 CB VAL C 500 -20.163 -21.032 1.555 1.00 0.00 C ATOM 765 CG1 VAL C 500 -19.202 -21.934 2.313 1.00 0.00 C ATOM 766 CG2 VAL C 500 -20.668 -19.917 2.456 1.00 0.00 C ATOM 0 H VAL C 500 -21.390 -19.802 -0.274 1.00 0.00 H new ATOM 0 HA VAL C 500 -18.646 -19.829 0.607 1.00 0.00 H new ATOM 0 HB VAL C 500 -21.014 -21.634 1.236 1.00 0.00 H new ATOM 0 HG11 VAL C 500 -19.699 -22.335 3.196 1.00 0.00 H new ATOM 0 HG12 VAL C 500 -18.889 -22.755 1.668 1.00 0.00 H new ATOM 0 HG13 VAL C 500 -18.328 -21.359 2.619 1.00 0.00 H new ATOM 0 HG21 VAL C 500 -21.139 -20.348 3.339 1.00 0.00 H new ATOM 0 HG22 VAL C 500 -19.831 -19.289 2.761 1.00 0.00 H new ATOM 0 HG23 VAL C 500 -21.396 -19.313 1.914 1.00 0.00 H new ATOM 776 N PRO C 501 -17.675 -21.655 -0.839 1.00 0.00 N ATOM 777 CA PRO C 501 -17.084 -22.694 -1.674 1.00 0.00 C ATOM 778 C PRO C 501 -17.137 -24.067 -1.021 1.00 0.00 C ATOM 779 O PRO C 501 -16.902 -24.215 0.184 1.00 0.00 O ATOM 780 CB PRO C 501 -15.620 -22.252 -1.840 1.00 0.00 C ATOM 781 CG PRO C 501 -15.574 -20.849 -1.346 1.00 0.00 C ATOM 782 CD PRO C 501 -16.660 -20.737 -0.327 1.00 0.00 C ATOM 0 HA PRO C 501 -17.623 -22.797 -2.616 1.00 0.00 H new ATOM 0 HB2 PRO C 501 -14.949 -22.892 -1.268 1.00 0.00 H new ATOM 0 HB3 PRO C 501 -15.307 -22.312 -2.882 1.00 0.00 H new ATOM 0 HG2 PRO C 501 -14.602 -20.621 -0.908 1.00 0.00 H new ATOM 0 HG3 PRO C 501 -15.729 -20.143 -2.161 1.00 0.00 H new ATOM 0 HD2 PRO C 501 -16.316 -21.027 0.666 1.00 0.00 H new ATOM 0 HD3 PRO C 501 -17.038 -19.718 -0.248 1.00 0.00 H new ATOM 790 N PHE C 502 -17.464 -25.058 -1.817 1.00 0.00 N ATOM 791 CA PHE C 502 -17.502 -26.434 -1.370 1.00 0.00 C ATOM 792 C PHE C 502 -16.937 -27.332 -2.463 1.00 0.00 C ATOM 793 O PHE C 502 -16.955 -26.952 -3.633 1.00 0.00 O ATOM 794 CB PHE C 502 -18.938 -26.855 -1.011 1.00 0.00 C ATOM 795 CG PHE C 502 -19.949 -26.607 -2.093 1.00 0.00 C ATOM 796 CD1 PHE C 502 -20.585 -25.387 -2.182 1.00 0.00 C ATOM 797 CD2 PHE C 502 -20.267 -27.592 -3.014 1.00 0.00 C ATOM 798 CE1 PHE C 502 -21.521 -25.147 -3.168 1.00 0.00 C ATOM 799 CE2 PHE C 502 -21.200 -27.360 -4.003 1.00 0.00 C ATOM 800 CZ PHE C 502 -21.830 -26.136 -4.080 1.00 0.00 C ATOM 0 H PHE C 502 -17.713 -24.933 -2.798 1.00 0.00 H new ATOM 0 HA PHE C 502 -16.894 -26.533 -0.471 1.00 0.00 H new ATOM 0 HB2 PHE C 502 -18.941 -27.917 -0.765 1.00 0.00 H new ATOM 0 HB3 PHE C 502 -19.246 -26.319 -0.113 1.00 0.00 H new ATOM 0 HD1 PHE C 502 -20.348 -24.609 -1.471 1.00 0.00 H new ATOM 0 HD2 PHE C 502 -19.778 -28.553 -2.957 1.00 0.00 H new ATOM 0 HE1 PHE C 502 -22.011 -24.186 -3.226 1.00 0.00 H new ATOM 0 HE2 PHE C 502 -21.437 -28.136 -4.716 1.00 0.00 H new ATOM 0 HZ PHE C 502 -22.563 -25.952 -4.851 1.00 0.00 H new ATOM 810 N PRO C 503 -16.399 -28.511 -2.107 1.00 0.00 N ATOM 811 CA PRO C 503 -15.858 -29.452 -3.096 1.00 0.00 C ATOM 812 C PRO C 503 -16.908 -29.833 -4.138 1.00 0.00 C ATOM 813 O PRO C 503 -17.991 -30.329 -3.794 1.00 0.00 O ATOM 814 CB PRO C 503 -15.480 -30.679 -2.254 1.00 0.00 C ATOM 815 CG PRO C 503 -15.288 -30.148 -0.877 1.00 0.00 C ATOM 816 CD PRO C 503 -16.261 -29.015 -0.730 1.00 0.00 C ATOM 0 HA PRO C 503 -15.022 -29.031 -3.654 1.00 0.00 H new ATOM 0 HB2 PRO C 503 -16.265 -31.435 -2.281 1.00 0.00 H new ATOM 0 HB3 PRO C 503 -14.571 -31.150 -2.627 1.00 0.00 H new ATOM 0 HG2 PRO C 503 -15.474 -30.921 -0.131 1.00 0.00 H new ATOM 0 HG3 PRO C 503 -14.264 -29.804 -0.731 1.00 0.00 H new ATOM 0 HD2 PRO C 503 -17.216 -29.353 -0.327 1.00 0.00 H new ATOM 0 HD3 PRO C 503 -15.885 -28.246 -0.055 1.00 0.00 H new ATOM 824 N THR C 504 -16.596 -29.589 -5.401 1.00 0.00 N ATOM 825 CA THR C 504 -17.502 -29.893 -6.482 1.00 0.00 C ATOM 826 C THR C 504 -16.784 -29.759 -7.842 1.00 0.00 C ATOM 827 O THR C 504 -16.707 -30.770 -8.577 1.00 0.00 O ATOM 828 CB THR C 504 -18.797 -29.003 -6.421 1.00 0.00 C ATOM 829 OG1 THR C 504 -19.767 -29.458 -7.369 1.00 0.00 O ATOM 830 CG2 THR C 504 -18.496 -27.527 -6.673 1.00 0.00 C ATOM 831 OXT THR C 504 -16.257 -28.664 -8.147 1.00 0.00 O ATOM 0 H THR C 504 -15.711 -29.177 -5.698 1.00 0.00 H new ATOM 0 HA THR C 504 -17.825 -30.928 -6.371 1.00 0.00 H new ATOM 0 HB THR C 504 -19.196 -29.099 -5.411 1.00 0.00 H new ATOM 0 HG1 THR C 504 -20.566 -28.894 -7.316 1.00 0.00 H new ATOM 0 HG21 THR C 504 -19.421 -26.953 -6.621 1.00 0.00 H new ATOM 0 HG22 THR C 504 -17.800 -27.163 -5.917 1.00 0.00 H new ATOM 0 HG23 THR C 504 -18.052 -27.410 -7.661 1.00 0.00 H new TER 839 THR C 504