USER MOD reduce.3.24.130724 H: found=0, std=0, add=385, rem=0, adj=6 USER MOD reduce.3.24.130724 removed 388 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: A 555 SER OG : rot 30:sc= -2.68! USER MOD Set 1.2: A 565 ASN : amide:sc= -9.23! C(o=-12!,f=-11!) USER MOD Set 2.1: A 550 GLN : amide:sc= -0.503 K(o=-6.9,f=-3.1) USER MOD Set 2.2: A 553 GLN : amide:sc= -6.38! K(o=-6.9!,f=-3.1) USER MOD Single : A 537 SER OG : rot 180:sc= 0 USER MOD Single : A 541 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 542 ASN : amide:sc= -0.724 K(o=-0.72,f=-6.6!) USER MOD Single : A 548 GLN : amide:sc= 0 K(o=0,f=-0.63) USER MOD Single : A 549 GLN : amide:sc= 0 K(o=0,f=-0.53) USER MOD Single : A 557 MET CE :methyl -119:sc= -1.3 (180deg=-2.9!) USER MOD Single : A 561 ASN : amide:sc= -1.03 K(o=-1,f=-5.3!) USER MOD Single : A 567 GLN : amide:sc= -0.333 X(o=-0.33,f=-0.38) USER MOD Single : A 572 THR OG1 : rot -72:sc= 1.02 USER MOD Single : A 577 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 586 SER OG : rot 180:sc= 0 USER MOD Single : A 587 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 536 -21.187 1.002 -17.447 1.00 0.00 N ATOM 2 CA GLY A 536 -21.881 1.969 -16.551 1.00 0.00 C ATOM 3 C GLY A 536 -21.877 1.525 -15.102 1.00 0.00 C ATOM 4 O GLY A 536 -22.324 2.259 -14.219 1.00 0.00 O ATOM 0 HA2 GLY A 536 -21.399 2.943 -16.630 1.00 0.00 H new ATOM 0 HA3 GLY A 536 -22.911 2.095 -16.886 1.00 0.00 H new ATOM 10 N SER A 537 -21.372 0.319 -14.855 1.00 0.00 N ATOM 11 CA SER A 537 -21.313 -0.223 -13.500 1.00 0.00 C ATOM 12 C SER A 537 -20.354 0.581 -12.614 1.00 0.00 C ATOM 13 O SER A 537 -20.722 0.973 -11.507 1.00 0.00 O ATOM 14 CB SER A 537 -20.905 -1.699 -13.528 1.00 0.00 C ATOM 15 OG SER A 537 -21.859 -2.479 -14.229 1.00 0.00 O ATOM 0 H SER A 537 -20.998 -0.301 -15.574 1.00 0.00 H new ATOM 0 HA SER A 537 -22.311 -0.143 -13.069 1.00 0.00 H new ATOM 0 HB2 SER A 537 -19.929 -1.801 -14.002 1.00 0.00 H new ATOM 0 HB3 SER A 537 -20.805 -2.071 -12.508 1.00 0.00 H new ATOM 0 HG SER A 537 -21.575 -3.417 -14.234 1.00 0.00 H new ATOM 21 N PRO A 538 -19.109 0.842 -13.078 1.00 0.00 N ATOM 22 CA PRO A 538 -18.130 1.607 -12.295 1.00 0.00 C ATOM 23 C PRO A 538 -18.615 3.022 -11.994 1.00 0.00 C ATOM 24 O PRO A 538 -18.468 3.919 -12.819 1.00 0.00 O ATOM 25 CB PRO A 538 -16.888 1.651 -13.196 1.00 0.00 C ATOM 26 CG PRO A 538 -17.074 0.532 -14.163 1.00 0.00 C ATOM 27 CD PRO A 538 -18.554 0.419 -14.378 1.00 0.00 C ATOM 0 HA PRO A 538 -17.945 1.149 -11.323 1.00 0.00 H new ATOM 0 HB2 PRO A 538 -16.807 2.608 -13.711 1.00 0.00 H new ATOM 0 HB3 PRO A 538 -15.974 1.523 -12.615 1.00 0.00 H new ATOM 0 HG2 PRO A 538 -16.557 0.736 -15.101 1.00 0.00 H new ATOM 0 HG3 PRO A 538 -16.664 -0.398 -13.769 1.00 0.00 H new ATOM 0 HD2 PRO A 538 -18.894 1.061 -15.191 1.00 0.00 H new ATOM 0 HD3 PRO A 538 -18.849 -0.599 -14.631 1.00 0.00 H new ATOM 35 N GLU A 539 -19.216 3.193 -10.813 1.00 0.00 N ATOM 36 CA GLU A 539 -19.739 4.490 -10.371 1.00 0.00 C ATOM 37 C GLU A 539 -18.707 5.613 -10.515 1.00 0.00 C ATOM 38 O GLU A 539 -18.083 6.027 -9.538 1.00 0.00 O ATOM 39 CB GLU A 539 -20.200 4.400 -8.914 1.00 0.00 C ATOM 40 CG GLU A 539 -21.312 3.390 -8.687 1.00 0.00 C ATOM 41 CD GLU A 539 -21.663 3.230 -7.222 1.00 0.00 C ATOM 42 OE1 GLU A 539 -22.531 3.984 -6.733 1.00 0.00 O ATOM 43 OE2 GLU A 539 -21.068 2.352 -6.561 1.00 0.00 O ATOM 0 H GLU A 539 -19.354 2.440 -10.139 1.00 0.00 H new ATOM 0 HA GLU A 539 -20.584 4.733 -11.016 1.00 0.00 H new ATOM 0 HB2 GLU A 539 -19.348 4.136 -8.288 1.00 0.00 H new ATOM 0 HB3 GLU A 539 -20.542 5.383 -8.589 1.00 0.00 H new ATOM 0 HG2 GLU A 539 -22.199 3.702 -9.237 1.00 0.00 H new ATOM 0 HG3 GLU A 539 -21.009 2.424 -9.092 1.00 0.00 H new ATOM 50 N PHE A 540 -18.537 6.093 -11.741 1.00 0.00 N ATOM 51 CA PHE A 540 -17.596 7.168 -12.031 1.00 0.00 C ATOM 52 C PHE A 540 -18.064 8.500 -11.451 1.00 0.00 C ATOM 53 O PHE A 540 -17.343 9.495 -11.514 1.00 0.00 O ATOM 54 CB PHE A 540 -17.397 7.304 -13.544 1.00 0.00 C ATOM 55 CG PHE A 540 -18.666 7.598 -14.296 1.00 0.00 C ATOM 56 CD1 PHE A 540 -19.456 6.567 -14.776 1.00 0.00 C ATOM 57 CD2 PHE A 540 -19.068 8.905 -14.518 1.00 0.00 C ATOM 58 CE1 PHE A 540 -20.623 6.833 -15.467 1.00 0.00 C ATOM 59 CE2 PHE A 540 -20.234 9.179 -15.209 1.00 0.00 C ATOM 60 CZ PHE A 540 -21.009 8.142 -15.688 1.00 0.00 C ATOM 0 H PHE A 540 -19.044 5.751 -12.557 1.00 0.00 H new ATOM 0 HA PHE A 540 -16.648 6.910 -11.560 1.00 0.00 H new ATOM 0 HB2 PHE A 540 -16.678 8.100 -13.737 1.00 0.00 H new ATOM 0 HB3 PHE A 540 -16.962 6.382 -13.929 1.00 0.00 H new ATOM 0 HD1 PHE A 540 -19.157 5.543 -14.608 1.00 0.00 H new ATOM 0 HD2 PHE A 540 -18.464 9.720 -14.147 1.00 0.00 H new ATOM 0 HE1 PHE A 540 -21.232 6.020 -15.834 1.00 0.00 H new ATOM 0 HE2 PHE A 540 -20.538 10.202 -15.374 1.00 0.00 H new ATOM 0 HZ PHE A 540 -21.916 8.353 -16.235 1.00 0.00 H new ATOM 70 N GLN A 541 -19.274 8.522 -10.898 1.00 0.00 N ATOM 71 CA GLN A 541 -19.830 9.743 -10.324 1.00 0.00 C ATOM 72 C GLN A 541 -18.919 10.335 -9.252 1.00 0.00 C ATOM 73 O GLN A 541 -18.671 11.542 -9.244 1.00 0.00 O ATOM 74 CB GLN A 541 -21.212 9.459 -9.732 1.00 0.00 C ATOM 75 CG GLN A 541 -21.814 10.642 -8.990 1.00 0.00 C ATOM 76 CD GLN A 541 -23.181 10.331 -8.411 1.00 0.00 C ATOM 77 OE1 GLN A 541 -23.295 9.866 -7.277 1.00 0.00 O ATOM 78 NE2 GLN A 541 -24.226 10.587 -9.190 1.00 0.00 N ATOM 0 H GLN A 541 -19.887 7.709 -10.836 1.00 0.00 H new ATOM 0 HA GLN A 541 -19.916 10.475 -11.127 1.00 0.00 H new ATOM 0 HB2 GLN A 541 -21.887 9.163 -10.535 1.00 0.00 H new ATOM 0 HB3 GLN A 541 -21.138 8.613 -9.049 1.00 0.00 H new ATOM 0 HG2 GLN A 541 -21.142 10.942 -8.186 1.00 0.00 H new ATOM 0 HG3 GLN A 541 -21.896 11.490 -9.670 1.00 0.00 H new ATOM 0 HE21 GLN A 541 -24.084 10.973 -10.124 1.00 0.00 H new ATOM 0 HE22 GLN A 541 -25.171 10.398 -8.855 1.00 0.00 H new ATOM 87 N ASN A 542 -18.418 9.494 -8.350 1.00 0.00 N ATOM 88 CA ASN A 542 -17.548 9.973 -7.281 1.00 0.00 C ATOM 89 C ASN A 542 -16.299 9.103 -7.125 1.00 0.00 C ATOM 90 O ASN A 542 -16.197 8.310 -6.189 1.00 0.00 O ATOM 91 CB ASN A 542 -18.320 10.030 -5.957 1.00 0.00 C ATOM 92 CG ASN A 542 -18.945 8.698 -5.585 1.00 0.00 C ATOM 93 OD1 ASN A 542 -19.291 7.893 -6.452 1.00 0.00 O ATOM 94 ND2 ASN A 542 -19.099 8.460 -4.288 1.00 0.00 N ATOM 0 H ASN A 542 -18.597 8.490 -8.338 1.00 0.00 H new ATOM 0 HA ASN A 542 -17.218 10.976 -7.552 1.00 0.00 H new ATOM 0 HB2 ASN A 542 -17.645 10.345 -5.161 1.00 0.00 H new ATOM 0 HB3 ASN A 542 -19.102 10.786 -6.029 1.00 0.00 H new ATOM 0 HD21 ASN A 542 -19.517 7.584 -3.976 1.00 0.00 H new ATOM 0 HD22 ASN A 542 -18.799 9.154 -3.603 1.00 0.00 H new ATOM 101 N PRO A 543 -15.329 9.246 -8.047 1.00 0.00 N ATOM 102 CA PRO A 543 -14.075 8.511 -8.008 1.00 0.00 C ATOM 103 C PRO A 543 -12.952 9.345 -7.394 1.00 0.00 C ATOM 104 O PRO A 543 -11.860 8.847 -7.121 1.00 0.00 O ATOM 105 CB PRO A 543 -13.814 8.269 -9.491 1.00 0.00 C ATOM 106 CG PRO A 543 -14.390 9.467 -10.187 1.00 0.00 C ATOM 107 CD PRO A 543 -15.390 10.103 -9.240 1.00 0.00 C ATOM 0 HA PRO A 543 -14.119 7.606 -7.402 1.00 0.00 H new ATOM 0 HB2 PRO A 543 -12.747 8.170 -9.693 1.00 0.00 H new ATOM 0 HB3 PRO A 543 -14.289 7.349 -9.830 1.00 0.00 H new ATOM 0 HG2 PRO A 543 -13.603 10.175 -10.447 1.00 0.00 H new ATOM 0 HG3 PRO A 543 -14.875 9.174 -11.118 1.00 0.00 H new ATOM 0 HD2 PRO A 543 -15.122 11.134 -9.007 1.00 0.00 H new ATOM 0 HD3 PRO A 543 -16.392 10.123 -9.669 1.00 0.00 H new ATOM 115 N GLU A 544 -13.241 10.626 -7.197 1.00 0.00 N ATOM 116 CA GLU A 544 -12.281 11.562 -6.627 1.00 0.00 C ATOM 117 C GLU A 544 -12.150 11.320 -5.138 1.00 0.00 C ATOM 118 O GLU A 544 -11.054 11.096 -4.621 1.00 0.00 O ATOM 119 CB GLU A 544 -12.704 13.010 -6.900 1.00 0.00 C ATOM 120 CG GLU A 544 -14.166 13.295 -6.593 1.00 0.00 C ATOM 121 CD GLU A 544 -14.532 14.750 -6.805 1.00 0.00 C ATOM 122 OE1 GLU A 544 -14.785 15.135 -7.967 1.00 0.00 O ATOM 123 OE2 GLU A 544 -14.566 15.506 -5.810 1.00 0.00 O ATOM 0 H GLU A 544 -14.143 11.043 -7.427 1.00 0.00 H new ATOM 0 HA GLU A 544 -11.312 11.400 -7.100 1.00 0.00 H new ATOM 0 HB2 GLU A 544 -12.081 13.678 -6.305 1.00 0.00 H new ATOM 0 HB3 GLU A 544 -12.511 13.243 -7.947 1.00 0.00 H new ATOM 0 HG2 GLU A 544 -14.795 12.670 -7.226 1.00 0.00 H new ATOM 0 HG3 GLU A 544 -14.378 13.017 -5.560 1.00 0.00 H new ATOM 130 N VAL A 545 -13.284 11.364 -4.456 1.00 0.00 N ATOM 131 CA VAL A 545 -13.321 11.130 -3.031 1.00 0.00 C ATOM 132 C VAL A 545 -12.917 9.696 -2.756 1.00 0.00 C ATOM 133 O VAL A 545 -12.131 9.418 -1.849 1.00 0.00 O ATOM 134 CB VAL A 545 -14.733 11.385 -2.462 1.00 0.00 C ATOM 135 CG1 VAL A 545 -14.789 11.072 -0.976 1.00 0.00 C ATOM 136 CG2 VAL A 545 -15.161 12.820 -2.726 1.00 0.00 C ATOM 0 H VAL A 545 -14.193 11.561 -4.874 1.00 0.00 H new ATOM 0 HA VAL A 545 -12.629 11.818 -2.546 1.00 0.00 H new ATOM 0 HB VAL A 545 -15.429 10.717 -2.970 1.00 0.00 H new ATOM 0 HG11 VAL A 545 -15.795 11.261 -0.602 1.00 0.00 H new ATOM 0 HG12 VAL A 545 -14.532 10.025 -0.815 1.00 0.00 H new ATOM 0 HG13 VAL A 545 -14.079 11.706 -0.444 1.00 0.00 H new ATOM 0 HG21 VAL A 545 -16.159 12.983 -2.318 1.00 0.00 H new ATOM 0 HG22 VAL A 545 -14.458 13.503 -2.249 1.00 0.00 H new ATOM 0 HG23 VAL A 545 -15.173 13.004 -3.800 1.00 0.00 H new ATOM 146 N ARG A 546 -13.463 8.788 -3.562 1.00 0.00 N ATOM 147 CA ARG A 546 -13.189 7.389 -3.440 1.00 0.00 C ATOM 148 C ARG A 546 -13.580 6.861 -2.088 1.00 0.00 C ATOM 149 O ARG A 546 -12.892 6.023 -1.527 1.00 0.00 O ATOM 150 CB ARG A 546 -11.728 7.152 -3.678 1.00 0.00 C ATOM 151 CG ARG A 546 -11.451 6.519 -5.006 1.00 0.00 C ATOM 152 CD ARG A 546 -12.311 5.297 -5.257 1.00 0.00 C ATOM 153 NE ARG A 546 -12.615 4.569 -4.026 1.00 0.00 N ATOM 154 CZ ARG A 546 -11.699 4.043 -3.224 1.00 0.00 C ATOM 155 NH1 ARG A 546 -10.407 4.188 -3.489 1.00 0.00 N ATOM 156 NH2 ARG A 546 -12.077 3.375 -2.144 1.00 0.00 N ATOM 0 H ARG A 546 -14.109 9.020 -4.316 1.00 0.00 H new ATOM 0 HA ARG A 546 -13.783 6.857 -4.184 1.00 0.00 H new ATOM 0 HB2 ARG A 546 -11.196 8.101 -3.615 1.00 0.00 H new ATOM 0 HB3 ARG A 546 -11.335 6.513 -2.887 1.00 0.00 H new ATOM 0 HG2 ARG A 546 -11.624 7.250 -5.796 1.00 0.00 H new ATOM 0 HG3 ARG A 546 -10.400 6.236 -5.058 1.00 0.00 H new ATOM 0 HD2 ARG A 546 -13.242 5.603 -5.735 1.00 0.00 H new ATOM 0 HD3 ARG A 546 -11.799 4.632 -5.953 1.00 0.00 H new ATOM 0 HE ARG A 546 -13.595 4.458 -3.767 1.00 0.00 H new ATOM 0 HH11 ARG A 546 -10.111 4.708 -4.315 1.00 0.00 H new ATOM 0 HH12 ARG A 546 -9.710 3.780 -2.866 1.00 0.00 H new ATOM 0 HH21 ARG A 546 -13.069 3.267 -1.932 1.00 0.00 H new ATOM 0 HH22 ARG A 546 -11.376 2.969 -1.524 1.00 0.00 H new ATOM 170 N PHE A 547 -14.703 7.309 -1.567 1.00 0.00 N ATOM 171 CA PHE A 547 -15.111 6.845 -0.264 1.00 0.00 C ATOM 172 C PHE A 547 -14.127 7.362 0.793 1.00 0.00 C ATOM 173 O PHE A 547 -14.017 6.800 1.881 1.00 0.00 O ATOM 174 CB PHE A 547 -15.127 5.321 -0.284 1.00 0.00 C ATOM 175 CG PHE A 547 -16.400 4.695 0.174 1.00 0.00 C ATOM 176 CD1 PHE A 547 -17.048 5.197 1.282 1.00 0.00 C ATOM 177 CD2 PHE A 547 -16.962 3.634 -0.514 1.00 0.00 C ATOM 178 CE1 PHE A 547 -18.246 4.650 1.705 1.00 0.00 C ATOM 179 CE2 PHE A 547 -18.159 3.084 -0.103 1.00 0.00 C ATOM 180 CZ PHE A 547 -18.731 3.472 1.042 1.00 0.00 C ATOM 0 H PHE A 547 -15.333 7.976 -2.013 1.00 0.00 H new ATOM 0 HA PHE A 547 -16.106 7.216 -0.016 1.00 0.00 H new ATOM 0 HB2 PHE A 547 -14.920 4.984 -1.300 1.00 0.00 H new ATOM 0 HB3 PHE A 547 -14.314 4.956 0.345 1.00 0.00 H new ATOM 0 HD1 PHE A 547 -16.616 6.025 1.825 1.00 0.00 H new ATOM 0 HD2 PHE A 547 -16.459 3.232 -1.381 1.00 0.00 H new ATOM 0 HE1 PHE A 547 -18.803 5.098 2.514 1.00 0.00 H new ATOM 0 HE2 PHE A 547 -18.639 2.332 -0.712 1.00 0.00 H new ATOM 0 HZ PHE A 547 -19.548 2.906 1.463 1.00 0.00 H new ATOM 190 N GLN A 548 -13.333 8.358 0.377 1.00 0.00 N ATOM 191 CA GLN A 548 -12.359 9.049 1.223 1.00 0.00 C ATOM 192 C GLN A 548 -11.697 8.150 2.256 1.00 0.00 C ATOM 193 O GLN A 548 -10.571 7.689 2.074 1.00 0.00 O ATOM 194 CB GLN A 548 -13.023 10.235 1.917 1.00 0.00 C ATOM 195 CG GLN A 548 -12.473 11.575 1.466 1.00 0.00 C ATOM 196 CD GLN A 548 -13.166 12.748 2.135 1.00 0.00 C ATOM 197 OE1 GLN A 548 -13.629 12.646 3.270 1.00 0.00 O ATOM 198 NE2 GLN A 548 -13.239 13.870 1.429 1.00 0.00 N ATOM 0 H GLN A 548 -13.353 8.711 -0.580 1.00 0.00 H new ATOM 0 HA GLN A 548 -11.565 9.391 0.559 1.00 0.00 H new ATOM 0 HB2 GLN A 548 -14.096 10.206 1.725 1.00 0.00 H new ATOM 0 HB3 GLN A 548 -12.890 10.139 2.994 1.00 0.00 H new ATOM 0 HG2 GLN A 548 -11.406 11.617 1.683 1.00 0.00 H new ATOM 0 HG3 GLN A 548 -12.582 11.662 0.385 1.00 0.00 H new ATOM 0 HE21 GLN A 548 -12.841 13.909 0.491 1.00 0.00 H new ATOM 0 HE22 GLN A 548 -13.693 14.693 1.825 1.00 0.00 H new ATOM 207 N GLN A 549 -12.414 7.906 3.334 1.00 0.00 N ATOM 208 CA GLN A 549 -11.887 7.095 4.438 1.00 0.00 C ATOM 209 C GLN A 549 -11.811 5.627 4.050 1.00 0.00 C ATOM 210 O GLN A 549 -10.775 4.982 4.205 1.00 0.00 O ATOM 211 CB GLN A 549 -12.761 7.259 5.681 1.00 0.00 C ATOM 212 CG GLN A 549 -12.753 8.668 6.250 1.00 0.00 C ATOM 213 CD GLN A 549 -13.585 8.794 7.513 1.00 0.00 C ATOM 214 OE1 GLN A 549 -14.573 8.081 7.691 1.00 0.00 O ATOM 215 NE2 GLN A 549 -13.188 9.704 8.394 1.00 0.00 N ATOM 0 H GLN A 549 -13.362 8.252 3.479 1.00 0.00 H new ATOM 0 HA GLN A 549 -10.879 7.445 4.660 1.00 0.00 H new ATOM 0 HB2 GLN A 549 -13.786 6.982 5.433 1.00 0.00 H new ATOM 0 HB3 GLN A 549 -12.420 6.564 6.449 1.00 0.00 H new ATOM 0 HG2 GLN A 549 -11.726 8.963 6.465 1.00 0.00 H new ATOM 0 HG3 GLN A 549 -13.133 9.361 5.499 1.00 0.00 H new ATOM 0 HE21 GLN A 549 -12.363 10.272 8.204 1.00 0.00 H new ATOM 0 HE22 GLN A 549 -13.708 9.835 9.262 1.00 0.00 H new ATOM 224 N GLN A 550 -12.924 5.109 3.560 1.00 0.00 N ATOM 225 CA GLN A 550 -12.991 3.748 3.110 1.00 0.00 C ATOM 226 C GLN A 550 -11.859 3.497 2.115 1.00 0.00 C ATOM 227 O GLN A 550 -11.206 2.444 2.125 1.00 0.00 O ATOM 228 CB GLN A 550 -14.357 3.538 2.501 1.00 0.00 C ATOM 229 CG GLN A 550 -15.426 3.167 3.514 1.00 0.00 C ATOM 230 CD GLN A 550 -15.273 3.907 4.828 1.00 0.00 C ATOM 231 OE1 GLN A 550 -14.713 3.379 5.790 1.00 0.00 O ATOM 232 NE2 GLN A 550 -15.749 5.142 4.866 1.00 0.00 N ATOM 0 H GLN A 550 -13.798 5.626 3.467 1.00 0.00 H new ATOM 0 HA GLN A 550 -12.862 3.037 3.926 1.00 0.00 H new ATOM 0 HB2 GLN A 550 -14.659 4.449 1.985 1.00 0.00 H new ATOM 0 HB3 GLN A 550 -14.293 2.752 1.749 1.00 0.00 H new ATOM 0 HG2 GLN A 550 -16.408 3.382 3.094 1.00 0.00 H new ATOM 0 HG3 GLN A 550 -15.387 2.094 3.700 1.00 0.00 H new ATOM 0 HE21 GLN A 550 -16.206 5.538 4.044 1.00 0.00 H new ATOM 0 HE22 GLN A 550 -15.659 5.697 5.717 1.00 0.00 H new ATOM 241 N LEU A 551 -11.634 4.492 1.260 1.00 0.00 N ATOM 242 CA LEU A 551 -10.544 4.445 0.287 1.00 0.00 C ATOM 243 C LEU A 551 -9.208 4.319 1.003 1.00 0.00 C ATOM 244 O LEU A 551 -8.355 3.518 0.627 1.00 0.00 O ATOM 245 CB LEU A 551 -10.551 5.717 -0.567 1.00 0.00 C ATOM 246 CG LEU A 551 -9.273 6.550 -0.547 1.00 0.00 C ATOM 247 CD1 LEU A 551 -8.247 5.985 -1.513 1.00 0.00 C ATOM 248 CD2 LEU A 551 -9.574 8.005 -0.874 1.00 0.00 C ATOM 0 H LEU A 551 -12.194 5.344 1.221 1.00 0.00 H new ATOM 0 HA LEU A 551 -10.687 3.577 -0.357 1.00 0.00 H new ATOM 0 HB2 LEU A 551 -10.760 5.435 -1.599 1.00 0.00 H new ATOM 0 HB3 LEU A 551 -11.376 6.348 -0.235 1.00 0.00 H new ATOM 0 HG LEU A 551 -8.854 6.506 0.458 1.00 0.00 H new ATOM 0 HD11 LEU A 551 -7.344 6.595 -1.482 1.00 0.00 H new ATOM 0 HD12 LEU A 551 -8.004 4.961 -1.228 1.00 0.00 H new ATOM 0 HD13 LEU A 551 -8.656 5.993 -2.523 1.00 0.00 H new ATOM 0 HD21 LEU A 551 -8.649 8.581 -0.854 1.00 0.00 H new ATOM 0 HD22 LEU A 551 -10.021 8.070 -1.866 1.00 0.00 H new ATOM 0 HD23 LEU A 551 -10.268 8.408 -0.136 1.00 0.00 H new ATOM 260 N GLU A 552 -9.048 5.131 2.040 1.00 0.00 N ATOM 261 CA GLU A 552 -7.824 5.148 2.821 1.00 0.00 C ATOM 262 C GLU A 552 -7.483 3.751 3.311 1.00 0.00 C ATOM 263 O GLU A 552 -6.313 3.412 3.460 1.00 0.00 O ATOM 264 CB GLU A 552 -7.948 6.106 4.007 1.00 0.00 C ATOM 265 CG GLU A 552 -7.832 7.573 3.620 1.00 0.00 C ATOM 266 CD GLU A 552 -6.448 7.935 3.120 1.00 0.00 C ATOM 267 OE1 GLU A 552 -6.177 7.725 1.919 1.00 0.00 O ATOM 268 OE2 GLU A 552 -5.635 8.430 3.928 1.00 0.00 O ATOM 0 H GLU A 552 -9.758 5.790 2.359 1.00 0.00 H new ATOM 0 HA GLU A 552 -7.018 5.499 2.176 1.00 0.00 H new ATOM 0 HB2 GLU A 552 -8.908 5.943 4.496 1.00 0.00 H new ATOM 0 HB3 GLU A 552 -7.174 5.869 4.737 1.00 0.00 H new ATOM 0 HG2 GLU A 552 -8.565 7.800 2.846 1.00 0.00 H new ATOM 0 HG3 GLU A 552 -8.077 8.193 4.482 1.00 0.00 H new ATOM 275 N GLN A 553 -8.510 2.947 3.564 1.00 0.00 N ATOM 276 CA GLN A 553 -8.312 1.602 4.053 1.00 0.00 C ATOM 277 C GLN A 553 -7.843 0.633 2.964 1.00 0.00 C ATOM 278 O GLN A 553 -6.759 0.052 3.098 1.00 0.00 O ATOM 279 CB GLN A 553 -9.611 1.128 4.659 1.00 0.00 C ATOM 280 CG GLN A 553 -9.807 1.553 6.106 1.00 0.00 C ATOM 281 CD GLN A 553 -11.258 1.485 6.545 1.00 0.00 C ATOM 282 OE1 GLN A 553 -11.552 1.191 7.703 1.00 0.00 O ATOM 283 NE2 GLN A 553 -12.172 1.768 5.622 1.00 0.00 N ATOM 0 H GLN A 553 -9.487 3.211 3.436 1.00 0.00 H new ATOM 0 HA GLN A 553 -7.517 1.620 4.799 1.00 0.00 H new ATOM 0 HB2 GLN A 553 -10.440 1.510 4.063 1.00 0.00 H new ATOM 0 HB3 GLN A 553 -9.652 0.040 4.601 1.00 0.00 H new ATOM 0 HG2 GLN A 553 -9.206 0.914 6.753 1.00 0.00 H new ATOM 0 HG3 GLN A 553 -9.440 2.571 6.234 1.00 0.00 H new ATOM 0 HE21 GLN A 553 -11.882 2.007 4.674 1.00 0.00 H new ATOM 0 HE22 GLN A 553 -13.163 1.746 5.862 1.00 0.00 H new ATOM 292 N LEU A 554 -8.606 0.439 1.869 1.00 0.00 N ATOM 293 CA LEU A 554 -8.142 -0.471 0.820 1.00 0.00 C ATOM 294 C LEU A 554 -6.828 0.021 0.250 1.00 0.00 C ATOM 295 O LEU A 554 -5.992 -0.775 -0.176 1.00 0.00 O ATOM 296 CB LEU A 554 -9.199 -0.648 -0.292 1.00 0.00 C ATOM 297 CG LEU A 554 -10.262 -1.717 -0.024 1.00 0.00 C ATOM 298 CD1 LEU A 554 -11.074 -1.973 -1.282 1.00 0.00 C ATOM 299 CD2 LEU A 554 -9.626 -3.008 0.475 1.00 0.00 C ATOM 0 H LEU A 554 -9.508 0.883 1.697 1.00 0.00 H new ATOM 0 HA LEU A 554 -7.984 -1.452 1.268 1.00 0.00 H new ATOM 0 HB2 LEU A 554 -9.700 0.307 -0.449 1.00 0.00 H new ATOM 0 HB3 LEU A 554 -8.686 -0.895 -1.221 1.00 0.00 H new ATOM 0 HG LEU A 554 -10.929 -1.350 0.756 1.00 0.00 H new ATOM 0 HD11 LEU A 554 -11.827 -2.735 -1.080 1.00 0.00 H new ATOM 0 HD12 LEU A 554 -11.565 -1.051 -1.592 1.00 0.00 H new ATOM 0 HD13 LEU A 554 -10.413 -2.318 -2.078 1.00 0.00 H new ATOM 0 HD21 LEU A 554 -10.404 -3.750 0.657 1.00 0.00 H new ATOM 0 HD22 LEU A 554 -8.933 -3.386 -0.276 1.00 0.00 H new ATOM 0 HD23 LEU A 554 -9.086 -2.813 1.402 1.00 0.00 H new ATOM 311 N SER A 555 -6.638 1.330 0.259 1.00 0.00 N ATOM 312 CA SER A 555 -5.396 1.899 -0.220 1.00 0.00 C ATOM 313 C SER A 555 -4.304 1.554 0.774 1.00 0.00 C ATOM 314 O SER A 555 -3.188 1.203 0.393 1.00 0.00 O ATOM 315 CB SER A 555 -5.510 3.413 -0.385 1.00 0.00 C ATOM 316 OG SER A 555 -6.345 3.740 -1.481 1.00 0.00 O ATOM 0 H SER A 555 -7.322 2.010 0.590 1.00 0.00 H new ATOM 0 HA SER A 555 -5.159 1.485 -1.200 1.00 0.00 H new ATOM 0 HB2 SER A 555 -5.912 3.853 0.528 1.00 0.00 H new ATOM 0 HB3 SER A 555 -4.520 3.842 -0.536 1.00 0.00 H new ATOM 0 HG SER A 555 -7.020 3.039 -1.598 1.00 0.00 H new ATOM 322 N ALA A 556 -4.640 1.666 2.061 1.00 0.00 N ATOM 323 CA ALA A 556 -3.710 1.340 3.126 1.00 0.00 C ATOM 324 C ALA A 556 -3.190 -0.085 3.010 1.00 0.00 C ATOM 325 O ALA A 556 -2.129 -0.400 3.550 1.00 0.00 O ATOM 326 CB ALA A 556 -4.363 1.544 4.486 1.00 0.00 C ATOM 0 H ALA A 556 -5.555 1.982 2.384 1.00 0.00 H new ATOM 0 HA ALA A 556 -2.860 2.015 3.029 1.00 0.00 H new ATOM 0 HB1 ALA A 556 -3.651 1.295 5.273 1.00 0.00 H new ATOM 0 HB2 ALA A 556 -4.669 2.585 4.590 1.00 0.00 H new ATOM 0 HB3 ALA A 556 -5.237 0.899 4.570 1.00 0.00 H new ATOM 332 N MET A 557 -3.922 -0.956 2.312 1.00 0.00 N ATOM 333 CA MET A 557 -3.489 -2.341 2.145 1.00 0.00 C ATOM 334 C MET A 557 -2.744 -2.510 0.824 1.00 0.00 C ATOM 335 O MET A 557 -2.640 -3.614 0.287 1.00 0.00 O ATOM 336 CB MET A 557 -4.700 -3.276 2.187 1.00 0.00 C ATOM 337 CG MET A 557 -5.266 -3.471 3.583 1.00 0.00 C ATOM 338 SD MET A 557 -4.087 -4.236 4.714 1.00 0.00 S ATOM 339 CE MET A 557 -3.816 -5.814 3.913 1.00 0.00 C ATOM 0 H MET A 557 -4.807 -0.729 1.859 1.00 0.00 H new ATOM 0 HA MET A 557 -2.813 -2.596 2.961 1.00 0.00 H new ATOM 0 HB2 MET A 557 -5.480 -2.876 1.540 1.00 0.00 H new ATOM 0 HB3 MET A 557 -4.414 -4.246 1.780 1.00 0.00 H new ATOM 0 HG2 MET A 557 -5.573 -2.505 3.984 1.00 0.00 H new ATOM 0 HG3 MET A 557 -6.161 -4.091 3.524 1.00 0.00 H new ATOM 0 HE1 MET A 557 -4.124 -6.619 4.581 1.00 0.00 H new ATOM 0 HE2 MET A 557 -4.401 -5.861 2.994 1.00 0.00 H new ATOM 0 HE3 MET A 557 -2.758 -5.924 3.675 1.00 0.00 H new ATOM 349 N GLY A 558 -2.225 -1.397 0.313 1.00 0.00 N ATOM 350 CA GLY A 558 -1.491 -1.410 -0.941 1.00 0.00 C ATOM 351 C GLY A 558 -2.282 -2.004 -2.095 1.00 0.00 C ATOM 352 O GLY A 558 -1.763 -2.827 -2.847 1.00 0.00 O ATOM 0 H GLY A 558 -2.301 -0.478 0.750 1.00 0.00 H new ATOM 0 HA2 GLY A 558 -1.201 -0.390 -1.195 1.00 0.00 H new ATOM 0 HA3 GLY A 558 -0.571 -1.979 -0.809 1.00 0.00 H new ATOM 356 N PHE A 559 -3.540 -1.588 -2.236 1.00 0.00 N ATOM 357 CA PHE A 559 -4.385 -2.075 -3.304 1.00 0.00 C ATOM 358 C PHE A 559 -3.868 -1.632 -4.673 1.00 0.00 C ATOM 359 O PHE A 559 -3.885 -2.422 -5.615 1.00 0.00 O ATOM 360 CB PHE A 559 -5.837 -1.653 -3.048 1.00 0.00 C ATOM 361 CG PHE A 559 -6.702 -2.807 -2.595 1.00 0.00 C ATOM 362 CD1 PHE A 559 -6.160 -3.863 -1.865 1.00 0.00 C ATOM 363 CD2 PHE A 559 -8.036 -2.870 -2.949 1.00 0.00 C ATOM 364 CE1 PHE A 559 -6.939 -4.951 -1.500 1.00 0.00 C ATOM 365 CE2 PHE A 559 -8.817 -3.944 -2.573 1.00 0.00 C ATOM 366 CZ PHE A 559 -8.268 -4.984 -1.851 1.00 0.00 C ATOM 0 H PHE A 559 -3.989 -0.913 -1.618 1.00 0.00 H new ATOM 0 HA PHE A 559 -4.356 -3.165 -3.316 1.00 0.00 H new ATOM 0 HB2 PHE A 559 -5.856 -0.869 -2.291 1.00 0.00 H new ATOM 0 HB3 PHE A 559 -6.254 -1.226 -3.960 1.00 0.00 H new ATOM 0 HD1 PHE A 559 -5.119 -3.834 -1.579 1.00 0.00 H new ATOM 0 HD2 PHE A 559 -8.473 -2.069 -3.527 1.00 0.00 H new ATOM 0 HE1 PHE A 559 -6.504 -5.768 -0.943 1.00 0.00 H new ATOM 0 HE2 PHE A 559 -9.862 -3.971 -2.845 1.00 0.00 H new ATOM 0 HZ PHE A 559 -8.882 -5.824 -1.562 1.00 0.00 H new ATOM 376 N LEU A 560 -3.439 -0.365 -4.796 1.00 0.00 N ATOM 377 CA LEU A 560 -2.853 0.150 -6.035 1.00 0.00 C ATOM 378 C LEU A 560 -3.895 0.419 -7.117 1.00 0.00 C ATOM 379 O LEU A 560 -3.549 0.656 -8.274 1.00 0.00 O ATOM 380 CB LEU A 560 -1.783 -0.804 -6.546 1.00 0.00 C ATOM 381 CG LEU A 560 -0.458 -0.775 -5.783 1.00 0.00 C ATOM 382 CD1 LEU A 560 0.468 -1.874 -6.281 1.00 0.00 C ATOM 383 CD2 LEU A 560 0.211 0.586 -5.915 1.00 0.00 C ATOM 0 H LEU A 560 -3.490 0.322 -4.044 1.00 0.00 H new ATOM 0 HA LEU A 560 -2.398 1.111 -5.797 1.00 0.00 H new ATOM 0 HB2 LEU A 560 -2.179 -1.819 -6.513 1.00 0.00 H new ATOM 0 HB3 LEU A 560 -1.585 -0.573 -7.593 1.00 0.00 H new ATOM 0 HG LEU A 560 -0.668 -0.951 -4.728 1.00 0.00 H new ATOM 0 HD11 LEU A 560 1.406 -1.838 -5.727 1.00 0.00 H new ATOM 0 HD12 LEU A 560 -0.005 -2.844 -6.131 1.00 0.00 H new ATOM 0 HD13 LEU A 560 0.668 -1.728 -7.343 1.00 0.00 H new ATOM 0 HD21 LEU A 560 1.152 0.584 -5.365 1.00 0.00 H new ATOM 0 HD22 LEU A 560 0.406 0.795 -6.967 1.00 0.00 H new ATOM 0 HD23 LEU A 560 -0.446 1.355 -5.508 1.00 0.00 H new ATOM 395 N ASN A 561 -5.168 0.385 -6.741 1.00 0.00 N ATOM 396 CA ASN A 561 -6.248 0.650 -7.685 1.00 0.00 C ATOM 397 C ASN A 561 -7.404 1.354 -6.982 1.00 0.00 C ATOM 398 O ASN A 561 -8.266 0.711 -6.391 1.00 0.00 O ATOM 399 CB ASN A 561 -6.724 -0.653 -8.326 1.00 0.00 C ATOM 400 CG ASN A 561 -7.587 -0.416 -9.550 1.00 0.00 C ATOM 401 OD1 ASN A 561 -8.289 0.592 -9.644 1.00 0.00 O ATOM 402 ND2 ASN A 561 -7.538 -1.346 -10.496 1.00 0.00 N ATOM 0 H ASN A 561 -5.478 0.177 -5.792 1.00 0.00 H new ATOM 0 HA ASN A 561 -5.872 1.304 -8.472 1.00 0.00 H new ATOM 0 HB2 ASN A 561 -5.859 -1.254 -8.606 1.00 0.00 H new ATOM 0 HB3 ASN A 561 -7.289 -1.230 -7.593 1.00 0.00 H new ATOM 0 HD21 ASN A 561 -8.096 -1.242 -11.343 1.00 0.00 H new ATOM 0 HD22 ASN A 561 -6.942 -2.165 -10.376 1.00 0.00 H new ATOM 409 N ARG A 562 -7.422 2.682 -7.078 1.00 0.00 N ATOM 410 CA ARG A 562 -8.449 3.496 -6.430 1.00 0.00 C ATOM 411 C ARG A 562 -9.854 3.097 -6.872 1.00 0.00 C ATOM 412 O ARG A 562 -10.696 2.737 -6.048 1.00 0.00 O ATOM 413 CB ARG A 562 -8.218 4.978 -6.735 1.00 0.00 C ATOM 414 CG ARG A 562 -6.790 5.440 -6.488 1.00 0.00 C ATOM 415 CD ARG A 562 -6.384 5.264 -5.032 1.00 0.00 C ATOM 416 NE ARG A 562 -5.065 5.828 -4.760 1.00 0.00 N ATOM 417 CZ ARG A 562 -4.172 5.261 -3.954 1.00 0.00 C ATOM 418 NH1 ARG A 562 -4.450 4.112 -3.356 1.00 0.00 N ATOM 419 NH2 ARG A 562 -3.000 5.844 -3.749 1.00 0.00 N ATOM 0 H ARG A 562 -6.732 3.220 -7.602 1.00 0.00 H new ATOM 0 HA ARG A 562 -8.371 3.323 -5.357 1.00 0.00 H new ATOM 0 HB2 ARG A 562 -8.477 5.170 -7.776 1.00 0.00 H new ATOM 0 HB3 ARG A 562 -8.894 5.575 -6.123 1.00 0.00 H new ATOM 0 HG2 ARG A 562 -6.110 4.876 -7.126 1.00 0.00 H new ATOM 0 HG3 ARG A 562 -6.694 6.489 -6.768 1.00 0.00 H new ATOM 0 HD2 ARG A 562 -7.123 5.743 -4.389 1.00 0.00 H new ATOM 0 HD3 ARG A 562 -6.383 4.203 -4.781 1.00 0.00 H new ATOM 0 HE ARG A 562 -4.814 6.706 -5.214 1.00 0.00 H new ATOM 0 HH11 ARG A 562 -5.351 3.660 -3.513 1.00 0.00 H new ATOM 0 HH12 ARG A 562 -3.763 3.679 -2.738 1.00 0.00 H new ATOM 0 HH21 ARG A 562 -2.783 6.728 -4.209 1.00 0.00 H new ATOM 0 HH22 ARG A 562 -2.315 5.409 -3.131 1.00 0.00 H new ATOM 433 N GLU A 563 -10.099 3.176 -8.174 1.00 0.00 N ATOM 434 CA GLU A 563 -11.404 2.837 -8.732 1.00 0.00 C ATOM 435 C GLU A 563 -11.857 1.445 -8.308 1.00 0.00 C ATOM 436 O GLU A 563 -13.053 1.206 -8.084 1.00 0.00 O ATOM 437 CB GLU A 563 -11.360 2.917 -10.256 1.00 0.00 C ATOM 438 CG GLU A 563 -11.707 4.291 -10.804 1.00 0.00 C ATOM 439 CD GLU A 563 -11.731 4.326 -12.320 1.00 0.00 C ATOM 440 OE1 GLU A 563 -10.661 4.550 -12.926 1.00 0.00 O ATOM 441 OE2 GLU A 563 -12.818 4.130 -12.901 1.00 0.00 O ATOM 0 H GLU A 563 -9.410 3.472 -8.865 1.00 0.00 H new ATOM 0 HA GLU A 563 -12.123 3.559 -8.344 1.00 0.00 H new ATOM 0 HB2 GLU A 563 -10.362 2.640 -10.597 1.00 0.00 H new ATOM 0 HB3 GLU A 563 -12.053 2.184 -10.670 1.00 0.00 H new ATOM 0 HG2 GLU A 563 -12.682 4.595 -10.422 1.00 0.00 H new ATOM 0 HG3 GLU A 563 -10.981 5.017 -10.439 1.00 0.00 H new ATOM 448 N ALA A 564 -10.904 0.534 -8.149 1.00 0.00 N ATOM 449 CA ALA A 564 -11.224 -0.831 -7.773 1.00 0.00 C ATOM 450 C ALA A 564 -11.577 -0.904 -6.299 1.00 0.00 C ATOM 451 O ALA A 564 -12.286 -1.816 -5.870 1.00 0.00 O ATOM 452 CB ALA A 564 -10.065 -1.764 -8.086 1.00 0.00 C ATOM 0 H ALA A 564 -9.909 0.718 -8.275 1.00 0.00 H new ATOM 0 HA ALA A 564 -12.087 -1.152 -8.356 1.00 0.00 H new ATOM 0 HB1 ALA A 564 -10.328 -2.781 -7.796 1.00 0.00 H new ATOM 0 HB2 ALA A 564 -9.853 -1.735 -9.155 1.00 0.00 H new ATOM 0 HB3 ALA A 564 -9.182 -1.446 -7.532 1.00 0.00 H new ATOM 458 N ASN A 565 -11.081 0.056 -5.517 1.00 0.00 N ATOM 459 CA ASN A 565 -11.362 0.072 -4.093 1.00 0.00 C ATOM 460 C ASN A 565 -12.818 0.440 -3.876 1.00 0.00 C ATOM 461 O ASN A 565 -13.530 -0.251 -3.159 1.00 0.00 O ATOM 462 CB ASN A 565 -10.475 1.071 -3.351 1.00 0.00 C ATOM 463 CG ASN A 565 -9.013 0.973 -3.715 1.00 0.00 C ATOM 464 OD1 ASN A 565 -8.513 -0.093 -4.066 1.00 0.00 O ATOM 465 ND2 ASN A 565 -8.316 2.099 -3.620 1.00 0.00 N ATOM 0 H ASN A 565 -10.491 0.820 -5.846 1.00 0.00 H new ATOM 0 HA ASN A 565 -11.154 -0.922 -3.697 1.00 0.00 H new ATOM 0 HB2 ASN A 565 -10.826 2.081 -3.562 1.00 0.00 H new ATOM 0 HB3 ASN A 565 -10.584 0.913 -2.278 1.00 0.00 H new ATOM 0 HD21 ASN A 565 -7.321 2.103 -3.843 1.00 0.00 H new ATOM 0 HD22 ASN A 565 -8.776 2.960 -3.324 1.00 0.00 H new ATOM 472 N LEU A 566 -13.261 1.542 -4.502 1.00 0.00 N ATOM 473 CA LEU A 566 -14.614 1.979 -4.392 1.00 0.00 C ATOM 474 C LEU A 566 -15.550 0.843 -4.716 1.00 0.00 C ATOM 475 O LEU A 566 -16.505 0.588 -3.987 1.00 0.00 O ATOM 476 CB LEU A 566 -14.854 3.121 -5.364 1.00 0.00 C ATOM 477 CG LEU A 566 -16.064 3.925 -5.029 1.00 0.00 C ATOM 478 CD1 LEU A 566 -15.688 5.236 -4.357 1.00 0.00 C ATOM 479 CD2 LEU A 566 -16.936 4.155 -6.253 1.00 0.00 C ATOM 0 H LEU A 566 -12.675 2.135 -5.090 1.00 0.00 H new ATOM 0 HA LEU A 566 -14.800 2.316 -3.372 1.00 0.00 H new ATOM 0 HB2 LEU A 566 -13.981 3.774 -5.372 1.00 0.00 H new ATOM 0 HB3 LEU A 566 -14.960 2.718 -6.371 1.00 0.00 H new ATOM 0 HG LEU A 566 -16.653 3.349 -4.315 1.00 0.00 H new ATOM 0 HD11 LEU A 566 -16.592 5.799 -4.126 1.00 0.00 H new ATOM 0 HD12 LEU A 566 -15.143 5.030 -3.436 1.00 0.00 H new ATOM 0 HD13 LEU A 566 -15.058 5.821 -5.027 1.00 0.00 H new ATOM 0 HD21 LEU A 566 -17.809 4.744 -5.972 1.00 0.00 H new ATOM 0 HD22 LEU A 566 -16.365 4.691 -7.011 1.00 0.00 H new ATOM 0 HD23 LEU A 566 -17.260 3.195 -6.654 1.00 0.00 H new ATOM 491 N GLN A 567 -15.280 0.164 -5.824 1.00 0.00 N ATOM 492 CA GLN A 567 -16.108 -0.956 -6.219 1.00 0.00 C ATOM 493 C GLN A 567 -16.210 -1.971 -5.096 1.00 0.00 C ATOM 494 O GLN A 567 -17.305 -2.438 -4.773 1.00 0.00 O ATOM 495 CB GLN A 567 -15.562 -1.618 -7.487 1.00 0.00 C ATOM 496 CG GLN A 567 -15.566 -0.706 -8.702 1.00 0.00 C ATOM 497 CD GLN A 567 -16.964 -0.297 -9.120 1.00 0.00 C ATOM 498 OE1 GLN A 567 -17.603 -0.969 -9.929 1.00 0.00 O ATOM 499 NE2 GLN A 567 -17.446 0.812 -8.570 1.00 0.00 N ATOM 0 H GLN A 567 -14.504 0.369 -6.454 1.00 0.00 H new ATOM 0 HA GLN A 567 -17.107 -0.576 -6.433 1.00 0.00 H new ATOM 0 HB2 GLN A 567 -14.542 -1.955 -7.300 1.00 0.00 H new ATOM 0 HB3 GLN A 567 -16.156 -2.505 -7.708 1.00 0.00 H new ATOM 0 HG2 GLN A 567 -14.981 0.187 -8.483 1.00 0.00 H new ATOM 0 HG3 GLN A 567 -15.076 -1.213 -9.533 1.00 0.00 H new ATOM 0 HE21 GLN A 567 -16.881 1.338 -7.903 1.00 0.00 H new ATOM 0 HE22 GLN A 567 -18.381 1.137 -8.814 1.00 0.00 H new ATOM 508 N ALA A 568 -15.081 -2.306 -4.486 1.00 0.00 N ATOM 509 CA ALA A 568 -15.072 -3.266 -3.402 1.00 0.00 C ATOM 510 C ALA A 568 -15.786 -2.727 -2.169 1.00 0.00 C ATOM 511 O ALA A 568 -16.543 -3.456 -1.530 1.00 0.00 O ATOM 512 CB ALA A 568 -13.645 -3.655 -3.064 1.00 0.00 C ATOM 0 H ALA A 568 -14.165 -1.926 -4.726 1.00 0.00 H new ATOM 0 HA ALA A 568 -15.614 -4.152 -3.732 1.00 0.00 H new ATOM 0 HB1 ALA A 568 -13.648 -4.377 -2.248 1.00 0.00 H new ATOM 0 HB2 ALA A 568 -13.172 -4.099 -3.940 1.00 0.00 H new ATOM 0 HB3 ALA A 568 -13.088 -2.768 -2.761 1.00 0.00 H new ATOM 518 N LEU A 569 -15.570 -1.451 -1.832 1.00 0.00 N ATOM 519 CA LEU A 569 -16.187 -0.855 -0.683 1.00 0.00 C ATOM 520 C LEU A 569 -17.706 -0.811 -0.811 1.00 0.00 C ATOM 521 O LEU A 569 -18.429 -1.093 0.146 1.00 0.00 O ATOM 522 CB LEU A 569 -15.648 0.551 -0.579 1.00 0.00 C ATOM 523 CG LEU A 569 -14.469 0.739 0.357 1.00 0.00 C ATOM 524 CD1 LEU A 569 -14.846 0.341 1.776 1.00 0.00 C ATOM 525 CD2 LEU A 569 -13.281 -0.067 -0.115 1.00 0.00 C ATOM 0 H LEU A 569 -14.963 -0.821 -2.356 1.00 0.00 H new ATOM 0 HA LEU A 569 -15.960 -1.447 0.204 1.00 0.00 H new ATOM 0 HB2 LEU A 569 -15.353 0.881 -1.575 1.00 0.00 H new ATOM 0 HB3 LEU A 569 -16.455 1.206 -0.252 1.00 0.00 H new ATOM 0 HG LEU A 569 -14.195 1.794 0.353 1.00 0.00 H new ATOM 0 HD11 LEU A 569 -13.988 0.482 2.434 1.00 0.00 H new ATOM 0 HD12 LEU A 569 -15.673 0.962 2.120 1.00 0.00 H new ATOM 0 HD13 LEU A 569 -15.147 -0.707 1.792 1.00 0.00 H new ATOM 0 HD21 LEU A 569 -12.446 0.081 0.569 1.00 0.00 H new ATOM 0 HD22 LEU A 569 -13.546 -1.124 -0.141 1.00 0.00 H new ATOM 0 HD23 LEU A 569 -12.994 0.260 -1.114 1.00 0.00 H new ATOM 537 N ILE A 570 -18.178 -0.452 -1.998 1.00 0.00 N ATOM 538 CA ILE A 570 -19.606 -0.344 -2.254 1.00 0.00 C ATOM 539 C ILE A 570 -20.292 -1.702 -2.133 1.00 0.00 C ATOM 540 O ILE A 570 -21.433 -1.792 -1.677 1.00 0.00 O ATOM 541 CB ILE A 570 -19.878 0.243 -3.656 1.00 0.00 C ATOM 542 CG1 ILE A 570 -19.430 1.707 -3.720 1.00 0.00 C ATOM 543 CG2 ILE A 570 -21.352 0.115 -4.023 1.00 0.00 C ATOM 544 CD1 ILE A 570 -20.207 2.628 -2.802 1.00 0.00 C ATOM 0 H ILE A 570 -17.589 -0.230 -2.801 1.00 0.00 H new ATOM 0 HA ILE A 570 -20.016 0.329 -1.501 1.00 0.00 H new ATOM 0 HB ILE A 570 -19.299 -0.328 -4.382 1.00 0.00 H new ATOM 0 HG12 ILE A 570 -18.372 1.764 -3.465 1.00 0.00 H new ATOM 0 HG13 ILE A 570 -19.530 2.063 -4.745 1.00 0.00 H new ATOM 0 HG21 ILE A 570 -21.518 0.536 -5.015 1.00 0.00 H new ATOM 0 HG22 ILE A 570 -21.637 -0.937 -4.023 1.00 0.00 H new ATOM 0 HG23 ILE A 570 -21.957 0.655 -3.294 1.00 0.00 H new ATOM 0 HD11 ILE A 570 -19.831 3.646 -2.905 1.00 0.00 H new ATOM 0 HD12 ILE A 570 -21.263 2.602 -3.070 1.00 0.00 H new ATOM 0 HD13 ILE A 570 -20.087 2.299 -1.770 1.00 0.00 H new ATOM 556 N ALA A 571 -19.590 -2.754 -2.539 1.00 0.00 N ATOM 557 CA ALA A 571 -20.140 -4.103 -2.486 1.00 0.00 C ATOM 558 C ALA A 571 -19.892 -4.772 -1.136 1.00 0.00 C ATOM 559 O ALA A 571 -20.542 -5.763 -0.803 1.00 0.00 O ATOM 560 CB ALA A 571 -19.558 -4.951 -3.607 1.00 0.00 C ATOM 0 H ALA A 571 -18.641 -2.699 -2.908 1.00 0.00 H new ATOM 0 HA ALA A 571 -21.219 -4.021 -2.616 1.00 0.00 H new ATOM 0 HB1 ALA A 571 -19.976 -5.956 -3.557 1.00 0.00 H new ATOM 0 HB2 ALA A 571 -19.806 -4.502 -4.569 1.00 0.00 H new ATOM 0 HB3 ALA A 571 -18.475 -5.003 -3.499 1.00 0.00 H new ATOM 566 N THR A 572 -18.955 -4.235 -0.357 1.00 0.00 N ATOM 567 CA THR A 572 -18.636 -4.808 0.944 1.00 0.00 C ATOM 568 C THR A 572 -19.167 -3.962 2.101 1.00 0.00 C ATOM 569 O THR A 572 -18.974 -4.309 3.266 1.00 0.00 O ATOM 570 CB THR A 572 -17.119 -4.988 1.118 1.00 0.00 C ATOM 571 OG1 THR A 572 -16.453 -3.731 0.974 1.00 0.00 O ATOM 572 CG2 THR A 572 -16.571 -5.986 0.105 1.00 0.00 C ATOM 0 H THR A 572 -18.408 -3.410 -0.604 1.00 0.00 H new ATOM 0 HA THR A 572 -19.128 -5.780 0.971 1.00 0.00 H new ATOM 0 HB THR A 572 -16.935 -5.377 2.119 1.00 0.00 H new ATOM 0 HG1 THR A 572 -16.468 -3.459 0.033 1.00 0.00 H new ATOM 0 HG21 THR A 572 -15.496 -6.096 0.248 1.00 0.00 H new ATOM 0 HG22 THR A 572 -17.057 -6.951 0.246 1.00 0.00 H new ATOM 0 HG23 THR A 572 -16.768 -5.625 -0.904 1.00 0.00 H new ATOM 580 N GLY A 573 -19.843 -2.860 1.781 1.00 0.00 N ATOM 581 CA GLY A 573 -20.392 -1.993 2.813 1.00 0.00 C ATOM 582 C GLY A 573 -19.369 -1.540 3.840 1.00 0.00 C ATOM 583 O GLY A 573 -19.715 -1.307 4.999 1.00 0.00 O ATOM 0 H GLY A 573 -20.021 -2.552 0.825 1.00 0.00 H new ATOM 0 HA2 GLY A 573 -20.832 -1.115 2.341 1.00 0.00 H new ATOM 0 HA3 GLY A 573 -21.199 -2.518 3.324 1.00 0.00 H new ATOM 587 N GLY A 574 -18.113 -1.404 3.423 1.00 0.00 N ATOM 588 CA GLY A 574 -17.072 -0.972 4.345 1.00 0.00 C ATOM 589 C GLY A 574 -16.195 -2.116 4.824 1.00 0.00 C ATOM 590 O GLY A 574 -15.245 -1.905 5.579 1.00 0.00 O ATOM 0 H GLY A 574 -17.797 -1.583 2.470 1.00 0.00 H new ATOM 0 HA2 GLY A 574 -16.449 -0.223 3.856 1.00 0.00 H new ATOM 0 HA3 GLY A 574 -17.534 -0.490 5.206 1.00 0.00 H new ATOM 594 N ASP A 575 -16.516 -3.328 4.385 1.00 0.00 N ATOM 595 CA ASP A 575 -15.749 -4.513 4.757 1.00 0.00 C ATOM 596 C ASP A 575 -14.477 -4.547 3.928 1.00 0.00 C ATOM 597 O ASP A 575 -14.361 -5.290 2.952 1.00 0.00 O ATOM 598 CB ASP A 575 -16.566 -5.790 4.551 1.00 0.00 C ATOM 599 CG ASP A 575 -16.203 -6.871 5.550 1.00 0.00 C ATOM 600 OD1 ASP A 575 -15.025 -7.287 5.575 1.00 0.00 O ATOM 601 OD2 ASP A 575 -17.096 -7.303 6.309 1.00 0.00 O ATOM 0 H ASP A 575 -17.306 -3.517 3.768 1.00 0.00 H new ATOM 0 HA ASP A 575 -15.498 -4.462 5.816 1.00 0.00 H new ATOM 0 HB2 ASP A 575 -17.627 -5.558 4.639 1.00 0.00 H new ATOM 0 HB3 ASP A 575 -16.404 -6.163 3.540 1.00 0.00 H new ATOM 606 N ILE A 576 -13.537 -3.723 4.344 1.00 0.00 N ATOM 607 CA ILE A 576 -12.267 -3.556 3.666 1.00 0.00 C ATOM 608 C ILE A 576 -11.529 -4.869 3.572 1.00 0.00 C ATOM 609 O ILE A 576 -10.885 -5.161 2.571 1.00 0.00 O ATOM 610 CB ILE A 576 -11.426 -2.526 4.428 1.00 0.00 C ATOM 611 CG1 ILE A 576 -12.178 -1.189 4.435 1.00 0.00 C ATOM 612 CG2 ILE A 576 -10.034 -2.390 3.827 1.00 0.00 C ATOM 613 CD1 ILE A 576 -12.059 -0.415 3.139 1.00 0.00 C ATOM 0 H ILE A 576 -13.635 -3.141 5.176 1.00 0.00 H new ATOM 0 HA ILE A 576 -12.449 -3.204 2.651 1.00 0.00 H new ATOM 0 HB ILE A 576 -11.282 -2.860 5.455 1.00 0.00 H new ATOM 0 HG12 ILE A 576 -13.232 -1.377 4.640 1.00 0.00 H new ATOM 0 HG13 ILE A 576 -11.799 -0.574 5.251 1.00 0.00 H new ATOM 0 HG21 ILE A 576 -9.465 -1.652 4.391 1.00 0.00 H new ATOM 0 HG22 ILE A 576 -9.524 -3.352 3.870 1.00 0.00 H new ATOM 0 HG23 ILE A 576 -10.116 -2.069 2.789 1.00 0.00 H new ATOM 0 HD11 ILE A 576 -12.616 0.518 3.220 1.00 0.00 H new ATOM 0 HD12 ILE A 576 -11.010 -0.195 2.942 1.00 0.00 H new ATOM 0 HD13 ILE A 576 -12.465 -1.010 2.321 1.00 0.00 H new ATOM 625 N ASN A 577 -11.694 -5.663 4.611 1.00 0.00 N ATOM 626 CA ASN A 577 -11.086 -6.962 4.737 1.00 0.00 C ATOM 627 C ASN A 577 -11.682 -7.919 3.712 1.00 0.00 C ATOM 628 O ASN A 577 -10.970 -8.663 3.029 1.00 0.00 O ATOM 629 CB ASN A 577 -11.364 -7.447 6.148 1.00 0.00 C ATOM 630 CG ASN A 577 -10.265 -7.067 7.114 1.00 0.00 C ATOM 631 OD1 ASN A 577 -9.369 -7.861 7.404 1.00 0.00 O ATOM 632 ND2 ASN A 577 -10.326 -5.837 7.606 1.00 0.00 N ATOM 0 H ASN A 577 -12.273 -5.410 5.412 1.00 0.00 H new ATOM 0 HA ASN A 577 -10.013 -6.913 4.554 1.00 0.00 H new ATOM 0 HB2 ASN A 577 -12.309 -7.028 6.494 1.00 0.00 H new ATOM 0 HB3 ASN A 577 -11.479 -8.531 6.141 1.00 0.00 H new ATOM 0 HD21 ASN A 577 -9.610 -5.511 8.255 1.00 0.00 H new ATOM 0 HD22 ASN A 577 -11.089 -5.217 7.335 1.00 0.00 H new ATOM 639 N ALA A 578 -13.005 -7.870 3.616 1.00 0.00 N ATOM 640 CA ALA A 578 -13.730 -8.698 2.670 1.00 0.00 C ATOM 641 C ALA A 578 -13.288 -8.326 1.267 1.00 0.00 C ATOM 642 O ALA A 578 -13.201 -9.172 0.374 1.00 0.00 O ATOM 643 CB ALA A 578 -15.232 -8.519 2.826 1.00 0.00 C ATOM 0 H ALA A 578 -13.596 -7.263 4.185 1.00 0.00 H new ATOM 0 HA ALA A 578 -13.509 -9.748 2.861 1.00 0.00 H new ATOM 0 HB1 ALA A 578 -15.751 -9.151 2.105 1.00 0.00 H new ATOM 0 HB2 ALA A 578 -15.529 -8.802 3.836 1.00 0.00 H new ATOM 0 HB3 ALA A 578 -15.494 -7.476 2.649 1.00 0.00 H new ATOM 649 N ALA A 579 -13.000 -7.042 1.094 1.00 0.00 N ATOM 650 CA ALA A 579 -12.545 -6.515 -0.178 1.00 0.00 C ATOM 651 C ALA A 579 -11.120 -6.962 -0.473 1.00 0.00 C ATOM 652 O ALA A 579 -10.742 -7.110 -1.630 1.00 0.00 O ATOM 653 CB ALA A 579 -12.630 -4.998 -0.172 1.00 0.00 C ATOM 0 H ALA A 579 -13.076 -6.342 1.832 1.00 0.00 H new ATOM 0 HA ALA A 579 -13.192 -6.905 -0.964 1.00 0.00 H new ATOM 0 HB1 ALA A 579 -12.286 -4.611 -1.131 1.00 0.00 H new ATOM 0 HB2 ALA A 579 -13.663 -4.692 -0.006 1.00 0.00 H new ATOM 0 HB3 ALA A 579 -12.002 -4.602 0.626 1.00 0.00 H new ATOM 659 N ILE A 580 -10.321 -7.151 0.576 1.00 0.00 N ATOM 660 CA ILE A 580 -8.949 -7.586 0.412 1.00 0.00 C ATOM 661 C ILE A 580 -8.890 -8.949 -0.265 1.00 0.00 C ATOM 662 O ILE A 580 -8.287 -9.112 -1.337 1.00 0.00 O ATOM 663 CB ILE A 580 -8.268 -7.695 1.785 1.00 0.00 C ATOM 664 CG1 ILE A 580 -8.471 -6.405 2.594 1.00 0.00 C ATOM 665 CG2 ILE A 580 -6.789 -8.026 1.620 1.00 0.00 C ATOM 666 CD1 ILE A 580 -7.465 -6.201 3.709 1.00 0.00 C ATOM 0 H ILE A 580 -10.607 -7.008 1.545 1.00 0.00 H new ATOM 0 HA ILE A 580 -8.436 -6.851 -0.209 1.00 0.00 H new ATOM 0 HB ILE A 580 -8.731 -8.509 2.343 1.00 0.00 H new ATOM 0 HG12 ILE A 580 -8.421 -5.553 1.916 1.00 0.00 H new ATOM 0 HG13 ILE A 580 -9.473 -6.413 3.022 1.00 0.00 H new ATOM 0 HG21 ILE A 580 -6.321 -8.100 2.602 1.00 0.00 H new ATOM 0 HG22 ILE A 580 -6.685 -8.976 1.096 1.00 0.00 H new ATOM 0 HG23 ILE A 580 -6.302 -7.239 1.044 1.00 0.00 H new ATOM 0 HD11 ILE A 580 -7.682 -5.267 4.228 1.00 0.00 H new ATOM 0 HD12 ILE A 580 -7.529 -7.031 4.413 1.00 0.00 H new ATOM 0 HD13 ILE A 580 -6.460 -6.158 3.289 1.00 0.00 H new ATOM 678 N GLU A 581 -9.560 -9.915 0.353 1.00 0.00 N ATOM 679 CA GLU A 581 -9.588 -11.275 -0.158 1.00 0.00 C ATOM 680 C GLU A 581 -10.303 -11.342 -1.498 1.00 0.00 C ATOM 681 O GLU A 581 -9.996 -12.196 -2.329 1.00 0.00 O ATOM 682 CB GLU A 581 -10.270 -12.207 0.844 1.00 0.00 C ATOM 683 CG GLU A 581 -10.258 -13.669 0.426 1.00 0.00 C ATOM 684 CD GLU A 581 -10.921 -14.575 1.446 1.00 0.00 C ATOM 685 OE1 GLU A 581 -12.150 -14.778 1.349 1.00 0.00 O ATOM 686 OE2 GLU A 581 -10.211 -15.081 2.340 1.00 0.00 O ATOM 0 H GLU A 581 -10.092 -9.778 1.212 1.00 0.00 H new ATOM 0 HA GLU A 581 -8.557 -11.599 -0.302 1.00 0.00 H new ATOM 0 HB2 GLU A 581 -9.776 -12.111 1.811 1.00 0.00 H new ATOM 0 HB3 GLU A 581 -11.303 -11.886 0.981 1.00 0.00 H new ATOM 0 HG2 GLU A 581 -10.768 -13.773 -0.532 1.00 0.00 H new ATOM 0 HG3 GLU A 581 -9.228 -13.991 0.275 1.00 0.00 H new ATOM 693 N ARG A 582 -11.261 -10.443 -1.710 1.00 0.00 N ATOM 694 CA ARG A 582 -12.012 -10.429 -2.947 1.00 0.00 C ATOM 695 C ARG A 582 -11.238 -9.819 -4.103 1.00 0.00 C ATOM 696 O ARG A 582 -11.199 -10.394 -5.192 1.00 0.00 O ATOM 697 CB ARG A 582 -13.317 -9.690 -2.773 1.00 0.00 C ATOM 698 CG ARG A 582 -14.433 -10.412 -3.468 1.00 0.00 C ATOM 699 CD ARG A 582 -15.412 -9.447 -4.105 1.00 0.00 C ATOM 700 NE ARG A 582 -16.450 -10.138 -4.866 1.00 0.00 N ATOM 701 CZ ARG A 582 -17.303 -9.520 -5.676 1.00 0.00 C ATOM 702 NH1 ARG A 582 -17.245 -8.204 -5.828 1.00 0.00 N ATOM 703 NH2 ARG A 582 -18.216 -10.218 -6.337 1.00 0.00 N ATOM 0 H ARG A 582 -11.529 -9.721 -1.041 1.00 0.00 H new ATOM 0 HA ARG A 582 -12.206 -11.473 -3.194 1.00 0.00 H new ATOM 0 HB2 ARG A 582 -13.546 -9.592 -1.712 1.00 0.00 H new ATOM 0 HB3 ARG A 582 -13.225 -8.681 -3.174 1.00 0.00 H new ATOM 0 HG2 ARG A 582 -14.020 -11.070 -4.233 1.00 0.00 H new ATOM 0 HG3 ARG A 582 -14.959 -11.045 -2.753 1.00 0.00 H new ATOM 0 HD2 ARG A 582 -15.877 -8.838 -3.329 1.00 0.00 H new ATOM 0 HD3 ARG A 582 -14.873 -8.767 -4.764 1.00 0.00 H new ATOM 0 HE ARG A 582 -16.524 -11.151 -4.770 1.00 0.00 H new ATOM 0 HH11 ARG A 582 -16.544 -7.663 -5.322 1.00 0.00 H new ATOM 0 HH12 ARG A 582 -17.901 -7.733 -6.451 1.00 0.00 H new ATOM 0 HH21 ARG A 582 -18.264 -11.231 -6.224 1.00 0.00 H new ATOM 0 HH22 ARG A 582 -18.870 -9.742 -6.958 1.00 0.00 H new ATOM 717 N LEU A 583 -10.626 -8.659 -3.879 1.00 0.00 N ATOM 718 CA LEU A 583 -9.898 -7.991 -4.893 1.00 0.00 C ATOM 719 C LEU A 583 -8.880 -8.896 -5.503 1.00 0.00 C ATOM 720 O LEU A 583 -8.883 -9.138 -6.711 1.00 0.00 O ATOM 721 CB LEU A 583 -9.194 -6.871 -4.216 1.00 0.00 C ATOM 722 CG LEU A 583 -8.522 -5.874 -5.090 1.00 0.00 C ATOM 723 CD1 LEU A 583 -7.262 -6.427 -5.736 1.00 0.00 C ATOM 724 CD2 LEU A 583 -9.482 -5.323 -6.118 1.00 0.00 C ATOM 0 H LEU A 583 -10.635 -8.176 -2.981 1.00 0.00 H new ATOM 0 HA LEU A 583 -10.565 -7.654 -5.686 1.00 0.00 H new ATOM 0 HB2 LEU A 583 -9.916 -6.344 -3.592 1.00 0.00 H new ATOM 0 HB3 LEU A 583 -8.445 -7.296 -3.547 1.00 0.00 H new ATOM 0 HG LEU A 583 -8.203 -5.049 -4.453 1.00 0.00 H new ATOM 0 HD11 LEU A 583 -6.809 -5.660 -6.364 1.00 0.00 H new ATOM 0 HD12 LEU A 583 -6.556 -6.725 -4.961 1.00 0.00 H new ATOM 0 HD13 LEU A 583 -7.516 -7.293 -6.347 1.00 0.00 H new ATOM 0 HD21 LEU A 583 -8.966 -4.596 -6.745 1.00 0.00 H new ATOM 0 HD22 LEU A 583 -9.856 -6.137 -6.739 1.00 0.00 H new ATOM 0 HD23 LEU A 583 -10.317 -4.838 -5.613 1.00 0.00 H new ATOM 736 N LEU A 584 -7.996 -9.404 -4.662 1.00 0.00 N ATOM 737 CA LEU A 584 -6.975 -10.263 -5.066 1.00 0.00 C ATOM 738 C LEU A 584 -7.496 -11.692 -5.255 1.00 0.00 C ATOM 739 O LEU A 584 -6.754 -12.581 -5.673 1.00 0.00 O ATOM 740 CB LEU A 584 -5.984 -10.149 -3.930 1.00 0.00 C ATOM 741 CG LEU A 584 -4.756 -9.367 -4.262 1.00 0.00 C ATOM 742 CD1 LEU A 584 -3.883 -9.190 -3.035 1.00 0.00 C ATOM 743 CD2 LEU A 584 -3.974 -10.001 -5.405 1.00 0.00 C ATOM 0 H LEU A 584 -7.996 -9.206 -3.661 1.00 0.00 H new ATOM 0 HA LEU A 584 -6.537 -10.010 -6.031 1.00 0.00 H new ATOM 0 HB2 LEU A 584 -6.478 -9.683 -3.078 1.00 0.00 H new ATOM 0 HB3 LEU A 584 -5.689 -11.151 -3.618 1.00 0.00 H new ATOM 0 HG LEU A 584 -5.076 -8.381 -4.599 1.00 0.00 H new ATOM 0 HD11 LEU A 584 -2.994 -8.618 -3.300 1.00 0.00 H new ATOM 0 HD12 LEU A 584 -4.441 -8.657 -2.265 1.00 0.00 H new ATOM 0 HD13 LEU A 584 -3.585 -10.168 -2.656 1.00 0.00 H new ATOM 0 HD21 LEU A 584 -3.088 -9.402 -5.616 1.00 0.00 H new ATOM 0 HD22 LEU A 584 -3.672 -11.010 -5.123 1.00 0.00 H new ATOM 0 HD23 LEU A 584 -4.602 -10.046 -6.295 1.00 0.00 H new ATOM 755 N GLY A 585 -8.784 -11.905 -4.945 1.00 0.00 N ATOM 756 CA GLY A 585 -9.371 -13.227 -5.096 1.00 0.00 C ATOM 757 C GLY A 585 -10.070 -13.408 -6.428 1.00 0.00 C ATOM 758 O GLY A 585 -9.427 -13.688 -7.439 1.00 0.00 O ATOM 0 H GLY A 585 -9.421 -11.189 -4.596 1.00 0.00 H new ATOM 0 HA2 GLY A 585 -8.590 -13.981 -4.995 1.00 0.00 H new ATOM 0 HA3 GLY A 585 -10.085 -13.397 -4.290 1.00 0.00 H new ATOM 762 N SER A 586 -11.397 -13.262 -6.420 1.00 0.00 N ATOM 763 CA SER A 586 -12.208 -13.404 -7.629 1.00 0.00 C ATOM 764 C SER A 586 -12.250 -14.855 -8.101 1.00 0.00 C ATOM 765 O SER A 586 -12.867 -15.166 -9.120 1.00 0.00 O ATOM 766 CB SER A 586 -11.677 -12.504 -8.748 1.00 0.00 C ATOM 767 OG SER A 586 -11.620 -11.150 -8.331 1.00 0.00 O ATOM 0 H SER A 586 -11.935 -13.044 -5.582 1.00 0.00 H new ATOM 0 HA SER A 586 -13.223 -13.095 -7.381 1.00 0.00 H new ATOM 0 HB2 SER A 586 -10.683 -12.838 -9.047 1.00 0.00 H new ATOM 0 HB3 SER A 586 -12.319 -12.591 -9.624 1.00 0.00 H new ATOM 0 HG SER A 586 -11.276 -10.596 -9.063 1.00 0.00 H new ATOM 773 N SER A 587 -11.595 -15.740 -7.353 1.00 0.00 N ATOM 774 CA SER A 587 -11.557 -17.160 -7.691 1.00 0.00 C ATOM 775 C SER A 587 -11.035 -17.375 -9.109 1.00 0.00 C ATOM 776 O SER A 587 -11.863 -17.445 -10.041 1.00 0.00 O ATOM 777 CB SER A 587 -12.951 -17.778 -7.545 1.00 0.00 C ATOM 778 OG SER A 587 -13.437 -17.634 -6.222 1.00 0.00 O ATOM 779 OXT SER A 587 -9.800 -17.470 -9.275 1.00 0.00 O ATOM 0 H SER A 587 -11.082 -15.497 -6.506 1.00 0.00 H new ATOM 0 HA SER A 587 -10.874 -17.652 -6.999 1.00 0.00 H new ATOM 0 HB2 SER A 587 -13.639 -17.300 -8.242 1.00 0.00 H new ATOM 0 HB3 SER A 587 -12.913 -18.835 -7.809 1.00 0.00 H new ATOM 0 HG SER A 587 -14.329 -18.035 -6.156 1.00 0.00 H new TER 785 SER A 587