USER MOD reduce.3.24.130724 H: found=0, std=0, add=776, rem=0, adj=14 USER MOD reduce.3.24.130724 removed 775 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 42 ASN : amide:sc= 0.023 K(o=0.1,f=-3.8!) USER MOD Set 1.2: A 64 GLN : amide:sc= 0.0815 K(o=0.1,f=-1.8) USER MOD Set 2.1: A 51 SER OG : rot 74:sc= 1.69 USER MOD Set 2.2: A 56 LYS NZ :NH3+ -167:sc= 0.674 (180deg=-0.0152) USER MOD Set 3.1: A 1 SER OG : rot -116:sc= 1.48 USER MOD Set 3.2: A 3 GLN : amide:sc= -0.522 K(o=2.4,f=1.6) USER MOD Set 3.3: A 7 SER OG : rot -150:sc= 0 USER MOD Set 3.4: A 16 GLN : amide:sc= 1.44 K(o=2.4,f=-3) USER MOD Single : A 1 SER N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 GLN : amide:sc=-0.00381 X(o=-0.0038,f=-0.0038) USER MOD Single : A 4 SER OG : rot -124:sc= 0.48 USER MOD Single : A 5 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 12 THR OG1 : rot 180:sc= 0 USER MOD Single : A 13 SER OG : rot 180:sc= 0 USER MOD Single : A 14 SER OG : rot 57:sc= 0.0856 USER MOD Single : A 20 ASN : amide:sc= -0.0609 X(o=-0.061,f=-0.29) USER MOD Single : A 27 MET CE :methyl -112:sc=-0.00384 (180deg=-0.12) USER MOD Single : A 31 ASN : amide:sc= -1.26 K(o=-1.3,f=-7.4!) USER MOD Single : A 33 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 36 SER OG : rot 180:sc= 0 USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 58 SER OG : rot 180:sc= -0.0303 USER MOD Single : A 65 GLN : amide:sc= -0.0137 K(o=-0.014,f=-0.56) USER MOD Single : A 66 GLN : amide:sc= -0.333 X(o=-0.33,f=0) USER MOD Single : A 73 GLN : amide:sc=-0.00469 X(o=-0.0047,f=0) USER MOD Single : A 80 SER OG : rot 45:sc= 0.461 USER MOD Single : A 89 GLN : amide:sc= -1.18 X(o=-1.2,f=-1) USER MOD Single : A 91 LYS NZ :NH3+ 135:sc= 1.25 (180deg=0.755) USER MOD Single : A 98 GLN : amide:sc= -0.0397 K(o=-0.04,f=-1.3) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 1 18.967 28.492 -14.799 1.00 25.00 N ATOM 2 CA SER A 1 19.075 29.962 -14.987 1.00 25.00 C ATOM 3 C SER A 1 19.848 30.361 -16.228 1.00 25.00 C ATOM 4 O SER A 1 20.833 29.760 -16.597 1.00 25.00 O ATOM 5 CB SER A 1 19.770 30.575 -13.762 1.00 25.00 C ATOM 6 OG SER A 1 20.068 31.956 -14.005 1.00 25.00 O ATOM 0 H1 SER A 1 18.427 28.292 -13.933 1.00 25.00 H new ATOM 0 H2 SER A 1 18.479 28.072 -15.616 1.00 25.00 H new ATOM 0 H3 SER A 1 19.919 28.082 -14.716 1.00 25.00 H new ATOM 0 HA SER A 1 18.058 30.336 -15.107 1.00 25.00 H new ATOM 0 HB2 SER A 1 19.128 30.482 -12.886 1.00 25.00 H new ATOM 0 HB3 SER A 1 20.688 30.030 -13.544 1.00 25.00 H new ATOM 0 HG SER A 1 21.039 32.085 -14.008 1.00 25.00 H new ATOM 14 N GLN A 2 19.393 31.441 -16.878 1.00 25.00 N ATOM 15 CA GLN A 2 20.064 31.997 -18.056 1.00 25.00 C ATOM 16 C GLN A 2 20.532 33.420 -17.744 1.00 25.00 C ATOM 17 O GLN A 2 20.594 34.276 -18.617 1.00 25.00 O ATOM 18 CB GLN A 2 19.133 31.950 -19.275 1.00 25.00 C ATOM 19 CG GLN A 2 19.839 31.508 -20.567 1.00 25.00 C ATOM 20 CD GLN A 2 20.644 32.619 -21.220 1.00 25.00 C ATOM 21 OE1 GLN A 2 20.110 33.419 -21.972 1.00 25.00 O ATOM 22 NE2 GLN A 2 21.929 32.654 -20.960 1.00 25.00 N ATOM 0 H GLN A 2 18.553 31.950 -16.602 1.00 25.00 H new ATOM 0 HA GLN A 2 20.940 31.397 -18.302 1.00 25.00 H new ATOM 0 HB2 GLN A 2 18.310 31.266 -19.068 1.00 25.00 H new ATOM 0 HB3 GLN A 2 18.697 32.937 -19.428 1.00 25.00 H new ATOM 0 HG2 GLN A 2 20.501 30.672 -20.343 1.00 25.00 H new ATOM 0 HG3 GLN A 2 19.094 31.144 -21.274 1.00 25.00 H new ATOM 0 HE21 GLN A 2 22.340 31.969 -20.326 1.00 25.00 H new ATOM 0 HE22 GLN A 2 22.517 33.367 -21.392 1.00 25.00 H new ATOM 31 N GLN A 3 20.833 33.649 -16.468 1.00 25.00 N ATOM 32 CA GLN A 3 21.385 34.924 -15.973 1.00 25.00 C ATOM 33 C GLN A 3 20.462 36.115 -16.278 1.00 25.00 C ATOM 34 O GLN A 3 20.891 37.266 -16.330 1.00 25.00 O ATOM 35 CB GLN A 3 22.801 35.161 -16.545 1.00 25.00 C ATOM 36 CG GLN A 3 23.830 34.074 -16.165 1.00 25.00 C ATOM 37 CD GLN A 3 23.634 32.762 -16.916 1.00 25.00 C ATOM 38 OE1 GLN A 3 23.658 32.716 -18.135 1.00 25.00 O ATOM 39 NE2 GLN A 3 23.418 31.699 -16.185 1.00 25.00 N ATOM 0 H GLN A 3 20.702 32.952 -15.735 1.00 25.00 H new ATOM 0 HA GLN A 3 21.455 34.848 -14.888 1.00 25.00 H new ATOM 0 HB2 GLN A 3 22.736 35.219 -17.632 1.00 25.00 H new ATOM 0 HB3 GLN A 3 23.165 36.127 -16.195 1.00 25.00 H new ATOM 0 HG2 GLN A 3 24.834 34.450 -16.363 1.00 25.00 H new ATOM 0 HG3 GLN A 3 23.766 33.883 -15.094 1.00 25.00 H new ATOM 0 HE21 GLN A 3 23.405 31.774 -15.168 1.00 25.00 H new ATOM 0 HE22 GLN A 3 23.263 30.795 -16.632 1.00 25.00 H new ATOM 48 N SER A 4 19.185 35.817 -16.457 1.00 25.00 N ATOM 49 CA SER A 4 18.178 36.832 -16.729 1.00 25.00 C ATOM 50 C SER A 4 17.901 37.631 -15.462 1.00 25.00 C ATOM 51 O SER A 4 18.023 37.111 -14.356 1.00 25.00 O ATOM 52 CB SER A 4 16.889 36.154 -17.195 1.00 25.00 C ATOM 53 OG SER A 4 15.837 37.092 -17.358 1.00 25.00 O ATOM 0 H SER A 4 18.817 34.866 -16.418 1.00 25.00 H new ATOM 0 HA SER A 4 18.541 37.504 -17.507 1.00 25.00 H new ATOM 0 HB2 SER A 4 17.068 35.639 -18.139 1.00 25.00 H new ATOM 0 HB3 SER A 4 16.593 35.396 -16.470 1.00 25.00 H new ATOM 0 HG SER A 4 15.067 36.817 -16.818 1.00 25.00 H new ATOM 59 N HIS A 5 17.474 38.877 -15.636 1.00 25.00 N ATOM 60 CA HIS A 5 17.107 39.750 -14.515 1.00 25.00 C ATOM 61 C HIS A 5 15.949 39.147 -13.711 1.00 25.00 C ATOM 62 O HIS A 5 15.775 39.427 -12.530 1.00 25.00 O ATOM 63 CB HIS A 5 16.708 41.127 -15.054 1.00 25.00 C ATOM 64 CG HIS A 5 16.673 42.197 -14.007 1.00 25.00 C ATOM 65 ND1 HIS A 5 17.768 42.914 -13.595 1.00 25.00 N ATOM 66 CD2 HIS A 5 15.635 42.684 -13.270 1.00 25.00 C ATOM 67 CE1 HIS A 5 17.373 43.779 -12.664 1.00 25.00 C ATOM 68 NE2 HIS A 5 16.079 43.685 -12.430 1.00 25.00 N ATOM 0 H HIS A 5 17.371 39.314 -16.552 1.00 25.00 H new ATOM 0 HA HIS A 5 17.966 39.850 -13.851 1.00 25.00 H new ATOM 0 HB2 HIS A 5 17.410 41.419 -15.835 1.00 25.00 H new ATOM 0 HB3 HIS A 5 15.725 41.054 -15.519 1.00 25.00 H new ATOM 0 HD2 HIS A 5 14.614 42.337 -13.334 1.00 25.00 H new ATOM 0 HE1 HIS A 5 18.031 44.473 -12.162 1.00 25.00 H new ATOM 0 HE2 HIS A 5 15.526 44.233 -11.771 1.00 25.00 H new ATOM 76 N SER A 6 15.179 38.283 -14.358 1.00 25.00 N ATOM 77 CA SER A 6 14.138 37.514 -13.691 1.00 25.00 C ATOM 78 C SER A 6 14.318 36.071 -14.126 1.00 25.00 C ATOM 79 O SER A 6 14.223 35.768 -15.314 1.00 25.00 O ATOM 80 CB SER A 6 12.757 38.031 -14.084 1.00 25.00 C ATOM 81 OG SER A 6 12.654 39.415 -13.786 1.00 25.00 O ATOM 0 H SER A 6 15.258 38.096 -15.358 1.00 25.00 H new ATOM 0 HA SER A 6 14.215 37.605 -12.608 1.00 25.00 H new ATOM 0 HB2 SER A 6 12.587 37.866 -15.148 1.00 25.00 H new ATOM 0 HB3 SER A 6 11.986 37.477 -13.548 1.00 25.00 H new ATOM 0 HG SER A 6 11.766 39.740 -14.042 1.00 25.00 H new ATOM 87 N SER A 7 14.641 35.198 -13.183 1.00 25.00 N ATOM 88 CA SER A 7 14.944 33.802 -13.496 1.00 25.00 C ATOM 89 C SER A 7 14.004 32.834 -12.776 1.00 25.00 C ATOM 90 O SER A 7 14.243 32.482 -11.621 1.00 25.00 O ATOM 91 CB SER A 7 16.388 33.478 -13.110 1.00 25.00 C ATOM 92 OG SER A 7 16.722 32.152 -13.486 1.00 25.00 O ATOM 0 H SER A 7 14.701 35.429 -12.191 1.00 25.00 H new ATOM 0 HA SER A 7 14.804 33.676 -14.570 1.00 25.00 H new ATOM 0 HB2 SER A 7 17.066 34.180 -13.595 1.00 25.00 H new ATOM 0 HB3 SER A 7 16.518 33.600 -12.035 1.00 25.00 H new ATOM 0 HG SER A 7 17.392 31.795 -12.866 1.00 25.00 H new ATOM 98 N PRO A 8 12.938 32.374 -13.456 1.00 25.00 N ATOM 99 CA PRO A 8 12.103 31.341 -12.833 1.00 25.00 C ATOM 100 C PRO A 8 12.831 29.997 -12.828 1.00 25.00 C ATOM 101 O PRO A 8 13.924 29.873 -13.389 1.00 25.00 O ATOM 102 CB PRO A 8 10.875 31.306 -13.744 1.00 25.00 C ATOM 103 CG PRO A 8 11.419 31.634 -15.077 1.00 25.00 C ATOM 104 CD PRO A 8 12.457 32.698 -14.814 1.00 25.00 C ATOM 0 HA PRO A 8 11.855 31.544 -11.791 1.00 25.00 H new ATOM 0 HB2 PRO A 8 10.398 30.326 -13.736 1.00 25.00 H new ATOM 0 HB3 PRO A 8 10.122 32.029 -13.430 1.00 25.00 H new ATOM 0 HG2 PRO A 8 11.861 30.758 -15.551 1.00 25.00 H new ATOM 0 HG3 PRO A 8 10.638 31.998 -15.745 1.00 25.00 H new ATOM 0 HD2 PRO A 8 13.264 32.662 -15.546 1.00 25.00 H new ATOM 0 HD3 PRO A 8 12.028 33.699 -14.861 1.00 25.00 H new ATOM 112 N GLY A 9 12.225 28.998 -12.206 1.00 25.00 N ATOM 113 CA GLY A 9 12.843 27.683 -12.092 1.00 25.00 C ATOM 114 C GLY A 9 13.103 27.351 -10.639 1.00 25.00 C ATOM 115 O GLY A 9 14.011 26.592 -10.304 1.00 25.00 O ATOM 0 H GLY A 9 11.305 29.071 -11.771 1.00 25.00 H new ATOM 0 HA2 GLY A 9 12.193 26.928 -12.534 1.00 25.00 H new ATOM 0 HA3 GLY A 9 13.779 27.664 -12.650 1.00 25.00 H new ATOM 119 N GLU A 10 12.275 27.925 -9.779 1.00 25.00 N ATOM 120 CA GLU A 10 12.346 27.790 -8.319 1.00 25.00 C ATOM 121 C GLU A 10 11.941 26.405 -7.790 1.00 25.00 C ATOM 122 O GLU A 10 11.505 26.247 -6.654 1.00 25.00 O ATOM 123 CB GLU A 10 11.450 28.874 -7.688 1.00 25.00 C ATOM 124 CG GLU A 10 9.958 28.807 -8.106 1.00 25.00 C ATOM 125 CD GLU A 10 9.619 29.728 -9.288 1.00 25.00 C ATOM 126 OE1 GLU A 10 8.902 30.724 -9.080 1.00 25.00 O ATOM 127 OE2 GLU A 10 10.067 29.444 -10.431 1.00 25.00 O ATOM 0 H GLU A 10 11.505 28.521 -10.083 1.00 25.00 H new ATOM 0 HA GLU A 10 13.392 27.914 -8.037 1.00 25.00 H new ATOM 0 HB2 GLU A 10 11.513 28.792 -6.603 1.00 25.00 H new ATOM 0 HB3 GLU A 10 11.845 29.854 -7.957 1.00 25.00 H new ATOM 0 HG2 GLU A 10 9.707 27.780 -8.371 1.00 25.00 H new ATOM 0 HG3 GLU A 10 9.336 29.077 -7.253 1.00 25.00 H new ATOM 134 N ILE A 11 12.123 25.402 -8.629 1.00 25.00 N ATOM 135 CA ILE A 11 11.845 24.029 -8.325 1.00 25.00 C ATOM 136 C ILE A 11 13.067 23.476 -7.600 1.00 25.00 C ATOM 137 O ILE A 11 13.062 22.435 -6.940 1.00 25.00 O ATOM 138 CB ILE A 11 11.558 23.345 -9.691 1.00 25.00 C ATOM 139 CG1 ILE A 11 10.160 23.760 -10.201 1.00 25.00 C ATOM 140 CG2 ILE A 11 11.727 21.882 -9.613 1.00 25.00 C ATOM 141 CD1 ILE A 11 9.929 23.484 -11.702 1.00 25.00 C ATOM 0 H ILE A 11 12.482 25.537 -9.574 1.00 25.00 H new ATOM 0 HA ILE A 11 10.987 23.865 -7.674 1.00 25.00 H new ATOM 0 HB ILE A 11 12.292 23.688 -10.420 1.00 25.00 H new ATOM 0 HG12 ILE A 11 9.402 23.229 -9.624 1.00 25.00 H new ATOM 0 HG13 ILE A 11 10.017 24.824 -10.012 1.00 25.00 H new ATOM 0 HG21 ILE A 11 11.518 21.439 -10.587 1.00 25.00 H new ATOM 0 HG22 ILE A 11 12.751 21.649 -9.321 1.00 25.00 H new ATOM 0 HG23 ILE A 11 11.037 21.475 -8.874 1.00 25.00 H new ATOM 0 HD11 ILE A 11 8.925 23.803 -11.980 1.00 25.00 H new ATOM 0 HD12 ILE A 11 10.662 24.036 -12.290 1.00 25.00 H new ATOM 0 HD13 ILE A 11 10.037 22.417 -11.897 1.00 25.00 H new ATOM 153 N THR A 12 14.100 24.270 -7.703 1.00 25.00 N ATOM 154 CA THR A 12 15.395 24.010 -7.089 1.00 25.00 C ATOM 155 C THR A 12 16.002 25.355 -6.705 1.00 25.00 C ATOM 156 O THR A 12 15.583 26.400 -7.206 1.00 25.00 O ATOM 157 CB THR A 12 16.331 23.229 -8.058 1.00 25.00 C ATOM 158 OG1 THR A 12 17.509 22.814 -7.361 1.00 25.00 O ATOM 159 CG2 THR A 12 16.753 24.080 -9.257 1.00 25.00 C ATOM 0 H THR A 12 14.073 25.143 -8.230 1.00 25.00 H new ATOM 0 HA THR A 12 15.272 23.385 -6.204 1.00 25.00 H new ATOM 0 HB THR A 12 15.772 22.368 -8.423 1.00 25.00 H new ATOM 0 HG1 THR A 12 18.095 22.321 -7.973 1.00 25.00 H new ATOM 0 HG21 THR A 12 17.405 23.496 -9.906 1.00 25.00 H new ATOM 0 HG22 THR A 12 15.868 24.388 -9.814 1.00 25.00 H new ATOM 0 HG23 THR A 12 17.287 24.963 -8.906 1.00 25.00 H new ATOM 167 N SER A 13 16.970 25.335 -5.801 1.00 25.00 N ATOM 168 CA SER A 13 17.611 26.558 -5.330 1.00 25.00 C ATOM 169 C SER A 13 18.960 26.753 -6.008 1.00 25.00 C ATOM 170 O SER A 13 19.752 25.816 -6.091 1.00 25.00 O ATOM 171 CB SER A 13 17.816 26.482 -3.818 1.00 25.00 C ATOM 172 OG SER A 13 16.590 26.197 -3.163 1.00 25.00 O ATOM 0 H SER A 13 17.332 24.481 -5.376 1.00 25.00 H new ATOM 0 HA SER A 13 16.966 27.402 -5.576 1.00 25.00 H new ATOM 0 HB2 SER A 13 18.549 25.710 -3.583 1.00 25.00 H new ATOM 0 HB3 SER A 13 18.220 27.426 -3.452 1.00 25.00 H new ATOM 0 HG SER A 13 16.739 26.150 -2.196 1.00 25.00 H new ATOM 178 N SER A 14 19.217 27.978 -6.463 1.00 25.00 N ATOM 179 CA SER A 14 20.498 28.368 -7.083 1.00 25.00 C ATOM 180 C SER A 14 21.117 27.325 -8.029 1.00 25.00 C ATOM 181 O SER A 14 22.204 26.815 -7.763 1.00 25.00 O ATOM 182 CB SER A 14 21.509 28.724 -5.981 1.00 25.00 C ATOM 183 OG SER A 14 21.704 27.651 -5.074 1.00 25.00 O ATOM 0 H SER A 14 18.541 28.740 -6.415 1.00 25.00 H new ATOM 0 HA SER A 14 20.266 29.226 -7.713 1.00 25.00 H new ATOM 0 HB2 SER A 14 22.462 28.992 -6.436 1.00 25.00 H new ATOM 0 HB3 SER A 14 21.158 29.600 -5.436 1.00 25.00 H new ATOM 0 HG SER A 14 22.000 26.857 -5.566 1.00 25.00 H new ATOM 189 N PRO A 15 20.455 27.021 -9.166 1.00 25.00 N ATOM 190 CA PRO A 15 21.064 25.991 -10.021 1.00 25.00 C ATOM 191 C PRO A 15 22.424 26.386 -10.608 1.00 25.00 C ATOM 192 O PRO A 15 23.352 25.593 -10.597 1.00 25.00 O ATOM 193 CB PRO A 15 20.010 25.785 -11.115 1.00 25.00 C ATOM 194 CG PRO A 15 19.278 27.080 -11.180 1.00 25.00 C ATOM 195 CD PRO A 15 19.186 27.515 -9.737 1.00 25.00 C ATOM 0 HA PRO A 15 21.299 25.089 -9.457 1.00 25.00 H new ATOM 0 HB2 PRO A 15 20.473 25.543 -12.071 1.00 25.00 H new ATOM 0 HB3 PRO A 15 19.339 24.962 -10.869 1.00 25.00 H new ATOM 0 HG2 PRO A 15 19.813 27.812 -11.785 1.00 25.00 H new ATOM 0 HG3 PRO A 15 18.290 26.959 -11.625 1.00 25.00 H new ATOM 0 HD2 PRO A 15 19.095 28.597 -9.646 1.00 25.00 H new ATOM 0 HD3 PRO A 15 18.321 27.079 -9.237 1.00 25.00 H new ATOM 203 N GLN A 16 22.575 27.628 -11.053 1.00 25.00 N ATOM 204 CA GLN A 16 23.872 28.077 -11.569 1.00 25.00 C ATOM 205 C GLN A 16 24.868 28.269 -10.423 1.00 25.00 C ATOM 206 O GLN A 16 26.058 28.379 -10.639 1.00 25.00 O ATOM 207 CB GLN A 16 23.737 29.382 -12.374 1.00 25.00 C ATOM 208 CG GLN A 16 23.453 30.638 -11.538 1.00 25.00 C ATOM 209 CD GLN A 16 23.461 31.902 -12.376 1.00 25.00 C ATOM 210 OE1 GLN A 16 22.658 32.069 -13.281 1.00 25.00 O ATOM 211 NE2 GLN A 16 24.356 32.798 -12.070 1.00 25.00 N ATOM 0 H GLN A 16 21.837 28.332 -11.070 1.00 25.00 H new ATOM 0 HA GLN A 16 24.245 27.303 -12.240 1.00 25.00 H new ATOM 0 HB2 GLN A 16 24.657 29.540 -12.937 1.00 25.00 H new ATOM 0 HB3 GLN A 16 22.935 29.260 -13.102 1.00 25.00 H new ATOM 0 HG2 GLN A 16 22.484 30.535 -11.049 1.00 25.00 H new ATOM 0 HG3 GLN A 16 24.200 30.723 -10.749 1.00 25.00 H new ATOM 0 HE21 GLN A 16 25.011 32.625 -11.308 1.00 25.00 H new ATOM 0 HE22 GLN A 16 24.402 33.673 -12.593 1.00 25.00 H new ATOM 220 N GLY A 17 24.365 28.316 -9.196 1.00 25.00 N ATOM 221 CA GLY A 17 25.224 28.535 -8.044 1.00 25.00 C ATOM 222 C GLY A 17 26.059 27.317 -7.723 1.00 25.00 C ATOM 223 O GLY A 17 27.087 27.423 -7.061 1.00 25.00 O ATOM 0 H GLY A 17 23.375 28.206 -8.976 1.00 25.00 H new ATOM 0 HA2 GLY A 17 25.880 29.384 -8.237 1.00 25.00 H new ATOM 0 HA3 GLY A 17 24.613 28.794 -7.180 1.00 25.00 H new ATOM 227 N LEU A 18 25.621 26.164 -8.207 1.00 25.00 N ATOM 228 CA LEU A 18 26.354 24.913 -8.003 1.00 25.00 C ATOM 229 C LEU A 18 27.674 24.941 -8.763 1.00 25.00 C ATOM 230 O LEU A 18 28.706 24.512 -8.258 1.00 25.00 O ATOM 231 CB LEU A 18 25.523 23.728 -8.507 1.00 25.00 C ATOM 232 CG LEU A 18 24.137 23.547 -7.875 1.00 25.00 C ATOM 233 CD1 LEU A 18 23.411 22.400 -8.567 1.00 25.00 C ATOM 234 CD2 LEU A 18 24.218 23.276 -6.365 1.00 25.00 C ATOM 0 H LEU A 18 24.760 26.064 -8.745 1.00 25.00 H new ATOM 0 HA LEU A 18 26.549 24.803 -6.936 1.00 25.00 H new ATOM 0 HB2 LEU A 18 25.396 23.834 -9.584 1.00 25.00 H new ATOM 0 HB3 LEU A 18 26.095 22.815 -8.342 1.00 25.00 H new ATOM 0 HG LEU A 18 23.586 24.478 -8.009 1.00 25.00 H new ATOM 0 HD11 LEU A 18 22.426 22.270 -8.119 1.00 25.00 H new ATOM 0 HD12 LEU A 18 23.300 22.626 -9.627 1.00 25.00 H new ATOM 0 HD13 LEU A 18 23.987 21.482 -8.450 1.00 25.00 H new ATOM 0 HD21 LEU A 18 23.212 23.155 -5.963 1.00 25.00 H new ATOM 0 HD22 LEU A 18 24.791 22.366 -6.189 1.00 25.00 H new ATOM 0 HD23 LEU A 18 24.708 24.115 -5.871 1.00 25.00 H new ATOM 246 N ASP A 19 27.614 25.451 -9.984 1.00 25.00 N ATOM 247 CA ASP A 19 28.783 25.546 -10.863 1.00 25.00 C ATOM 248 C ASP A 19 29.579 26.806 -10.538 1.00 25.00 C ATOM 249 O ASP A 19 30.793 26.870 -10.712 1.00 25.00 O ATOM 250 CB ASP A 19 28.308 25.608 -12.314 1.00 25.00 C ATOM 251 CG ASP A 19 29.450 25.460 -13.314 1.00 25.00 C ATOM 252 OD1 ASP A 19 30.144 24.420 -13.288 1.00 25.00 O ATOM 253 OD2 ASP A 19 29.612 26.363 -14.163 1.00 25.00 O ATOM 0 H ASP A 19 26.755 25.813 -10.399 1.00 25.00 H new ATOM 0 HA ASP A 19 29.421 24.675 -10.714 1.00 25.00 H new ATOM 0 HB2 ASP A 19 27.575 24.820 -12.486 1.00 25.00 H new ATOM 0 HB3 ASP A 19 27.801 26.557 -12.486 1.00 25.00 H new ATOM 258 N ASN A 20 28.880 27.814 -10.039 1.00 25.00 N ATOM 259 CA ASN A 20 29.495 29.079 -9.681 1.00 25.00 C ATOM 260 C ASN A 20 29.436 29.375 -8.185 1.00 25.00 C ATOM 261 O ASN A 20 28.614 30.192 -7.740 1.00 25.00 O ATOM 262 CB ASN A 20 28.780 30.230 -10.387 1.00 25.00 C ATOM 263 CG ASN A 20 28.907 30.194 -11.884 1.00 25.00 C ATOM 264 OD1 ASN A 20 27.922 30.315 -12.590 1.00 25.00 O ATOM 265 ND2 ASN A 20 30.113 30.155 -12.372 1.00 25.00 N ATOM 0 H ASN A 20 27.874 27.777 -9.872 1.00 25.00 H new ATOM 0 HA ASN A 20 30.538 28.994 -9.985 1.00 25.00 H new ATOM 0 HB2 ASN A 20 27.723 30.207 -10.120 1.00 25.00 H new ATOM 0 HB3 ASN A 20 29.181 31.175 -10.020 1.00 25.00 H new ATOM 0 HD21 ASN A 20 30.258 30.227 -13.379 1.00 25.00 H new ATOM 0 HD22 ASN A 20 30.913 30.053 -11.747 1.00 25.00 H new ATOM 272 N PRO A 21 30.390 28.836 -7.405 1.00 25.00 N ATOM 273 CA PRO A 21 30.442 29.254 -6.001 1.00 25.00 C ATOM 274 C PRO A 21 30.719 30.741 -5.873 1.00 25.00 C ATOM 275 O PRO A 21 30.267 31.375 -4.942 1.00 25.00 O ATOM 276 CB PRO A 21 31.620 28.450 -5.439 1.00 25.00 C ATOM 277 CG PRO A 21 32.426 28.105 -6.611 1.00 25.00 C ATOM 278 CD PRO A 21 31.484 27.908 -7.730 1.00 25.00 C ATOM 0 HA PRO A 21 29.501 29.079 -5.480 1.00 25.00 H new ATOM 0 HB2 PRO A 21 32.194 29.037 -4.722 1.00 25.00 H new ATOM 0 HB3 PRO A 21 31.277 27.557 -4.917 1.00 25.00 H new ATOM 0 HG2 PRO A 21 33.137 28.899 -6.839 1.00 25.00 H new ATOM 0 HG3 PRO A 21 33.006 27.200 -6.429 1.00 25.00 H new ATOM 0 HD2 PRO A 21 31.942 28.144 -8.690 1.00 25.00 H new ATOM 0 HD3 PRO A 21 31.135 26.877 -7.788 1.00 25.00 H new ATOM 286 N ALA A 22 31.450 31.303 -6.826 1.00 25.00 N ATOM 287 CA ALA A 22 31.783 32.719 -6.793 1.00 25.00 C ATOM 288 C ALA A 22 30.539 33.599 -6.885 1.00 25.00 C ATOM 289 O ALA A 22 30.421 34.585 -6.164 1.00 25.00 O ATOM 290 CB ALA A 22 32.757 33.043 -7.926 1.00 25.00 C ATOM 0 H ALA A 22 31.823 30.800 -7.631 1.00 25.00 H new ATOM 0 HA ALA A 22 32.256 32.934 -5.835 1.00 25.00 H new ATOM 0 HB1 ALA A 22 33.005 34.104 -7.900 1.00 25.00 H new ATOM 0 HB2 ALA A 22 33.666 32.454 -7.804 1.00 25.00 H new ATOM 0 HB3 ALA A 22 32.295 32.802 -8.883 1.00 25.00 H new ATOM 296 N LEU A 23 29.619 33.240 -7.767 1.00 25.00 N ATOM 297 CA LEU A 23 28.412 34.039 -7.957 1.00 25.00 C ATOM 298 C LEU A 23 27.423 33.766 -6.833 1.00 25.00 C ATOM 299 O LEU A 23 26.712 34.661 -6.395 1.00 25.00 O ATOM 300 CB LEU A 23 27.753 33.740 -9.313 1.00 25.00 C ATOM 301 CG LEU A 23 28.618 33.906 -10.582 1.00 25.00 C ATOM 302 CD1 LEU A 23 27.747 33.663 -11.810 1.00 25.00 C ATOM 303 CD2 LEU A 23 29.283 35.259 -10.708 1.00 25.00 C ATOM 0 H LEU A 23 29.680 32.411 -8.358 1.00 25.00 H new ATOM 0 HA LEU A 23 28.699 35.090 -7.942 1.00 25.00 H new ATOM 0 HB2 LEU A 23 27.386 32.714 -9.289 1.00 25.00 H new ATOM 0 HB3 LEU A 23 26.882 34.388 -9.413 1.00 25.00 H new ATOM 0 HG LEU A 23 29.423 33.175 -10.504 1.00 25.00 H new ATOM 0 HD11 LEU A 23 28.349 33.778 -12.711 1.00 25.00 H new ATOM 0 HD12 LEU A 23 27.339 32.653 -11.773 1.00 25.00 H new ATOM 0 HD13 LEU A 23 26.930 34.384 -11.825 1.00 25.00 H new ATOM 0 HD21 LEU A 23 29.871 35.292 -11.626 1.00 25.00 H new ATOM 0 HD22 LEU A 23 28.521 36.038 -10.737 1.00 25.00 H new ATOM 0 HD23 LEU A 23 29.937 35.424 -9.852 1.00 25.00 H new ATOM 315 N LEU A 24 27.385 32.533 -6.347 1.00 25.00 N ATOM 316 CA LEU A 24 26.480 32.194 -5.256 1.00 25.00 C ATOM 317 C LEU A 24 26.920 32.882 -3.970 1.00 25.00 C ATOM 318 O LEU A 24 26.101 33.440 -3.256 1.00 25.00 O ATOM 319 CB LEU A 24 26.419 30.677 -5.056 1.00 25.00 C ATOM 320 CG LEU A 24 25.436 30.196 -3.974 1.00 25.00 C ATOM 321 CD1 LEU A 24 24.039 30.790 -4.147 1.00 25.00 C ATOM 322 CD2 LEU A 24 25.353 28.686 -3.987 1.00 25.00 C ATOM 0 H LEU A 24 27.960 31.761 -6.684 1.00 25.00 H new ATOM 0 HA LEU A 24 25.482 32.546 -5.516 1.00 25.00 H new ATOM 0 HB2 LEU A 24 26.146 30.213 -6.004 1.00 25.00 H new ATOM 0 HB3 LEU A 24 27.417 30.320 -4.802 1.00 25.00 H new ATOM 0 HG LEU A 24 25.820 30.542 -3.014 1.00 25.00 H new ATOM 0 HD11 LEU A 24 23.385 30.418 -3.358 1.00 25.00 H new ATOM 0 HD12 LEU A 24 24.096 31.877 -4.089 1.00 25.00 H new ATOM 0 HD13 LEU A 24 23.638 30.499 -5.118 1.00 25.00 H new ATOM 0 HD21 LEU A 24 24.655 28.353 -3.218 1.00 25.00 H new ATOM 0 HD22 LEU A 24 25.005 28.349 -4.963 1.00 25.00 H new ATOM 0 HD23 LEU A 24 26.339 28.266 -3.789 1.00 25.00 H new ATOM 334 N ARG A 25 28.221 32.896 -3.717 1.00 25.00 N ATOM 335 CA ARG A 25 28.791 33.608 -2.573 1.00 25.00 C ATOM 336 C ARG A 25 28.376 35.072 -2.633 1.00 25.00 C ATOM 337 O ARG A 25 27.973 35.643 -1.634 1.00 25.00 O ATOM 338 CB ARG A 25 30.323 33.459 -2.611 1.00 25.00 C ATOM 339 CG ARG A 25 31.111 34.212 -1.536 1.00 25.00 C ATOM 340 CD ARG A 25 31.582 35.591 -2.013 1.00 25.00 C ATOM 341 NE ARG A 25 32.445 35.532 -3.206 1.00 25.00 N ATOM 342 CZ ARG A 25 32.501 36.465 -4.152 1.00 25.00 C ATOM 343 NH1 ARG A 25 31.785 37.558 -4.100 1.00 25.00 N ATOM 344 NH2 ARG A 25 33.297 36.295 -5.172 1.00 25.00 N ATOM 0 H ARG A 25 28.912 32.417 -4.294 1.00 25.00 H new ATOM 0 HA ARG A 25 28.422 33.190 -1.636 1.00 25.00 H new ATOM 0 HB2 ARG A 25 30.564 32.399 -2.531 1.00 25.00 H new ATOM 0 HB3 ARG A 25 30.674 33.793 -3.587 1.00 25.00 H new ATOM 0 HG2 ARG A 25 30.488 34.331 -0.649 1.00 25.00 H new ATOM 0 HG3 ARG A 25 31.976 33.618 -1.241 1.00 25.00 H new ATOM 0 HD2 ARG A 25 30.711 36.208 -2.233 1.00 25.00 H new ATOM 0 HD3 ARG A 25 32.124 36.082 -1.205 1.00 25.00 H new ATOM 0 HE ARG A 25 33.045 34.714 -3.314 1.00 25.00 H new ATOM 0 HH11 ARG A 25 31.155 37.718 -3.314 1.00 25.00 H new ATOM 0 HH12 ARG A 25 31.856 38.250 -4.846 1.00 25.00 H new ATOM 0 HH21 ARG A 25 33.869 35.453 -5.238 1.00 25.00 H new ATOM 0 HH22 ARG A 25 33.348 37.004 -5.903 1.00 25.00 H new ATOM 358 N ASP A 26 28.462 35.664 -3.812 1.00 25.00 N ATOM 359 CA ASP A 26 28.102 37.072 -3.993 1.00 25.00 C ATOM 360 C ASP A 26 26.618 37.320 -3.708 1.00 25.00 C ATOM 361 O ASP A 26 26.260 38.239 -2.975 1.00 25.00 O ATOM 362 CB ASP A 26 28.433 37.505 -5.424 1.00 25.00 C ATOM 363 CG ASP A 26 28.784 38.974 -5.520 1.00 25.00 C ATOM 364 OD1 ASP A 26 29.666 39.419 -4.751 1.00 25.00 O ATOM 365 OD2 ASP A 26 28.263 39.656 -6.420 1.00 25.00 O ATOM 0 H ASP A 26 28.777 35.197 -4.662 1.00 25.00 H new ATOM 0 HA ASP A 26 28.680 37.661 -3.281 1.00 25.00 H new ATOM 0 HB2 ASP A 26 29.268 36.911 -5.796 1.00 25.00 H new ATOM 0 HB3 ASP A 26 27.580 37.296 -6.070 1.00 25.00 H new ATOM 370 N MET A 27 25.764 36.459 -4.248 1.00 25.00 N ATOM 371 CA MET A 27 24.313 36.568 -4.047 1.00 25.00 C ATOM 372 C MET A 27 23.968 36.463 -2.579 1.00 25.00 C ATOM 373 O MET A 27 23.220 37.268 -2.044 1.00 25.00 O ATOM 374 CB MET A 27 23.605 35.437 -4.803 1.00 25.00 C ATOM 375 CG MET A 27 22.080 35.555 -4.859 1.00 25.00 C ATOM 376 SD MET A 27 21.177 35.107 -3.333 1.00 25.00 S ATOM 377 CE MET A 27 21.347 33.308 -3.281 1.00 25.00 C ATOM 0 H MET A 27 26.047 35.672 -4.832 1.00 25.00 H new ATOM 0 HA MET A 27 23.985 37.537 -4.423 1.00 25.00 H new ATOM 0 HB2 MET A 27 23.990 35.404 -5.822 1.00 25.00 H new ATOM 0 HB3 MET A 27 23.864 34.488 -4.334 1.00 25.00 H new ATOM 0 HG2 MET A 27 21.826 36.583 -5.118 1.00 25.00 H new ATOM 0 HG3 MET A 27 21.717 34.923 -5.669 1.00 25.00 H new ATOM 0 HE1 MET A 27 20.374 32.846 -3.446 1.00 25.00 H new ATOM 0 HE2 MET A 27 22.039 32.985 -4.059 1.00 25.00 H new ATOM 0 HE3 MET A 27 21.731 33.007 -2.306 1.00 25.00 H new ATOM 387 N LEU A 28 24.508 35.443 -1.940 1.00 25.00 N ATOM 388 CA LEU A 28 24.220 35.167 -0.542 1.00 25.00 C ATOM 389 C LEU A 28 24.634 36.312 0.359 1.00 25.00 C ATOM 390 O LEU A 28 23.893 36.697 1.248 1.00 25.00 O ATOM 391 CB LEU A 28 24.943 33.916 -0.111 1.00 25.00 C ATOM 392 CG LEU A 28 24.317 32.617 -0.614 1.00 25.00 C ATOM 393 CD1 LEU A 28 25.317 31.541 -0.420 1.00 25.00 C ATOM 394 CD2 LEU A 28 23.035 32.298 0.127 1.00 25.00 C ATOM 0 H LEU A 28 25.156 34.784 -2.371 1.00 25.00 H new ATOM 0 HA LEU A 28 23.142 35.035 -0.450 1.00 25.00 H new ATOM 0 HB2 LEU A 28 25.973 33.968 -0.463 1.00 25.00 H new ATOM 0 HB3 LEU A 28 24.979 33.889 0.978 1.00 25.00 H new ATOM 0 HG LEU A 28 24.053 32.713 -1.667 1.00 25.00 H new ATOM 0 HD11 LEU A 28 24.905 30.594 -0.769 1.00 25.00 H new ATOM 0 HD12 LEU A 28 26.218 31.775 -0.987 1.00 25.00 H new ATOM 0 HD13 LEU A 28 25.565 31.461 0.638 1.00 25.00 H new ATOM 0 HD21 LEU A 28 22.616 31.368 -0.256 1.00 25.00 H new ATOM 0 HD22 LEU A 28 23.247 32.190 1.191 1.00 25.00 H new ATOM 0 HD23 LEU A 28 22.319 33.106 -0.020 1.00 25.00 H new ATOM 406 N LEU A 29 25.807 36.874 0.122 1.00 25.00 N ATOM 407 CA LEU A 29 26.283 37.994 0.939 1.00 25.00 C ATOM 408 C LEU A 29 25.375 39.204 0.774 1.00 25.00 C ATOM 409 O LEU A 29 25.127 39.943 1.725 1.00 25.00 O ATOM 410 CB LEU A 29 27.711 38.382 0.548 1.00 25.00 C ATOM 411 CG LEU A 29 28.815 37.411 0.993 1.00 25.00 C ATOM 412 CD1 LEU A 29 30.104 37.774 0.282 1.00 25.00 C ATOM 413 CD2 LEU A 29 29.028 37.430 2.506 1.00 25.00 C ATOM 0 H LEU A 29 26.446 36.583 -0.618 1.00 25.00 H new ATOM 0 HA LEU A 29 26.270 37.672 1.980 1.00 25.00 H new ATOM 0 HB2 LEU A 29 27.756 38.481 -0.537 1.00 25.00 H new ATOM 0 HB3 LEU A 29 27.928 39.365 0.967 1.00 25.00 H new ATOM 0 HG LEU A 29 28.505 36.400 0.728 1.00 25.00 H new ATOM 0 HD11 LEU A 29 30.895 37.090 0.591 1.00 25.00 H new ATOM 0 HD12 LEU A 29 29.959 37.698 -0.796 1.00 25.00 H new ATOM 0 HD13 LEU A 29 30.386 38.795 0.539 1.00 25.00 H new ATOM 0 HD21 LEU A 29 29.818 36.727 2.771 1.00 25.00 H new ATOM 0 HD22 LEU A 29 29.314 38.434 2.821 1.00 25.00 H new ATOM 0 HD23 LEU A 29 28.104 37.143 3.007 1.00 25.00 H new ATOM 425 N ALA A 30 24.864 39.388 -0.432 1.00 25.00 N ATOM 426 CA ALA A 30 23.966 40.494 -0.729 1.00 25.00 C ATOM 427 C ALA A 30 22.529 40.224 -0.251 1.00 25.00 C ATOM 428 O ALA A 30 21.692 41.129 -0.262 1.00 25.00 O ATOM 429 CB ALA A 30 23.973 40.761 -2.243 1.00 25.00 C ATOM 0 H ALA A 30 25.057 38.780 -1.228 1.00 25.00 H new ATOM 0 HA ALA A 30 24.325 41.370 -0.189 1.00 25.00 H new ATOM 0 HB1 ALA A 30 23.301 41.589 -2.470 1.00 25.00 H new ATOM 0 HB2 ALA A 30 24.983 41.015 -2.563 1.00 25.00 H new ATOM 0 HB3 ALA A 30 23.639 39.868 -2.771 1.00 25.00 H new ATOM 435 N ASN A 31 22.225 38.988 0.129 1.00 25.00 N ATOM 436 CA ASN A 31 20.856 38.615 0.484 1.00 25.00 C ATOM 437 C ASN A 31 20.721 38.203 1.955 1.00 25.00 C ATOM 438 O ASN A 31 21.008 37.060 2.321 1.00 25.00 O ATOM 439 CB ASN A 31 20.394 37.473 -0.413 1.00 25.00 C ATOM 440 CG ASN A 31 18.904 37.288 -0.381 1.00 25.00 C ATOM 441 OD1 ASN A 31 18.266 37.396 0.666 1.00 25.00 O ATOM 442 ND2 ASN A 31 18.336 37.009 -1.518 1.00 25.00 N ATOM 0 H ASN A 31 22.903 38.229 0.200 1.00 25.00 H new ATOM 0 HA ASN A 31 20.228 39.494 0.337 1.00 25.00 H new ATOM 0 HB2 ASN A 31 20.711 37.668 -1.437 1.00 25.00 H new ATOM 0 HB3 ASN A 31 20.879 36.549 -0.099 1.00 25.00 H new ATOM 0 HD21 ASN A 31 17.326 36.871 -1.563 1.00 25.00 H new ATOM 0 HD22 ASN A 31 18.900 36.928 -2.364 1.00 25.00 H new ATOM 449 N PRO A 32 20.233 39.115 2.813 1.00 25.00 N ATOM 450 CA PRO A 32 20.156 38.758 4.235 1.00 25.00 C ATOM 451 C PRO A 32 19.186 37.621 4.577 1.00 25.00 C ATOM 452 O PRO A 32 19.370 36.932 5.575 1.00 25.00 O ATOM 453 CB PRO A 32 19.731 40.074 4.892 1.00 25.00 C ATOM 454 CG PRO A 32 18.990 40.793 3.820 1.00 25.00 C ATOM 455 CD PRO A 32 19.768 40.495 2.583 1.00 25.00 C ATOM 0 HA PRO A 32 21.107 38.358 4.586 1.00 25.00 H new ATOM 0 HB2 PRO A 32 19.100 39.899 5.764 1.00 25.00 H new ATOM 0 HB3 PRO A 32 20.594 40.646 5.233 1.00 25.00 H new ATOM 0 HG2 PRO A 32 17.962 40.440 3.740 1.00 25.00 H new ATOM 0 HG3 PRO A 32 18.945 41.864 4.015 1.00 25.00 H new ATOM 0 HD2 PRO A 32 19.149 40.569 1.689 1.00 25.00 H new ATOM 0 HD3 PRO A 32 20.601 41.186 2.453 1.00 25.00 H new ATOM 463 N HIS A 33 18.162 37.406 3.760 1.00 25.00 N ATOM 464 CA HIS A 33 17.219 36.317 4.011 1.00 25.00 C ATOM 465 C HIS A 33 17.822 34.970 3.617 1.00 25.00 C ATOM 466 O HIS A 33 17.665 33.969 4.313 1.00 25.00 O ATOM 467 CB HIS A 33 15.932 36.541 3.214 1.00 25.00 C ATOM 468 CG HIS A 33 14.890 35.496 3.462 1.00 25.00 C ATOM 469 ND1 HIS A 33 14.048 35.482 4.546 1.00 25.00 N ATOM 470 CD2 HIS A 33 14.563 34.381 2.749 1.00 25.00 C ATOM 471 CE1 HIS A 33 13.270 34.406 4.456 1.00 25.00 C ATOM 472 NE2 HIS A 33 13.536 33.702 3.376 1.00 25.00 N ATOM 0 H HIS A 33 17.963 37.962 2.928 1.00 25.00 H new ATOM 0 HA HIS A 33 16.996 36.307 5.078 1.00 25.00 H new ATOM 0 HB2 HIS A 33 15.522 37.519 3.467 1.00 25.00 H new ATOM 0 HB3 HIS A 33 16.171 36.560 2.151 1.00 25.00 H new ATOM 0 HD2 HIS A 33 15.037 34.073 1.829 1.00 25.00 H new ATOM 0 HE1 HIS A 33 12.513 34.143 5.180 1.00 25.00 H new ATOM 0 HE2 HIS A 33 13.082 32.842 3.069 1.00 25.00 H new ATOM 480 N GLU A 34 18.497 34.949 2.483 1.00 25.00 N ATOM 481 CA GLU A 34 19.037 33.709 1.930 1.00 25.00 C ATOM 482 C GLU A 34 20.240 33.270 2.752 1.00 25.00 C ATOM 483 O GLU A 34 20.399 32.105 3.075 1.00 25.00 O ATOM 484 CB GLU A 34 19.424 33.933 0.472 1.00 25.00 C ATOM 485 CG GLU A 34 18.375 33.468 -0.539 1.00 25.00 C ATOM 486 CD GLU A 34 18.397 31.959 -0.786 1.00 25.00 C ATOM 487 OE1 GLU A 34 19.261 31.255 -0.221 1.00 25.00 O ATOM 488 OE2 GLU A 34 17.552 31.483 -1.573 1.00 25.00 O ATOM 0 H GLU A 34 18.688 35.778 1.920 1.00 25.00 H new ATOM 0 HA GLU A 34 18.285 32.921 1.972 1.00 25.00 H new ATOM 0 HB2 GLU A 34 19.613 34.995 0.318 1.00 25.00 H new ATOM 0 HB3 GLU A 34 20.360 33.410 0.273 1.00 25.00 H new ATOM 0 HG2 GLU A 34 17.386 33.756 -0.184 1.00 25.00 H new ATOM 0 HG3 GLU A 34 18.537 33.986 -1.484 1.00 25.00 H new ATOM 495 N LEU A 35 21.042 34.225 3.181 1.00 25.00 N ATOM 496 CA LEU A 35 22.170 33.908 4.044 1.00 25.00 C ATOM 497 C LEU A 35 21.669 33.365 5.388 1.00 25.00 C ATOM 498 O LEU A 35 22.335 32.558 6.031 1.00 25.00 O ATOM 499 CB LEU A 35 23.073 35.125 4.165 1.00 25.00 C ATOM 500 CG LEU A 35 22.869 36.249 5.181 1.00 25.00 C ATOM 501 CD1 LEU A 35 23.128 35.872 6.632 1.00 25.00 C ATOM 502 CD2 LEU A 35 23.834 37.326 4.752 1.00 25.00 C ATOM 0 H LEU A 35 20.939 35.214 2.952 1.00 25.00 H new ATOM 0 HA LEU A 35 22.777 33.114 3.610 1.00 25.00 H new ATOM 0 HB2 LEU A 35 24.079 34.741 4.336 1.00 25.00 H new ATOM 0 HB3 LEU A 35 23.075 35.600 3.184 1.00 25.00 H new ATOM 0 HG LEU A 35 21.821 36.548 5.176 1.00 25.00 H new ATOM 0 HD11 LEU A 35 22.955 36.739 7.270 1.00 25.00 H new ATOM 0 HD12 LEU A 35 22.454 35.066 6.924 1.00 25.00 H new ATOM 0 HD13 LEU A 35 24.160 35.540 6.743 1.00 25.00 H new ATOM 0 HD21 LEU A 35 23.755 38.176 5.429 1.00 25.00 H new ATOM 0 HD22 LEU A 35 24.851 36.935 4.778 1.00 25.00 H new ATOM 0 HD23 LEU A 35 23.594 37.646 3.738 1.00 25.00 H new ATOM 514 N SER A 36 20.486 33.805 5.798 1.00 25.00 N ATOM 515 CA SER A 36 19.868 33.369 7.052 1.00 25.00 C ATOM 516 C SER A 36 19.315 31.953 6.943 1.00 25.00 C ATOM 517 O SER A 36 19.482 31.156 7.854 1.00 25.00 O ATOM 518 CB SER A 36 18.750 34.322 7.474 1.00 25.00 C ATOM 519 OG SER A 36 18.284 34.002 8.776 1.00 25.00 O ATOM 0 H SER A 36 19.924 34.475 5.273 1.00 25.00 H new ATOM 0 HA SER A 36 20.651 33.378 7.811 1.00 25.00 H new ATOM 0 HB2 SER A 36 19.114 35.349 7.455 1.00 25.00 H new ATOM 0 HB3 SER A 36 17.926 34.262 6.763 1.00 25.00 H new ATOM 0 HG SER A 36 17.570 34.623 9.030 1.00 25.00 H new ATOM 525 N LEU A 37 18.681 31.617 5.829 1.00 25.00 N ATOM 526 CA LEU A 37 18.168 30.257 5.650 1.00 25.00 C ATOM 527 C LEU A 37 19.315 29.321 5.531 1.00 25.00 C ATOM 528 O LEU A 37 19.247 28.174 5.904 1.00 25.00 O ATOM 529 CB LEU A 37 17.248 30.152 4.448 1.00 25.00 C ATOM 530 CG LEU A 37 17.669 30.185 2.969 1.00 25.00 C ATOM 531 CD1 LEU A 37 18.262 28.879 2.489 1.00 25.00 C ATOM 532 CD2 LEU A 37 16.436 30.520 2.127 1.00 25.00 C ATOM 0 H LEU A 37 18.509 32.249 5.047 1.00 25.00 H new ATOM 0 HA LEU A 37 17.569 29.991 6.521 1.00 25.00 H new ATOM 0 HB2 LEU A 37 16.706 29.215 4.576 1.00 25.00 H new ATOM 0 HB3 LEU A 37 16.524 30.958 4.563 1.00 25.00 H new ATOM 0 HG LEU A 37 18.448 30.940 2.863 1.00 25.00 H new ATOM 0 HD11 LEU A 37 18.538 28.969 1.438 1.00 25.00 H new ATOM 0 HD12 LEU A 37 19.148 28.644 3.078 1.00 25.00 H new ATOM 0 HD13 LEU A 37 17.528 28.082 2.604 1.00 25.00 H new ATOM 0 HD21 LEU A 37 16.712 30.549 1.073 1.00 25.00 H new ATOM 0 HD22 LEU A 37 15.672 29.758 2.281 1.00 25.00 H new ATOM 0 HD23 LEU A 37 16.044 31.492 2.426 1.00 25.00 H new ATOM 544 N LEU A 38 20.388 29.827 4.982 1.00 25.00 N ATOM 545 CA LEU A 38 21.566 29.032 4.811 1.00 25.00 C ATOM 546 C LEU A 38 22.189 28.647 6.142 1.00 25.00 C ATOM 547 O LEU A 38 22.507 27.494 6.350 1.00 25.00 O ATOM 548 CB LEU A 38 22.520 29.807 3.947 1.00 25.00 C ATOM 549 CG LEU A 38 23.745 29.006 3.504 1.00 25.00 C ATOM 550 CD1 LEU A 38 23.342 27.859 2.599 1.00 25.00 C ATOM 551 CD2 LEU A 38 24.736 29.901 2.808 1.00 25.00 C ATOM 0 H LEU A 38 20.466 30.787 4.647 1.00 25.00 H new ATOM 0 HA LEU A 38 21.310 28.090 4.326 1.00 25.00 H new ATOM 0 HB2 LEU A 38 21.989 30.160 3.063 1.00 25.00 H new ATOM 0 HB3 LEU A 38 22.853 30.690 4.492 1.00 25.00 H new ATOM 0 HG LEU A 38 24.217 28.589 4.393 1.00 25.00 H new ATOM 0 HD11 LEU A 38 24.230 27.304 2.297 1.00 25.00 H new ATOM 0 HD12 LEU A 38 22.664 27.194 3.134 1.00 25.00 H new ATOM 0 HD13 LEU A 38 22.842 28.252 1.714 1.00 25.00 H new ATOM 0 HD21 LEU A 38 25.602 29.315 2.499 1.00 25.00 H new ATOM 0 HD22 LEU A 38 24.269 30.348 1.930 1.00 25.00 H new ATOM 0 HD23 LEU A 38 25.056 30.689 3.490 1.00 25.00 H new ATOM 563 N LYS A 39 22.301 29.580 7.074 1.00 25.00 N ATOM 564 CA LYS A 39 22.781 29.225 8.424 1.00 25.00 C ATOM 565 C LYS A 39 21.759 28.400 9.206 1.00 25.00 C ATOM 566 O LYS A 39 22.134 27.614 10.060 1.00 25.00 O ATOM 567 CB LYS A 39 23.235 30.451 9.232 1.00 25.00 C ATOM 568 CG LYS A 39 22.246 31.608 9.279 1.00 25.00 C ATOM 569 CD LYS A 39 22.660 32.698 10.262 1.00 25.00 C ATOM 570 CE LYS A 39 23.873 33.479 9.754 1.00 25.00 C ATOM 571 NZ LYS A 39 24.246 34.586 10.695 1.00 25.00 N ATOM 0 H LYS A 39 22.076 30.566 6.939 1.00 25.00 H new ATOM 0 HA LYS A 39 23.659 28.598 8.270 1.00 25.00 H new ATOM 0 HB2 LYS A 39 23.445 30.134 10.253 1.00 25.00 H new ATOM 0 HB3 LYS A 39 24.173 30.814 8.812 1.00 25.00 H new ATOM 0 HG2 LYS A 39 22.151 32.040 8.283 1.00 25.00 H new ATOM 0 HG3 LYS A 39 21.263 31.229 9.557 1.00 25.00 H new ATOM 0 HD2 LYS A 39 21.826 33.382 10.421 1.00 25.00 H new ATOM 0 HD3 LYS A 39 22.893 32.249 11.228 1.00 25.00 H new ATOM 0 HE2 LYS A 39 24.719 32.802 9.633 1.00 25.00 H new ATOM 0 HE3 LYS A 39 23.654 33.894 8.770 1.00 25.00 H new ATOM 0 HZ1 LYS A 39 25.072 35.096 10.321 1.00 25.00 H new ATOM 0 HZ2 LYS A 39 23.447 35.245 10.791 1.00 25.00 H new ATOM 0 HZ3 LYS A 39 24.478 34.186 11.627 1.00 25.00 H new ATOM 585 N GLU A 40 20.484 28.550 8.882 1.00 25.00 N ATOM 586 CA GLU A 40 19.426 27.740 9.494 1.00 25.00 C ATOM 587 C GLU A 40 19.512 26.287 9.003 1.00 25.00 C ATOM 588 O GLU A 40 19.483 25.347 9.792 1.00 25.00 O ATOM 589 CB GLU A 40 18.060 28.340 9.112 1.00 25.00 C ATOM 590 CG GLU A 40 16.829 27.558 9.562 1.00 25.00 C ATOM 591 CD GLU A 40 15.562 28.084 8.891 1.00 25.00 C ATOM 592 OE1 GLU A 40 15.034 29.122 9.337 1.00 25.00 O ATOM 593 OE2 GLU A 40 15.123 27.486 7.873 1.00 25.00 O ATOM 0 H GLU A 40 20.149 29.227 8.196 1.00 25.00 H new ATOM 0 HA GLU A 40 19.546 27.744 10.577 1.00 25.00 H new ATOM 0 HB2 GLU A 40 17.999 29.345 9.530 1.00 25.00 H new ATOM 0 HB3 GLU A 40 18.023 28.443 8.028 1.00 25.00 H new ATOM 0 HG2 GLU A 40 16.958 26.502 9.323 1.00 25.00 H new ATOM 0 HG3 GLU A 40 16.726 27.629 10.645 1.00 25.00 H new ATOM 600 N ARG A 41 19.553 26.112 7.688 1.00 25.00 N ATOM 601 CA ARG A 41 19.453 24.775 7.076 1.00 25.00 C ATOM 602 C ARG A 41 20.767 24.073 6.775 1.00 25.00 C ATOM 603 O ARG A 41 20.827 22.848 6.747 1.00 25.00 O ATOM 604 CB ARG A 41 18.642 24.893 5.788 1.00 25.00 C ATOM 605 CG ARG A 41 17.300 25.520 6.064 1.00 25.00 C ATOM 606 CD ARG A 41 16.421 25.669 4.854 1.00 25.00 C ATOM 607 NE ARG A 41 15.288 26.524 5.235 1.00 25.00 N ATOM 608 CZ ARG A 41 14.333 26.962 4.431 1.00 25.00 C ATOM 609 NH1 ARG A 41 14.282 26.656 3.157 1.00 25.00 N ATOM 610 NH2 ARG A 41 13.417 27.735 4.936 1.00 25.00 N ATOM 0 H ARG A 41 19.655 26.874 7.017 1.00 25.00 H new ATOM 0 HA ARG A 41 18.972 24.148 7.827 1.00 25.00 H new ATOM 0 HB2 ARG A 41 19.188 25.494 5.061 1.00 25.00 H new ATOM 0 HB3 ARG A 41 18.505 23.906 5.346 1.00 25.00 H new ATOM 0 HG2 ARG A 41 16.777 24.916 6.805 1.00 25.00 H new ATOM 0 HG3 ARG A 41 17.457 26.504 6.507 1.00 25.00 H new ATOM 0 HD2 ARG A 41 16.977 26.114 4.029 1.00 25.00 H new ATOM 0 HD3 ARG A 41 16.069 24.695 4.513 1.00 25.00 H new ATOM 0 HE ARG A 41 15.233 26.807 6.213 1.00 25.00 H new ATOM 0 HH11 ARG A 41 14.998 26.056 2.747 1.00 25.00 H new ATOM 0 HH12 ARG A 41 13.526 27.017 2.576 1.00 25.00 H new ATOM 0 HH21 ARG A 41 13.449 27.986 5.924 1.00 25.00 H new ATOM 0 HH22 ARG A 41 12.666 28.090 4.344 1.00 25.00 H new ATOM 624 N ASN A 42 21.803 24.843 6.501 1.00 25.00 N ATOM 625 CA ASN A 42 23.123 24.289 6.153 1.00 25.00 C ATOM 626 C ASN A 42 24.289 24.985 6.863 1.00 25.00 C ATOM 627 O ASN A 42 25.090 25.677 6.218 1.00 25.00 O ATOM 628 CB ASN A 42 23.352 24.389 4.641 1.00 25.00 C ATOM 629 CG ASN A 42 24.403 23.423 4.158 1.00 25.00 C ATOM 630 OD1 ASN A 42 25.041 22.745 4.937 1.00 25.00 O ATOM 631 ND2 ASN A 42 24.573 23.344 2.874 1.00 25.00 N ATOM 0 H ASN A 42 21.768 25.862 6.510 1.00 25.00 H new ATOM 0 HA ASN A 42 23.106 23.251 6.486 1.00 25.00 H new ATOM 0 HB2 ASN A 42 22.415 24.194 4.120 1.00 25.00 H new ATOM 0 HB3 ASN A 42 23.652 25.406 4.387 1.00 25.00 H new ATOM 0 HD21 ASN A 42 25.261 22.696 2.490 1.00 25.00 H new ATOM 0 HD22 ASN A 42 24.019 23.929 2.249 1.00 25.00 H new ATOM 638 N PRO A 43 24.425 24.799 8.189 1.00 25.00 N ATOM 639 CA PRO A 43 25.537 25.503 8.843 1.00 25.00 C ATOM 640 C PRO A 43 26.970 25.306 8.285 1.00 25.00 C ATOM 641 O PRO A 43 27.709 26.285 8.228 1.00 25.00 O ATOM 642 CB PRO A 43 25.419 25.069 10.312 1.00 25.00 C ATOM 643 CG PRO A 43 24.576 23.836 10.299 1.00 25.00 C ATOM 644 CD PRO A 43 23.628 24.021 9.156 1.00 25.00 C ATOM 0 HA PRO A 43 25.428 26.572 8.661 1.00 25.00 H new ATOM 0 HB2 PRO A 43 26.400 24.869 10.742 1.00 25.00 H new ATOM 0 HB3 PRO A 43 24.960 25.851 10.916 1.00 25.00 H new ATOM 0 HG2 PRO A 43 25.186 22.943 10.164 1.00 25.00 H new ATOM 0 HG3 PRO A 43 24.039 23.716 11.240 1.00 25.00 H new ATOM 0 HD2 PRO A 43 23.307 23.066 8.739 1.00 25.00 H new ATOM 0 HD3 PRO A 43 22.728 24.555 9.460 1.00 25.00 H new ATOM 652 N PRO A 44 27.371 24.094 7.812 1.00 25.00 N ATOM 653 CA PRO A 44 28.749 24.110 7.293 1.00 25.00 C ATOM 654 C PRO A 44 28.971 24.919 5.997 1.00 25.00 C ATOM 655 O PRO A 44 30.045 25.474 5.791 1.00 25.00 O ATOM 656 CB PRO A 44 29.047 22.625 7.066 1.00 25.00 C ATOM 657 CG PRO A 44 27.742 22.035 6.771 1.00 25.00 C ATOM 658 CD PRO A 44 26.800 22.735 7.715 1.00 25.00 C ATOM 0 HA PRO A 44 29.411 24.615 7.996 1.00 25.00 H new ATOM 0 HB2 PRO A 44 29.744 22.481 6.241 1.00 25.00 H new ATOM 0 HB3 PRO A 44 29.499 22.171 7.948 1.00 25.00 H new ATOM 0 HG2 PRO A 44 27.457 22.197 5.731 1.00 25.00 H new ATOM 0 HG3 PRO A 44 27.745 20.958 6.937 1.00 25.00 H new ATOM 0 HD2 PRO A 44 25.781 22.753 7.328 1.00 25.00 H new ATOM 0 HD3 PRO A 44 26.764 22.243 8.687 1.00 25.00 H new ATOM 666 N LEU A 45 27.973 25.018 5.123 1.00 25.00 N ATOM 667 CA LEU A 45 28.132 25.863 3.933 1.00 25.00 C ATOM 668 C LEU A 45 28.005 27.317 4.354 1.00 25.00 C ATOM 669 O LEU A 45 28.666 28.205 3.817 1.00 25.00 O ATOM 670 CB LEU A 45 27.098 25.517 2.857 1.00 25.00 C ATOM 671 CG LEU A 45 27.162 26.322 1.536 1.00 25.00 C ATOM 672 CD1 LEU A 45 28.536 26.291 0.872 1.00 25.00 C ATOM 673 CD2 LEU A 45 26.133 25.759 0.557 1.00 25.00 C ATOM 0 H LEU A 45 27.074 24.544 5.206 1.00 25.00 H new ATOM 0 HA LEU A 45 29.115 25.686 3.496 1.00 25.00 H new ATOM 0 HB2 LEU A 45 27.202 24.459 2.615 1.00 25.00 H new ATOM 0 HB3 LEU A 45 26.105 25.649 3.286 1.00 25.00 H new ATOM 0 HG LEU A 45 26.950 27.361 1.790 1.00 25.00 H new ATOM 0 HD11 LEU A 45 28.509 26.875 -0.048 1.00 25.00 H new ATOM 0 HD12 LEU A 45 29.277 26.715 1.549 1.00 25.00 H new ATOM 0 HD13 LEU A 45 28.805 25.260 0.640 1.00 25.00 H new ATOM 0 HD21 LEU A 45 26.173 26.321 -0.376 1.00 25.00 H new ATOM 0 HD22 LEU A 45 26.355 24.711 0.358 1.00 25.00 H new ATOM 0 HD23 LEU A 45 25.136 25.843 0.989 1.00 25.00 H new ATOM 685 N ALA A 46 27.169 27.553 5.349 1.00 25.00 N ATOM 686 CA ALA A 46 26.976 28.895 5.857 1.00 25.00 C ATOM 687 C ALA A 46 28.240 29.456 6.492 1.00 25.00 C ATOM 688 O ALA A 46 28.609 30.570 6.189 1.00 25.00 O ATOM 689 CB ALA A 46 25.856 28.916 6.854 1.00 25.00 C ATOM 0 H ALA A 46 26.616 26.835 5.818 1.00 25.00 H new ATOM 0 HA ALA A 46 26.723 29.528 5.006 1.00 25.00 H new ATOM 0 HB1 ALA A 46 25.721 29.931 7.228 1.00 25.00 H new ATOM 0 HB2 ALA A 46 24.936 28.581 6.375 1.00 25.00 H new ATOM 0 HB3 ALA A 46 26.096 28.252 7.684 1.00 25.00 H new ATOM 695 N GLU A 47 28.888 28.713 7.380 1.00 25.00 N ATOM 696 CA GLU A 47 30.059 29.232 8.103 1.00 25.00 C ATOM 697 C GLU A 47 31.179 29.615 7.140 1.00 25.00 C ATOM 698 O GLU A 47 31.907 30.588 7.370 1.00 25.00 O ATOM 699 CB GLU A 47 30.552 28.237 9.164 1.00 25.00 C ATOM 700 CG GLU A 47 31.181 26.977 8.612 1.00 25.00 C ATOM 701 CD GLU A 47 31.584 26.010 9.701 1.00 25.00 C ATOM 702 OE1 GLU A 47 30.698 25.332 10.264 1.00 25.00 O ATOM 703 OE2 GLU A 47 32.799 25.926 9.992 1.00 25.00 O ATOM 0 H GLU A 47 28.631 27.756 7.621 1.00 25.00 H new ATOM 0 HA GLU A 47 29.747 30.137 8.624 1.00 25.00 H new ATOM 0 HB2 GLU A 47 31.279 28.739 9.802 1.00 25.00 H new ATOM 0 HB3 GLU A 47 29.711 27.958 9.798 1.00 25.00 H new ATOM 0 HG2 GLU A 47 30.478 26.488 7.938 1.00 25.00 H new ATOM 0 HG3 GLU A 47 32.058 27.241 8.021 1.00 25.00 H new ATOM 710 N ALA A 48 31.269 28.907 6.023 1.00 25.00 N ATOM 711 CA ALA A 48 32.195 29.245 4.980 1.00 25.00 C ATOM 712 C ALA A 48 31.909 30.639 4.415 1.00 25.00 C ATOM 713 O ALA A 48 32.819 31.448 4.243 1.00 25.00 O ATOM 714 CB ALA A 48 32.099 28.200 3.901 1.00 25.00 C ATOM 0 H ALA A 48 30.698 28.085 5.825 1.00 25.00 H new ATOM 0 HA ALA A 48 33.207 29.267 5.386 1.00 25.00 H new ATOM 0 HB1 ALA A 48 32.796 28.440 3.099 1.00 25.00 H new ATOM 0 HB2 ALA A 48 32.347 27.224 4.317 1.00 25.00 H new ATOM 0 HB3 ALA A 48 31.084 28.178 3.505 1.00 25.00 H new ATOM 720 N LEU A 49 30.637 30.922 4.181 1.00 25.00 N ATOM 721 CA LEU A 49 30.213 32.225 3.684 1.00 25.00 C ATOM 722 C LEU A 49 30.473 33.308 4.725 1.00 25.00 C ATOM 723 O LEU A 49 30.896 34.407 4.390 1.00 25.00 O ATOM 724 CB LEU A 49 28.713 32.194 3.378 1.00 25.00 C ATOM 725 CG LEU A 49 28.155 33.469 2.737 1.00 25.00 C ATOM 726 CD1 LEU A 49 28.363 33.416 1.237 1.00 25.00 C ATOM 727 CD2 LEU A 49 26.685 33.617 3.083 1.00 25.00 C ATOM 0 H LEU A 49 29.874 30.262 4.328 1.00 25.00 H new ATOM 0 HA LEU A 49 30.781 32.448 2.781 1.00 25.00 H new ATOM 0 HB2 LEU A 49 28.510 31.353 2.714 1.00 25.00 H new ATOM 0 HB3 LEU A 49 28.172 32.005 4.305 1.00 25.00 H new ATOM 0 HG LEU A 49 28.684 34.339 3.126 1.00 25.00 H new ATOM 0 HD11 LEU A 49 27.966 34.323 0.782 1.00 25.00 H new ATOM 0 HD12 LEU A 49 29.428 33.338 1.020 1.00 25.00 H new ATOM 0 HD13 LEU A 49 27.845 32.549 0.828 1.00 25.00 H new ATOM 0 HD21 LEU A 49 26.293 34.525 2.625 1.00 25.00 H new ATOM 0 HD22 LEU A 49 26.134 32.754 2.708 1.00 25.00 H new ATOM 0 HD23 LEU A 49 26.570 33.678 4.165 1.00 25.00 H new ATOM 739 N LEU A 50 30.205 32.996 5.988 1.00 25.00 N ATOM 740 CA LEU A 50 30.332 33.981 7.070 1.00 25.00 C ATOM 741 C LEU A 50 31.778 34.416 7.236 1.00 25.00 C ATOM 742 O LEU A 50 32.060 35.536 7.641 1.00 25.00 O ATOM 743 CB LEU A 50 29.846 33.415 8.416 1.00 25.00 C ATOM 744 CG LEU A 50 28.464 32.746 8.510 1.00 25.00 C ATOM 745 CD1 LEU A 50 28.076 32.561 9.960 1.00 25.00 C ATOM 746 CD2 LEU A 50 27.367 33.471 7.737 1.00 25.00 C ATOM 0 H LEU A 50 29.899 32.072 6.293 1.00 25.00 H new ATOM 0 HA LEU A 50 29.710 34.832 6.790 1.00 25.00 H new ATOM 0 HB2 LEU A 50 30.584 32.684 8.747 1.00 25.00 H new ATOM 0 HB3 LEU A 50 29.861 34.232 9.137 1.00 25.00 H new ATOM 0 HG LEU A 50 28.559 31.773 8.027 1.00 25.00 H new ATOM 0 HD11 LEU A 50 27.096 32.087 10.017 1.00 25.00 H new ATOM 0 HD12 LEU A 50 28.814 31.931 10.456 1.00 25.00 H new ATOM 0 HD13 LEU A 50 28.038 33.532 10.453 1.00 25.00 H new ATOM 0 HD21 LEU A 50 26.425 32.936 7.854 1.00 25.00 H new ATOM 0 HD22 LEU A 50 27.259 34.485 8.123 1.00 25.00 H new ATOM 0 HD23 LEU A 50 27.632 33.511 6.681 1.00 25.00 H new ATOM 758 N SER A 51 32.690 33.506 6.928 1.00 25.00 N ATOM 759 CA SER A 51 34.109 33.774 7.025 1.00 25.00 C ATOM 760 C SER A 51 34.587 34.670 5.880 1.00 25.00 C ATOM 761 O SER A 51 35.583 35.368 6.008 1.00 25.00 O ATOM 762 CB SER A 51 34.844 32.462 6.955 1.00 25.00 C ATOM 763 OG SER A 51 34.451 31.581 7.999 1.00 25.00 O ATOM 0 H SER A 51 32.464 32.565 6.605 1.00 25.00 H new ATOM 0 HA SER A 51 34.305 34.288 7.966 1.00 25.00 H new ATOM 0 HB2 SER A 51 34.655 31.990 5.991 1.00 25.00 H new ATOM 0 HB3 SER A 51 35.917 32.643 7.016 1.00 25.00 H new ATOM 0 HG SER A 51 33.561 31.220 7.805 1.00 25.00 H new ATOM 769 N GLY A 52 33.884 34.621 4.755 1.00 25.00 N ATOM 770 CA GLY A 52 34.187 35.479 3.619 1.00 25.00 C ATOM 771 C GLY A 52 35.098 34.839 2.593 1.00 25.00 C ATOM 772 O GLY A 52 35.116 35.240 1.431 1.00 25.00 O ATOM 0 H GLY A 52 33.095 33.991 4.606 1.00 25.00 H new ATOM 0 HA2 GLY A 52 33.254 35.766 3.134 1.00 25.00 H new ATOM 0 HA3 GLY A 52 34.652 36.395 3.982 1.00 25.00 H new ATOM 776 N ASP A 53 35.849 33.833 3.015 1.00 25.00 N ATOM 777 CA ASP A 53 36.765 33.134 2.117 1.00 25.00 C ATOM 778 C ASP A 53 36.000 32.379 1.034 1.00 25.00 C ATOM 779 O ASP A 53 35.209 31.477 1.318 1.00 25.00 O ATOM 780 CB ASP A 53 37.612 32.128 2.885 1.00 25.00 C ATOM 781 CG ASP A 53 38.730 31.555 2.049 1.00 25.00 C ATOM 782 OD1 ASP A 53 38.914 32.006 0.897 1.00 25.00 O ATOM 783 OD2 ASP A 53 39.354 30.585 2.506 1.00 25.00 O ATOM 0 H ASP A 53 35.845 33.480 3.972 1.00 25.00 H new ATOM 0 HA ASP A 53 37.404 33.890 1.660 1.00 25.00 H new ATOM 0 HB2 ASP A 53 38.033 32.611 3.767 1.00 25.00 H new ATOM 0 HB3 ASP A 53 36.975 31.317 3.239 1.00 25.00 H new ATOM 788 N LEU A 54 36.271 32.702 -0.217 1.00 25.00 N ATOM 789 CA LEU A 54 35.665 31.970 -1.313 1.00 25.00 C ATOM 790 C LEU A 54 36.167 30.540 -1.329 1.00 25.00 C ATOM 791 O LEU A 54 35.421 29.627 -1.632 1.00 25.00 O ATOM 792 CB LEU A 54 36.035 32.597 -2.651 1.00 25.00 C ATOM 793 CG LEU A 54 35.506 31.794 -3.854 1.00 25.00 C ATOM 794 CD1 LEU A 54 34.020 32.001 -4.071 1.00 25.00 C ATOM 795 CD2 LEU A 54 36.303 32.142 -5.045 1.00 25.00 C ATOM 0 H LEU A 54 36.898 33.456 -0.497 1.00 25.00 H new ATOM 0 HA LEU A 54 34.585 32.000 -1.168 1.00 25.00 H new ATOM 0 HB2 LEU A 54 35.638 33.611 -2.694 1.00 25.00 H new ATOM 0 HB3 LEU A 54 37.120 32.677 -2.722 1.00 25.00 H new ATOM 0 HG LEU A 54 35.621 30.729 -3.652 1.00 25.00 H new ATOM 0 HD11 LEU A 54 33.693 31.415 -4.930 1.00 25.00 H new ATOM 0 HD12 LEU A 54 33.475 31.680 -3.184 1.00 25.00 H new ATOM 0 HD13 LEU A 54 33.823 33.057 -4.256 1.00 25.00 H new ATOM 0 HD21 LEU A 54 35.938 31.579 -5.904 1.00 25.00 H new ATOM 0 HD22 LEU A 54 36.212 33.210 -5.245 1.00 25.00 H new ATOM 0 HD23 LEU A 54 37.350 31.895 -4.867 1.00 25.00 H new ATOM 807 N GLU A 55 37.446 30.343 -1.071 1.00 25.00 N ATOM 808 CA GLU A 55 38.050 29.032 -1.273 1.00 25.00 C ATOM 809 C GLU A 55 37.461 28.027 -0.303 1.00 25.00 C ATOM 810 O GLU A 55 37.272 26.857 -0.631 1.00 25.00 O ATOM 811 CB GLU A 55 39.569 29.133 -1.132 1.00 25.00 C ATOM 812 CG GLU A 55 40.105 30.317 -1.939 1.00 25.00 C ATOM 813 CD GLU A 55 41.531 30.141 -2.451 1.00 25.00 C ATOM 814 OE1 GLU A 55 41.932 30.953 -3.321 1.00 25.00 O ATOM 815 OE2 GLU A 55 42.253 29.238 -1.988 1.00 25.00 O ATOM 0 H GLU A 55 38.083 31.061 -0.726 1.00 25.00 H new ATOM 0 HA GLU A 55 37.829 28.682 -2.281 1.00 25.00 H new ATOM 0 HB2 GLU A 55 39.835 29.251 -0.082 1.00 25.00 H new ATOM 0 HB3 GLU A 55 40.034 28.210 -1.477 1.00 25.00 H new ATOM 0 HG2 GLU A 55 39.446 30.488 -2.790 1.00 25.00 H new ATOM 0 HG3 GLU A 55 40.063 31.212 -1.318 1.00 25.00 H new ATOM 822 N LYS A 56 37.060 28.511 0.862 1.00 25.00 N ATOM 823 CA LYS A 56 36.410 27.620 1.842 1.00 25.00 C ATOM 824 C LYS A 56 34.974 27.405 1.434 1.00 25.00 C ATOM 825 O LYS A 56 34.462 26.305 1.566 1.00 25.00 O ATOM 826 CB LYS A 56 36.531 28.078 3.319 1.00 25.00 C ATOM 827 CG LYS A 56 35.656 29.142 3.794 1.00 25.00 C ATOM 828 CD LYS A 56 36.185 29.669 5.135 1.00 25.00 C ATOM 829 CE LYS A 56 35.811 28.765 6.325 1.00 25.00 C ATOM 830 NZ LYS A 56 36.320 29.305 7.632 1.00 25.00 N ATOM 0 H LYS A 56 37.163 29.482 1.157 1.00 25.00 H new ATOM 0 HA LYS A 56 36.952 26.674 1.820 1.00 25.00 H new ATOM 0 HB2 LYS A 56 36.364 27.206 3.951 1.00 25.00 H new ATOM 0 HB3 LYS A 56 37.560 28.398 3.483 1.00 25.00 H new ATOM 0 HG2 LYS A 56 35.615 29.949 3.063 1.00 25.00 H new ATOM 0 HG3 LYS A 56 34.639 28.767 3.912 1.00 25.00 H new ATOM 0 HD2 LYS A 56 37.270 29.760 5.081 1.00 25.00 H new ATOM 0 HD3 LYS A 56 35.790 30.670 5.308 1.00 25.00 H new ATOM 0 HE2 LYS A 56 34.727 28.662 6.374 1.00 25.00 H new ATOM 0 HE3 LYS A 56 36.219 27.767 6.163 1.00 25.00 H new ATOM 0 HZ1 LYS A 56 36.242 28.571 8.365 1.00 25.00 H new ATOM 0 HZ2 LYS A 56 37.316 29.586 7.527 1.00 25.00 H new ATOM 0 HZ3 LYS A 56 35.754 30.132 7.910 1.00 25.00 H new ATOM 844 N PHE A 57 34.345 28.436 0.882 1.00 25.00 N ATOM 845 CA PHE A 57 32.968 28.338 0.405 1.00 25.00 C ATOM 846 C PHE A 57 32.872 27.344 -0.744 1.00 25.00 C ATOM 847 O PHE A 57 32.030 26.471 -0.728 1.00 25.00 O ATOM 848 CB PHE A 57 32.457 29.725 -0.009 1.00 25.00 C ATOM 849 CG PHE A 57 31.030 29.728 -0.472 1.00 25.00 C ATOM 850 CD1 PHE A 57 30.724 29.688 -1.846 1.00 25.00 C ATOM 851 CD2 PHE A 57 29.978 29.773 0.461 1.00 25.00 C ATOM 852 CE1 PHE A 57 29.380 29.679 -2.287 1.00 25.00 C ATOM 853 CE2 PHE A 57 28.629 29.771 0.029 1.00 25.00 C ATOM 854 CZ PHE A 57 28.335 29.723 -1.350 1.00 25.00 C ATOM 0 H PHE A 57 34.768 29.355 0.753 1.00 25.00 H new ATOM 0 HA PHE A 57 32.335 27.970 1.213 1.00 25.00 H new ATOM 0 HB2 PHE A 57 32.557 30.406 0.836 1.00 25.00 H new ATOM 0 HB3 PHE A 57 33.090 30.112 -0.808 1.00 25.00 H new ATOM 0 HD1 PHE A 57 31.524 29.664 -2.571 1.00 25.00 H new ATOM 0 HD2 PHE A 57 30.201 29.809 1.517 1.00 25.00 H new ATOM 0 HE1 PHE A 57 29.158 29.638 -3.343 1.00 25.00 H new ATOM 0 HE2 PHE A 57 27.828 29.806 0.753 1.00 25.00 H new ATOM 0 HZ PHE A 57 27.308 29.720 -1.684 1.00 25.00 H new ATOM 864 N SER A 58 33.775 27.441 -1.704 1.00 25.00 N ATOM 865 CA SER A 58 33.816 26.536 -2.847 1.00 25.00 C ATOM 866 C SER A 58 34.137 25.108 -2.422 1.00 25.00 C ATOM 867 O SER A 58 33.588 24.153 -2.968 1.00 25.00 O ATOM 868 CB SER A 58 34.884 27.010 -3.832 1.00 25.00 C ATOM 869 OG SER A 58 34.857 26.244 -5.022 1.00 25.00 O ATOM 0 H SER A 58 34.506 28.153 -1.716 1.00 25.00 H new ATOM 0 HA SER A 58 32.831 26.543 -3.314 1.00 25.00 H new ATOM 0 HB2 SER A 58 34.723 28.062 -4.069 1.00 25.00 H new ATOM 0 HB3 SER A 58 35.868 26.935 -3.370 1.00 25.00 H new ATOM 0 HG SER A 58 35.549 26.568 -5.636 1.00 25.00 H new ATOM 875 N ARG A 59 35.021 24.961 -1.447 1.00 25.00 N ATOM 876 CA ARG A 59 35.423 23.631 -0.981 1.00 25.00 C ATOM 877 C ARG A 59 34.235 22.926 -0.361 1.00 25.00 C ATOM 878 O ARG A 59 33.926 21.796 -0.709 1.00 25.00 O ATOM 879 CB ARG A 59 36.560 23.739 0.045 1.00 25.00 C ATOM 880 CG ARG A 59 36.992 22.399 0.654 1.00 25.00 C ATOM 881 CD ARG A 59 37.083 22.504 2.169 1.00 25.00 C ATOM 882 NE ARG A 59 36.957 21.188 2.805 1.00 25.00 N ATOM 883 CZ ARG A 59 37.093 20.933 4.098 1.00 25.00 C ATOM 884 NH1 ARG A 59 37.409 21.860 4.972 1.00 25.00 N ATOM 885 NH2 ARG A 59 36.900 19.719 4.513 1.00 25.00 N ATOM 0 H ARG A 59 35.474 25.736 -0.963 1.00 25.00 H new ATOM 0 HA ARG A 59 35.781 23.055 -1.835 1.00 25.00 H new ATOM 0 HB2 ARG A 59 37.423 24.202 -0.434 1.00 25.00 H new ATOM 0 HB3 ARG A 59 36.246 24.405 0.849 1.00 25.00 H new ATOM 0 HG2 ARG A 59 36.278 21.622 0.380 1.00 25.00 H new ATOM 0 HG3 ARG A 59 37.958 22.103 0.246 1.00 25.00 H new ATOM 0 HD2 ARG A 59 38.036 22.955 2.447 1.00 25.00 H new ATOM 0 HD3 ARG A 59 36.298 23.165 2.537 1.00 25.00 H new ATOM 0 HE ARG A 59 36.745 20.397 2.196 1.00 25.00 H new ATOM 0 HH11 ARG A 59 37.560 22.821 4.664 1.00 25.00 H new ATOM 0 HH12 ARG A 59 37.503 21.620 5.959 1.00 25.00 H new ATOM 0 HH21 ARG A 59 36.650 18.987 3.849 1.00 25.00 H new ATOM 0 HH22 ARG A 59 36.999 19.497 5.504 1.00 25.00 H new ATOM 899 N VAL A 60 33.551 23.592 0.550 1.00 25.00 N ATOM 900 CA VAL A 60 32.430 22.962 1.224 1.00 25.00 C ATOM 901 C VAL A 60 31.283 22.791 0.221 1.00 25.00 C ATOM 902 O VAL A 60 30.517 21.845 0.313 1.00 25.00 O ATOM 903 CB VAL A 60 32.024 23.736 2.520 1.00 25.00 C ATOM 904 CG1 VAL A 60 31.482 25.079 2.211 1.00 25.00 C ATOM 905 CG2 VAL A 60 31.030 22.924 3.352 1.00 25.00 C ATOM 0 H VAL A 60 33.746 24.551 0.837 1.00 25.00 H new ATOM 0 HA VAL A 60 32.716 21.970 1.575 1.00 25.00 H new ATOM 0 HB VAL A 60 32.929 23.879 3.111 1.00 25.00 H new ATOM 0 HG11 VAL A 60 31.212 25.584 3.138 1.00 25.00 H new ATOM 0 HG12 VAL A 60 32.237 25.664 1.686 1.00 25.00 H new ATOM 0 HG13 VAL A 60 30.598 24.979 1.581 1.00 25.00 H new ATOM 0 HG21 VAL A 60 30.763 23.484 4.248 1.00 25.00 H new ATOM 0 HG22 VAL A 60 30.133 22.733 2.763 1.00 25.00 H new ATOM 0 HG23 VAL A 60 31.485 21.976 3.639 1.00 25.00 H new ATOM 915 N LEU A 61 31.188 23.678 -0.766 1.00 25.00 N ATOM 916 CA LEU A 61 30.144 23.577 -1.786 1.00 25.00 C ATOM 917 C LEU A 61 30.263 22.274 -2.568 1.00 25.00 C ATOM 918 O LEU A 61 29.272 21.571 -2.755 1.00 25.00 O ATOM 919 CB LEU A 61 30.232 24.763 -2.757 1.00 25.00 C ATOM 920 CG LEU A 61 28.999 25.005 -3.642 1.00 25.00 C ATOM 921 CD1 LEU A 61 28.169 26.112 -3.032 1.00 25.00 C ATOM 922 CD2 LEU A 61 29.365 25.418 -5.059 1.00 25.00 C ATOM 0 H LEU A 61 31.818 24.472 -0.882 1.00 25.00 H new ATOM 0 HA LEU A 61 29.180 23.592 -1.277 1.00 25.00 H new ATOM 0 HB2 LEU A 61 30.422 25.667 -2.178 1.00 25.00 H new ATOM 0 HB3 LEU A 61 31.095 24.612 -3.405 1.00 25.00 H new ATOM 0 HG LEU A 61 28.450 24.065 -3.695 1.00 25.00 H new ATOM 0 HD11 LEU A 61 27.291 26.292 -3.652 1.00 25.00 H new ATOM 0 HD12 LEU A 61 27.852 25.820 -2.031 1.00 25.00 H new ATOM 0 HD13 LEU A 61 28.765 27.023 -2.973 1.00 25.00 H new ATOM 0 HD21 LEU A 61 28.455 25.575 -5.639 1.00 25.00 H new ATOM 0 HD22 LEU A 61 29.942 26.342 -5.031 1.00 25.00 H new ATOM 0 HD23 LEU A 61 29.960 24.633 -5.525 1.00 25.00 H new ATOM 934 N VAL A 62 31.461 21.936 -3.023 1.00 25.00 N ATOM 935 CA VAL A 62 31.639 20.714 -3.809 1.00 25.00 C ATOM 936 C VAL A 62 31.532 19.481 -2.906 1.00 25.00 C ATOM 937 O VAL A 62 30.965 18.471 -3.302 1.00 25.00 O ATOM 938 CB VAL A 62 32.968 20.739 -4.648 1.00 25.00 C ATOM 939 CG1 VAL A 62 34.226 20.693 -3.770 1.00 25.00 C ATOM 940 CG2 VAL A 62 32.984 19.587 -5.642 1.00 25.00 C ATOM 0 H VAL A 62 32.312 22.476 -2.868 1.00 25.00 H new ATOM 0 HA VAL A 62 30.832 20.657 -4.540 1.00 25.00 H new ATOM 0 HB VAL A 62 32.986 21.688 -5.183 1.00 25.00 H new ATOM 0 HG11 VAL A 62 35.113 20.713 -4.404 1.00 25.00 H new ATOM 0 HG12 VAL A 62 34.237 21.556 -3.104 1.00 25.00 H new ATOM 0 HG13 VAL A 62 34.223 19.778 -3.178 1.00 25.00 H new ATOM 0 HG21 VAL A 62 33.910 19.615 -6.217 1.00 25.00 H new ATOM 0 HG22 VAL A 62 32.920 18.641 -5.104 1.00 25.00 H new ATOM 0 HG23 VAL A 62 32.134 19.678 -6.318 1.00 25.00 H new ATOM 950 N GLU A 63 31.998 19.580 -1.672 1.00 25.00 N ATOM 951 CA GLU A 63 31.868 18.470 -0.717 1.00 25.00 C ATOM 952 C GLU A 63 30.396 18.167 -0.430 1.00 25.00 C ATOM 953 O GLU A 63 29.985 17.008 -0.407 1.00 25.00 O ATOM 954 CB GLU A 63 32.580 18.807 0.593 1.00 25.00 C ATOM 955 CG GLU A 63 34.098 18.725 0.499 1.00 25.00 C ATOM 956 CD GLU A 63 34.781 19.068 1.809 1.00 25.00 C ATOM 957 OE1 GLU A 63 35.948 18.658 1.997 1.00 25.00 O ATOM 958 OE2 GLU A 63 34.191 19.799 2.634 1.00 25.00 O ATOM 0 H GLU A 63 32.467 20.406 -1.301 1.00 25.00 H new ATOM 0 HA GLU A 63 32.330 17.590 -1.164 1.00 25.00 H new ATOM 0 HB2 GLU A 63 32.297 19.813 0.902 1.00 25.00 H new ATOM 0 HB3 GLU A 63 32.235 18.125 1.370 1.00 25.00 H new ATOM 0 HG2 GLU A 63 34.386 17.718 0.196 1.00 25.00 H new ATOM 0 HG3 GLU A 63 34.448 19.405 -0.278 1.00 25.00 H new ATOM 965 N GLN A 64 29.593 19.210 -0.255 1.00 25.00 N ATOM 966 CA GLN A 64 28.158 19.043 -0.030 1.00 25.00 C ATOM 967 C GLN A 64 27.523 18.340 -1.221 1.00 25.00 C ATOM 968 O GLN A 64 26.679 17.465 -1.053 1.00 25.00 O ATOM 969 CB GLN A 64 27.480 20.407 0.155 1.00 25.00 C ATOM 970 CG GLN A 64 27.690 21.036 1.531 1.00 25.00 C ATOM 971 CD GLN A 64 26.754 20.474 2.572 1.00 25.00 C ATOM 972 OE1 GLN A 64 25.539 20.480 2.395 1.00 25.00 O ATOM 973 NE2 GLN A 64 27.300 20.005 3.662 1.00 25.00 N ATOM 0 H GLN A 64 29.908 20.180 -0.264 1.00 25.00 H new ATOM 0 HA GLN A 64 28.023 18.445 0.871 1.00 25.00 H new ATOM 0 HB2 GLN A 64 27.856 21.092 -0.605 1.00 25.00 H new ATOM 0 HB3 GLN A 64 26.410 20.294 -0.019 1.00 25.00 H new ATOM 0 HG2 GLN A 64 28.720 20.874 1.848 1.00 25.00 H new ATOM 0 HG3 GLN A 64 27.544 22.114 1.460 1.00 25.00 H new ATOM 0 HE21 GLN A 64 28.314 20.018 3.771 1.00 25.00 H new ATOM 0 HE22 GLN A 64 26.712 19.626 4.404 1.00 25.00 H new ATOM 982 N GLN A 65 27.927 18.712 -2.425 1.00 25.00 N ATOM 983 CA GLN A 65 27.372 18.088 -3.624 1.00 25.00 C ATOM 984 C GLN A 65 27.796 16.623 -3.730 1.00 25.00 C ATOM 985 O GLN A 65 26.995 15.780 -4.118 1.00 25.00 O ATOM 986 CB GLN A 65 27.787 18.861 -4.879 1.00 25.00 C ATOM 987 CG GLN A 65 27.136 20.237 -4.970 1.00 25.00 C ATOM 988 CD GLN A 65 27.472 20.955 -6.255 1.00 25.00 C ATOM 989 OE1 GLN A 65 26.914 20.659 -7.290 1.00 25.00 O ATOM 990 NE2 GLN A 65 28.360 21.914 -6.184 1.00 25.00 N ATOM 0 H GLN A 65 28.627 19.432 -2.601 1.00 25.00 H new ATOM 0 HA GLN A 65 26.285 18.119 -3.544 1.00 25.00 H new ATOM 0 HB2 GLN A 65 28.871 18.976 -4.887 1.00 25.00 H new ATOM 0 HB3 GLN A 65 27.522 18.280 -5.762 1.00 25.00 H new ATOM 0 HG2 GLN A 65 26.054 20.129 -4.891 1.00 25.00 H new ATOM 0 HG3 GLN A 65 27.458 20.844 -4.124 1.00 25.00 H new ATOM 0 HE21 GLN A 65 28.806 22.131 -5.293 1.00 25.00 H new ATOM 0 HE22 GLN A 65 28.606 22.444 -7.020 1.00 25.00 H new ATOM 999 N GLN A 66 29.024 16.304 -3.345 1.00 25.00 N ATOM 1000 CA GLN A 66 29.491 14.916 -3.387 1.00 25.00 C ATOM 1001 C GLN A 66 28.786 14.039 -2.352 1.00 25.00 C ATOM 1002 O GLN A 66 28.452 12.897 -2.644 1.00 25.00 O ATOM 1003 CB GLN A 66 31.002 14.847 -3.172 1.00 25.00 C ATOM 1004 CG GLN A 66 31.806 15.365 -4.359 1.00 25.00 C ATOM 1005 CD GLN A 66 33.292 15.203 -4.153 1.00 25.00 C ATOM 1006 OE1 GLN A 66 33.814 14.103 -4.182 1.00 25.00 O ATOM 1007 NE2 GLN A 66 33.973 16.293 -3.927 1.00 25.00 N ATOM 0 H GLN A 66 29.712 16.975 -3.003 1.00 25.00 H new ATOM 0 HA GLN A 66 29.246 14.532 -4.377 1.00 25.00 H new ATOM 0 HB2 GLN A 66 31.262 15.426 -2.286 1.00 25.00 H new ATOM 0 HB3 GLN A 66 31.287 13.814 -2.973 1.00 25.00 H new ATOM 0 HG2 GLN A 66 31.505 14.831 -5.260 1.00 25.00 H new ATOM 0 HG3 GLN A 66 31.576 16.418 -4.520 1.00 25.00 H new ATOM 0 HE21 GLN A 66 33.499 17.196 -3.911 1.00 25.00 H new ATOM 0 HE22 GLN A 66 34.979 16.242 -3.767 1.00 25.00 H new ATOM 1016 N ASP A 67 28.521 14.557 -1.160 1.00 25.00 N ATOM 1017 CA ASP A 67 27.796 13.768 -0.154 1.00 25.00 C ATOM 1018 C ASP A 67 26.367 13.533 -0.610 1.00 25.00 C ATOM 1019 O ASP A 67 25.805 12.451 -0.437 1.00 25.00 O ATOM 1020 CB ASP A 67 27.742 14.474 1.188 1.00 25.00 C ATOM 1021 CG ASP A 67 27.139 13.593 2.278 1.00 25.00 C ATOM 1022 OD1 ASP A 67 26.120 14.007 2.876 1.00 25.00 O ATOM 1023 OD2 ASP A 67 27.646 12.462 2.502 1.00 25.00 O ATOM 0 H ASP A 67 28.786 15.496 -0.864 1.00 25.00 H new ATOM 0 HA ASP A 67 28.333 12.826 -0.042 1.00 25.00 H new ATOM 0 HB2 ASP A 67 28.749 14.773 1.480 1.00 25.00 H new ATOM 0 HB3 ASP A 67 27.153 15.386 1.093 1.00 25.00 H new ATOM 1028 N ARG A 68 25.785 14.538 -1.246 1.00 25.00 N ATOM 1029 CA ARG A 68 24.451 14.368 -1.813 1.00 25.00 C ATOM 1030 C ARG A 68 24.535 13.275 -2.856 1.00 25.00 C ATOM 1031 O ARG A 68 23.776 12.336 -2.811 1.00 25.00 O ATOM 1032 CB ARG A 68 23.921 15.652 -2.451 1.00 25.00 C ATOM 1033 CG ARG A 68 23.510 16.717 -1.460 1.00 25.00 C ATOM 1034 CD ARG A 68 23.115 17.980 -2.202 1.00 25.00 C ATOM 1035 NE ARG A 68 22.885 19.110 -1.287 1.00 25.00 N ATOM 1036 CZ ARG A 68 22.379 20.287 -1.641 1.00 25.00 C ATOM 1037 NH1 ARG A 68 22.013 20.552 -2.873 1.00 25.00 N ATOM 1038 NH2 ARG A 68 22.237 21.215 -0.735 1.00 25.00 N ATOM 0 H ARG A 68 26.201 15.460 -1.382 1.00 25.00 H new ATOM 0 HA ARG A 68 23.758 14.107 -1.013 1.00 25.00 H new ATOM 0 HB2 ARG A 68 24.689 16.061 -3.108 1.00 25.00 H new ATOM 0 HB3 ARG A 68 23.064 15.405 -3.077 1.00 25.00 H new ATOM 0 HG2 ARG A 68 22.675 16.362 -0.856 1.00 25.00 H new ATOM 0 HG3 ARG A 68 24.332 16.928 -0.776 1.00 25.00 H new ATOM 0 HD2 ARG A 68 23.899 18.243 -2.912 1.00 25.00 H new ATOM 0 HD3 ARG A 68 22.210 17.792 -2.780 1.00 25.00 H new ATOM 0 HE ARG A 68 23.133 18.980 -0.306 1.00 25.00 H new ATOM 0 HH11 ARG A 68 22.113 19.842 -3.599 1.00 25.00 H new ATOM 0 HH12 ARG A 68 21.629 21.468 -3.105 1.00 25.00 H new ATOM 0 HH21 ARG A 68 22.513 21.032 0.230 1.00 25.00 H new ATOM 0 HH22 ARG A 68 21.850 22.123 -0.992 1.00 25.00 H new ATOM 1052 N ALA A 69 25.492 13.362 -3.763 1.00 25.00 N ATOM 1053 CA ALA A 69 25.628 12.355 -4.807 1.00 25.00 C ATOM 1054 C ALA A 69 25.772 10.944 -4.221 1.00 25.00 C ATOM 1055 O ALA A 69 25.199 9.996 -4.747 1.00 25.00 O ATOM 1056 CB ALA A 69 26.823 12.690 -5.710 1.00 25.00 C ATOM 0 H ALA A 69 26.182 14.112 -3.800 1.00 25.00 H new ATOM 0 HA ALA A 69 24.716 12.367 -5.404 1.00 25.00 H new ATOM 0 HB1 ALA A 69 26.916 11.931 -6.487 1.00 25.00 H new ATOM 0 HB2 ALA A 69 26.668 13.665 -6.172 1.00 25.00 H new ATOM 0 HB3 ALA A 69 27.735 12.712 -5.113 1.00 25.00 H new ATOM 1062 N ARG A 70 26.507 10.799 -3.125 1.00 25.00 N ATOM 1063 CA ARG A 70 26.719 9.487 -2.533 1.00 25.00 C ATOM 1064 C ARG A 70 25.417 8.907 -1.962 1.00 25.00 C ATOM 1065 O ARG A 70 25.158 7.724 -2.119 1.00 25.00 O ATOM 1066 CB ARG A 70 27.861 9.570 -1.494 1.00 25.00 C ATOM 1067 CG ARG A 70 27.442 9.558 -0.046 1.00 25.00 C ATOM 1068 CD ARG A 70 28.619 9.351 0.879 1.00 25.00 C ATOM 1069 NE ARG A 70 28.146 9.182 2.260 1.00 25.00 N ATOM 1070 CZ ARG A 70 27.721 8.039 2.792 1.00 25.00 C ATOM 1071 NH1 ARG A 70 27.689 6.912 2.117 1.00 25.00 N ATOM 1072 NH2 ARG A 70 27.309 8.028 4.028 1.00 25.00 N ATOM 0 H ARG A 70 26.962 11.568 -2.633 1.00 25.00 H new ATOM 0 HA ARG A 70 27.029 8.785 -3.307 1.00 25.00 H new ATOM 0 HB2 ARG A 70 28.539 8.733 -1.662 1.00 25.00 H new ATOM 0 HB3 ARG A 70 28.428 10.482 -1.680 1.00 25.00 H new ATOM 0 HG2 ARG A 70 26.950 10.500 0.197 1.00 25.00 H new ATOM 0 HG3 ARG A 70 26.711 8.766 0.114 1.00 25.00 H new ATOM 0 HD2 ARG A 70 29.186 8.473 0.570 1.00 25.00 H new ATOM 0 HD3 ARG A 70 29.295 10.204 0.819 1.00 25.00 H new ATOM 0 HE ARG A 70 28.143 10.008 2.859 1.00 25.00 H new ATOM 0 HH11 ARG A 70 27.998 6.891 1.145 1.00 25.00 H new ATOM 0 HH12 ARG A 70 27.355 6.059 2.565 1.00 25.00 H new ATOM 0 HH21 ARG A 70 27.315 8.889 4.575 1.00 25.00 H new ATOM 0 HH22 ARG A 70 26.981 7.159 4.448 1.00 25.00 H new ATOM 1086 N ARG A 71 24.599 9.728 -1.314 1.00 25.00 N ATOM 1087 CA ARG A 71 23.334 9.240 -0.739 1.00 25.00 C ATOM 1088 C ARG A 71 22.221 9.138 -1.781 1.00 25.00 C ATOM 1089 O ARG A 71 21.334 8.299 -1.678 1.00 25.00 O ATOM 1090 CB ARG A 71 22.903 10.127 0.433 1.00 25.00 C ATOM 1091 CG ARG A 71 22.248 11.412 0.018 1.00 25.00 C ATOM 1092 CD ARG A 71 22.073 12.386 1.130 1.00 25.00 C ATOM 1093 NE ARG A 71 21.317 13.524 0.598 1.00 25.00 N ATOM 1094 CZ ARG A 71 21.058 14.649 1.242 1.00 25.00 C ATOM 1095 NH1 ARG A 71 21.476 14.875 2.463 1.00 25.00 N ATOM 1096 NH2 ARG A 71 20.359 15.563 0.627 1.00 25.00 N ATOM 0 H ARG A 71 24.778 10.722 -1.170 1.00 25.00 H new ATOM 0 HA ARG A 71 23.515 8.230 -0.371 1.00 25.00 H new ATOM 0 HB2 ARG A 71 22.213 9.567 1.064 1.00 25.00 H new ATOM 0 HB3 ARG A 71 23.777 10.357 1.042 1.00 25.00 H new ATOM 0 HG2 ARG A 71 22.845 11.876 -0.767 1.00 25.00 H new ATOM 0 HG3 ARG A 71 21.272 11.188 -0.413 1.00 25.00 H new ATOM 0 HD2 ARG A 71 21.541 11.927 1.963 1.00 25.00 H new ATOM 0 HD3 ARG A 71 23.041 12.712 1.511 1.00 25.00 H new ATOM 0 HE ARG A 71 20.959 13.440 -0.353 1.00 25.00 H new ATOM 0 HH11 ARG A 71 22.024 14.168 2.953 1.00 25.00 H new ATOM 0 HH12 ARG A 71 21.253 15.758 2.923 1.00 25.00 H new ATOM 0 HH21 ARG A 71 20.029 15.399 -0.324 1.00 25.00 H new ATOM 0 HH22 ARG A 71 20.143 16.442 1.097 1.00 25.00 H new ATOM 1110 N GLU A 72 22.265 9.996 -2.790 1.00 25.00 N ATOM 1111 CA GLU A 72 21.249 9.977 -3.845 1.00 25.00 C ATOM 1112 C GLU A 72 21.382 8.666 -4.619 1.00 25.00 C ATOM 1113 O GLU A 72 20.390 8.105 -5.047 1.00 25.00 O ATOM 1114 CB GLU A 72 21.376 11.151 -4.831 1.00 25.00 C ATOM 1115 CG GLU A 72 21.040 12.593 -4.320 1.00 25.00 C ATOM 1116 CD GLU A 72 20.070 12.677 -3.132 1.00 25.00 C ATOM 1117 OE1 GLU A 72 20.444 13.275 -2.087 1.00 25.00 O ATOM 1118 OE2 GLU A 72 18.911 12.238 -3.255 1.00 25.00 O ATOM 0 H GLU A 72 22.984 10.710 -2.905 1.00 25.00 H new ATOM 0 HA GLU A 72 20.276 10.069 -3.363 1.00 25.00 H new ATOM 0 HB2 GLU A 72 22.400 11.161 -5.205 1.00 25.00 H new ATOM 0 HB3 GLU A 72 20.728 10.941 -5.682 1.00 25.00 H new ATOM 0 HG2 GLU A 72 21.972 13.083 -4.038 1.00 25.00 H new ATOM 0 HG3 GLU A 72 20.618 13.162 -5.149 1.00 25.00 H new ATOM 1125 N GLN A 73 22.597 8.142 -4.728 1.00 25.00 N ATOM 1126 CA GLN A 73 22.821 6.831 -5.367 1.00 25.00 C ATOM 1127 C GLN A 73 22.001 5.721 -4.703 1.00 25.00 C ATOM 1128 O GLN A 73 21.533 4.799 -5.364 1.00 25.00 O ATOM 1129 CB GLN A 73 24.298 6.439 -5.291 1.00 25.00 C ATOM 1130 CG GLN A 73 25.176 7.105 -6.327 1.00 25.00 C ATOM 1131 CD GLN A 73 26.646 6.873 -6.055 1.00 25.00 C ATOM 1132 OE1 GLN A 73 27.109 5.743 -6.005 1.00 25.00 O ATOM 1133 NE2 GLN A 73 27.382 7.936 -5.869 1.00 25.00 N ATOM 0 H GLN A 73 23.445 8.595 -4.387 1.00 25.00 H new ATOM 0 HA GLN A 73 22.506 6.936 -6.405 1.00 25.00 H new ATOM 0 HB2 GLN A 73 24.676 6.686 -4.299 1.00 25.00 H new ATOM 0 HB3 GLN A 73 24.381 5.358 -5.403 1.00 25.00 H new ATOM 0 HG2 GLN A 73 24.925 6.722 -7.316 1.00 25.00 H new ATOM 0 HG3 GLN A 73 24.974 8.176 -6.340 1.00 25.00 H new ATOM 0 HE21 GLN A 73 26.960 8.863 -5.918 1.00 25.00 H new ATOM 0 HE22 GLN A 73 28.379 7.839 -5.674 1.00 25.00 H new ATOM 1142 N GLU A 74 21.833 5.803 -3.394 1.00 25.00 N ATOM 1143 CA GLU A 74 21.035 4.818 -2.671 1.00 25.00 C ATOM 1144 C GLU A 74 19.555 5.066 -2.921 1.00 25.00 C ATOM 1145 O GLU A 74 18.760 4.137 -3.032 1.00 25.00 O ATOM 1146 CB GLU A 74 21.327 4.912 -1.165 1.00 25.00 C ATOM 1147 CG GLU A 74 22.817 4.804 -0.813 1.00 25.00 C ATOM 1148 CD GLU A 74 23.083 5.028 0.671 1.00 25.00 C ATOM 1149 OE1 GLU A 74 22.778 6.132 1.178 1.00 25.00 O ATOM 1150 OE2 GLU A 74 23.636 4.115 1.323 1.00 25.00 O ATOM 0 H GLU A 74 22.235 6.536 -2.810 1.00 25.00 H new ATOM 0 HA GLU A 74 21.297 3.821 -3.026 1.00 25.00 H new ATOM 0 HB2 GLU A 74 20.943 5.860 -0.789 1.00 25.00 H new ATOM 0 HB3 GLU A 74 20.783 4.120 -0.649 1.00 25.00 H new ATOM 0 HG2 GLU A 74 23.185 3.819 -1.100 1.00 25.00 H new ATOM 0 HG3 GLU A 74 23.378 5.536 -1.394 1.00 25.00 H new ATOM 1157 N ARG A 75 19.188 6.332 -3.018 1.00 25.00 N ATOM 1158 CA ARG A 75 17.792 6.719 -3.217 1.00 25.00 C ATOM 1159 C ARG A 75 17.263 6.401 -4.603 1.00 25.00 C ATOM 1160 O ARG A 75 16.133 5.961 -4.714 1.00 25.00 O ATOM 1161 CB ARG A 75 17.630 8.208 -2.957 1.00 25.00 C ATOM 1162 CG ARG A 75 17.747 8.579 -1.495 1.00 25.00 C ATOM 1163 CD ARG A 75 17.846 10.068 -1.385 1.00 25.00 C ATOM 1164 NE ARG A 75 17.622 10.568 -0.025 1.00 25.00 N ATOM 1165 CZ ARG A 75 17.572 11.853 0.302 1.00 25.00 C ATOM 1166 NH1 ARG A 75 17.757 12.805 -0.578 1.00 25.00 N ATOM 1167 NH2 ARG A 75 17.321 12.185 1.539 1.00 25.00 N ATOM 0 H ARG A 75 19.837 7.117 -2.963 1.00 25.00 H new ATOM 0 HA ARG A 75 17.209 6.129 -2.509 1.00 25.00 H new ATOM 0 HB2 ARG A 75 18.385 8.753 -3.524 1.00 25.00 H new ATOM 0 HB3 ARG A 75 16.658 8.531 -3.329 1.00 25.00 H new ATOM 0 HG2 ARG A 75 16.880 8.216 -0.942 1.00 25.00 H new ATOM 0 HG3 ARG A 75 18.626 8.108 -1.055 1.00 25.00 H new ATOM 0 HD2 ARG A 75 18.833 10.385 -1.723 1.00 25.00 H new ATOM 0 HD3 ARG A 75 17.118 10.524 -2.056 1.00 25.00 H new ATOM 0 HE ARG A 75 17.496 9.882 0.719 1.00 25.00 H new ATOM 0 HH11 ARG A 75 17.947 12.569 -1.552 1.00 25.00 H new ATOM 0 HH12 ARG A 75 17.711 13.782 -0.289 1.00 25.00 H new ATOM 0 HH21 ARG A 75 17.166 11.461 2.240 1.00 25.00 H new ATOM 0 HH22 ARG A 75 17.280 13.169 1.805 1.00 25.00 H new ATOM 1181 N ILE A 76 18.058 6.590 -5.648 1.00 25.00 N ATOM 1182 CA ILE A 76 17.597 6.312 -7.021 1.00 25.00 C ATOM 1183 C ILE A 76 17.289 4.832 -7.223 1.00 25.00 C ATOM 1184 O ILE A 76 16.568 4.463 -8.139 1.00 25.00 O ATOM 1185 CB ILE A 76 18.602 6.793 -8.112 1.00 25.00 C ATOM 1186 CG1 ILE A 76 19.960 6.082 -7.962 1.00 25.00 C ATOM 1187 CG2 ILE A 76 18.755 8.321 -8.038 1.00 25.00 C ATOM 1188 CD1 ILE A 76 20.956 6.358 -9.094 1.00 25.00 C ATOM 0 H ILE A 76 19.017 6.931 -5.583 1.00 25.00 H new ATOM 0 HA ILE A 76 16.679 6.887 -7.141 1.00 25.00 H new ATOM 0 HB ILE A 76 18.210 6.533 -9.095 1.00 25.00 H new ATOM 0 HG12 ILE A 76 20.411 6.386 -7.017 1.00 25.00 H new ATOM 0 HG13 ILE A 76 19.787 5.007 -7.902 1.00 25.00 H new ATOM 0 HG21 ILE A 76 19.458 8.654 -8.802 1.00 25.00 H new ATOM 0 HG22 ILE A 76 17.787 8.792 -8.206 1.00 25.00 H new ATOM 0 HG23 ILE A 76 19.129 8.602 -7.053 1.00 25.00 H new ATOM 0 HD11 ILE A 76 21.883 5.816 -8.904 1.00 25.00 H new ATOM 0 HD12 ILE A 76 20.531 6.027 -10.042 1.00 25.00 H new ATOM 0 HD13 ILE A 76 21.164 7.427 -9.143 1.00 25.00 H new ATOM 1200 N ARG A 77 17.813 3.980 -6.350 1.00 25.00 N ATOM 1201 CA ARG A 77 17.498 2.548 -6.411 1.00 25.00 C ATOM 1202 C ARG A 77 16.054 2.242 -6.001 1.00 25.00 C ATOM 1203 O ARG A 77 15.608 1.104 -6.131 1.00 25.00 O ATOM 1204 CB ARG A 77 18.449 1.767 -5.509 1.00 25.00 C ATOM 1205 CG ARG A 77 19.868 1.751 -6.022 1.00 25.00 C ATOM 1206 CD ARG A 77 20.787 1.056 -5.041 1.00 25.00 C ATOM 1207 NE ARG A 77 22.070 0.704 -5.675 1.00 25.00 N ATOM 1208 CZ ARG A 77 22.303 -0.410 -6.362 1.00 25.00 C ATOM 1209 NH1 ARG A 77 21.386 -1.333 -6.540 1.00 25.00 N ATOM 1210 NH2 ARG A 77 23.482 -0.598 -6.886 1.00 25.00 N ATOM 0 H ARG A 77 18.450 4.245 -5.599 1.00 25.00 H new ATOM 0 HA ARG A 77 17.619 2.243 -7.450 1.00 25.00 H new ATOM 0 HB2 ARG A 77 18.434 2.204 -4.510 1.00 25.00 H new ATOM 0 HB3 ARG A 77 18.091 0.742 -5.414 1.00 25.00 H new ATOM 0 HG2 ARG A 77 19.905 1.242 -6.985 1.00 25.00 H new ATOM 0 HG3 ARG A 77 20.211 2.772 -6.188 1.00 25.00 H new ATOM 0 HD2 ARG A 77 20.967 1.705 -4.184 1.00 25.00 H new ATOM 0 HD3 ARG A 77 20.305 0.154 -4.662 1.00 25.00 H new ATOM 0 HE ARG A 77 22.839 1.367 -5.579 1.00 25.00 H new ATOM 0 HH11 ARG A 77 20.454 -1.209 -6.144 1.00 25.00 H new ATOM 0 HH12 ARG A 77 21.606 -2.174 -7.074 1.00 25.00 H new ATOM 0 HH21 ARG A 77 24.211 0.105 -6.766 1.00 25.00 H new ATOM 0 HH22 ARG A 77 23.675 -1.448 -7.416 1.00 25.00 H new ATOM 1224 N LEU A 78 15.354 3.232 -5.463 1.00 25.00 N ATOM 1225 CA LEU A 78 13.985 3.046 -4.965 1.00 25.00 C ATOM 1226 C LEU A 78 13.038 4.159 -5.441 1.00 25.00 C ATOM 1227 O LEU A 78 11.929 3.894 -5.893 1.00 25.00 O ATOM 1228 CB LEU A 78 14.035 3.006 -3.427 1.00 25.00 C ATOM 1229 CG LEU A 78 12.870 2.346 -2.660 1.00 25.00 C ATOM 1230 CD1 LEU A 78 13.304 2.159 -1.203 1.00 25.00 C ATOM 1231 CD2 LEU A 78 11.571 3.152 -2.691 1.00 25.00 C ATOM 0 H LEU A 78 15.710 4.182 -5.357 1.00 25.00 H new ATOM 0 HA LEU A 78 13.590 2.111 -5.362 1.00 25.00 H new ATOM 0 HB2 LEU A 78 14.952 2.491 -3.140 1.00 25.00 H new ATOM 0 HB3 LEU A 78 14.122 4.033 -3.073 1.00 25.00 H new ATOM 0 HG LEU A 78 12.655 1.398 -3.154 1.00 25.00 H new ATOM 0 HD11 LEU A 78 12.496 1.693 -0.639 1.00 25.00 H new ATOM 0 HD12 LEU A 78 14.187 1.521 -1.165 1.00 25.00 H new ATOM 0 HD13 LEU A 78 13.539 3.130 -0.766 1.00 25.00 H new ATOM 0 HD21 LEU A 78 10.801 2.622 -2.130 1.00 25.00 H new ATOM 0 HD22 LEU A 78 11.739 4.131 -2.241 1.00 25.00 H new ATOM 0 HD23 LEU A 78 11.246 3.278 -3.724 1.00 25.00 H new ATOM 1243 N PHE A 79 13.480 5.402 -5.323 1.00 25.00 N ATOM 1244 CA PHE A 79 12.661 6.563 -5.654 1.00 25.00 C ATOM 1245 C PHE A 79 13.035 7.128 -7.018 1.00 25.00 C ATOM 1246 O PHE A 79 14.196 7.088 -7.414 1.00 25.00 O ATOM 1247 CB PHE A 79 12.884 7.657 -4.603 1.00 25.00 C ATOM 1248 CG PHE A 79 12.663 7.195 -3.185 1.00 25.00 C ATOM 1249 CD1 PHE A 79 11.364 7.140 -2.644 1.00 25.00 C ATOM 1250 CD2 PHE A 79 13.755 6.823 -2.377 1.00 25.00 C ATOM 1251 CE1 PHE A 79 11.155 6.714 -1.306 1.00 25.00 C ATOM 1252 CE2 PHE A 79 13.559 6.388 -1.043 1.00 25.00 C ATOM 1253 CZ PHE A 79 12.256 6.338 -0.506 1.00 25.00 C ATOM 0 H PHE A 79 14.417 5.637 -4.995 1.00 25.00 H new ATOM 0 HA PHE A 79 11.618 6.247 -5.672 1.00 25.00 H new ATOM 0 HB2 PHE A 79 13.902 8.036 -4.697 1.00 25.00 H new ATOM 0 HB3 PHE A 79 12.213 8.490 -4.812 1.00 25.00 H new ATOM 0 HD1 PHE A 79 10.519 7.425 -3.253 1.00 25.00 H new ATOM 0 HD2 PHE A 79 14.756 6.870 -2.780 1.00 25.00 H new ATOM 0 HE1 PHE A 79 10.155 6.678 -0.900 1.00 25.00 H new ATOM 0 HE2 PHE A 79 14.405 6.095 -0.439 1.00 25.00 H new ATOM 0 HZ PHE A 79 12.101 6.014 0.512 1.00 25.00 H new ATOM 1263 N SER A 80 12.060 7.704 -7.705 1.00 25.00 N ATOM 1264 CA SER A 80 12.307 8.377 -8.975 1.00 25.00 C ATOM 1265 C SER A 80 12.991 9.717 -8.701 1.00 25.00 C ATOM 1266 O SER A 80 12.348 10.687 -8.289 1.00 25.00 O ATOM 1267 CB SER A 80 10.986 8.600 -9.706 1.00 25.00 C ATOM 1268 OG SER A 80 10.040 9.189 -8.828 1.00 25.00 O ATOM 0 H SER A 80 11.086 7.720 -7.404 1.00 25.00 H new ATOM 0 HA SER A 80 12.952 7.761 -9.602 1.00 25.00 H new ATOM 0 HB2 SER A 80 11.143 9.245 -10.570 1.00 25.00 H new ATOM 0 HB3 SER A 80 10.604 7.651 -10.082 1.00 25.00 H new ATOM 0 HG SER A 80 10.469 9.910 -8.321 1.00 25.00 H new ATOM 1274 N ALA A 81 14.299 9.740 -8.890 1.00 25.00 N ATOM 1275 CA ALA A 81 15.119 10.931 -8.682 1.00 25.00 C ATOM 1276 C ALA A 81 16.224 10.882 -9.740 1.00 25.00 C ATOM 1277 O ALA A 81 17.387 11.194 -9.487 1.00 25.00 O ATOM 1278 CB ALA A 81 15.700 10.941 -7.254 1.00 25.00 C ATOM 0 H ALA A 81 14.832 8.926 -9.196 1.00 25.00 H new ATOM 0 HA ALA A 81 14.534 11.845 -8.783 1.00 25.00 H new ATOM 0 HB1 ALA A 81 16.308 11.835 -7.115 1.00 25.00 H new ATOM 0 HB2 ALA A 81 14.885 10.940 -6.530 1.00 25.00 H new ATOM 0 HB3 ALA A 81 16.318 10.055 -7.106 1.00 25.00 H new ATOM 1284 N ASP A 82 15.835 10.404 -10.908 1.00 25.00 N ATOM 1285 CA ASP A 82 16.736 10.213 -12.037 1.00 25.00 C ATOM 1286 C ASP A 82 17.190 11.560 -12.621 1.00 25.00 C ATOM 1287 O ASP A 82 16.425 12.526 -12.649 1.00 25.00 O ATOM 1288 CB ASP A 82 16.039 9.371 -13.125 1.00 25.00 C ATOM 1289 CG ASP A 82 14.571 9.773 -13.351 1.00 25.00 C ATOM 1290 OD1 ASP A 82 14.237 10.207 -14.470 1.00 25.00 O ATOM 1291 OD2 ASP A 82 13.734 9.544 -12.431 1.00 25.00 O ATOM 0 H ASP A 82 14.872 10.133 -11.105 1.00 25.00 H new ATOM 0 HA ASP A 82 17.621 9.686 -11.682 1.00 25.00 H new ATOM 0 HB2 ASP A 82 16.586 9.474 -14.062 1.00 25.00 H new ATOM 0 HB3 ASP A 82 16.082 8.318 -12.845 1.00 25.00 H new ATOM 1296 N PRO A 83 18.462 11.648 -13.062 1.00 25.00 N ATOM 1297 CA PRO A 83 18.924 12.924 -13.614 1.00 25.00 C ATOM 1298 C PRO A 83 18.469 13.145 -15.052 1.00 25.00 C ATOM 1299 O PRO A 83 18.145 12.203 -15.772 1.00 25.00 O ATOM 1300 CB PRO A 83 20.444 12.783 -13.550 1.00 25.00 C ATOM 1301 CG PRO A 83 20.666 11.348 -13.811 1.00 25.00 C ATOM 1302 CD PRO A 83 19.544 10.643 -13.074 1.00 25.00 C ATOM 0 HA PRO A 83 18.526 13.778 -13.066 1.00 25.00 H new ATOM 0 HB2 PRO A 83 20.937 13.408 -14.295 1.00 25.00 H new ATOM 0 HB3 PRO A 83 20.834 13.079 -12.576 1.00 25.00 H new ATOM 0 HG2 PRO A 83 20.636 11.131 -14.879 1.00 25.00 H new ATOM 0 HG3 PRO A 83 21.642 11.026 -13.448 1.00 25.00 H new ATOM 0 HD2 PRO A 83 19.239 9.729 -13.584 1.00 25.00 H new ATOM 0 HD3 PRO A 83 19.841 10.360 -12.064 1.00 25.00 H new ATOM 1310 N PHE A 84 18.495 14.398 -15.480 1.00 25.00 N ATOM 1311 CA PHE A 84 18.089 14.768 -16.836 1.00 25.00 C ATOM 1312 C PHE A 84 19.280 15.341 -17.599 1.00 25.00 C ATOM 1313 O PHE A 84 19.125 16.048 -18.587 1.00 25.00 O ATOM 1314 CB PHE A 84 16.947 15.785 -16.768 1.00 25.00 C ATOM 1315 CG PHE A 84 15.816 15.357 -15.866 1.00 25.00 C ATOM 1316 CD1 PHE A 84 15.381 16.196 -14.821 1.00 25.00 C ATOM 1317 CD2 PHE A 84 15.193 14.104 -16.039 1.00 25.00 C ATOM 1318 CE1 PHE A 84 14.336 15.789 -13.953 1.00 25.00 C ATOM 1319 CE2 PHE A 84 14.152 13.687 -15.175 1.00 25.00 C ATOM 1320 CZ PHE A 84 13.723 14.531 -14.131 1.00 25.00 C ATOM 0 H PHE A 84 18.795 15.185 -14.905 1.00 25.00 H new ATOM 0 HA PHE A 84 17.738 13.883 -17.366 1.00 25.00 H new ATOM 0 HB2 PHE A 84 17.340 16.739 -16.417 1.00 25.00 H new ATOM 0 HB3 PHE A 84 16.558 15.951 -17.773 1.00 25.00 H new ATOM 0 HD1 PHE A 84 15.848 17.159 -14.680 1.00 25.00 H new ATOM 0 HD2 PHE A 84 15.514 13.455 -16.840 1.00 25.00 H new ATOM 0 HE1 PHE A 84 14.010 16.441 -13.157 1.00 25.00 H new ATOM 0 HE2 PHE A 84 13.687 12.723 -15.316 1.00 25.00 H new ATOM 0 HZ PHE A 84 12.929 14.216 -13.470 1.00 25.00 H new ATOM 1330 N ASP A 85 20.471 15.045 -17.099 1.00 25.00 N ATOM 1331 CA ASP A 85 21.721 15.519 -17.672 1.00 25.00 C ATOM 1332 C ASP A 85 22.699 14.383 -17.471 1.00 25.00 C ATOM 1333 O ASP A 85 23.009 14.006 -16.341 1.00 25.00 O ATOM 1334 CB ASP A 85 22.218 16.784 -16.977 1.00 25.00 C ATOM 1335 CG ASP A 85 23.438 17.373 -17.661 1.00 25.00 C ATOM 1336 OD1 ASP A 85 23.786 18.528 -17.358 1.00 25.00 O ATOM 1337 OD2 ASP A 85 24.058 16.674 -18.499 1.00 25.00 O ATOM 0 H ASP A 85 20.597 14.461 -16.272 1.00 25.00 H new ATOM 0 HA ASP A 85 21.600 15.785 -18.722 1.00 25.00 H new ATOM 0 HB2 ASP A 85 21.419 17.525 -16.961 1.00 25.00 H new ATOM 0 HB3 ASP A 85 22.461 16.555 -15.939 1.00 25.00 H new ATOM 1342 N LEU A 86 23.076 13.759 -18.569 1.00 25.00 N ATOM 1343 CA LEU A 86 23.936 12.592 -18.528 1.00 25.00 C ATOM 1344 C LEU A 86 25.404 12.938 -18.286 1.00 25.00 C ATOM 1345 O LEU A 86 26.126 12.160 -17.669 1.00 25.00 O ATOM 1346 CB LEU A 86 23.793 11.821 -19.836 1.00 25.00 C ATOM 1347 CG LEU A 86 22.391 11.266 -20.146 1.00 25.00 C ATOM 1348 CD1 LEU A 86 22.398 10.599 -21.521 1.00 25.00 C ATOM 1349 CD2 LEU A 86 21.934 10.261 -19.086 1.00 25.00 C ATOM 0 H LEU A 86 22.798 14.043 -19.508 1.00 25.00 H new ATOM 0 HA LEU A 86 23.617 11.982 -17.683 1.00 25.00 H new ATOM 0 HB2 LEU A 86 24.091 12.476 -20.655 1.00 25.00 H new ATOM 0 HB3 LEU A 86 24.496 10.988 -19.822 1.00 25.00 H new ATOM 0 HG LEU A 86 21.689 12.100 -20.139 1.00 25.00 H new ATOM 0 HD11 LEU A 86 21.405 10.206 -21.740 1.00 25.00 H new ATOM 0 HD12 LEU A 86 22.674 11.332 -22.279 1.00 25.00 H new ATOM 0 HD13 LEU A 86 23.120 9.783 -21.526 1.00 25.00 H new ATOM 0 HD21 LEU A 86 20.940 9.892 -19.339 1.00 25.00 H new ATOM 0 HD22 LEU A 86 22.634 9.426 -19.051 1.00 25.00 H new ATOM 0 HD23 LEU A 86 21.902 10.749 -18.112 1.00 25.00 H new ATOM 1361 N GLU A 87 25.861 14.064 -18.822 1.00 25.00 N ATOM 1362 CA GLU A 87 27.259 14.475 -18.639 1.00 25.00 C ATOM 1363 C GLU A 87 27.443 15.235 -17.326 1.00 25.00 C ATOM 1364 O GLU A 87 28.428 15.032 -16.623 1.00 25.00 O ATOM 1365 CB GLU A 87 27.781 15.273 -19.845 1.00 25.00 C ATOM 1366 CG GLU A 87 27.097 16.611 -20.146 1.00 25.00 C ATOM 1367 CD GLU A 87 27.670 17.282 -21.398 1.00 25.00 C ATOM 1368 OE1 GLU A 87 28.507 16.657 -22.090 1.00 25.00 O ATOM 1369 OE2 GLU A 87 27.291 18.438 -21.683 1.00 25.00 O ATOM 0 H GLU A 87 25.297 14.705 -19.380 1.00 25.00 H new ATOM 0 HA GLU A 87 27.864 13.570 -18.578 1.00 25.00 H new ATOM 0 HB2 GLU A 87 28.843 15.463 -19.691 1.00 25.00 H new ATOM 0 HB3 GLU A 87 27.696 14.643 -20.730 1.00 25.00 H new ATOM 0 HG2 GLU A 87 26.027 16.449 -20.279 1.00 25.00 H new ATOM 0 HG3 GLU A 87 27.214 17.278 -19.292 1.00 25.00 H new ATOM 1376 N ALA A 88 26.462 16.076 -17.012 1.00 25.00 N ATOM 1377 CA ALA A 88 26.364 16.836 -15.754 1.00 25.00 C ATOM 1378 C ALA A 88 27.495 17.849 -15.498 1.00 25.00 C ATOM 1379 O ALA A 88 27.501 18.523 -14.463 1.00 25.00 O ATOM 1380 CB ALA A 88 26.199 15.873 -14.565 1.00 25.00 C ATOM 0 H ALA A 88 25.682 16.259 -17.644 1.00 25.00 H new ATOM 0 HA ALA A 88 25.474 17.456 -15.863 1.00 25.00 H new ATOM 0 HB1 ALA A 88 26.128 16.446 -13.640 1.00 25.00 H new ATOM 0 HB2 ALA A 88 25.292 15.283 -14.698 1.00 25.00 H new ATOM 0 HB3 ALA A 88 27.060 15.207 -14.514 1.00 25.00 H new ATOM 1386 N GLN A 89 28.377 18.013 -16.480 1.00 25.00 N ATOM 1387 CA GLN A 89 29.430 19.010 -16.455 1.00 25.00 C ATOM 1388 C GLN A 89 30.238 19.002 -15.137 1.00 25.00 C ATOM 1389 O GLN A 89 30.512 17.944 -14.588 1.00 25.00 O ATOM 1390 CB GLN A 89 28.767 20.350 -16.786 1.00 25.00 C ATOM 1391 CG GLN A 89 29.476 21.142 -17.874 1.00 25.00 C ATOM 1392 CD GLN A 89 30.714 21.864 -17.375 1.00 25.00 C ATOM 1393 OE1 GLN A 89 31.837 21.472 -17.657 1.00 25.00 O ATOM 1394 NE2 GLN A 89 30.513 22.905 -16.605 1.00 25.00 N ATOM 0 H GLN A 89 28.376 17.445 -17.327 1.00 25.00 H new ATOM 0 HA GLN A 89 30.195 18.791 -17.200 1.00 25.00 H new ATOM 0 HB2 GLN A 89 27.738 20.167 -17.097 1.00 25.00 H new ATOM 0 HB3 GLN A 89 28.724 20.955 -15.881 1.00 25.00 H new ATOM 0 HG2 GLN A 89 29.758 20.466 -18.682 1.00 25.00 H new ATOM 0 HG3 GLN A 89 28.783 21.870 -18.295 1.00 25.00 H new ATOM 0 HE21 GLN A 89 29.562 23.204 -16.390 1.00 25.00 H new ATOM 0 HE22 GLN A 89 31.308 23.416 -16.220 1.00 25.00 H new ATOM 1403 N ALA A 90 30.654 20.184 -14.698 1.00 25.00 N ATOM 1404 CA ALA A 90 31.455 20.400 -13.484 1.00 25.00 C ATOM 1405 C ALA A 90 32.746 19.576 -13.380 1.00 25.00 C ATOM 1406 O ALA A 90 32.796 18.456 -12.879 1.00 25.00 O ATOM 1407 CB ALA A 90 30.624 20.222 -12.257 1.00 25.00 C ATOM 0 H ALA A 90 30.439 21.052 -15.189 1.00 25.00 H new ATOM 0 HA ALA A 90 31.790 21.434 -13.567 1.00 25.00 H new ATOM 0 HB1 ALA A 90 31.240 20.387 -11.373 1.00 25.00 H new ATOM 0 HB2 ALA A 90 29.803 20.939 -12.266 1.00 25.00 H new ATOM 0 HB3 ALA A 90 30.221 19.209 -12.234 1.00 25.00 H new ATOM 1413 N LYS A 91 33.810 20.214 -13.822 1.00 25.00 N ATOM 1414 CA LYS A 91 35.150 19.627 -13.801 1.00 25.00 C ATOM 1415 C LYS A 91 35.913 20.044 -12.546 1.00 25.00 C ATOM 1416 O LYS A 91 35.519 20.972 -11.848 1.00 25.00 O ATOM 1417 CB LYS A 91 35.930 20.057 -15.044 1.00 25.00 C ATOM 1418 CG LYS A 91 36.012 21.573 -15.234 1.00 25.00 C ATOM 1419 CD LYS A 91 37.311 21.982 -15.906 1.00 25.00 C ATOM 1420 CE LYS A 91 37.436 21.439 -17.328 1.00 25.00 C ATOM 1421 NZ LYS A 91 38.748 21.860 -17.913 1.00 25.00 N ATOM 0 H LYS A 91 33.778 21.157 -14.209 1.00 25.00 H new ATOM 0 HA LYS A 91 35.043 18.542 -13.795 1.00 25.00 H new ATOM 0 HB2 LYS A 91 36.941 19.654 -14.984 1.00 25.00 H new ATOM 0 HB3 LYS A 91 35.463 19.616 -15.924 1.00 25.00 H new ATOM 0 HG2 LYS A 91 35.168 21.911 -15.835 1.00 25.00 H new ATOM 0 HG3 LYS A 91 35.931 22.067 -14.266 1.00 25.00 H new ATOM 0 HD2 LYS A 91 37.376 23.070 -15.930 1.00 25.00 H new ATOM 0 HD3 LYS A 91 38.151 21.626 -15.310 1.00 25.00 H new ATOM 0 HE2 LYS A 91 37.362 20.352 -17.321 1.00 25.00 H new ATOM 0 HE3 LYS A 91 36.616 21.810 -17.943 1.00 25.00 H new ATOM 0 HZ1 LYS A 91 39.191 21.050 -18.391 1.00 25.00 H new ATOM 0 HZ2 LYS A 91 38.592 22.625 -18.600 1.00 25.00 H new ATOM 0 HZ3 LYS A 91 39.374 22.199 -17.154 1.00 25.00 H new ATOM 1435 N ILE A 92 37.036 19.381 -12.308 1.00 25.00 N ATOM 1436 CA ILE A 92 37.911 19.678 -11.189 1.00 25.00 C ATOM 1437 C ILE A 92 39.287 19.915 -11.795 1.00 25.00 C ATOM 1438 O ILE A 92 39.814 19.071 -12.513 1.00 25.00 O ATOM 1439 CB ILE A 92 37.972 18.497 -10.162 1.00 25.00 C ATOM 1440 CG1 ILE A 92 36.562 18.212 -9.594 1.00 25.00 C ATOM 1441 CG2 ILE A 92 38.963 18.831 -9.007 1.00 25.00 C ATOM 1442 CD1 ILE A 92 36.463 16.928 -8.745 1.00 25.00 C ATOM 0 H ILE A 92 37.366 18.614 -12.894 1.00 25.00 H new ATOM 0 HA ILE A 92 37.545 20.543 -10.636 1.00 25.00 H new ATOM 0 HB ILE A 92 38.330 17.605 -10.677 1.00 25.00 H new ATOM 0 HG12 ILE A 92 36.251 19.061 -8.985 1.00 25.00 H new ATOM 0 HG13 ILE A 92 35.858 18.140 -10.423 1.00 25.00 H new ATOM 0 HG21 ILE A 92 38.994 18.000 -8.302 1.00 25.00 H new ATOM 0 HG22 ILE A 92 39.959 18.995 -9.418 1.00 25.00 H new ATOM 0 HG23 ILE A 92 38.631 19.732 -8.492 1.00 25.00 H new ATOM 0 HD11 ILE A 92 35.441 16.806 -8.387 1.00 25.00 H new ATOM 0 HD12 ILE A 92 36.740 16.067 -9.354 1.00 25.00 H new ATOM 0 HD13 ILE A 92 37.139 17.002 -7.893 1.00 25.00 H new ATOM 1454 N GLU A 93 39.830 21.085 -11.520 1.00 25.00 N ATOM 1455 CA GLU A 93 41.172 21.472 -11.962 1.00 25.00 C ATOM 1456 C GLU A 93 42.111 21.315 -10.767 1.00 25.00 C ATOM 1457 O GLU A 93 41.650 21.277 -9.624 1.00 25.00 O ATOM 1458 CB GLU A 93 41.176 22.935 -12.413 1.00 25.00 C ATOM 1459 CG GLU A 93 40.471 23.194 -13.738 1.00 25.00 C ATOM 1460 CD GLU A 93 41.218 22.603 -14.931 1.00 25.00 C ATOM 1461 OE1 GLU A 93 42.457 22.693 -14.975 1.00 25.00 O ATOM 1462 OE2 GLU A 93 40.549 22.098 -15.859 1.00 25.00 O ATOM 0 H GLU A 93 39.354 21.807 -10.979 1.00 25.00 H new ATOM 0 HA GLU A 93 41.489 20.848 -12.798 1.00 25.00 H new ATOM 0 HB2 GLU A 93 40.702 23.541 -11.640 1.00 25.00 H new ATOM 0 HB3 GLU A 93 42.209 23.273 -12.494 1.00 25.00 H new ATOM 0 HG2 GLU A 93 39.467 22.772 -13.699 1.00 25.00 H new ATOM 0 HG3 GLU A 93 40.360 24.269 -13.881 1.00 25.00 H new ATOM 1469 N GLU A 94 43.412 21.253 -11.016 1.00 25.00 N ATOM 1470 CA GLU A 94 44.400 21.114 -9.942 1.00 25.00 C ATOM 1471 C GLU A 94 45.346 22.310 -9.914 1.00 25.00 C ATOM 1472 O GLU A 94 45.430 23.064 -10.879 1.00 25.00 O ATOM 1473 CB GLU A 94 45.210 19.824 -10.108 1.00 25.00 C ATOM 1474 CG GLU A 94 44.388 18.562 -9.913 1.00 25.00 C ATOM 1475 CD GLU A 94 45.161 17.494 -9.150 1.00 25.00 C ATOM 1476 OE1 GLU A 94 44.701 17.098 -8.058 1.00 25.00 O ATOM 1477 OE2 GLU A 94 46.240 17.074 -9.624 1.00 25.00 O ATOM 0 H GLU A 94 43.814 21.296 -11.953 1.00 25.00 H new ATOM 0 HA GLU A 94 43.855 21.071 -8.999 1.00 25.00 H new ATOM 0 HB2 GLU A 94 45.654 19.809 -11.104 1.00 25.00 H new ATOM 0 HB3 GLU A 94 46.032 19.826 -9.393 1.00 25.00 H new ATOM 0 HG2 GLU A 94 43.473 18.804 -9.372 1.00 25.00 H new ATOM 0 HG3 GLU A 94 44.089 18.169 -10.885 1.00 25.00 H new ATOM 1484 N ASP A 95 46.020 22.478 -8.779 1.00 25.00 N ATOM 1485 CA ASP A 95 46.951 23.595 -8.523 1.00 25.00 C ATOM 1486 C ASP A 95 46.336 24.960 -8.854 1.00 25.00 C ATOM 1487 O ASP A 95 46.991 25.872 -9.364 1.00 25.00 O ATOM 1488 CB ASP A 95 48.280 23.407 -9.264 1.00 25.00 C ATOM 1489 CG ASP A 95 49.408 24.241 -8.655 1.00 25.00 C ATOM 1490 OD1 ASP A 95 50.478 24.363 -9.285 1.00 25.00 O ATOM 1491 OD2 ASP A 95 49.238 24.721 -7.504 1.00 25.00 O ATOM 0 H ASP A 95 45.939 21.835 -7.992 1.00 25.00 H new ATOM 0 HA ASP A 95 47.153 23.581 -7.452 1.00 25.00 H new ATOM 0 HB2 ASP A 95 48.559 22.353 -9.244 1.00 25.00 H new ATOM 0 HB3 ASP A 95 48.152 23.683 -10.311 1.00 25.00 H new ATOM 1496 N ILE A 96 45.056 25.099 -8.548 1.00 25.00 N ATOM 1497 CA ILE A 96 44.319 26.317 -8.836 1.00 25.00 C ATOM 1498 C ILE A 96 44.523 27.355 -7.762 1.00 25.00 C ATOM 1499 O ILE A 96 43.633 27.699 -6.986 1.00 25.00 O ATOM 1500 CB ILE A 96 42.825 26.085 -9.051 1.00 25.00 C ATOM 1501 CG1 ILE A 96 42.273 25.033 -8.059 1.00 25.00 C ATOM 1502 CG2 ILE A 96 42.578 25.654 -10.508 1.00 25.00 C ATOM 1503 CD1 ILE A 96 40.739 24.984 -7.982 1.00 25.00 C ATOM 0 H ILE A 96 44.501 24.373 -8.095 1.00 25.00 H new ATOM 0 HA ILE A 96 44.729 26.686 -9.776 1.00 25.00 H new ATOM 0 HB ILE A 96 42.293 27.017 -8.861 1.00 25.00 H new ATOM 0 HG12 ILE A 96 42.643 24.049 -8.347 1.00 25.00 H new ATOM 0 HG13 ILE A 96 42.669 25.244 -7.066 1.00 25.00 H new ATOM 0 HG21 ILE A 96 41.512 25.488 -10.663 1.00 25.00 H new ATOM 0 HG22 ILE A 96 42.925 26.437 -11.183 1.00 25.00 H new ATOM 0 HG23 ILE A 96 43.122 24.732 -10.712 1.00 25.00 H new ATOM 0 HD11 ILE A 96 40.435 24.221 -7.265 1.00 25.00 H new ATOM 0 HD12 ILE A 96 40.360 25.955 -7.662 1.00 25.00 H new ATOM 0 HD13 ILE A 96 40.333 24.741 -8.964 1.00 25.00 H new ATOM 1515 N ARG A 97 45.737 27.864 -7.779 1.00 25.00 N ATOM 1516 CA ARG A 97 46.173 28.976 -6.935 1.00 25.00 C ATOM 1517 C ARG A 97 46.178 28.583 -5.453 1.00 25.00 C ATOM 1518 O ARG A 97 46.151 29.420 -4.554 1.00 25.00 O ATOM 1519 CB ARG A 97 45.288 30.211 -7.190 1.00 25.00 C ATOM 1520 CG ARG A 97 45.912 31.550 -6.831 1.00 25.00 C ATOM 1521 CD ARG A 97 44.859 32.644 -6.928 1.00 25.00 C ATOM 1522 NE ARG A 97 45.106 33.722 -5.957 1.00 25.00 N ATOM 1523 CZ ARG A 97 44.693 33.720 -4.691 1.00 25.00 C ATOM 1524 NH1 ARG A 97 44.021 32.729 -4.170 1.00 25.00 N ATOM 1525 NH2 ARG A 97 44.968 34.747 -3.934 1.00 25.00 N ATOM 0 H ARG A 97 46.472 27.513 -8.393 1.00 25.00 H new ATOM 0 HA ARG A 97 47.199 29.230 -7.199 1.00 25.00 H new ATOM 0 HB2 ARG A 97 45.015 30.229 -8.245 1.00 25.00 H new ATOM 0 HB3 ARG A 97 44.364 30.097 -6.623 1.00 25.00 H new ATOM 0 HG2 ARG A 97 46.321 31.513 -5.821 1.00 25.00 H new ATOM 0 HG3 ARG A 97 46.741 31.768 -7.504 1.00 25.00 H new ATOM 0 HD2 ARG A 97 44.854 33.057 -7.937 1.00 25.00 H new ATOM 0 HD3 ARG A 97 43.872 32.216 -6.754 1.00 25.00 H new ATOM 0 HE ARG A 97 45.634 34.533 -6.279 1.00 25.00 H new ATOM 0 HH11 ARG A 97 43.792 31.913 -4.738 1.00 25.00 H new ATOM 0 HH12 ARG A 97 43.725 32.771 -3.195 1.00 25.00 H new ATOM 0 HH21 ARG A 97 45.492 35.535 -4.314 1.00 25.00 H new ATOM 0 HH22 ARG A 97 44.659 34.761 -2.962 1.00 25.00 H new ATOM 1539 N GLN A 98 46.241 27.275 -5.222 1.00 25.00 N ATOM 1540 CA GLN A 98 46.271 26.709 -3.867 1.00 25.00 C ATOM 1541 C GLN A 98 47.533 27.100 -3.089 1.00 25.00 C ATOM 1542 O GLN A 98 48.593 27.422 -3.585 1.00 25.00 O ATOM 1543 CB GLN A 98 46.046 25.172 -3.897 1.00 25.00 C ATOM 1544 CG GLN A 98 47.129 24.403 -4.701 1.00 25.00 C ATOM 1545 CD GLN A 98 48.437 24.272 -3.952 1.00 25.00 C ATOM 1546 OE1 GLN A 98 48.517 24.034 -2.770 1.00 25.00 O ATOM 1547 NE2 GLN A 98 49.534 24.422 -4.672 1.00 25.00 N ATOM 1548 OXT GLN A 98 47.389 27.048 -1.806 1.00 25.00 O ATOM 0 H GLN A 98 46.273 26.575 -5.963 1.00 25.00 H new ATOM 0 HA GLN A 98 45.439 27.150 -3.318 1.00 25.00 H new ATOM 0 HB2 GLN A 98 46.028 24.795 -2.874 1.00 25.00 H new ATOM 0 HB3 GLN A 98 45.068 24.964 -4.330 1.00 25.00 H new ATOM 0 HG2 GLN A 98 46.755 23.409 -4.945 1.00 25.00 H new ATOM 0 HG3 GLN A 98 47.307 24.918 -5.645 1.00 25.00 H new ATOM 0 HE21 GLN A 98 49.466 24.623 -5.670 1.00 25.00 H new ATOM 0 HE22 GLN A 98 50.449 24.337 -4.230 1.00 25.00 H new TER 1558 GLN A 98