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 -126:sc= 0.599 USER MOD Set 1.2: C 489 THR OG1 : rot -64:sc= 1.25 USER MOD Set 2.1: C 462 HIS : no HD1:sc= -0.443 K(o=-0.99,f=-0.14) USER MOD Set 2.2: C 463 GLN : amide:sc= -0.542 K(o=-0.99,f=-0.31) USER MOD Set 3.1: C 454 ASN : amide:sc=-0.000741 X(o=-1.5,f=-1.5) USER MOD Set 3.2: C 458 ASN : amide:sc= -1.5 K(o=-1.5,f=-3.8!) USER MOD Single : C 453 SER OG : rot 38:sc= 0.139 USER MOD Single : C 455 SER OG : rot 180:sc= 0 USER MOD Single : C 456 GLN : amide:sc= -0.213 X(o=-0.21,f=-0.44) USER MOD Single : C 460 MET CE :methyl 165:sc= -3.53! (180deg=-4.8!) USER MOD Single : C 465 GLN : amide:sc= -0.245 K(o=-0.24,f=-0.88) USER MOD Single : C 467 MET CE :methyl 178:sc= -1.34 (180deg=-1.38) USER MOD Single : C 470 GLN : amide:sc= -0.236 K(o=-0.24,f=-0.75) USER MOD Single : C 473 TYR OH : rot 54:sc= 0.376 USER MOD Single : C 474 HIS : no HD1:sc= 0 X(o=0,f=-0.0057) USER MOD Single : C 478 GLN : amide:sc= -1.21! K(o=-1.2!,f=-0.032) USER MOD Single : C 481 GLN : amide:sc= 0 X(o=0,f=-0.4) USER MOD Single : C 485 SER OG : rot 150:sc= -1.04 USER MOD Single : C 490 THR OG1 : rot 64:sc= 1.22 USER MOD Single : C 492 ASN : amide:sc= -1.74! X(o=-1.7!,f=-1.8) USER MOD Single : C 499 GLN : amide:sc= -0.525 K(o=-0.52,f=-2.8) USER MOD Single : C 504 THR OG1 : rot -5:sc= 1.02 USER MOD ----------------------------------------------------------------- ATOM 1 N SER C 453 -11.046 3.574 7.498 1.00 0.00 N ATOM 2 CA SER C 453 -9.808 2.815 7.298 1.00 0.00 C ATOM 3 C SER C 453 -10.120 1.379 6.890 1.00 0.00 C ATOM 4 O SER C 453 -10.841 0.663 7.593 1.00 0.00 O ATOM 5 CB SER C 453 -8.979 2.830 8.581 1.00 0.00 C ATOM 6 OG SER C 453 -8.734 4.161 9.007 1.00 0.00 O ATOM 0 HA SER C 453 -9.236 3.283 6.497 1.00 0.00 H new ATOM 0 HB2 SER C 453 -9.504 2.283 9.365 1.00 0.00 H new ATOM 0 HB3 SER C 453 -8.032 2.317 8.413 1.00 0.00 H new ATOM 0 HG SER C 453 -9.527 4.711 8.835 1.00 0.00 H new ATOM 14 N ASN C 454 -9.563 0.954 5.762 1.00 0.00 N ATOM 15 CA ASN C 454 -9.784 -0.395 5.242 1.00 0.00 C ATOM 16 C ASN C 454 -9.217 -1.450 6.196 1.00 0.00 C ATOM 17 O ASN C 454 -9.670 -2.594 6.215 1.00 0.00 O ATOM 18 CB ASN C 454 -9.165 -0.532 3.841 1.00 0.00 C ATOM 19 CG ASN C 454 -9.374 -1.907 3.226 1.00 0.00 C ATOM 20 OD1 ASN C 454 -10.402 -2.174 2.599 1.00 0.00 O ATOM 21 ND2 ASN C 454 -8.395 -2.773 3.373 1.00 0.00 N ATOM 0 H ASN C 454 -8.949 1.528 5.184 1.00 0.00 H new ATOM 0 HA ASN C 454 -10.858 -0.563 5.164 1.00 0.00 H new ATOM 0 HB2 ASN C 454 -9.598 0.222 3.184 1.00 0.00 H new ATOM 0 HB3 ASN C 454 -8.096 -0.327 3.901 1.00 0.00 H new ATOM 0 HD21 ASN C 454 -8.471 -3.703 2.961 1.00 0.00 H new ATOM 0 HD22 ASN C 454 -7.560 -2.515 3.899 1.00 0.00 H new ATOM 28 N SER C 455 -8.239 -1.043 7.002 1.00 0.00 N ATOM 29 CA SER C 455 -7.624 -1.929 7.986 1.00 0.00 C ATOM 30 C SER C 455 -8.672 -2.472 8.963 1.00 0.00 C ATOM 31 O SER C 455 -8.571 -3.611 9.428 1.00 0.00 O ATOM 32 CB SER C 455 -6.528 -1.188 8.749 1.00 0.00 C ATOM 33 OG SER C 455 -5.558 -0.654 7.857 1.00 0.00 O ATOM 0 H SER C 455 -7.854 -0.099 6.992 1.00 0.00 H new ATOM 0 HA SER C 455 -7.181 -2.772 7.456 1.00 0.00 H new ATOM 0 HB2 SER C 455 -6.970 -0.383 9.336 1.00 0.00 H new ATOM 0 HB3 SER C 455 -6.046 -1.868 9.452 1.00 0.00 H new ATOM 0 HG SER C 455 -4.868 -0.183 8.368 1.00 0.00 H new ATOM 39 N GLN C 456 -9.685 -1.655 9.258 1.00 0.00 N ATOM 40 CA GLN C 456 -10.757 -2.064 10.153 1.00 0.00 C ATOM 41 C GLN C 456 -11.631 -3.103 9.476 1.00 0.00 C ATOM 42 O GLN C 456 -12.066 -4.066 10.100 1.00 0.00 O ATOM 43 CB GLN C 456 -11.596 -0.861 10.587 1.00 0.00 C ATOM 44 CG GLN C 456 -10.836 0.139 11.443 1.00 0.00 C ATOM 45 CD GLN C 456 -10.260 -0.493 12.697 1.00 0.00 C ATOM 46 OE1 GLN C 456 -9.130 -0.978 12.697 1.00 0.00 O ATOM 47 NE2 GLN C 456 -11.027 -0.486 13.769 1.00 0.00 N ATOM 0 H GLN C 456 -9.781 -0.709 8.889 1.00 0.00 H new ATOM 0 HA GLN C 456 -10.312 -2.503 11.046 1.00 0.00 H new ATOM 0 HB2 GLN C 456 -11.973 -0.353 9.699 1.00 0.00 H new ATOM 0 HB3 GLN C 456 -12.463 -1.216 11.143 1.00 0.00 H new ATOM 0 HG2 GLN C 456 -10.028 0.576 10.856 1.00 0.00 H new ATOM 0 HG3 GLN C 456 -11.503 0.954 11.724 1.00 0.00 H new ATOM 0 HE21 GLN C 456 -11.959 -0.073 13.727 1.00 0.00 H new ATOM 0 HE22 GLN C 456 -10.689 -0.893 14.641 1.00 0.00 H new ATOM 56 N LEU C 457 -11.867 -2.907 8.185 1.00 0.00 N ATOM 57 CA LEU C 457 -12.641 -3.848 7.388 1.00 0.00 C ATOM 58 C LEU C 457 -11.953 -5.199 7.366 1.00 0.00 C ATOM 59 O LEU C 457 -12.602 -6.243 7.481 1.00 0.00 O ATOM 60 CB LEU C 457 -12.821 -3.321 5.958 1.00 0.00 C ATOM 61 CG LEU C 457 -13.912 -2.259 5.746 1.00 0.00 C ATOM 62 CD1 LEU C 457 -15.279 -2.847 5.995 1.00 0.00 C ATOM 63 CD2 LEU C 457 -13.695 -1.052 6.634 1.00 0.00 C ATOM 0 H LEU C 457 -11.530 -2.097 7.665 1.00 0.00 H new ATOM 0 HA LEU C 457 -13.626 -3.960 7.841 1.00 0.00 H new ATOM 0 HB2 LEU C 457 -11.870 -2.903 5.627 1.00 0.00 H new ATOM 0 HB3 LEU C 457 -13.040 -4.168 5.308 1.00 0.00 H new ATOM 0 HG LEU C 457 -13.850 -1.929 4.709 1.00 0.00 H new ATOM 0 HD11 LEU C 457 -16.038 -2.081 5.840 1.00 0.00 H new ATOM 0 HD12 LEU C 457 -15.451 -3.673 5.305 1.00 0.00 H new ATOM 0 HD13 LEU C 457 -15.336 -3.213 7.020 1.00 0.00 H new ATOM 0 HD21 LEU C 457 -14.485 -0.323 6.456 1.00 0.00 H new ATOM 0 HD22 LEU C 457 -13.714 -1.361 7.679 1.00 0.00 H new ATOM 0 HD23 LEU C 457 -12.729 -0.602 6.407 1.00 0.00 H new ATOM 75 N ASN C 458 -10.629 -5.170 7.228 1.00 0.00 N ATOM 76 CA ASN C 458 -9.827 -6.386 7.254 1.00 0.00 C ATOM 77 C ASN C 458 -10.025 -7.104 8.570 1.00 0.00 C ATOM 78 O ASN C 458 -10.248 -8.306 8.596 1.00 0.00 O ATOM 79 CB ASN C 458 -8.336 -6.075 7.077 1.00 0.00 C ATOM 80 CG ASN C 458 -7.990 -5.513 5.717 1.00 0.00 C ATOM 81 OD1 ASN C 458 -8.637 -5.817 4.717 1.00 0.00 O ATOM 82 ND2 ASN C 458 -6.955 -4.703 5.668 1.00 0.00 N ATOM 0 H ASN C 458 -10.090 -4.314 7.097 1.00 0.00 H new ATOM 0 HA ASN C 458 -10.153 -7.017 6.427 1.00 0.00 H new ATOM 0 HB2 ASN C 458 -8.029 -5.363 7.843 1.00 0.00 H new ATOM 0 HB3 ASN C 458 -7.762 -6.987 7.240 1.00 0.00 H new ATOM 0 HD21 ASN C 458 -6.663 -4.302 4.777 1.00 0.00 H new ATOM 0 HD22 ASN C 458 -6.444 -4.476 6.521 1.00 0.00 H new ATOM 89 N ALA C 459 -9.952 -6.345 9.661 1.00 0.00 N ATOM 90 CA ALA C 459 -10.114 -6.889 11.004 1.00 0.00 C ATOM 91 C ALA C 459 -11.488 -7.515 11.186 1.00 0.00 C ATOM 92 O ALA C 459 -11.606 -8.624 11.696 1.00 0.00 O ATOM 93 CB ALA C 459 -9.886 -5.802 12.047 1.00 0.00 C ATOM 0 H ALA C 459 -9.780 -5.340 9.638 1.00 0.00 H new ATOM 0 HA ALA C 459 -9.368 -7.672 11.140 1.00 0.00 H new ATOM 0 HB1 ALA C 459 -10.010 -6.223 13.045 1.00 0.00 H new ATOM 0 HB2 ALA C 459 -8.876 -5.405 11.944 1.00 0.00 H new ATOM 0 HB3 ALA C 459 -10.608 -4.999 11.900 1.00 0.00 H new ATOM 99 N MET C 460 -12.526 -6.808 10.750 1.00 0.00 N ATOM 100 CA MET C 460 -13.884 -7.304 10.882 1.00 0.00 C ATOM 101 C MET C 460 -14.062 -8.624 10.131 1.00 0.00 C ATOM 102 O MET C 460 -14.623 -9.582 10.662 1.00 0.00 O ATOM 103 CB MET C 460 -14.898 -6.261 10.400 1.00 0.00 C ATOM 104 CG MET C 460 -14.841 -4.942 11.168 1.00 0.00 C ATOM 105 SD MET C 460 -16.405 -4.042 11.134 1.00 0.00 S ATOM 106 CE MET C 460 -16.596 -3.774 9.386 1.00 0.00 C ATOM 0 H MET C 460 -12.449 -5.894 10.304 1.00 0.00 H new ATOM 0 HA MET C 460 -14.070 -7.492 11.940 1.00 0.00 H new ATOM 0 HB2 MET C 460 -14.725 -6.062 9.342 1.00 0.00 H new ATOM 0 HB3 MET C 460 -15.902 -6.677 10.486 1.00 0.00 H new ATOM 0 HG2 MET C 460 -14.565 -5.142 12.203 1.00 0.00 H new ATOM 0 HG3 MET C 460 -14.057 -4.314 10.744 1.00 0.00 H new ATOM 0 HE1 MET C 460 -17.622 -3.474 9.174 1.00 0.00 H new ATOM 0 HE2 MET C 460 -15.914 -2.988 9.062 1.00 0.00 H new ATOM 0 HE3 MET C 460 -16.369 -4.695 8.850 1.00 0.00 H new ATOM 116 N ALA C 461 -13.561 -8.672 8.903 1.00 0.00 N ATOM 117 CA ALA C 461 -13.631 -9.883 8.093 1.00 0.00 C ATOM 118 C ALA C 461 -12.749 -10.983 8.688 1.00 0.00 C ATOM 119 O ALA C 461 -13.082 -12.167 8.632 1.00 0.00 O ATOM 120 CB ALA C 461 -13.205 -9.580 6.665 1.00 0.00 C ATOM 0 H ALA C 461 -13.101 -7.885 8.445 1.00 0.00 H new ATOM 0 HA ALA C 461 -14.662 -10.237 8.087 1.00 0.00 H new ATOM 0 HB1 ALA C 461 -13.261 -10.490 6.068 1.00 0.00 H new ATOM 0 HB2 ALA C 461 -13.868 -8.826 6.240 1.00 0.00 H new ATOM 0 HB3 ALA C 461 -12.181 -9.206 6.662 1.00 0.00 H new ATOM 126 N HIS C 462 -11.634 -10.567 9.268 1.00 0.00 N ATOM 127 CA HIS C 462 -10.667 -11.472 9.880 1.00 0.00 C ATOM 128 C HIS C 462 -11.304 -12.292 10.993 1.00 0.00 C ATOM 129 O HIS C 462 -11.143 -13.506 11.041 1.00 0.00 O ATOM 130 CB HIS C 462 -9.470 -10.665 10.413 1.00 0.00 C ATOM 131 CG HIS C 462 -8.360 -11.488 10.988 1.00 0.00 C ATOM 132 ND1 HIS C 462 -7.412 -12.131 10.221 1.00 0.00 N ATOM 133 CD2 HIS C 462 -8.042 -11.755 12.269 1.00 0.00 C ATOM 134 CE1 HIS C 462 -6.564 -12.757 11.012 1.00 0.00 C ATOM 135 NE2 HIS C 462 -6.925 -12.544 12.257 1.00 0.00 N ATOM 0 H HIS C 462 -11.370 -9.584 9.329 1.00 0.00 H new ATOM 0 HA HIS C 462 -10.317 -12.171 9.121 1.00 0.00 H new ATOM 0 HB2 HIS C 462 -9.069 -10.058 9.601 1.00 0.00 H new ATOM 0 HB3 HIS C 462 -9.827 -9.977 11.179 1.00 0.00 H new ATOM 0 HD2 HIS C 462 -8.572 -11.410 13.145 1.00 0.00 H new ATOM 0 HE1 HIS C 462 -5.717 -13.345 10.691 1.00 0.00 H new ATOM 0 HE2 HIS C 462 -6.449 -12.908 13.082 1.00 0.00 H new ATOM 144 N GLN C 463 -12.043 -11.632 11.868 1.00 0.00 N ATOM 145 CA GLN C 463 -12.666 -12.307 13.001 1.00 0.00 C ATOM 146 C GLN C 463 -13.832 -13.197 12.591 1.00 0.00 C ATOM 147 O GLN C 463 -14.171 -14.148 13.301 1.00 0.00 O ATOM 148 CB GLN C 463 -13.061 -11.310 14.090 1.00 0.00 C ATOM 149 CG GLN C 463 -12.035 -11.232 15.212 1.00 0.00 C ATOM 150 CD GLN C 463 -10.628 -10.952 14.705 1.00 0.00 C ATOM 151 OE1 GLN C 463 -10.431 -10.208 13.747 1.00 0.00 O ATOM 152 NE2 GLN C 463 -9.649 -11.585 15.308 1.00 0.00 N ATOM 0 H GLN C 463 -12.228 -10.630 11.819 1.00 0.00 H new ATOM 0 HA GLN C 463 -11.914 -12.975 13.421 1.00 0.00 H new ATOM 0 HB2 GLN C 463 -13.184 -10.322 13.646 1.00 0.00 H new ATOM 0 HB3 GLN C 463 -14.027 -11.595 14.506 1.00 0.00 H new ATOM 0 HG2 GLN C 463 -12.327 -10.449 15.911 1.00 0.00 H new ATOM 0 HG3 GLN C 463 -12.037 -12.171 15.766 1.00 0.00 H new ATOM 0 HE21 GLN C 463 -9.848 -12.195 16.101 1.00 0.00 H new ATOM 0 HE22 GLN C 463 -8.689 -11.467 14.984 1.00 0.00 H new ATOM 161 N ILE C 464 -14.448 -12.904 11.459 1.00 0.00 N ATOM 162 CA ILE C 464 -15.500 -13.763 10.947 1.00 0.00 C ATOM 163 C ILE C 464 -14.895 -15.054 10.422 1.00 0.00 C ATOM 164 O ILE C 464 -15.415 -16.139 10.668 1.00 0.00 O ATOM 165 CB ILE C 464 -16.319 -13.090 9.829 1.00 0.00 C ATOM 166 CG1 ILE C 464 -17.066 -11.875 10.375 1.00 0.00 C ATOM 167 CG2 ILE C 464 -17.305 -14.089 9.209 1.00 0.00 C ATOM 168 CD1 ILE C 464 -17.884 -11.158 9.330 1.00 0.00 C ATOM 0 H ILE C 464 -14.241 -12.088 10.883 1.00 0.00 H new ATOM 0 HA ILE C 464 -16.180 -13.969 11.773 1.00 0.00 H new ATOM 0 HB ILE C 464 -15.632 -12.755 9.052 1.00 0.00 H new ATOM 0 HG12 ILE C 464 -17.723 -12.194 11.184 1.00 0.00 H new ATOM 0 HG13 ILE C 464 -16.347 -11.178 10.805 1.00 0.00 H new ATOM 0 HG21 ILE C 464 -17.875 -13.596 8.421 1.00 0.00 H new ATOM 0 HG22 ILE C 464 -16.754 -14.930 8.787 1.00 0.00 H new ATOM 0 HG23 ILE C 464 -17.987 -14.452 9.978 1.00 0.00 H new ATOM 0 HD11 ILE C 464 -18.388 -10.305 9.785 1.00 0.00 H new ATOM 0 HD12 ILE C 464 -17.229 -10.809 8.532 1.00 0.00 H new ATOM 0 HD13 ILE C 464 -18.626 -11.841 8.917 1.00 0.00 H new ATOM 180 N GLN C 465 -13.769 -14.938 9.720 1.00 0.00 N ATOM 181 CA GLN C 465 -13.084 -16.107 9.181 1.00 0.00 C ATOM 182 C GLN C 465 -12.534 -16.971 10.316 1.00 0.00 C ATOM 183 O GLN C 465 -12.271 -18.160 10.141 1.00 0.00 O ATOM 184 CB GLN C 465 -11.952 -15.702 8.243 1.00 0.00 C ATOM 185 CG GLN C 465 -11.388 -16.877 7.453 1.00 0.00 C ATOM 186 CD GLN C 465 -10.175 -16.516 6.635 1.00 0.00 C ATOM 187 OE1 GLN C 465 -10.282 -16.143 5.469 1.00 0.00 O ATOM 188 NE2 GLN C 465 -9.011 -16.629 7.237 1.00 0.00 N ATOM 0 H GLN C 465 -13.315 -14.049 9.513 1.00 0.00 H new ATOM 0 HA GLN C 465 -13.811 -16.684 8.610 1.00 0.00 H new ATOM 0 HB2 GLN C 465 -12.316 -14.945 7.548 1.00 0.00 H new ATOM 0 HB3 GLN C 465 -11.152 -15.244 8.824 1.00 0.00 H new ATOM 0 HG2 GLN C 465 -11.127 -17.679 8.144 1.00 0.00 H new ATOM 0 HG3 GLN C 465 -12.162 -17.266 6.791 1.00 0.00 H new ATOM 0 HE21 GLN C 465 -8.967 -16.942 8.207 1.00 0.00 H new ATOM 0 HE22 GLN C 465 -8.153 -16.403 6.734 1.00 0.00 H new ATOM 197 N GLU C 466 -12.355 -16.361 11.478 1.00 0.00 N ATOM 198 CA GLU C 466 -11.903 -17.076 12.657 1.00 0.00 C ATOM 199 C GLU C 466 -13.011 -17.994 13.164 1.00 0.00 C ATOM 200 O GLU C 466 -12.762 -18.954 13.888 1.00 0.00 O ATOM 201 CB GLU C 466 -11.481 -16.087 13.742 1.00 0.00 C ATOM 202 CG GLU C 466 -10.262 -15.258 13.365 1.00 0.00 C ATOM 203 CD GLU C 466 -8.999 -16.084 13.272 1.00 0.00 C ATOM 204 OE1 GLU C 466 -8.829 -16.816 12.276 1.00 0.00 O ATOM 205 OE2 GLU C 466 -8.165 -16.006 14.197 1.00 0.00 O ATOM 0 H GLU C 466 -12.518 -15.365 11.628 1.00 0.00 H new ATOM 0 HA GLU C 466 -11.039 -17.687 12.396 1.00 0.00 H new ATOM 0 HB2 GLU C 466 -12.314 -15.417 13.956 1.00 0.00 H new ATOM 0 HB3 GLU C 466 -11.268 -16.635 14.660 1.00 0.00 H new ATOM 0 HG2 GLU C 466 -10.442 -14.769 12.408 1.00 0.00 H new ATOM 0 HG3 GLU C 466 -10.122 -14.469 14.104 1.00 0.00 H new ATOM 212 N MET C 467 -14.240 -17.677 12.775 1.00 0.00 N ATOM 213 CA MET C 467 -15.391 -18.486 13.116 1.00 0.00 C ATOM 214 C MET C 467 -15.745 -19.388 11.945 1.00 0.00 C ATOM 215 O MET C 467 -16.159 -20.533 12.122 1.00 0.00 O ATOM 216 CB MET C 467 -16.592 -17.598 13.447 1.00 0.00 C ATOM 217 CG MET C 467 -16.366 -16.636 14.599 1.00 0.00 C ATOM 218 SD MET C 467 -17.871 -15.760 15.083 1.00 0.00 S ATOM 219 CE MET C 467 -18.290 -14.913 13.559 1.00 0.00 C ATOM 0 H MET C 467 -14.461 -16.853 12.216 1.00 0.00 H new ATOM 0 HA MET C 467 -15.145 -19.090 13.989 1.00 0.00 H new ATOM 0 HB2 MET C 467 -16.860 -17.025 12.559 1.00 0.00 H new ATOM 0 HB3 MET C 467 -17.444 -18.235 13.684 1.00 0.00 H new ATOM 0 HG2 MET C 467 -15.980 -17.187 15.456 1.00 0.00 H new ATOM 0 HG3 MET C 467 -15.603 -15.910 14.317 1.00 0.00 H new ATOM 0 HE1 MET C 467 -19.219 -14.359 13.694 1.00 0.00 H new ATOM 0 HE2 MET C 467 -17.490 -14.221 13.295 1.00 0.00 H new ATOM 0 HE3 MET C 467 -18.417 -15.643 12.760 1.00 0.00 H new ATOM 229 N PHE C 468 -15.567 -18.860 10.740 1.00 0.00 N ATOM 230 CA PHE C 468 -15.887 -19.572 9.521 1.00 0.00 C ATOM 231 C PHE C 468 -14.703 -19.596 8.558 1.00 0.00 C ATOM 232 O PHE C 468 -14.622 -18.781 7.645 1.00 0.00 O ATOM 233 CB PHE C 468 -17.096 -18.930 8.836 1.00 0.00 C ATOM 234 CG PHE C 468 -18.391 -19.170 9.545 1.00 0.00 C ATOM 235 CD1 PHE C 468 -18.829 -18.298 10.522 1.00 0.00 C ATOM 236 CD2 PHE C 468 -19.169 -20.270 9.236 1.00 0.00 C ATOM 237 CE1 PHE C 468 -20.020 -18.520 11.175 1.00 0.00 C ATOM 238 CE2 PHE C 468 -20.360 -20.497 9.887 1.00 0.00 C ATOM 239 CZ PHE C 468 -20.788 -19.619 10.858 1.00 0.00 C ATOM 0 H PHE C 468 -15.195 -17.923 10.586 1.00 0.00 H new ATOM 0 HA PHE C 468 -16.125 -20.601 9.792 1.00 0.00 H new ATOM 0 HB2 PHE C 468 -16.929 -17.856 8.758 1.00 0.00 H new ATOM 0 HB3 PHE C 468 -17.173 -19.315 7.819 1.00 0.00 H new ATOM 0 HD1 PHE C 468 -18.232 -17.435 10.776 1.00 0.00 H new ATOM 0 HD2 PHE C 468 -18.838 -20.960 8.474 1.00 0.00 H new ATOM 0 HE1 PHE C 468 -20.353 -17.831 11.937 1.00 0.00 H new ATOM 0 HE2 PHE C 468 -20.957 -21.361 9.637 1.00 0.00 H new ATOM 0 HZ PHE C 468 -21.723 -19.792 11.370 1.00 0.00 H new ATOM 249 N PRO C 469 -13.756 -20.524 8.761 1.00 0.00 N ATOM 250 CA PRO C 469 -12.605 -20.689 7.873 1.00 0.00 C ATOM 251 C PRO C 469 -13.025 -21.310 6.546 1.00 0.00 C ATOM 252 O PRO C 469 -12.261 -21.344 5.584 1.00 0.00 O ATOM 253 CB PRO C 469 -11.687 -21.661 8.633 1.00 0.00 C ATOM 254 CG PRO C 469 -12.249 -21.739 10.013 1.00 0.00 C ATOM 255 CD PRO C 469 -13.707 -21.448 9.887 1.00 0.00 C ATOM 0 HA PRO C 469 -12.128 -19.738 7.637 1.00 0.00 H new ATOM 0 HB2 PRO C 469 -11.674 -22.642 8.158 1.00 0.00 H new ATOM 0 HB3 PRO C 469 -10.659 -21.300 8.647 1.00 0.00 H new ATOM 0 HG2 PRO C 469 -12.085 -22.726 10.445 1.00 0.00 H new ATOM 0 HG3 PRO C 469 -11.764 -21.019 10.672 1.00 0.00 H new ATOM 0 HD2 PRO C 469 -14.285 -22.352 9.694 1.00 0.00 H new ATOM 0 HD3 PRO C 469 -14.110 -21.000 10.795 1.00 0.00 H new ATOM 263 N GLN C 470 -14.256 -21.795 6.524 1.00 0.00 N ATOM 264 CA GLN C 470 -14.833 -22.453 5.357 1.00 0.00 C ATOM 265 C GLN C 470 -15.159 -21.455 4.240 1.00 0.00 C ATOM 266 O GLN C 470 -15.410 -21.852 3.103 1.00 0.00 O ATOM 267 CB GLN C 470 -16.104 -23.208 5.765 1.00 0.00 C ATOM 268 CG GLN C 470 -17.199 -22.307 6.326 1.00 0.00 C ATOM 269 CD GLN C 470 -18.395 -23.078 6.864 1.00 0.00 C ATOM 270 OE1 GLN C 470 -18.259 -24.203 7.342 1.00 0.00 O ATOM 271 NE2 GLN C 470 -19.571 -22.477 6.787 1.00 0.00 N ATOM 0 H GLN C 470 -14.890 -21.744 7.321 1.00 0.00 H new ATOM 0 HA GLN C 470 -14.092 -23.153 4.970 1.00 0.00 H new ATOM 0 HB2 GLN C 470 -16.493 -23.741 4.898 1.00 0.00 H new ATOM 0 HB3 GLN C 470 -15.846 -23.959 6.512 1.00 0.00 H new ATOM 0 HG2 GLN C 470 -16.782 -21.694 7.125 1.00 0.00 H new ATOM 0 HG3 GLN C 470 -17.536 -21.626 5.544 1.00 0.00 H new ATOM 0 HE21 GLN C 470 -19.641 -21.543 6.383 1.00 0.00 H new ATOM 0 HE22 GLN C 470 -20.408 -22.948 7.131 1.00 0.00 H new ATOM 280 N VAL C 471 -15.158 -20.170 4.563 1.00 0.00 N ATOM 281 CA VAL C 471 -15.499 -19.157 3.588 1.00 0.00 C ATOM 282 C VAL C 471 -14.262 -18.360 3.156 1.00 0.00 C ATOM 283 O VAL C 471 -13.248 -18.341 3.858 1.00 0.00 O ATOM 284 CB VAL C 471 -16.575 -18.184 4.129 1.00 0.00 C ATOM 285 CG1 VAL C 471 -17.771 -18.942 4.673 1.00 0.00 C ATOM 286 CG2 VAL C 471 -15.995 -17.259 5.179 1.00 0.00 C ATOM 0 H VAL C 471 -14.926 -19.810 5.489 1.00 0.00 H new ATOM 0 HA VAL C 471 -15.905 -19.680 2.722 1.00 0.00 H new ATOM 0 HB VAL C 471 -16.918 -17.570 3.296 1.00 0.00 H new ATOM 0 HG11 VAL C 471 -18.511 -18.234 5.046 1.00 0.00 H new ATOM 0 HG12 VAL C 471 -18.213 -19.544 3.879 1.00 0.00 H new ATOM 0 HG13 VAL C 471 -17.450 -19.594 5.486 1.00 0.00 H new ATOM 0 HG21 VAL C 471 -16.773 -16.587 5.541 1.00 0.00 H new ATOM 0 HG22 VAL C 471 -15.609 -17.849 6.010 1.00 0.00 H new ATOM 0 HG23 VAL C 471 -15.185 -16.675 4.742 1.00 0.00 H new ATOM 296 N PRO C 472 -14.328 -17.714 1.979 1.00 0.00 N ATOM 297 CA PRO C 472 -13.246 -16.886 1.458 1.00 0.00 C ATOM 298 C PRO C 472 -13.210 -15.515 2.121 1.00 0.00 C ATOM 299 O PRO C 472 -14.253 -14.918 2.412 1.00 0.00 O ATOM 300 CB PRO C 472 -13.584 -16.738 -0.036 1.00 0.00 C ATOM 301 CG PRO C 472 -14.767 -17.615 -0.262 1.00 0.00 C ATOM 302 CD PRO C 472 -15.448 -17.744 1.062 1.00 0.00 C ATOM 0 HA PRO C 472 -12.269 -17.332 1.644 1.00 0.00 H new ATOM 0 HB2 PRO C 472 -13.809 -15.702 -0.287 1.00 0.00 H new ATOM 0 HB3 PRO C 472 -12.744 -17.042 -0.661 1.00 0.00 H new ATOM 0 HG2 PRO C 472 -15.437 -17.181 -1.004 1.00 0.00 H new ATOM 0 HG3 PRO C 472 -14.462 -18.591 -0.640 1.00 0.00 H new ATOM 0 HD2 PRO C 472 -16.146 -16.927 1.243 1.00 0.00 H new ATOM 0 HD3 PRO C 472 -16.015 -18.671 1.141 1.00 0.00 H new ATOM 310 N TYR C 473 -12.011 -15.016 2.320 1.00 0.00 N ATOM 311 CA TYR C 473 -11.785 -13.732 2.973 1.00 0.00 C ATOM 312 C TYR C 473 -12.387 -12.588 2.146 1.00 0.00 C ATOM 313 O TYR C 473 -13.002 -11.670 2.694 1.00 0.00 O ATOM 314 CB TYR C 473 -10.279 -13.517 3.139 1.00 0.00 C ATOM 315 CG TYR C 473 -9.881 -12.594 4.275 1.00 0.00 C ATOM 316 CD1 TYR C 473 -10.010 -11.216 4.168 1.00 0.00 C ATOM 317 CD2 TYR C 473 -9.345 -13.112 5.444 1.00 0.00 C ATOM 318 CE1 TYR C 473 -9.615 -10.383 5.200 1.00 0.00 C ATOM 319 CE2 TYR C 473 -8.957 -12.291 6.477 1.00 0.00 C ATOM 320 CZ TYR C 473 -9.091 -10.930 6.351 1.00 0.00 C ATOM 321 OH TYR C 473 -8.682 -10.108 7.378 1.00 0.00 O ATOM 0 H TYR C 473 -11.154 -15.488 2.033 1.00 0.00 H new ATOM 0 HA TYR C 473 -12.270 -13.738 3.949 1.00 0.00 H new ATOM 0 HB2 TYR C 473 -9.805 -14.486 3.296 1.00 0.00 H new ATOM 0 HB3 TYR C 473 -9.881 -13.114 2.208 1.00 0.00 H new ATOM 0 HD1 TYR C 473 -10.424 -10.788 3.267 1.00 0.00 H new ATOM 0 HD2 TYR C 473 -9.230 -14.181 5.545 1.00 0.00 H new ATOM 0 HE1 TYR C 473 -9.717 -9.312 5.104 1.00 0.00 H new ATOM 0 HE2 TYR C 473 -8.549 -12.715 7.383 1.00 0.00 H new ATOM 0 HH TYR C 473 -9.413 -9.504 7.625 1.00 0.00 H new ATOM 331 N HIS C 474 -12.221 -12.670 0.817 1.00 0.00 N ATOM 332 CA HIS C 474 -12.707 -11.625 -0.108 1.00 0.00 C ATOM 333 C HIS C 474 -14.183 -11.343 0.078 1.00 0.00 C ATOM 334 O HIS C 474 -14.586 -10.203 0.275 1.00 0.00 O ATOM 335 CB HIS C 474 -12.502 -12.029 -1.572 1.00 0.00 C ATOM 336 CG HIS C 474 -11.089 -12.194 -2.002 1.00 0.00 C ATOM 337 ND1 HIS C 474 -10.100 -11.279 -1.732 1.00 0.00 N ATOM 338 CD2 HIS C 474 -10.507 -13.183 -2.704 1.00 0.00 C ATOM 339 CE1 HIS C 474 -8.965 -11.698 -2.251 1.00 0.00 C ATOM 340 NE2 HIS C 474 -9.184 -12.856 -2.847 1.00 0.00 N ATOM 0 H HIS C 474 -11.753 -13.450 0.354 1.00 0.00 H new ATOM 0 HA HIS C 474 -12.125 -10.734 0.127 1.00 0.00 H new ATOM 0 HB2 HIS C 474 -13.028 -12.967 -1.748 1.00 0.00 H new ATOM 0 HB3 HIS C 474 -12.970 -11.277 -2.207 1.00 0.00 H new ATOM 0 HD2 HIS C 474 -10.992 -14.070 -3.084 1.00 0.00 H new ATOM 0 HE1 HIS C 474 -8.017 -11.183 -2.198 1.00 0.00 H new ATOM 0 HE2 HIS C 474 -8.483 -13.415 -3.334 1.00 0.00 H new ATOM 349 N LEU C 475 -14.980 -12.395 0.017 1.00 0.00 N ATOM 350 CA LEU C 475 -16.427 -12.269 0.050 1.00 0.00 C ATOM 351 C LEU C 475 -16.899 -11.672 1.361 1.00 0.00 C ATOM 352 O LEU C 475 -17.829 -10.862 1.386 1.00 0.00 O ATOM 353 CB LEU C 475 -17.079 -13.624 -0.188 1.00 0.00 C ATOM 354 CG LEU C 475 -16.497 -14.451 -1.344 1.00 0.00 C ATOM 355 CD1 LEU C 475 -17.373 -15.649 -1.634 1.00 0.00 C ATOM 356 CD2 LEU C 475 -16.306 -13.604 -2.598 1.00 0.00 C ATOM 0 H LEU C 475 -14.645 -13.356 -0.056 1.00 0.00 H new ATOM 0 HA LEU C 475 -16.726 -11.590 -0.749 1.00 0.00 H new ATOM 0 HB2 LEU C 475 -17.001 -14.210 0.728 1.00 0.00 H new ATOM 0 HB3 LEU C 475 -18.141 -13.467 -0.377 1.00 0.00 H new ATOM 0 HG LEU C 475 -15.514 -14.807 -1.036 1.00 0.00 H new ATOM 0 HD11 LEU C 475 -16.945 -16.223 -2.456 1.00 0.00 H new ATOM 0 HD12 LEU C 475 -17.435 -16.278 -0.746 1.00 0.00 H new ATOM 0 HD13 LEU C 475 -18.372 -15.311 -1.910 1.00 0.00 H new ATOM 0 HD21 LEU C 475 -15.893 -14.222 -3.395 1.00 0.00 H new ATOM 0 HD22 LEU C 475 -17.268 -13.200 -2.914 1.00 0.00 H new ATOM 0 HD23 LEU C 475 -15.621 -12.784 -2.382 1.00 0.00 H new ATOM 368 N VAL C 476 -16.254 -12.068 2.442 1.00 0.00 N ATOM 369 CA VAL C 476 -16.582 -11.551 3.753 1.00 0.00 C ATOM 370 C VAL C 476 -16.237 -10.068 3.827 1.00 0.00 C ATOM 371 O VAL C 476 -17.089 -9.238 4.133 1.00 0.00 O ATOM 372 CB VAL C 476 -15.821 -12.320 4.857 1.00 0.00 C ATOM 373 CG1 VAL C 476 -16.155 -11.770 6.229 1.00 0.00 C ATOM 374 CG2 VAL C 476 -16.149 -13.800 4.791 1.00 0.00 C ATOM 0 H VAL C 476 -15.496 -12.750 2.435 1.00 0.00 H new ATOM 0 HA VAL C 476 -17.652 -11.685 3.915 1.00 0.00 H new ATOM 0 HB VAL C 476 -14.752 -12.188 4.687 1.00 0.00 H new ATOM 0 HG11 VAL C 476 -15.607 -12.328 6.988 1.00 0.00 H new ATOM 0 HG12 VAL C 476 -15.873 -10.718 6.278 1.00 0.00 H new ATOM 0 HG13 VAL C 476 -17.226 -11.868 6.409 1.00 0.00 H new ATOM 0 HG21 VAL C 476 -15.606 -14.328 5.574 1.00 0.00 H new ATOM 0 HG22 VAL C 476 -17.220 -13.942 4.933 1.00 0.00 H new ATOM 0 HG23 VAL C 476 -15.857 -14.194 3.818 1.00 0.00 H new ATOM 384 N LEU C 477 -14.988 -9.746 3.500 1.00 0.00 N ATOM 385 CA LEU C 477 -14.491 -8.370 3.510 1.00 0.00 C ATOM 386 C LEU C 477 -15.395 -7.484 2.658 1.00 0.00 C ATOM 387 O LEU C 477 -15.740 -6.365 3.046 1.00 0.00 O ATOM 388 CB LEU C 477 -13.063 -8.353 2.949 1.00 0.00 C ATOM 389 CG LEU C 477 -12.097 -7.333 3.550 1.00 0.00 C ATOM 390 CD1 LEU C 477 -10.730 -7.455 2.902 1.00 0.00 C ATOM 391 CD2 LEU C 477 -12.626 -5.920 3.404 1.00 0.00 C ATOM 0 H LEU C 477 -14.289 -10.433 3.219 1.00 0.00 H new ATOM 0 HA LEU C 477 -14.489 -7.988 4.531 1.00 0.00 H new ATOM 0 HB2 LEU C 477 -12.634 -9.346 3.082 1.00 0.00 H new ATOM 0 HB3 LEU C 477 -13.122 -8.173 1.876 1.00 0.00 H new ATOM 0 HG LEU C 477 -12.004 -7.547 4.615 1.00 0.00 H new ATOM 0 HD11 LEU C 477 -10.053 -6.722 3.340 1.00 0.00 H new ATOM 0 HD12 LEU C 477 -10.337 -8.458 3.069 1.00 0.00 H new ATOM 0 HD13 LEU C 477 -10.818 -7.273 1.831 1.00 0.00 H new ATOM 0 HD21 LEU C 477 -11.916 -5.219 3.841 1.00 0.00 H new ATOM 0 HD22 LEU C 477 -12.760 -5.689 2.347 1.00 0.00 H new ATOM 0 HD23 LEU C 477 -13.583 -5.835 3.918 1.00 0.00 H new ATOM 403 N GLN C 478 -15.770 -8.005 1.502 1.00 0.00 N ATOM 404 CA GLN C 478 -16.638 -7.314 0.576 1.00 0.00 C ATOM 405 C GLN C 478 -17.923 -6.859 1.257 1.00 0.00 C ATOM 406 O GLN C 478 -18.247 -5.674 1.250 1.00 0.00 O ATOM 407 CB GLN C 478 -16.980 -8.225 -0.598 1.00 0.00 C ATOM 408 CG GLN C 478 -17.908 -7.587 -1.604 1.00 0.00 C ATOM 409 CD GLN C 478 -18.365 -8.544 -2.686 1.00 0.00 C ATOM 410 OE1 GLN C 478 -18.607 -8.137 -3.821 1.00 0.00 O ATOM 411 NE2 GLN C 478 -18.502 -9.814 -2.346 1.00 0.00 N ATOM 0 H GLN C 478 -15.476 -8.927 1.181 1.00 0.00 H new ATOM 0 HA GLN C 478 -16.108 -6.432 0.215 1.00 0.00 H new ATOM 0 HB2 GLN C 478 -16.058 -8.519 -1.101 1.00 0.00 H new ATOM 0 HB3 GLN C 478 -17.440 -9.137 -0.218 1.00 0.00 H new ATOM 0 HG2 GLN C 478 -18.781 -7.193 -1.084 1.00 0.00 H new ATOM 0 HG3 GLN C 478 -17.403 -6.739 -2.067 1.00 0.00 H new ATOM 0 HE21 GLN C 478 -18.291 -10.113 -1.394 1.00 0.00 H new ATOM 0 HE22 GLN C 478 -18.819 -10.495 -3.036 1.00 0.00 H new ATOM 420 N ASP C 479 -18.641 -7.799 1.866 1.00 0.00 N ATOM 421 CA ASP C 479 -19.919 -7.481 2.502 1.00 0.00 C ATOM 422 C ASP C 479 -19.735 -6.545 3.671 1.00 0.00 C ATOM 423 O ASP C 479 -20.616 -5.768 3.993 1.00 0.00 O ATOM 424 CB ASP C 479 -20.649 -8.733 2.963 1.00 0.00 C ATOM 425 CG ASP C 479 -22.036 -8.407 3.494 1.00 0.00 C ATOM 426 OD1 ASP C 479 -22.887 -7.961 2.696 1.00 0.00 O ATOM 427 OD2 ASP C 479 -22.285 -8.600 4.701 1.00 0.00 O ATOM 0 H ASP C 479 -18.364 -8.778 1.933 1.00 0.00 H new ATOM 0 HA ASP C 479 -20.527 -6.986 1.745 1.00 0.00 H new ATOM 0 HB2 ASP C 479 -20.732 -9.434 2.132 1.00 0.00 H new ATOM 0 HB3 ASP C 479 -20.068 -9.228 3.741 1.00 0.00 H new ATOM 432 N LEU C 480 -18.585 -6.606 4.295 1.00 0.00 N ATOM 433 CA LEU C 480 -18.292 -5.739 5.415 1.00 0.00 C ATOM 434 C LEU C 480 -18.220 -4.284 4.987 1.00 0.00 C ATOM 435 O LEU C 480 -18.431 -3.390 5.788 1.00 0.00 O ATOM 436 CB LEU C 480 -17.010 -6.158 6.133 1.00 0.00 C ATOM 437 CG LEU C 480 -17.201 -7.017 7.380 1.00 0.00 C ATOM 438 CD1 LEU C 480 -18.333 -6.486 8.238 1.00 0.00 C ATOM 439 CD2 LEU C 480 -17.478 -8.425 6.995 1.00 0.00 C ATOM 0 H LEU C 480 -17.832 -7.248 4.047 1.00 0.00 H new ATOM 0 HA LEU C 480 -19.116 -5.841 6.121 1.00 0.00 H new ATOM 0 HB2 LEU C 480 -16.384 -6.706 5.429 1.00 0.00 H new ATOM 0 HB3 LEU C 480 -16.462 -5.259 6.414 1.00 0.00 H new ATOM 0 HG LEU C 480 -16.280 -6.977 7.962 1.00 0.00 H new ATOM 0 HD11 LEU C 480 -18.448 -7.116 9.120 1.00 0.00 H new ATOM 0 HD12 LEU C 480 -18.107 -5.466 8.548 1.00 0.00 H new ATOM 0 HD13 LEU C 480 -19.259 -6.494 7.664 1.00 0.00 H new ATOM 0 HD21 LEU C 480 -17.612 -9.028 7.893 1.00 0.00 H new ATOM 0 HD22 LEU C 480 -18.385 -8.466 6.392 1.00 0.00 H new ATOM 0 HD23 LEU C 480 -16.640 -8.816 6.418 1.00 0.00 H new ATOM 451 N GLN C 481 -17.925 -4.049 3.727 1.00 0.00 N ATOM 452 CA GLN C 481 -17.898 -2.697 3.209 1.00 0.00 C ATOM 453 C GLN C 481 -19.313 -2.277 2.827 1.00 0.00 C ATOM 454 O GLN C 481 -19.630 -1.089 2.740 1.00 0.00 O ATOM 455 CB GLN C 481 -16.968 -2.605 2.002 1.00 0.00 C ATOM 456 CG GLN C 481 -15.527 -2.956 2.321 1.00 0.00 C ATOM 457 CD GLN C 481 -14.596 -2.732 1.152 1.00 0.00 C ATOM 458 OE1 GLN C 481 -14.989 -2.859 -0.008 1.00 0.00 O ATOM 459 NE2 GLN C 481 -13.356 -2.392 1.447 1.00 0.00 N ATOM 0 H GLN C 481 -17.701 -4.773 3.044 1.00 0.00 H new ATOM 0 HA GLN C 481 -17.518 -2.024 3.978 1.00 0.00 H new ATOM 0 HB2 GLN C 481 -17.332 -3.273 1.221 1.00 0.00 H new ATOM 0 HB3 GLN C 481 -17.007 -1.593 1.600 1.00 0.00 H new ATOM 0 HG2 GLN C 481 -15.191 -2.357 3.167 1.00 0.00 H new ATOM 0 HG3 GLN C 481 -15.472 -4.000 2.628 1.00 0.00 H new ATOM 0 HE21 GLN C 481 -13.071 -2.298 2.422 1.00 0.00 H new ATOM 0 HE22 GLN C 481 -12.682 -2.224 0.700 1.00 0.00 H new ATOM 468 N LEU C 482 -20.152 -3.275 2.620 1.00 0.00 N ATOM 469 CA LEU C 482 -21.535 -3.087 2.260 1.00 0.00 C ATOM 470 C LEU C 482 -22.418 -2.901 3.492 1.00 0.00 C ATOM 471 O LEU C 482 -23.175 -1.937 3.583 1.00 0.00 O ATOM 472 CB LEU C 482 -22.016 -4.295 1.471 1.00 0.00 C ATOM 473 CG LEU C 482 -21.721 -4.298 -0.032 1.00 0.00 C ATOM 474 CD1 LEU C 482 -20.257 -4.010 -0.328 1.00 0.00 C ATOM 475 CD2 LEU C 482 -22.120 -5.623 -0.622 1.00 0.00 C ATOM 0 H LEU C 482 -19.881 -4.255 2.700 1.00 0.00 H new ATOM 0 HA LEU C 482 -21.608 -2.183 1.655 1.00 0.00 H new ATOM 0 HB2 LEU C 482 -21.567 -5.187 1.907 1.00 0.00 H new ATOM 0 HB3 LEU C 482 -23.094 -4.382 1.606 1.00 0.00 H new ATOM 0 HG LEU C 482 -22.305 -3.499 -0.489 1.00 0.00 H new ATOM 0 HD11 LEU C 482 -20.094 -4.022 -1.406 1.00 0.00 H new ATOM 0 HD12 LEU C 482 -19.992 -3.030 0.068 1.00 0.00 H new ATOM 0 HD13 LEU C 482 -19.634 -4.771 0.141 1.00 0.00 H new ATOM 0 HD21 LEU C 482 -21.909 -5.623 -1.691 1.00 0.00 H new ATOM 0 HD22 LEU C 482 -21.554 -6.421 -0.141 1.00 0.00 H new ATOM 0 HD23 LEU C 482 -23.186 -5.786 -0.462 1.00 0.00 H new ATOM 487 N THR C 483 -22.313 -3.825 4.440 1.00 0.00 N ATOM 488 CA THR C 483 -23.154 -3.793 5.626 1.00 0.00 C ATOM 489 C THR C 483 -22.423 -3.208 6.827 1.00 0.00 C ATOM 490 O THR C 483 -23.040 -2.575 7.683 1.00 0.00 O ATOM 491 CB THR C 483 -23.650 -5.210 5.990 1.00 0.00 C ATOM 492 OG1 THR C 483 -22.527 -6.087 6.167 1.00 0.00 O ATOM 493 CG2 THR C 483 -24.556 -5.762 4.903 1.00 0.00 C ATOM 0 H THR C 483 -21.655 -4.603 4.409 1.00 0.00 H new ATOM 0 HA THR C 483 -24.003 -3.154 5.386 1.00 0.00 H new ATOM 0 HB THR C 483 -24.218 -5.146 6.918 1.00 0.00 H new ATOM 0 HG1 THR C 483 -22.632 -6.873 5.591 1.00 0.00 H new ATOM 0 HG21 THR C 483 -24.892 -6.761 5.182 1.00 0.00 H new ATOM 0 HG22 THR C 483 -25.420 -5.108 4.783 1.00 0.00 H new ATOM 0 HG23 THR C 483 -24.007 -5.814 3.963 1.00 0.00 H new ATOM 501 N ARG C 484 -21.098 -3.417 6.882 1.00 0.00 N ATOM 502 CA ARG C 484 -20.276 -2.986 8.015 1.00 0.00 C ATOM 503 C ARG C 484 -20.711 -3.685 9.293 1.00 0.00 C ATOM 504 O ARG C 484 -20.390 -3.251 10.402 1.00 0.00 O ATOM 505 CB ARG C 484 -20.307 -1.466 8.205 1.00 0.00 C ATOM 506 CG ARG C 484 -19.539 -0.675 7.156 1.00 0.00 C ATOM 507 CD ARG C 484 -20.272 -0.615 5.833 1.00 0.00 C ATOM 508 NE ARG C 484 -21.575 0.035 5.961 1.00 0.00 N ATOM 509 CZ ARG C 484 -22.125 0.808 5.027 1.00 0.00 C ATOM 510 NH1 ARG C 484 -21.482 1.039 3.884 1.00 0.00 N ATOM 511 NH2 ARG C 484 -23.319 1.344 5.238 1.00 0.00 N ATOM 0 H ARG C 484 -20.572 -3.887 6.145 1.00 0.00 H new ATOM 0 HA ARG C 484 -19.248 -3.268 7.789 1.00 0.00 H new ATOM 0 HB2 ARG C 484 -21.345 -1.135 8.201 1.00 0.00 H new ATOM 0 HB3 ARG C 484 -19.900 -1.229 9.188 1.00 0.00 H new ATOM 0 HG2 ARG C 484 -19.368 0.338 7.521 1.00 0.00 H new ATOM 0 HG3 ARG C 484 -18.560 -1.129 7.006 1.00 0.00 H new ATOM 0 HD2 ARG C 484 -19.666 -0.074 5.106 1.00 0.00 H new ATOM 0 HD3 ARG C 484 -20.407 -1.625 5.446 1.00 0.00 H new ATOM 0 HE ARG C 484 -22.098 -0.114 6.824 1.00 0.00 H new ATOM 0 HH11 ARG C 484 -20.565 0.623 3.722 1.00 0.00 H new ATOM 0 HH12 ARG C 484 -21.907 1.632 3.171 1.00 0.00 H new ATOM 0 HH21 ARG C 484 -23.812 1.163 6.113 1.00 0.00 H new ATOM 0 HH22 ARG C 484 -23.745 1.937 4.526 1.00 0.00 H new ATOM 525 N SER C 485 -21.419 -4.779 9.133 1.00 0.00 N ATOM 526 CA SER C 485 -21.915 -5.525 10.247 1.00 0.00 C ATOM 527 C SER C 485 -21.475 -6.961 10.147 1.00 0.00 C ATOM 528 O SER C 485 -22.040 -7.731 9.371 1.00 0.00 O ATOM 529 CB SER C 485 -23.440 -5.460 10.287 1.00 0.00 C ATOM 530 OG SER C 485 -23.953 -6.137 11.424 1.00 0.00 O ATOM 0 H SER C 485 -21.663 -5.170 8.223 1.00 0.00 H new ATOM 0 HA SER C 485 -21.514 -5.090 11.162 1.00 0.00 H new ATOM 0 HB2 SER C 485 -23.762 -4.419 10.305 1.00 0.00 H new ATOM 0 HB3 SER C 485 -23.849 -5.905 9.380 1.00 0.00 H new ATOM 0 HG SER C 485 -24.792 -5.716 11.704 1.00 0.00 H new ATOM 536 N VAL C 486 -20.451 -7.327 10.914 1.00 0.00 N ATOM 537 CA VAL C 486 -19.992 -8.699 10.931 1.00 0.00 C ATOM 538 C VAL C 486 -21.119 -9.638 11.361 1.00 0.00 C ATOM 539 O VAL C 486 -21.124 -10.817 11.014 1.00 0.00 O ATOM 540 CB VAL C 486 -18.751 -8.908 11.839 1.00 0.00 C ATOM 541 CG1 VAL C 486 -17.617 -8.001 11.422 1.00 0.00 C ATOM 542 CG2 VAL C 486 -19.078 -8.710 13.301 1.00 0.00 C ATOM 0 H VAL C 486 -19.933 -6.694 11.524 1.00 0.00 H new ATOM 0 HA VAL C 486 -19.688 -8.937 9.912 1.00 0.00 H new ATOM 0 HB VAL C 486 -18.434 -9.943 11.712 1.00 0.00 H new ATOM 0 HG11 VAL C 486 -16.760 -8.167 12.074 1.00 0.00 H new ATOM 0 HG12 VAL C 486 -17.337 -8.219 10.391 1.00 0.00 H new ATOM 0 HG13 VAL C 486 -17.935 -6.961 11.499 1.00 0.00 H new ATOM 0 HG21 VAL C 486 -18.180 -8.866 13.899 1.00 0.00 H new ATOM 0 HG22 VAL C 486 -19.446 -7.696 13.457 1.00 0.00 H new ATOM 0 HG23 VAL C 486 -19.844 -9.425 13.603 1.00 0.00 H new ATOM 552 N GLU C 487 -22.081 -9.101 12.112 1.00 0.00 N ATOM 553 CA GLU C 487 -23.237 -9.871 12.525 1.00 0.00 C ATOM 554 C GLU C 487 -24.056 -10.266 11.318 1.00 0.00 C ATOM 555 O GLU C 487 -24.421 -11.434 11.161 1.00 0.00 O ATOM 556 CB GLU C 487 -24.100 -9.086 13.508 1.00 0.00 C ATOM 557 CG GLU C 487 -23.429 -8.847 14.840 1.00 0.00 C ATOM 558 CD GLU C 487 -22.844 -10.115 15.412 1.00 0.00 C ATOM 559 OE1 GLU C 487 -23.597 -11.097 15.598 1.00 0.00 O ATOM 560 OE2 GLU C 487 -21.621 -10.146 15.660 1.00 0.00 O ATOM 0 H GLU C 487 -22.076 -8.136 12.443 1.00 0.00 H new ATOM 0 HA GLU C 487 -22.882 -10.770 13.029 1.00 0.00 H new ATOM 0 HB2 GLU C 487 -24.361 -8.125 13.064 1.00 0.00 H new ATOM 0 HB3 GLU C 487 -25.033 -9.625 13.672 1.00 0.00 H new ATOM 0 HG2 GLU C 487 -22.640 -8.105 14.721 1.00 0.00 H new ATOM 0 HG3 GLU C 487 -24.153 -8.433 15.542 1.00 0.00 H new ATOM 567 N ILE C 488 -24.329 -9.292 10.456 1.00 0.00 N ATOM 568 CA ILE C 488 -25.076 -9.551 9.245 1.00 0.00 C ATOM 569 C ILE C 488 -24.275 -10.440 8.325 1.00 0.00 C ATOM 570 O ILE C 488 -24.721 -11.478 7.969 1.00 0.00 O ATOM 571 CB ILE C 488 -25.451 -8.256 8.494 1.00 0.00 C ATOM 572 CG1 ILE C 488 -26.233 -7.314 9.412 1.00 0.00 C ATOM 573 CG2 ILE C 488 -26.266 -8.584 7.245 1.00 0.00 C ATOM 574 CD1 ILE C 488 -26.694 -6.041 8.735 1.00 0.00 C ATOM 0 H ILE C 488 -24.042 -8.321 10.579 1.00 0.00 H new ATOM 0 HA ILE C 488 -26.001 -10.045 9.543 1.00 0.00 H new ATOM 0 HB ILE C 488 -24.533 -7.754 8.187 1.00 0.00 H new ATOM 0 HG12 ILE C 488 -27.103 -7.842 9.802 1.00 0.00 H new ATOM 0 HG13 ILE C 488 -25.608 -7.054 10.267 1.00 0.00 H new ATOM 0 HG21 ILE C 488 -26.523 -7.661 6.726 1.00 0.00 H new ATOM 0 HG22 ILE C 488 -25.678 -9.221 6.584 1.00 0.00 H new ATOM 0 HG23 ILE C 488 -27.179 -9.105 7.533 1.00 0.00 H new ATOM 0 HD11 ILE C 488 -27.241 -5.426 9.450 1.00 0.00 H new ATOM 0 HD12 ILE C 488 -25.828 -5.489 8.369 1.00 0.00 H new ATOM 0 HD13 ILE C 488 -27.346 -6.290 7.898 1.00 0.00 H new ATOM 586 N THR C 489 -23.075 -10.003 7.968 1.00 0.00 N ATOM 587 CA THR C 489 -22.165 -10.754 7.104 1.00 0.00 C ATOM 588 C THR C 489 -22.078 -12.248 7.480 1.00 0.00 C ATOM 589 O THR C 489 -22.144 -13.114 6.609 1.00 0.00 O ATOM 590 CB THR C 489 -20.764 -10.133 7.157 1.00 0.00 C ATOM 591 OG1 THR C 489 -20.866 -8.724 6.926 1.00 0.00 O ATOM 592 CG2 THR C 489 -19.850 -10.745 6.111 1.00 0.00 C ATOM 0 H THR C 489 -22.698 -9.105 8.273 1.00 0.00 H new ATOM 0 HA THR C 489 -22.569 -10.696 6.093 1.00 0.00 H new ATOM 0 HB THR C 489 -20.338 -10.329 8.141 1.00 0.00 H new ATOM 0 HG1 THR C 489 -21.210 -8.565 6.022 1.00 0.00 H new ATOM 0 HG21 THR C 489 -18.864 -10.284 6.174 1.00 0.00 H new ATOM 0 HG22 THR C 489 -19.761 -11.817 6.288 1.00 0.00 H new ATOM 0 HG23 THR C 489 -20.267 -10.575 5.119 1.00 0.00 H new ATOM 600 N THR C 490 -21.955 -12.548 8.770 1.00 0.00 N ATOM 601 CA THR C 490 -21.864 -13.931 9.214 1.00 0.00 C ATOM 602 C THR C 490 -23.203 -14.646 9.020 1.00 0.00 C ATOM 603 O THR C 490 -23.256 -15.771 8.512 1.00 0.00 O ATOM 604 CB THR C 490 -21.434 -14.022 10.687 1.00 0.00 C ATOM 605 OG1 THR C 490 -20.223 -13.280 10.882 1.00 0.00 O ATOM 606 CG2 THR C 490 -21.200 -15.463 11.081 1.00 0.00 C ATOM 0 H THR C 490 -21.916 -11.857 9.519 1.00 0.00 H new ATOM 0 HA THR C 490 -21.104 -14.421 8.606 1.00 0.00 H new ATOM 0 HB THR C 490 -22.229 -13.607 11.307 1.00 0.00 H new ATOM 0 HG1 THR C 490 -20.390 -12.330 10.709 1.00 0.00 H new ATOM 0 HG21 THR C 490 -20.896 -15.510 12.127 1.00 0.00 H new ATOM 0 HG22 THR C 490 -22.120 -16.031 10.945 1.00 0.00 H new ATOM 0 HG23 THR C 490 -20.415 -15.888 10.456 1.00 0.00 H new ATOM 614 N ASP C 491 -24.279 -13.976 9.403 1.00 0.00 N ATOM 615 CA ASP C 491 -25.626 -14.521 9.238 1.00 0.00 C ATOM 616 C ASP C 491 -25.949 -14.619 7.754 1.00 0.00 C ATOM 617 O ASP C 491 -26.633 -15.533 7.306 1.00 0.00 O ATOM 618 CB ASP C 491 -26.639 -13.625 9.948 1.00 0.00 C ATOM 619 CG ASP C 491 -28.051 -14.148 9.858 1.00 0.00 C ATOM 620 OD1 ASP C 491 -28.360 -15.155 10.529 1.00 0.00 O ATOM 621 OD2 ASP C 491 -28.866 -13.540 9.140 1.00 0.00 O ATOM 0 H ASP C 491 -24.250 -13.051 9.832 1.00 0.00 H new ATOM 0 HA ASP C 491 -25.677 -15.516 9.680 1.00 0.00 H new ATOM 0 HB2 ASP C 491 -26.359 -13.529 10.997 1.00 0.00 H new ATOM 0 HB3 ASP C 491 -26.599 -12.626 9.515 1.00 0.00 H new ATOM 626 N ASN C 492 -25.414 -13.667 7.014 1.00 0.00 N ATOM 627 CA ASN C 492 -25.522 -13.590 5.571 1.00 0.00 C ATOM 628 C ASN C 492 -24.996 -14.877 4.963 1.00 0.00 C ATOM 629 O ASN C 492 -25.628 -15.482 4.100 1.00 0.00 O ATOM 630 CB ASN C 492 -24.698 -12.387 5.064 1.00 0.00 C ATOM 631 CG ASN C 492 -25.532 -11.295 4.439 1.00 0.00 C ATOM 632 OD1 ASN C 492 -26.585 -11.549 3.862 1.00 0.00 O ATOM 633 ND2 ASN C 492 -25.050 -10.064 4.540 1.00 0.00 N ATOM 0 H ASN C 492 -24.874 -12.900 7.415 1.00 0.00 H new ATOM 0 HA ASN C 492 -26.564 -13.457 5.280 1.00 0.00 H new ATOM 0 HB2 ASN C 492 -24.134 -11.968 5.897 1.00 0.00 H new ATOM 0 HB3 ASN C 492 -23.971 -12.739 4.332 1.00 0.00 H new ATOM 0 HD21 ASN C 492 -25.559 -9.282 4.129 1.00 0.00 H new ATOM 0 HD22 ASN C 492 -24.170 -9.899 5.029 1.00 0.00 H new ATOM 640 N ILE C 493 -23.828 -15.297 5.438 1.00 0.00 N ATOM 641 CA ILE C 493 -23.217 -16.543 5.002 1.00 0.00 C ATOM 642 C ILE C 493 -24.149 -17.711 5.307 1.00 0.00 C ATOM 643 O ILE C 493 -24.438 -18.542 4.445 1.00 0.00 O ATOM 644 CB ILE C 493 -21.882 -16.801 5.748 1.00 0.00 C ATOM 645 CG1 ILE C 493 -20.905 -15.653 5.542 1.00 0.00 C ATOM 646 CG2 ILE C 493 -21.260 -18.111 5.299 1.00 0.00 C ATOM 647 CD1 ILE C 493 -19.695 -15.719 6.456 1.00 0.00 C ATOM 0 H ILE C 493 -23.283 -14.785 6.132 1.00 0.00 H new ATOM 0 HA ILE C 493 -23.031 -16.460 3.931 1.00 0.00 H new ATOM 0 HB ILE C 493 -22.105 -16.869 6.813 1.00 0.00 H new ATOM 0 HG12 ILE C 493 -20.568 -15.654 4.505 1.00 0.00 H new ATOM 0 HG13 ILE C 493 -21.425 -14.709 5.707 1.00 0.00 H new ATOM 0 HG21 ILE C 493 -20.325 -18.272 5.835 1.00 0.00 H new ATOM 0 HG22 ILE C 493 -21.946 -18.931 5.511 1.00 0.00 H new ATOM 0 HG23 ILE C 493 -21.062 -18.072 4.228 1.00 0.00 H new ATOM 0 HD11 ILE C 493 -19.041 -14.871 6.255 1.00 0.00 H new ATOM 0 HD12 ILE C 493 -20.022 -15.687 7.495 1.00 0.00 H new ATOM 0 HD13 ILE C 493 -19.152 -16.647 6.275 1.00 0.00 H new ATOM 659 N LEU C 494 -24.625 -17.738 6.541 1.00 0.00 N ATOM 660 CA LEU C 494 -25.479 -18.803 7.048 1.00 0.00 C ATOM 661 C LEU C 494 -26.837 -18.860 6.347 1.00 0.00 C ATOM 662 O LEU C 494 -27.484 -19.903 6.335 1.00 0.00 O ATOM 663 CB LEU C 494 -25.643 -18.644 8.555 1.00 0.00 C ATOM 664 CG LEU C 494 -24.372 -18.905 9.365 1.00 0.00 C ATOM 665 CD1 LEU C 494 -24.505 -18.358 10.773 1.00 0.00 C ATOM 666 CD2 LEU C 494 -24.063 -20.395 9.401 1.00 0.00 C ATOM 0 H LEU C 494 -24.427 -17.012 7.229 1.00 0.00 H new ATOM 0 HA LEU C 494 -24.992 -19.754 6.831 1.00 0.00 H new ATOM 0 HB2 LEU C 494 -25.990 -17.632 8.765 1.00 0.00 H new ATOM 0 HB3 LEU C 494 -26.422 -19.326 8.896 1.00 0.00 H new ATOM 0 HG LEU C 494 -23.546 -18.388 8.877 1.00 0.00 H new ATOM 0 HD11 LEU C 494 -23.588 -18.556 11.328 1.00 0.00 H new ATOM 0 HD12 LEU C 494 -24.678 -17.283 10.731 1.00 0.00 H new ATOM 0 HD13 LEU C 494 -25.344 -18.841 11.273 1.00 0.00 H new ATOM 0 HD21 LEU C 494 -23.156 -20.565 9.981 1.00 0.00 H new ATOM 0 HD22 LEU C 494 -24.894 -20.928 9.863 1.00 0.00 H new ATOM 0 HD23 LEU C 494 -23.918 -20.761 8.385 1.00 0.00 H new ATOM 678 N GLU C 495 -27.269 -17.746 5.767 1.00 0.00 N ATOM 679 CA GLU C 495 -28.526 -17.721 5.016 1.00 0.00 C ATOM 680 C GLU C 495 -28.313 -18.227 3.601 1.00 0.00 C ATOM 681 O GLU C 495 -29.253 -18.322 2.815 1.00 0.00 O ATOM 682 CB GLU C 495 -29.122 -16.317 4.956 1.00 0.00 C ATOM 683 CG GLU C 495 -29.613 -15.785 6.281 1.00 0.00 C ATOM 684 CD GLU C 495 -30.433 -14.530 6.117 1.00 0.00 C ATOM 685 OE1 GLU C 495 -29.866 -13.490 5.732 1.00 0.00 O ATOM 686 OE2 GLU C 495 -31.659 -14.582 6.357 1.00 0.00 O ATOM 0 H GLU C 495 -26.775 -16.854 5.799 1.00 0.00 H new ATOM 0 HA GLU C 495 -29.223 -18.373 5.542 1.00 0.00 H new ATOM 0 HB2 GLU C 495 -28.370 -15.634 4.561 1.00 0.00 H new ATOM 0 HB3 GLU C 495 -29.952 -16.319 4.250 1.00 0.00 H new ATOM 0 HG2 GLU C 495 -30.213 -16.548 6.778 1.00 0.00 H new ATOM 0 HG3 GLU C 495 -28.760 -15.579 6.927 1.00 0.00 H new ATOM 693 N GLY C 496 -27.070 -18.539 3.278 1.00 0.00 N ATOM 694 CA GLY C 496 -26.752 -18.999 1.952 1.00 0.00 C ATOM 695 C GLY C 496 -26.619 -17.851 0.984 1.00 0.00 C ATOM 696 O GLY C 496 -26.672 -18.041 -0.228 1.00 0.00 O ATOM 0 H GLY C 496 -26.275 -18.481 3.915 1.00 0.00 H new ATOM 0 HA2 GLY C 496 -25.821 -19.565 1.976 1.00 0.00 H new ATOM 0 HA3 GLY C 496 -27.530 -19.679 1.606 1.00 0.00 H new ATOM 700 N ARG C 497 -26.455 -16.652 1.527 1.00 0.00 N ATOM 701 CA ARG C 497 -26.295 -15.457 0.717 1.00 0.00 C ATOM 702 C ARG C 497 -24.910 -15.439 0.104 1.00 0.00 C ATOM 703 O ARG C 497 -24.728 -15.043 -1.047 1.00 0.00 O ATOM 704 CB ARG C 497 -26.535 -14.198 1.585 1.00 0.00 C ATOM 705 CG ARG C 497 -26.517 -12.870 0.824 1.00 0.00 C ATOM 706 CD ARG C 497 -25.099 -12.381 0.586 1.00 0.00 C ATOM 707 NE ARG C 497 -25.056 -11.112 -0.131 1.00 0.00 N ATOM 708 CZ ARG C 497 -24.463 -10.018 0.330 1.00 0.00 C ATOM 709 NH1 ARG C 497 -23.932 -10.015 1.540 1.00 0.00 N ATOM 710 NH2 ARG C 497 -24.416 -8.921 -0.412 1.00 0.00 N ATOM 0 H ARG C 497 -26.430 -16.483 2.533 1.00 0.00 H new ATOM 0 HA ARG C 497 -27.028 -15.460 -0.089 1.00 0.00 H new ATOM 0 HB2 ARG C 497 -27.498 -14.299 2.085 1.00 0.00 H new ATOM 0 HB3 ARG C 497 -25.774 -14.163 2.364 1.00 0.00 H new ATOM 0 HG2 ARG C 497 -27.026 -12.991 -0.132 1.00 0.00 H new ATOM 0 HG3 ARG C 497 -27.071 -12.120 1.387 1.00 0.00 H new ATOM 0 HD2 ARG C 497 -24.591 -12.270 1.544 1.00 0.00 H new ATOM 0 HD3 ARG C 497 -24.550 -13.133 0.019 1.00 0.00 H new ATOM 0 HE ARG C 497 -25.510 -11.062 -1.043 1.00 0.00 H new ATOM 0 HH11 ARG C 497 -23.978 -10.853 2.119 1.00 0.00 H new ATOM 0 HH12 ARG C 497 -23.476 -9.174 1.895 1.00 0.00 H new ATOM 0 HH21 ARG C 497 -24.837 -8.915 -1.341 1.00 0.00 H new ATOM 0 HH22 ARG C 497 -23.959 -8.082 -0.054 1.00 0.00 H new ATOM 724 N ILE C 498 -23.943 -15.881 0.874 1.00 0.00 N ATOM 725 CA ILE C 498 -22.573 -15.911 0.424 1.00 0.00 C ATOM 726 C ILE C 498 -22.169 -17.335 0.086 1.00 0.00 C ATOM 727 O ILE C 498 -21.992 -18.171 0.977 1.00 0.00 O ATOM 728 CB ILE C 498 -21.610 -15.319 1.487 1.00 0.00 C ATOM 729 CG1 ILE C 498 -21.994 -13.863 1.788 1.00 0.00 C ATOM 730 CG2 ILE C 498 -20.166 -15.403 1.008 1.00 0.00 C ATOM 731 CD1 ILE C 498 -21.165 -13.212 2.878 1.00 0.00 C ATOM 0 H ILE C 498 -24.083 -16.227 1.823 1.00 0.00 H new ATOM 0 HA ILE C 498 -22.500 -15.292 -0.470 1.00 0.00 H new ATOM 0 HB ILE C 498 -21.698 -15.903 2.403 1.00 0.00 H new ATOM 0 HG12 ILE C 498 -21.896 -13.277 0.874 1.00 0.00 H new ATOM 0 HG13 ILE C 498 -23.044 -13.829 2.077 1.00 0.00 H new ATOM 0 HG21 ILE C 498 -19.506 -14.983 1.767 1.00 0.00 H new ATOM 0 HG22 ILE C 498 -19.901 -16.446 0.833 1.00 0.00 H new ATOM 0 HG23 ILE C 498 -20.057 -14.840 0.081 1.00 0.00 H new ATOM 0 HD11 ILE C 498 -21.501 -12.186 3.027 1.00 0.00 H new ATOM 0 HD12 ILE C 498 -21.282 -13.771 3.807 1.00 0.00 H new ATOM 0 HD13 ILE C 498 -20.115 -13.211 2.585 1.00 0.00 H new ATOM 743 N GLN C 499 -22.064 -17.611 -1.198 1.00 0.00 N ATOM 744 CA GLN C 499 -21.683 -18.927 -1.671 1.00 0.00 C ATOM 745 C GLN C 499 -20.179 -19.095 -1.585 1.00 0.00 C ATOM 746 O GLN C 499 -19.429 -18.157 -1.860 1.00 0.00 O ATOM 747 CB GLN C 499 -22.147 -19.157 -3.121 1.00 0.00 C ATOM 748 CG GLN C 499 -23.661 -19.142 -3.323 1.00 0.00 C ATOM 749 CD GLN C 499 -24.263 -17.752 -3.238 1.00 0.00 C ATOM 750 OE1 GLN C 499 -23.618 -16.759 -3.568 1.00 0.00 O ATOM 751 NE2 GLN C 499 -25.497 -17.674 -2.797 1.00 0.00 N ATOM 0 H GLN C 499 -22.239 -16.933 -1.940 1.00 0.00 H new ATOM 0 HA GLN C 499 -22.171 -19.665 -1.034 1.00 0.00 H new ATOM 0 HB2 GLN C 499 -21.703 -18.389 -3.755 1.00 0.00 H new ATOM 0 HB3 GLN C 499 -21.759 -20.116 -3.463 1.00 0.00 H new ATOM 0 HG2 GLN C 499 -23.895 -19.573 -4.296 1.00 0.00 H new ATOM 0 HG3 GLN C 499 -24.127 -19.779 -2.572 1.00 0.00 H new ATOM 0 HE21 GLN C 499 -25.999 -18.522 -2.533 1.00 0.00 H new ATOM 0 HE22 GLN C 499 -25.954 -16.766 -2.718 1.00 0.00 H new ATOM 760 N VAL C 500 -19.741 -20.271 -1.204 1.00 0.00 N ATOM 761 CA VAL C 500 -18.329 -20.547 -1.088 1.00 0.00 C ATOM 762 C VAL C 500 -17.780 -21.196 -2.364 1.00 0.00 C ATOM 763 O VAL C 500 -18.159 -22.314 -2.721 1.00 0.00 O ATOM 764 CB VAL C 500 -18.015 -21.434 0.142 1.00 0.00 C ATOM 765 CG1 VAL C 500 -18.218 -20.645 1.422 1.00 0.00 C ATOM 766 CG2 VAL C 500 -18.886 -22.681 0.156 1.00 0.00 C ATOM 0 H VAL C 500 -20.347 -21.057 -0.968 1.00 0.00 H new ATOM 0 HA VAL C 500 -17.831 -19.588 -0.947 1.00 0.00 H new ATOM 0 HB VAL C 500 -16.973 -21.747 0.075 1.00 0.00 H new ATOM 0 HG11 VAL C 500 -17.994 -21.279 2.280 1.00 0.00 H new ATOM 0 HG12 VAL C 500 -17.553 -19.781 1.426 1.00 0.00 H new ATOM 0 HG13 VAL C 500 -19.253 -20.307 1.481 1.00 0.00 H new ATOM 0 HG21 VAL C 500 -18.643 -23.284 1.031 1.00 0.00 H new ATOM 0 HG22 VAL C 500 -19.936 -22.391 0.195 1.00 0.00 H new ATOM 0 HG23 VAL C 500 -18.704 -23.262 -0.748 1.00 0.00 H new ATOM 776 N PRO C 501 -16.916 -20.479 -3.095 1.00 0.00 N ATOM 777 CA PRO C 501 -16.290 -20.998 -4.300 1.00 0.00 C ATOM 778 C PRO C 501 -15.129 -21.931 -3.975 1.00 0.00 C ATOM 779 O PRO C 501 -14.615 -21.939 -2.851 1.00 0.00 O ATOM 780 CB PRO C 501 -15.767 -19.738 -5.022 1.00 0.00 C ATOM 781 CG PRO C 501 -16.210 -18.576 -4.191 1.00 0.00 C ATOM 782 CD PRO C 501 -16.494 -19.113 -2.824 1.00 0.00 C ATOM 0 HA PRO C 501 -16.988 -21.583 -4.899 1.00 0.00 H new ATOM 0 HB2 PRO C 501 -14.681 -19.762 -5.112 1.00 0.00 H new ATOM 0 HB3 PRO C 501 -16.170 -19.671 -6.033 1.00 0.00 H new ATOM 0 HG2 PRO C 501 -15.436 -17.809 -4.153 1.00 0.00 H new ATOM 0 HG3 PRO C 501 -17.099 -18.111 -4.617 1.00 0.00 H new ATOM 0 HD2 PRO C 501 -15.611 -19.082 -2.186 1.00 0.00 H new ATOM 0 HD3 PRO C 501 -17.273 -18.542 -2.319 1.00 0.00 H new ATOM 790 N PHE C 502 -14.723 -22.705 -4.953 1.00 0.00 N ATOM 791 CA PHE C 502 -13.614 -23.624 -4.793 1.00 0.00 C ATOM 792 C PHE C 502 -12.567 -23.354 -5.862 1.00 0.00 C ATOM 793 O PHE C 502 -12.917 -23.089 -7.013 1.00 0.00 O ATOM 794 CB PHE C 502 -14.098 -25.084 -4.849 1.00 0.00 C ATOM 795 CG PHE C 502 -15.029 -25.386 -5.992 1.00 0.00 C ATOM 796 CD1 PHE C 502 -16.386 -25.153 -5.865 1.00 0.00 C ATOM 797 CD2 PHE C 502 -14.550 -25.905 -7.183 1.00 0.00 C ATOM 798 CE1 PHE C 502 -17.253 -25.429 -6.903 1.00 0.00 C ATOM 799 CE2 PHE C 502 -15.411 -26.183 -8.228 1.00 0.00 C ATOM 800 CZ PHE C 502 -16.764 -25.945 -8.087 1.00 0.00 C ATOM 0 H PHE C 502 -15.148 -22.718 -5.880 1.00 0.00 H new ATOM 0 HA PHE C 502 -13.163 -23.466 -3.813 1.00 0.00 H new ATOM 0 HB2 PHE C 502 -13.230 -25.739 -4.920 1.00 0.00 H new ATOM 0 HB3 PHE C 502 -14.602 -25.323 -3.913 1.00 0.00 H new ATOM 0 HD1 PHE C 502 -16.773 -24.750 -4.941 1.00 0.00 H new ATOM 0 HD2 PHE C 502 -13.493 -26.095 -7.297 1.00 0.00 H new ATOM 0 HE1 PHE C 502 -18.311 -25.242 -6.790 1.00 0.00 H new ATOM 0 HE2 PHE C 502 -15.026 -26.586 -9.153 1.00 0.00 H new ATOM 0 HZ PHE C 502 -17.439 -26.162 -8.902 1.00 0.00 H new ATOM 810 N PRO C 503 -11.269 -23.383 -5.497 1.00 0.00 N ATOM 811 CA PRO C 503 -10.184 -23.109 -6.444 1.00 0.00 C ATOM 812 C PRO C 503 -10.268 -23.993 -7.682 1.00 0.00 C ATOM 813 O PRO C 503 -10.212 -25.225 -7.588 1.00 0.00 O ATOM 814 CB PRO C 503 -8.921 -23.431 -5.641 1.00 0.00 C ATOM 815 CG PRO C 503 -9.324 -23.255 -4.220 1.00 0.00 C ATOM 816 CD PRO C 503 -10.764 -23.669 -4.143 1.00 0.00 C ATOM 0 HA PRO C 503 -10.215 -22.086 -6.819 1.00 0.00 H new ATOM 0 HB2 PRO C 503 -8.578 -24.448 -5.833 1.00 0.00 H new ATOM 0 HB3 PRO C 503 -8.102 -22.763 -5.906 1.00 0.00 H new ATOM 0 HG2 PRO C 503 -8.707 -23.866 -3.561 1.00 0.00 H new ATOM 0 HG3 PRO C 503 -9.199 -22.219 -3.905 1.00 0.00 H new ATOM 0 HD2 PRO C 503 -10.867 -24.724 -3.889 1.00 0.00 H new ATOM 0 HD3 PRO C 503 -11.305 -23.105 -3.384 1.00 0.00 H new ATOM 824 N THR C 504 -10.385 -23.350 -8.830 1.00 0.00 N ATOM 825 CA THR C 504 -10.512 -24.008 -10.119 1.00 0.00 C ATOM 826 C THR C 504 -10.358 -22.968 -11.230 1.00 0.00 C ATOM 827 O THR C 504 -9.330 -22.991 -11.934 1.00 0.00 O ATOM 828 CB THR C 504 -11.885 -24.736 -10.280 1.00 0.00 C ATOM 829 OG1 THR C 504 -11.991 -25.819 -9.339 1.00 0.00 O ATOM 830 CG2 THR C 504 -12.049 -25.284 -11.691 1.00 0.00 C ATOM 831 OXT THR C 504 -11.254 -22.105 -11.367 1.00 0.00 O ATOM 0 H THR C 504 -10.395 -22.332 -8.894 1.00 0.00 H new ATOM 0 HA THR C 504 -9.729 -24.764 -10.185 1.00 0.00 H new ATOM 0 HB THR C 504 -12.672 -24.006 -10.089 1.00 0.00 H new ATOM 0 HG1 THR C 504 -11.144 -25.916 -8.855 1.00 0.00 H new ATOM 0 HG21 THR C 504 -13.013 -25.786 -11.777 1.00 0.00 H new ATOM 0 HG22 THR C 504 -12.002 -24.464 -12.408 1.00 0.00 H new ATOM 0 HG23 THR C 504 -11.250 -25.995 -11.900 1.00 0.00 H new TER 839 THR C 504