USER MOD reduce.3.24.130724 H: found=0, std=0, add=776, rem=0, adj=16 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 51 SER OG : rot 77:sc= 1.63 USER MOD Set 1.2: A 56 LYS NZ :NH3+ -167:sc= 0.727 (180deg=0) USER MOD Single : A 1 SER N :NH3+ 165:sc= 0.071 (180deg=-0.231) USER MOD Single : A 1 SER OG : rot 180:sc= 0.0893 USER MOD Single : A 2 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 3 GLN : amide:sc= -0.0131 X(o=-0.013,f=-0.13) USER MOD Single : A 4 SER OG : rot 180:sc= 0.182 USER MOD Single : A 5 HIS : no HE2:sc= 0.106 K(o=0.11,f=-0.55) USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 7 SER OG : rot 180:sc= 0 USER MOD Single : A 12 THR OG1 : rot 52:sc= 0.332 USER MOD Single : A 13 SER OG : rot 180:sc= 0 USER MOD Single : A 14 SER OG : rot -157:sc= 1.26 USER MOD Single : A 16 GLN : amide:sc= -0.0053 X(o=-0.0053,f=0) USER MOD Single : A 20 ASN : amide:sc= -0.028 K(o=-0.028,f=-2.3!) USER MOD Single : A 27 MET CE :methyl -160:sc= 0 (180deg=-0.436) USER MOD Single : A 31 ASN : amide:sc= -1.36 K(o=-1.4,f=-7.1!) USER MOD Single : A 33 HIS : no HD1:sc=-0.00942 X(o=-0.0094,f=-0.0011) USER MOD Single : A 36 SER OG : rot 81:sc= 1.23 USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 ASN : amide:sc= -0.516 K(o=-0.52,f=-5!) USER MOD Single : A 58 SER OG : rot 180:sc=-0.00262 USER MOD Single : A 64 GLN : amide:sc= -0.224 X(o=-0.22,f=-0.43) USER MOD Single : A 65 GLN : amide:sc= 0.185 K(o=0.19,f=-1.3) USER MOD Single : A 66 GLN : amide:sc= -0.0374 X(o=-0.037,f=0) USER MOD Single : A 73 GLN : amide:sc= 0.349 X(o=0.35,f=-0.017) USER MOD Single : A 80 SER OG : rot 180:sc= 0 USER MOD Single : A 89 GLN : amide:sc= 0.611 K(o=0.61,f=-0.11) USER MOD Single : A 91 LYS NZ :NH3+ 168:sc= 0.347 (180deg=0.174) USER MOD Single : A 98 GLN : amide:sc= -0.128 X(o=-0.13,f=-0.11) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 1 -8.481 10.433 -1.443 1.00 25.00 N ATOM 2 CA SER A 1 -7.145 10.871 -0.947 1.00 25.00 C ATOM 3 C SER A 1 -6.057 10.818 -1.992 1.00 25.00 C ATOM 4 O SER A 1 -4.878 10.797 -1.735 1.00 25.00 O ATOM 5 CB SER A 1 -6.757 9.996 0.250 1.00 25.00 C ATOM 6 OG SER A 1 -7.928 9.787 1.048 1.00 25.00 O ATOM 0 H1 SER A 1 -9.109 10.252 -0.634 1.00 25.00 H new ATOM 0 H2 SER A 1 -8.891 11.179 -2.040 1.00 25.00 H new ATOM 0 H3 SER A 1 -8.376 9.562 -2.001 1.00 25.00 H new ATOM 0 HA SER A 1 -7.236 11.919 -0.663 1.00 25.00 H new ATOM 0 HB2 SER A 1 -6.354 9.042 -0.091 1.00 25.00 H new ATOM 0 HB3 SER A 1 -5.977 10.480 0.838 1.00 25.00 H new ATOM 0 HG SER A 1 -7.702 9.227 1.820 1.00 25.00 H new ATOM 14 N GLN A 2 -6.513 10.754 -3.240 1.00 25.00 N ATOM 15 CA GLN A 2 -5.626 10.668 -4.398 1.00 25.00 C ATOM 16 C GLN A 2 -5.446 12.037 -5.050 1.00 25.00 C ATOM 17 O GLN A 2 -6.415 12.761 -5.281 1.00 25.00 O ATOM 18 CB GLN A 2 -6.198 9.689 -5.426 1.00 25.00 C ATOM 19 CG GLN A 2 -6.291 8.253 -4.913 1.00 25.00 C ATOM 20 CD GLN A 2 -6.814 7.297 -5.964 1.00 25.00 C ATOM 21 OE1 GLN A 2 -6.265 7.183 -7.042 1.00 25.00 O ATOM 22 NE2 GLN A 2 -7.889 6.618 -5.655 1.00 25.00 N ATOM 0 H GLN A 2 -7.505 10.760 -3.477 1.00 25.00 H new ATOM 0 HA GLN A 2 -4.655 10.313 -4.053 1.00 25.00 H new ATOM 0 HB2 GLN A 2 -7.191 10.025 -5.723 1.00 25.00 H new ATOM 0 HB3 GLN A 2 -5.575 9.708 -6.320 1.00 25.00 H new ATOM 0 HG2 GLN A 2 -5.306 7.923 -4.584 1.00 25.00 H new ATOM 0 HG3 GLN A 2 -6.945 8.223 -4.041 1.00 25.00 H new ATOM 0 HE21 GLN A 2 -8.323 6.739 -4.740 1.00 25.00 H new ATOM 0 HE22 GLN A 2 -8.293 5.967 -6.329 1.00 25.00 H new ATOM 31 N GLN A 3 -4.204 12.364 -5.374 1.00 25.00 N ATOM 32 CA GLN A 3 -3.861 13.581 -6.105 1.00 25.00 C ATOM 33 C GLN A 3 -2.883 13.119 -7.174 1.00 25.00 C ATOM 34 O GLN A 3 -2.404 11.994 -7.106 1.00 25.00 O ATOM 35 CB GLN A 3 -3.210 14.633 -5.194 1.00 25.00 C ATOM 36 CG GLN A 3 -4.168 15.270 -4.176 1.00 25.00 C ATOM 37 CD GLN A 3 -4.344 14.440 -2.920 1.00 25.00 C ATOM 38 OE1 GLN A 3 -3.384 14.069 -2.275 1.00 25.00 O ATOM 39 NE2 GLN A 3 -5.568 14.168 -2.561 1.00 25.00 N ATOM 0 H GLN A 3 -3.396 11.789 -5.136 1.00 25.00 H new ATOM 0 HA GLN A 3 -4.746 14.062 -6.521 1.00 25.00 H new ATOM 0 HB2 GLN A 3 -2.384 14.169 -4.656 1.00 25.00 H new ATOM 0 HB3 GLN A 3 -2.783 15.420 -5.815 1.00 25.00 H new ATOM 0 HG2 GLN A 3 -3.793 16.256 -3.902 1.00 25.00 H new ATOM 0 HG3 GLN A 3 -5.141 15.418 -4.645 1.00 25.00 H new ATOM 0 HE21 GLN A 3 -6.350 14.496 -3.127 1.00 25.00 H new ATOM 0 HE22 GLN A 3 -5.743 13.627 -1.714 1.00 25.00 H new ATOM 48 N SER A 4 -2.599 13.963 -8.158 1.00 25.00 N ATOM 49 CA SER A 4 -1.733 13.587 -9.277 1.00 25.00 C ATOM 50 C SER A 4 -0.324 13.161 -8.863 1.00 25.00 C ATOM 51 O SER A 4 0.252 12.279 -9.485 1.00 25.00 O ATOM 52 CB SER A 4 -1.642 14.766 -10.238 1.00 25.00 C ATOM 53 OG SER A 4 -2.440 15.840 -9.750 1.00 25.00 O ATOM 0 H SER A 4 -2.956 14.917 -8.207 1.00 25.00 H new ATOM 0 HA SER A 4 -2.186 12.714 -9.747 1.00 25.00 H new ATOM 0 HB2 SER A 4 -0.605 15.087 -10.340 1.00 25.00 H new ATOM 0 HB3 SER A 4 -1.982 14.468 -11.230 1.00 25.00 H new ATOM 0 HG SER A 4 -2.380 16.599 -10.367 1.00 25.00 H new ATOM 59 N HIS A 5 0.212 13.798 -7.822 1.00 25.00 N ATOM 60 CA HIS A 5 1.534 13.470 -7.253 1.00 25.00 C ATOM 61 C HIS A 5 2.654 13.283 -8.306 1.00 25.00 C ATOM 62 O HIS A 5 3.502 12.400 -8.194 1.00 25.00 O ATOM 63 CB HIS A 5 1.400 12.222 -6.367 1.00 25.00 C ATOM 64 CG HIS A 5 2.331 12.214 -5.193 1.00 25.00 C ATOM 65 ND1 HIS A 5 3.691 12.070 -5.285 1.00 25.00 N ATOM 66 CD2 HIS A 5 2.080 12.351 -3.862 1.00 25.00 C ATOM 67 CE1 HIS A 5 4.201 12.122 -4.058 1.00 25.00 C ATOM 68 NE2 HIS A 5 3.261 12.292 -3.149 1.00 25.00 N ATOM 0 H HIS A 5 -0.258 14.565 -7.340 1.00 25.00 H new ATOM 0 HA HIS A 5 1.848 14.330 -6.662 1.00 25.00 H new ATOM 0 HB2 HIS A 5 0.374 12.152 -6.006 1.00 25.00 H new ATOM 0 HB3 HIS A 5 1.586 11.335 -6.973 1.00 25.00 H new ATOM 0 HD1 HIS A 5 4.221 11.944 -6.147 1.00 25.00 H new ATOM 0 HD2 HIS A 5 1.101 12.486 -3.427 1.00 25.00 H new ATOM 0 HE1 HIS A 5 5.254 12.036 -3.834 1.00 25.00 H new ATOM 76 N SER A 6 2.631 14.112 -9.341 1.00 25.00 N ATOM 77 CA SER A 6 3.602 14.012 -10.431 1.00 25.00 C ATOM 78 C SER A 6 4.906 14.699 -10.033 1.00 25.00 C ATOM 79 O SER A 6 4.907 15.576 -9.170 1.00 25.00 O ATOM 80 CB SER A 6 3.035 14.671 -11.690 1.00 25.00 C ATOM 81 OG SER A 6 3.901 14.490 -12.798 1.00 25.00 O ATOM 0 H SER A 6 1.951 14.864 -9.452 1.00 25.00 H new ATOM 0 HA SER A 6 3.802 12.960 -10.634 1.00 25.00 H new ATOM 0 HB2 SER A 6 2.057 14.247 -11.917 1.00 25.00 H new ATOM 0 HB3 SER A 6 2.887 15.736 -11.511 1.00 25.00 H new ATOM 0 HG SER A 6 3.514 14.919 -13.589 1.00 25.00 H new ATOM 87 N SER A 7 6.003 14.329 -10.678 1.00 25.00 N ATOM 88 CA SER A 7 7.302 14.954 -10.424 1.00 25.00 C ATOM 89 C SER A 7 8.058 15.121 -11.747 1.00 25.00 C ATOM 90 O SER A 7 8.068 14.203 -12.570 1.00 25.00 O ATOM 91 CB SER A 7 8.118 14.081 -9.472 1.00 25.00 C ATOM 92 OG SER A 7 7.395 13.854 -8.272 1.00 25.00 O ATOM 0 H SER A 7 6.023 13.595 -11.386 1.00 25.00 H new ATOM 0 HA SER A 7 7.148 15.933 -9.969 1.00 25.00 H new ATOM 0 HB2 SER A 7 8.351 13.129 -9.950 1.00 25.00 H new ATOM 0 HB3 SER A 7 9.068 14.566 -9.246 1.00 25.00 H new ATOM 0 HG SER A 7 7.927 13.292 -7.671 1.00 25.00 H new ATOM 98 N PRO A 8 8.664 16.302 -11.989 1.00 25.00 N ATOM 99 CA PRO A 8 9.395 16.489 -13.246 1.00 25.00 C ATOM 100 C PRO A 8 10.774 15.843 -13.225 1.00 25.00 C ATOM 101 O PRO A 8 11.284 15.464 -12.173 1.00 25.00 O ATOM 102 CB PRO A 8 9.526 18.009 -13.329 1.00 25.00 C ATOM 103 CG PRO A 8 9.669 18.417 -11.920 1.00 25.00 C ATOM 104 CD PRO A 8 8.711 17.528 -11.170 1.00 25.00 C ATOM 0 HA PRO A 8 8.884 16.030 -14.093 1.00 25.00 H new ATOM 0 HB2 PRO A 8 10.390 18.306 -13.923 1.00 25.00 H new ATOM 0 HB3 PRO A 8 8.650 18.463 -13.792 1.00 25.00 H new ATOM 0 HG2 PRO A 8 10.692 18.282 -11.570 1.00 25.00 H new ATOM 0 HG3 PRO A 8 9.422 19.470 -11.785 1.00 25.00 H new ATOM 0 HD2 PRO A 8 9.063 17.322 -10.159 1.00 25.00 H new ATOM 0 HD3 PRO A 8 7.727 17.987 -11.078 1.00 25.00 H new ATOM 112 N GLY A 9 11.392 15.774 -14.395 1.00 25.00 N ATOM 113 CA GLY A 9 12.737 15.220 -14.520 1.00 25.00 C ATOM 114 C GLY A 9 13.643 16.091 -15.363 1.00 25.00 C ATOM 115 O GLY A 9 14.679 15.669 -15.844 1.00 25.00 O ATOM 0 H GLY A 9 10.985 16.094 -15.274 1.00 25.00 H new ATOM 0 HA2 GLY A 9 13.172 15.101 -13.528 1.00 25.00 H new ATOM 0 HA3 GLY A 9 12.678 14.226 -14.963 1.00 25.00 H new ATOM 119 N GLU A 10 13.213 17.326 -15.541 1.00 25.00 N ATOM 120 CA GLU A 10 13.904 18.306 -16.392 1.00 25.00 C ATOM 121 C GLU A 10 14.604 19.326 -15.500 1.00 25.00 C ATOM 122 O GLU A 10 14.746 20.493 -15.833 1.00 25.00 O ATOM 123 CB GLU A 10 12.876 18.996 -17.293 1.00 25.00 C ATOM 124 CG GLU A 10 12.161 18.032 -18.239 1.00 25.00 C ATOM 125 CD GLU A 10 10.979 18.679 -18.933 1.00 25.00 C ATOM 126 OE1 GLU A 10 9.978 18.966 -18.235 1.00 25.00 O ATOM 127 OE2 GLU A 10 11.021 18.859 -20.166 1.00 25.00 O ATOM 0 H GLU A 10 12.369 17.691 -15.100 1.00 25.00 H new ATOM 0 HA GLU A 10 14.647 17.813 -17.018 1.00 25.00 H new ATOM 0 HB2 GLU A 10 12.136 19.499 -16.670 1.00 25.00 H new ATOM 0 HB3 GLU A 10 13.376 19.767 -17.880 1.00 25.00 H new ATOM 0 HG2 GLU A 10 12.866 17.671 -18.988 1.00 25.00 H new ATOM 0 HG3 GLU A 10 11.819 17.162 -17.678 1.00 25.00 H new ATOM 134 N ILE A 11 14.988 18.866 -14.321 1.00 25.00 N ATOM 135 CA ILE A 11 15.511 19.680 -13.268 1.00 25.00 C ATOM 136 C ILE A 11 17.038 19.823 -13.446 1.00 25.00 C ATOM 137 O ILE A 11 17.760 20.424 -12.650 1.00 25.00 O ATOM 138 CB ILE A 11 15.022 18.936 -11.976 1.00 25.00 C ATOM 139 CG1 ILE A 11 13.511 19.182 -11.742 1.00 25.00 C ATOM 140 CG2 ILE A 11 15.834 19.227 -10.811 1.00 25.00 C ATOM 141 CD1 ILE A 11 13.090 20.649 -11.490 1.00 25.00 C ATOM 0 H ILE A 11 14.937 17.877 -14.075 1.00 25.00 H new ATOM 0 HA ILE A 11 15.172 20.715 -13.237 1.00 25.00 H new ATOM 0 HB ILE A 11 15.155 17.867 -12.144 1.00 25.00 H new ATOM 0 HG12 ILE A 11 12.965 18.813 -12.610 1.00 25.00 H new ATOM 0 HG13 ILE A 11 13.194 18.583 -10.888 1.00 25.00 H new ATOM 0 HG21 ILE A 11 15.444 18.683 -9.951 1.00 25.00 H new ATOM 0 HG22 ILE A 11 16.863 18.920 -10.999 1.00 25.00 H new ATOM 0 HG23 ILE A 11 15.806 20.297 -10.606 1.00 25.00 H new ATOM 0 HD11 ILE A 11 12.011 20.697 -11.340 1.00 25.00 H new ATOM 0 HD12 ILE A 11 13.597 21.026 -10.602 1.00 25.00 H new ATOM 0 HD13 ILE A 11 13.364 21.259 -12.351 1.00 25.00 H new ATOM 153 N THR A 12 17.501 19.306 -14.563 1.00 25.00 N ATOM 154 CA THR A 12 18.914 19.341 -14.928 1.00 25.00 C ATOM 155 C THR A 12 19.347 20.707 -15.459 1.00 25.00 C ATOM 156 O THR A 12 19.354 20.960 -16.663 1.00 25.00 O ATOM 157 CB THR A 12 19.222 18.303 -15.997 1.00 25.00 C ATOM 158 OG1 THR A 12 18.267 18.415 -17.053 1.00 25.00 O ATOM 159 CG2 THR A 12 19.134 16.893 -15.432 1.00 25.00 C ATOM 0 H THR A 12 16.909 18.844 -15.254 1.00 25.00 H new ATOM 0 HA THR A 12 19.466 19.126 -14.013 1.00 25.00 H new ATOM 0 HB THR A 12 20.233 18.484 -16.361 1.00 25.00 H new ATOM 0 HG1 THR A 12 18.223 19.346 -17.357 1.00 25.00 H new ATOM 0 HG21 THR A 12 19.359 16.172 -16.218 1.00 25.00 H new ATOM 0 HG22 THR A 12 19.852 16.781 -14.620 1.00 25.00 H new ATOM 0 HG23 THR A 12 18.128 16.715 -15.053 1.00 25.00 H new ATOM 167 N SER A 13 19.707 21.579 -14.537 1.00 25.00 N ATOM 168 CA SER A 13 20.165 22.930 -14.843 1.00 25.00 C ATOM 169 C SER A 13 20.941 23.408 -13.620 1.00 25.00 C ATOM 170 O SER A 13 20.799 22.831 -12.543 1.00 25.00 O ATOM 171 CB SER A 13 18.967 23.849 -15.109 1.00 25.00 C ATOM 172 OG SER A 13 19.388 25.161 -15.447 1.00 25.00 O ATOM 0 H SER A 13 19.691 21.371 -13.539 1.00 25.00 H new ATOM 0 HA SER A 13 20.790 22.944 -15.736 1.00 25.00 H new ATOM 0 HB2 SER A 13 18.364 23.438 -15.919 1.00 25.00 H new ATOM 0 HB3 SER A 13 18.331 23.886 -14.225 1.00 25.00 H new ATOM 0 HG SER A 13 18.603 25.724 -15.613 1.00 25.00 H new ATOM 178 N SER A 14 21.729 24.463 -13.776 1.00 25.00 N ATOM 179 CA SER A 14 22.527 25.013 -12.672 1.00 25.00 C ATOM 180 C SER A 14 22.146 26.452 -12.296 1.00 25.00 C ATOM 181 O SER A 14 22.995 27.344 -12.322 1.00 25.00 O ATOM 182 CB SER A 14 24.001 24.974 -13.068 1.00 25.00 C ATOM 183 OG SER A 14 24.378 23.653 -13.408 1.00 25.00 O ATOM 0 H SER A 14 21.838 24.962 -14.659 1.00 25.00 H new ATOM 0 HA SER A 14 22.328 24.398 -11.795 1.00 25.00 H new ATOM 0 HB2 SER A 14 24.176 25.640 -13.913 1.00 25.00 H new ATOM 0 HB3 SER A 14 24.617 25.336 -12.244 1.00 25.00 H new ATOM 0 HG SER A 14 25.347 23.551 -13.301 1.00 25.00 H new ATOM 189 N PRO A 15 20.864 26.714 -11.958 1.00 25.00 N ATOM 190 CA PRO A 15 20.558 28.134 -11.754 1.00 25.00 C ATOM 191 C PRO A 15 21.116 28.763 -10.479 1.00 25.00 C ATOM 192 O PRO A 15 21.546 29.906 -10.502 1.00 25.00 O ATOM 193 CB PRO A 15 19.028 28.148 -11.733 1.00 25.00 C ATOM 194 CG PRO A 15 18.650 26.818 -11.206 1.00 25.00 C ATOM 195 CD PRO A 15 19.653 25.878 -11.811 1.00 25.00 C ATOM 0 HA PRO A 15 21.026 28.735 -12.534 1.00 25.00 H new ATOM 0 HB2 PRO A 15 18.648 28.949 -11.099 1.00 25.00 H new ATOM 0 HB3 PRO A 15 18.619 28.310 -12.730 1.00 25.00 H new ATOM 0 HG2 PRO A 15 18.691 26.796 -10.117 1.00 25.00 H new ATOM 0 HG3 PRO A 15 17.633 26.552 -11.492 1.00 25.00 H new ATOM 0 HD2 PRO A 15 19.835 25.017 -11.168 1.00 25.00 H new ATOM 0 HD3 PRO A 15 19.313 25.492 -12.772 1.00 25.00 H new ATOM 203 N GLN A 16 21.120 28.026 -9.375 1.00 25.00 N ATOM 204 CA GLN A 16 21.542 28.574 -8.080 1.00 25.00 C ATOM 205 C GLN A 16 23.061 28.602 -7.890 1.00 25.00 C ATOM 206 O GLN A 16 23.553 28.360 -6.800 1.00 25.00 O ATOM 207 CB GLN A 16 20.900 27.773 -6.936 1.00 25.00 C ATOM 208 CG GLN A 16 19.380 27.828 -6.915 1.00 25.00 C ATOM 209 CD GLN A 16 18.812 27.202 -5.658 1.00 25.00 C ATOM 210 OE1 GLN A 16 19.026 26.024 -5.383 1.00 25.00 O ATOM 211 NE2 GLN A 16 18.104 27.981 -4.885 1.00 25.00 N ATOM 0 H GLN A 16 20.837 27.047 -9.345 1.00 25.00 H new ATOM 0 HA GLN A 16 21.203 29.610 -8.064 1.00 25.00 H new ATOM 0 HB2 GLN A 16 21.214 26.732 -7.015 1.00 25.00 H new ATOM 0 HB3 GLN A 16 21.280 28.149 -5.986 1.00 25.00 H new ATOM 0 HG2 GLN A 16 19.053 28.865 -6.984 1.00 25.00 H new ATOM 0 HG3 GLN A 16 18.985 27.310 -7.789 1.00 25.00 H new ATOM 0 HE21 GLN A 16 17.948 28.954 -5.147 1.00 25.00 H new ATOM 0 HE22 GLN A 16 17.707 27.616 -4.019 1.00 25.00 H new ATOM 220 N GLY A 17 23.806 28.882 -8.949 1.00 25.00 N ATOM 221 CA GLY A 17 25.254 29.009 -8.835 1.00 25.00 C ATOM 222 C GLY A 17 25.983 27.770 -8.352 1.00 25.00 C ATOM 223 O GLY A 17 27.029 27.886 -7.725 1.00 25.00 O ATOM 0 H GLY A 17 23.438 29.025 -9.889 1.00 25.00 H new ATOM 0 HA2 GLY A 17 25.654 29.288 -9.810 1.00 25.00 H new ATOM 0 HA3 GLY A 17 25.476 29.829 -8.152 1.00 25.00 H new ATOM 227 N LEU A 18 25.455 26.585 -8.628 1.00 25.00 N ATOM 228 CA LEU A 18 26.095 25.353 -8.152 1.00 25.00 C ATOM 229 C LEU A 18 27.436 25.104 -8.854 1.00 25.00 C ATOM 230 O LEU A 18 28.342 24.521 -8.270 1.00 25.00 O ATOM 231 CB LEU A 18 25.135 24.166 -8.246 1.00 25.00 C ATOM 232 CG LEU A 18 24.764 23.620 -9.622 1.00 25.00 C ATOM 233 CD1 LEU A 18 25.765 22.584 -10.062 1.00 25.00 C ATOM 234 CD2 LEU A 18 23.376 23.013 -9.541 1.00 25.00 C ATOM 0 H LEU A 18 24.601 26.445 -9.168 1.00 25.00 H new ATOM 0 HA LEU A 18 26.332 25.477 -7.095 1.00 25.00 H new ATOM 0 HB2 LEU A 18 25.569 23.346 -7.673 1.00 25.00 H new ATOM 0 HB3 LEU A 18 24.210 24.451 -7.745 1.00 25.00 H new ATOM 0 HG LEU A 18 24.772 24.427 -10.355 1.00 25.00 H new ATOM 0 HD11 LEU A 18 25.487 22.204 -11.045 1.00 25.00 H new ATOM 0 HD12 LEU A 18 26.756 23.035 -10.114 1.00 25.00 H new ATOM 0 HD13 LEU A 18 25.777 21.763 -9.346 1.00 25.00 H new ATOM 0 HD21 LEU A 18 23.094 22.617 -10.517 1.00 25.00 H new ATOM 0 HD22 LEU A 18 23.374 22.206 -8.808 1.00 25.00 H new ATOM 0 HD23 LEU A 18 22.661 23.779 -9.240 1.00 25.00 H new ATOM 246 N ASP A 19 27.579 25.618 -10.070 1.00 25.00 N ATOM 247 CA ASP A 19 28.846 25.524 -10.809 1.00 25.00 C ATOM 248 C ASP A 19 29.638 26.814 -10.621 1.00 25.00 C ATOM 249 O ASP A 19 30.749 26.972 -11.120 1.00 25.00 O ATOM 250 CB ASP A 19 28.579 25.310 -12.301 1.00 25.00 C ATOM 251 CG ASP A 19 28.057 23.923 -12.604 1.00 25.00 C ATOM 252 OD1 ASP A 19 27.034 23.817 -13.313 1.00 25.00 O ATOM 253 OD2 ASP A 19 28.650 22.938 -12.123 1.00 25.00 O ATOM 0 H ASP A 19 26.836 26.106 -10.571 1.00 25.00 H new ATOM 0 HA ASP A 19 29.415 24.677 -10.425 1.00 25.00 H new ATOM 0 HB2 ASP A 19 27.857 26.050 -12.647 1.00 25.00 H new ATOM 0 HB3 ASP A 19 29.500 25.478 -12.859 1.00 25.00 H new ATOM 258 N ASN A 20 29.042 27.758 -9.909 1.00 25.00 N ATOM 259 CA ASN A 20 29.626 29.062 -9.702 1.00 25.00 C ATOM 260 C ASN A 20 29.602 29.462 -8.236 1.00 25.00 C ATOM 261 O ASN A 20 28.848 30.362 -7.839 1.00 25.00 O ATOM 262 CB ASN A 20 28.832 30.087 -10.496 1.00 25.00 C ATOM 263 CG ASN A 20 28.986 29.926 -11.977 1.00 25.00 C ATOM 264 OD1 ASN A 20 28.191 29.270 -12.618 1.00 25.00 O ATOM 265 ND2 ASN A 20 29.980 30.567 -12.535 1.00 25.00 N ATOM 0 H ASN A 20 28.135 27.634 -9.459 1.00 25.00 H new ATOM 0 HA ASN A 20 30.664 29.024 -10.031 1.00 25.00 H new ATOM 0 HB2 ASN A 20 27.777 30.003 -10.235 1.00 25.00 H new ATOM 0 HB3 ASN A 20 29.153 31.089 -10.209 1.00 25.00 H new ATOM 0 HD21 ASN A 20 30.109 30.527 -13.546 1.00 25.00 H new ATOM 0 HD22 ASN A 20 30.626 31.107 -11.959 1.00 25.00 H new ATOM 272 N PRO A 21 30.482 28.864 -7.419 1.00 25.00 N ATOM 273 CA PRO A 21 30.543 29.255 -6.009 1.00 25.00 C ATOM 274 C PRO A 21 30.845 30.730 -5.825 1.00 25.00 C ATOM 275 O PRO A 21 30.385 31.337 -4.881 1.00 25.00 O ATOM 276 CB PRO A 21 31.701 28.407 -5.465 1.00 25.00 C ATOM 277 CG PRO A 21 32.477 28.031 -6.662 1.00 25.00 C ATOM 278 CD PRO A 21 31.485 27.831 -7.727 1.00 25.00 C ATOM 0 HA PRO A 21 29.592 29.095 -5.501 1.00 25.00 H new ATOM 0 HB2 PRO A 21 32.309 28.972 -4.759 1.00 25.00 H new ATOM 0 HB3 PRO A 21 31.335 27.527 -4.937 1.00 25.00 H new ATOM 0 HG2 PRO A 21 33.188 28.812 -6.930 1.00 25.00 H new ATOM 0 HG3 PRO A 21 33.053 27.122 -6.487 1.00 25.00 H new ATOM 0 HD2 PRO A 21 31.919 27.968 -8.718 1.00 25.00 H new ATOM 0 HD3 PRO A 21 31.058 26.829 -7.702 1.00 25.00 H new ATOM 286 N ALA A 22 31.600 31.313 -6.745 1.00 25.00 N ATOM 287 CA ALA A 22 31.934 32.725 -6.662 1.00 25.00 C ATOM 288 C ALA A 22 30.675 33.589 -6.730 1.00 25.00 C ATOM 289 O ALA A 22 30.504 34.501 -5.932 1.00 25.00 O ATOM 290 CB ALA A 22 32.902 33.090 -7.790 1.00 25.00 C ATOM 0 H ALA A 22 31.991 30.831 -7.554 1.00 25.00 H new ATOM 0 HA ALA A 22 32.415 32.917 -5.703 1.00 25.00 H new ATOM 0 HB1 ALA A 22 33.152 34.149 -7.727 1.00 25.00 H new ATOM 0 HB2 ALA A 22 33.811 32.497 -7.695 1.00 25.00 H new ATOM 0 HB3 ALA A 22 32.433 32.885 -8.752 1.00 25.00 H new ATOM 296 N LEU A 23 29.798 33.284 -7.678 1.00 25.00 N ATOM 297 CA LEU A 23 28.579 34.072 -7.873 1.00 25.00 C ATOM 298 C LEU A 23 27.589 33.812 -6.753 1.00 25.00 C ATOM 299 O LEU A 23 26.937 34.726 -6.267 1.00 25.00 O ATOM 300 CB LEU A 23 27.907 33.727 -9.211 1.00 25.00 C ATOM 301 CG LEU A 23 28.734 33.923 -10.493 1.00 25.00 C ATOM 302 CD1 LEU A 23 27.879 33.541 -11.700 1.00 25.00 C ATOM 303 CD2 LEU A 23 29.236 35.349 -10.660 1.00 25.00 C ATOM 0 H LEU A 23 29.903 32.501 -8.323 1.00 25.00 H new ATOM 0 HA LEU A 23 28.869 35.123 -7.874 1.00 25.00 H new ATOM 0 HB2 LEU A 23 27.592 32.684 -9.170 1.00 25.00 H new ATOM 0 HB3 LEU A 23 27.003 34.330 -9.299 1.00 25.00 H new ATOM 0 HG LEU A 23 29.612 33.282 -10.417 1.00 25.00 H new ATOM 0 HD11 LEU A 23 28.458 33.677 -12.614 1.00 25.00 H new ATOM 0 HD12 LEU A 23 27.575 32.498 -11.615 1.00 25.00 H new ATOM 0 HD13 LEU A 23 26.993 34.175 -11.734 1.00 25.00 H new ATOM 0 HD21 LEU A 23 29.813 35.426 -11.582 1.00 25.00 H new ATOM 0 HD22 LEU A 23 28.387 36.031 -10.705 1.00 25.00 H new ATOM 0 HD23 LEU A 23 29.869 35.613 -9.813 1.00 25.00 H new ATOM 315 N LEU A 24 27.478 32.561 -6.335 1.00 25.00 N ATOM 316 CA LEU A 24 26.545 32.209 -5.272 1.00 25.00 C ATOM 317 C LEU A 24 26.964 32.838 -3.953 1.00 25.00 C ATOM 318 O LEU A 24 26.135 33.344 -3.211 1.00 25.00 O ATOM 319 CB LEU A 24 26.458 30.692 -5.111 1.00 25.00 C ATOM 320 CG LEU A 24 25.472 30.229 -4.023 1.00 25.00 C ATOM 321 CD1 LEU A 24 24.067 30.797 -4.210 1.00 25.00 C ATOM 322 CD2 LEU A 24 25.427 28.729 -3.982 1.00 25.00 C ATOM 0 H LEU A 24 28.015 31.779 -6.709 1.00 25.00 H new ATOM 0 HA LEU A 24 25.564 32.594 -5.550 1.00 25.00 H new ATOM 0 HB2 LEU A 24 26.163 30.253 -6.064 1.00 25.00 H new ATOM 0 HB3 LEU A 24 27.450 30.305 -4.876 1.00 25.00 H new ATOM 0 HG LEU A 24 25.839 30.616 -3.072 1.00 25.00 H new ATOM 0 HD11 LEU A 24 23.419 30.434 -3.412 1.00 25.00 H new ATOM 0 HD12 LEU A 24 24.107 31.886 -4.178 1.00 25.00 H new ATOM 0 HD13 LEU A 24 23.670 30.477 -5.174 1.00 25.00 H new ATOM 0 HD21 LEU A 24 24.728 28.407 -3.210 1.00 25.00 H new ATOM 0 HD22 LEU A 24 25.100 28.348 -4.950 1.00 25.00 H new ATOM 0 HD23 LEU A 24 26.420 28.341 -3.756 1.00 25.00 H new ATOM 334 N ARG A 25 28.261 32.839 -3.680 1.00 25.00 N ATOM 335 CA ARG A 25 28.793 33.449 -2.459 1.00 25.00 C ATOM 336 C ARG A 25 28.402 34.906 -2.462 1.00 25.00 C ATOM 337 O ARG A 25 27.960 35.447 -1.466 1.00 25.00 O ATOM 338 CB ARG A 25 30.323 33.323 -2.441 1.00 25.00 C ATOM 339 CG ARG A 25 31.008 33.907 -1.214 1.00 25.00 C ATOM 340 CD ARG A 25 32.381 34.449 -1.562 1.00 25.00 C ATOM 341 NE ARG A 25 32.288 35.667 -2.391 1.00 25.00 N ATOM 342 CZ ARG A 25 33.163 36.666 -2.398 1.00 25.00 C ATOM 343 NH1 ARG A 25 34.241 36.663 -1.652 1.00 25.00 N ATOM 344 NH2 ARG A 25 32.949 37.700 -3.162 1.00 25.00 N ATOM 0 H ARG A 25 28.969 32.425 -4.286 1.00 25.00 H new ATOM 0 HA ARG A 25 28.392 32.949 -1.577 1.00 25.00 H new ATOM 0 HB2 ARG A 25 30.585 32.268 -2.516 1.00 25.00 H new ATOM 0 HB3 ARG A 25 30.722 33.814 -3.328 1.00 25.00 H new ATOM 0 HG2 ARG A 25 30.394 34.705 -0.796 1.00 25.00 H new ATOM 0 HG3 ARG A 25 31.100 33.140 -0.445 1.00 25.00 H new ATOM 0 HD2 ARG A 25 32.928 34.672 -0.646 1.00 25.00 H new ATOM 0 HD3 ARG A 25 32.950 33.687 -2.095 1.00 25.00 H new ATOM 0 HE ARG A 25 31.483 35.748 -3.012 1.00 25.00 H new ATOM 0 HH11 ARG A 25 34.433 35.873 -1.036 1.00 25.00 H new ATOM 0 HH12 ARG A 25 34.888 37.451 -1.687 1.00 25.00 H new ATOM 0 HH21 ARG A 25 32.115 37.737 -3.748 1.00 25.00 H new ATOM 0 HH22 ARG A 25 33.616 38.472 -3.174 1.00 25.00 H new ATOM 358 N ASP A 26 28.565 35.535 -3.606 1.00 25.00 N ATOM 359 CA ASP A 26 28.267 36.948 -3.747 1.00 25.00 C ATOM 360 C ASP A 26 26.774 37.242 -3.543 1.00 25.00 C ATOM 361 O ASP A 26 26.410 38.160 -2.810 1.00 25.00 O ATOM 362 CB ASP A 26 28.725 37.391 -5.126 1.00 25.00 C ATOM 363 CG ASP A 26 29.513 38.678 -5.081 1.00 25.00 C ATOM 364 OD1 ASP A 26 29.070 39.696 -5.641 1.00 25.00 O ATOM 365 OD2 ASP A 26 30.621 38.648 -4.489 1.00 25.00 O ATOM 0 H ASP A 26 28.904 35.089 -4.458 1.00 25.00 H new ATOM 0 HA ASP A 26 28.797 37.507 -2.976 1.00 25.00 H new ATOM 0 HB2 ASP A 26 29.338 36.608 -5.572 1.00 25.00 H new ATOM 0 HB3 ASP A 26 27.856 37.522 -5.771 1.00 25.00 H new ATOM 370 N MET A 27 25.915 36.418 -4.132 1.00 25.00 N ATOM 371 CA MET A 27 24.464 36.563 -3.967 1.00 25.00 C ATOM 372 C MET A 27 24.061 36.376 -2.515 1.00 25.00 C ATOM 373 O MET A 27 23.260 37.130 -1.988 1.00 25.00 O ATOM 374 CB MET A 27 23.728 35.522 -4.814 1.00 25.00 C ATOM 375 CG MET A 27 22.215 35.728 -4.849 1.00 25.00 C ATOM 376 SD MET A 27 21.371 34.432 -5.781 1.00 25.00 S ATOM 377 CE MET A 27 21.205 33.123 -4.526 1.00 25.00 C ATOM 0 H MET A 27 26.194 35.640 -4.730 1.00 25.00 H new ATOM 0 HA MET A 27 24.194 37.568 -4.291 1.00 25.00 H new ATOM 0 HB2 MET A 27 24.115 35.554 -5.832 1.00 25.00 H new ATOM 0 HB3 MET A 27 23.943 34.528 -4.422 1.00 25.00 H new ATOM 0 HG2 MET A 27 21.829 35.750 -3.830 1.00 25.00 H new ATOM 0 HG3 MET A 27 21.992 36.697 -5.295 1.00 25.00 H new ATOM 0 HE1 MET A 27 21.040 32.165 -5.019 1.00 25.00 H new ATOM 0 HE2 MET A 27 22.116 33.072 -3.930 1.00 25.00 H new ATOM 0 HE3 MET A 27 20.359 33.347 -3.876 1.00 25.00 H new ATOM 387 N LEU A 28 24.626 35.370 -1.871 1.00 25.00 N ATOM 388 CA LEU A 28 24.321 35.072 -0.481 1.00 25.00 C ATOM 389 C LEU A 28 24.740 36.198 0.438 1.00 25.00 C ATOM 390 O LEU A 28 24.008 36.573 1.341 1.00 25.00 O ATOM 391 CB LEU A 28 25.044 33.816 -0.068 1.00 25.00 C ATOM 392 CG LEU A 28 24.240 32.560 -0.363 1.00 25.00 C ATOM 393 CD1 LEU A 28 25.178 31.416 -0.452 1.00 25.00 C ATOM 394 CD2 LEU A 28 23.231 32.342 0.734 1.00 25.00 C ATOM 0 H LEU A 28 25.306 34.739 -2.294 1.00 25.00 H new ATOM 0 HA LEU A 28 23.242 34.943 -0.398 1.00 25.00 H new ATOM 0 HB2 LEU A 28 26.000 33.763 -0.589 1.00 25.00 H new ATOM 0 HB3 LEU A 28 25.264 33.861 0.999 1.00 25.00 H new ATOM 0 HG LEU A 28 23.702 32.659 -1.306 1.00 25.00 H new ATOM 0 HD11 LEU A 28 24.620 30.504 -0.663 1.00 25.00 H new ATOM 0 HD12 LEU A 28 25.896 31.596 -1.252 1.00 25.00 H new ATOM 0 HD13 LEU A 28 25.708 31.306 0.494 1.00 25.00 H new ATOM 0 HD21 LEU A 28 22.654 31.442 0.524 1.00 25.00 H new ATOM 0 HD22 LEU A 28 23.748 32.227 1.687 1.00 25.00 H new ATOM 0 HD23 LEU A 28 22.560 33.199 0.787 1.00 25.00 H new ATOM 406 N LEU A 29 25.916 36.751 0.189 1.00 25.00 N ATOM 407 CA LEU A 29 26.426 37.859 1.003 1.00 25.00 C ATOM 408 C LEU A 29 25.504 39.065 0.882 1.00 25.00 C ATOM 409 O LEU A 29 25.287 39.797 1.846 1.00 25.00 O ATOM 410 CB LEU A 29 27.841 38.251 0.555 1.00 25.00 C ATOM 411 CG LEU A 29 28.978 37.319 1.009 1.00 25.00 C ATOM 412 CD1 LEU A 29 30.235 37.592 0.183 1.00 25.00 C ATOM 413 CD2 LEU A 29 29.288 37.495 2.498 1.00 25.00 C ATOM 0 H LEU A 29 26.538 36.458 -0.565 1.00 25.00 H new ATOM 0 HA LEU A 29 26.461 37.532 2.042 1.00 25.00 H new ATOM 0 HB2 LEU A 29 27.854 38.303 -0.534 1.00 25.00 H new ATOM 0 HB3 LEU A 29 28.052 39.255 0.924 1.00 25.00 H new ATOM 0 HG LEU A 29 28.651 36.291 0.852 1.00 25.00 H new ATOM 0 HD11 LEU A 29 31.036 36.929 0.510 1.00 25.00 H new ATOM 0 HD12 LEU A 29 30.023 37.414 -0.871 1.00 25.00 H new ATOM 0 HD13 LEU A 29 30.543 38.628 0.321 1.00 25.00 H new ATOM 0 HD21 LEU A 29 30.096 36.821 2.784 1.00 25.00 H new ATOM 0 HD22 LEU A 29 29.590 38.525 2.687 1.00 25.00 H new ATOM 0 HD23 LEU A 29 28.399 37.264 3.085 1.00 25.00 H new ATOM 425 N ALA A 30 24.953 39.253 -0.306 1.00 25.00 N ATOM 426 CA ALA A 30 24.048 40.362 -0.575 1.00 25.00 C ATOM 427 C ALA A 30 22.598 40.082 -0.143 1.00 25.00 C ATOM 428 O ALA A 30 21.768 40.992 -0.155 1.00 25.00 O ATOM 429 CB ALA A 30 24.091 40.690 -2.075 1.00 25.00 C ATOM 0 H ALA A 30 25.118 38.645 -1.108 1.00 25.00 H new ATOM 0 HA ALA A 30 24.388 41.210 0.019 1.00 25.00 H new ATOM 0 HB1 ALA A 30 23.416 41.520 -2.286 1.00 25.00 H new ATOM 0 HB2 ALA A 30 25.106 40.968 -2.358 1.00 25.00 H new ATOM 0 HB3 ALA A 30 23.781 39.816 -2.648 1.00 25.00 H new ATOM 435 N ASN A 31 22.270 38.837 0.186 1.00 25.00 N ATOM 436 CA ASN A 31 20.881 38.471 0.474 1.00 25.00 C ATOM 437 C ASN A 31 20.683 38.052 1.932 1.00 25.00 C ATOM 438 O ASN A 31 20.995 36.921 2.314 1.00 25.00 O ATOM 439 CB ASN A 31 20.436 37.351 -0.465 1.00 25.00 C ATOM 440 CG ASN A 31 18.946 37.182 -0.484 1.00 25.00 C ATOM 441 OD1 ASN A 31 18.280 37.235 0.549 1.00 25.00 O ATOM 442 ND2 ASN A 31 18.410 36.968 -1.653 1.00 25.00 N ATOM 0 H ASN A 31 22.937 38.069 0.260 1.00 25.00 H new ATOM 0 HA ASN A 31 20.265 39.355 0.308 1.00 25.00 H new ATOM 0 HB2 ASN A 31 20.788 37.565 -1.474 1.00 25.00 H new ATOM 0 HB3 ASN A 31 20.902 36.415 -0.157 1.00 25.00 H new ATOM 0 HD21 ASN A 31 17.402 36.837 -1.736 1.00 25.00 H new ATOM 0 HD22 ASN A 31 18.999 36.932 -2.485 1.00 25.00 H new ATOM 449 N PRO A 32 20.127 38.949 2.767 1.00 25.00 N ATOM 450 CA PRO A 32 20.005 38.594 4.184 1.00 25.00 C ATOM 451 C PRO A 32 19.051 37.437 4.487 1.00 25.00 C ATOM 452 O PRO A 32 19.216 36.753 5.491 1.00 25.00 O ATOM 453 CB PRO A 32 19.519 39.899 4.822 1.00 25.00 C ATOM 454 CG PRO A 32 18.794 40.593 3.726 1.00 25.00 C ATOM 455 CD PRO A 32 19.624 40.314 2.515 1.00 25.00 C ATOM 0 HA PRO A 32 20.952 38.221 4.573 1.00 25.00 H new ATOM 0 HB2 PRO A 32 18.865 39.707 5.673 1.00 25.00 H new ATOM 0 HB3 PRO A 32 20.353 40.497 5.189 1.00 25.00 H new ATOM 0 HG2 PRO A 32 17.780 40.210 3.612 1.00 25.00 H new ATOM 0 HG3 PRO A 32 18.711 41.663 3.916 1.00 25.00 H new ATOM 0 HD2 PRO A 32 19.034 40.364 1.600 1.00 25.00 H new ATOM 0 HD3 PRO A 32 20.438 41.031 2.409 1.00 25.00 H new ATOM 463 N HIS A 33 18.065 37.196 3.635 1.00 25.00 N ATOM 464 CA HIS A 33 17.142 36.086 3.855 1.00 25.00 C ATOM 465 C HIS A 33 17.809 34.763 3.495 1.00 25.00 C ATOM 466 O HIS A 33 17.652 33.760 4.187 1.00 25.00 O ATOM 467 CB HIS A 33 15.882 36.256 3.002 1.00 25.00 C ATOM 468 CG HIS A 33 14.866 35.177 3.219 1.00 25.00 C ATOM 469 ND1 HIS A 33 13.890 35.213 4.184 1.00 25.00 N ATOM 470 CD2 HIS A 33 14.681 33.989 2.574 1.00 25.00 C ATOM 471 CE1 HIS A 33 13.179 34.092 4.097 1.00 25.00 C ATOM 472 NE2 HIS A 33 13.620 33.307 3.137 1.00 25.00 N ATOM 0 H HIS A 33 17.882 37.745 2.795 1.00 25.00 H new ATOM 0 HA HIS A 33 16.867 36.082 4.910 1.00 25.00 H new ATOM 0 HB2 HIS A 33 15.429 37.222 3.225 1.00 25.00 H new ATOM 0 HB3 HIS A 33 16.164 36.272 1.949 1.00 25.00 H new ATOM 0 HD2 HIS A 33 15.276 33.634 1.746 1.00 25.00 H new ATOM 0 HE1 HIS A 33 12.342 33.855 4.736 1.00 25.00 H new ATOM 0 HE2 HIS A 33 13.257 32.393 2.867 1.00 25.00 H new ATOM 480 N GLU A 34 18.541 34.768 2.396 1.00 25.00 N ATOM 481 CA GLU A 34 19.143 33.548 1.871 1.00 25.00 C ATOM 482 C GLU A 34 20.286 33.136 2.780 1.00 25.00 C ATOM 483 O GLU A 34 20.414 31.992 3.165 1.00 25.00 O ATOM 484 CB GLU A 34 19.631 33.792 0.443 1.00 25.00 C ATOM 485 CG GLU A 34 19.177 32.761 -0.573 1.00 25.00 C ATOM 486 CD GLU A 34 20.091 31.541 -0.644 1.00 25.00 C ATOM 487 OE1 GLU A 34 20.860 31.433 -1.623 1.00 25.00 O ATOM 488 OE2 GLU A 34 20.046 30.695 0.273 1.00 25.00 O ATOM 0 H GLU A 34 18.736 35.604 1.845 1.00 25.00 H new ATOM 0 HA GLU A 34 18.410 32.742 1.843 1.00 25.00 H new ATOM 0 HB2 GLU A 34 19.287 34.775 0.120 1.00 25.00 H new ATOM 0 HB3 GLU A 34 20.721 33.821 0.447 1.00 25.00 H new ATOM 0 HG2 GLU A 34 18.167 32.436 -0.324 1.00 25.00 H new ATOM 0 HG3 GLU A 34 19.128 33.228 -1.557 1.00 25.00 H new ATOM 495 N LEU A 35 21.074 34.101 3.216 1.00 25.00 N ATOM 496 CA LEU A 35 22.165 33.806 4.128 1.00 25.00 C ATOM 497 C LEU A 35 21.637 33.253 5.458 1.00 25.00 C ATOM 498 O LEU A 35 22.297 32.451 6.114 1.00 25.00 O ATOM 499 CB LEU A 35 23.038 35.036 4.269 1.00 25.00 C ATOM 500 CG LEU A 35 22.786 36.161 5.270 1.00 25.00 C ATOM 501 CD1 LEU A 35 22.940 35.782 6.735 1.00 25.00 C ATOM 502 CD2 LEU A 35 23.804 37.201 4.893 1.00 25.00 C ATOM 0 H LEU A 35 20.982 35.084 2.958 1.00 25.00 H new ATOM 0 HA LEU A 35 22.794 33.012 3.725 1.00 25.00 H new ATOM 0 HB2 LEU A 35 24.045 34.671 4.471 1.00 25.00 H new ATOM 0 HB3 LEU A 35 23.061 35.505 3.286 1.00 25.00 H new ATOM 0 HG LEU A 35 21.747 36.485 5.207 1.00 25.00 H new ATOM 0 HD11 LEU A 35 22.739 36.653 7.359 1.00 25.00 H new ATOM 0 HD12 LEU A 35 22.235 34.988 6.982 1.00 25.00 H new ATOM 0 HD13 LEU A 35 23.957 35.433 6.916 1.00 25.00 H new ATOM 0 HD21 LEU A 35 23.709 38.061 5.556 1.00 25.00 H new ATOM 0 HD22 LEU A 35 24.805 36.780 4.985 1.00 25.00 H new ATOM 0 HD23 LEU A 35 23.637 37.517 3.863 1.00 25.00 H new ATOM 514 N SER A 36 20.438 33.680 5.841 1.00 25.00 N ATOM 515 CA SER A 36 19.787 33.219 7.066 1.00 25.00 C ATOM 516 C SER A 36 19.245 31.807 6.919 1.00 25.00 C ATOM 517 O SER A 36 19.387 30.996 7.813 1.00 25.00 O ATOM 518 CB SER A 36 18.659 34.159 7.480 1.00 25.00 C ATOM 519 OG SER A 36 19.185 35.434 7.812 1.00 25.00 O ATOM 0 H SER A 36 19.888 34.356 5.311 1.00 25.00 H new ATOM 0 HA SER A 36 20.550 33.216 7.844 1.00 25.00 H new ATOM 0 HB2 SER A 36 17.938 34.254 6.668 1.00 25.00 H new ATOM 0 HB3 SER A 36 18.124 33.744 8.334 1.00 25.00 H new ATOM 0 HG SER A 36 19.337 35.949 6.992 1.00 25.00 H new ATOM 525 N LEU A 37 18.647 31.488 5.785 1.00 25.00 N ATOM 526 CA LEU A 37 18.155 30.133 5.574 1.00 25.00 C ATOM 527 C LEU A 37 19.322 29.225 5.504 1.00 25.00 C ATOM 528 O LEU A 37 19.262 28.092 5.911 1.00 25.00 O ATOM 529 CB LEU A 37 17.287 30.031 4.332 1.00 25.00 C ATOM 530 CG LEU A 37 17.757 30.049 2.872 1.00 25.00 C ATOM 531 CD1 LEU A 37 18.402 28.759 2.434 1.00 25.00 C ATOM 532 CD2 LEU A 37 16.535 30.325 2.000 1.00 25.00 C ATOM 0 H LEU A 37 18.491 32.131 5.009 1.00 25.00 H new ATOM 0 HA LEU A 37 17.514 29.845 6.407 1.00 25.00 H new ATOM 0 HB2 LEU A 37 16.729 29.101 4.445 1.00 25.00 H new ATOM 0 HB3 LEU A 37 16.568 30.846 4.414 1.00 25.00 H new ATOM 0 HG LEU A 37 18.520 30.821 2.771 1.00 25.00 H new ATOM 0 HD11 LEU A 37 18.710 28.842 1.392 1.00 25.00 H new ATOM 0 HD12 LEU A 37 19.275 28.559 3.056 1.00 25.00 H new ATOM 0 HD13 LEU A 37 17.688 27.942 2.537 1.00 25.00 H new ATOM 0 HD21 LEU A 37 16.833 30.345 0.952 1.00 25.00 H new ATOM 0 HD22 LEU A 37 15.795 29.540 2.152 1.00 25.00 H new ATOM 0 HD23 LEU A 37 16.103 31.288 2.273 1.00 25.00 H new ATOM 544 N LEU A 38 20.399 29.732 4.961 1.00 25.00 N ATOM 545 CA LEU A 38 21.588 28.952 4.805 1.00 25.00 C ATOM 546 C LEU A 38 22.203 28.545 6.127 1.00 25.00 C ATOM 547 O LEU A 38 22.555 27.397 6.301 1.00 25.00 O ATOM 548 CB LEU A 38 22.557 29.746 3.973 1.00 25.00 C ATOM 549 CG LEU A 38 23.798 28.946 3.561 1.00 25.00 C ATOM 550 CD1 LEU A 38 23.407 27.813 2.642 1.00 25.00 C ATOM 551 CD2 LEU A 38 24.836 29.816 2.901 1.00 25.00 C ATOM 0 H LEU A 38 20.471 30.690 4.619 1.00 25.00 H new ATOM 0 HA LEU A 38 21.333 28.017 4.306 1.00 25.00 H new ATOM 0 HB2 LEU A 38 22.049 30.103 3.077 1.00 25.00 H new ATOM 0 HB3 LEU A 38 22.870 30.627 4.534 1.00 25.00 H new ATOM 0 HG LEU A 38 24.241 28.538 4.469 1.00 25.00 H new ATOM 0 HD11 LEU A 38 24.297 27.252 2.356 1.00 25.00 H new ATOM 0 HD12 LEU A 38 22.711 27.151 3.157 1.00 25.00 H new ATOM 0 HD13 LEU A 38 22.931 28.217 1.749 1.00 25.00 H new ATOM 0 HD21 LEU A 38 25.698 29.209 2.625 1.00 25.00 H new ATOM 0 HD22 LEU A 38 24.413 30.272 2.006 1.00 25.00 H new ATOM 0 HD23 LEU A 38 25.149 30.597 3.593 1.00 25.00 H new ATOM 563 N LYS A 39 22.287 29.454 7.084 1.00 25.00 N ATOM 564 CA LYS A 39 22.797 29.075 8.415 1.00 25.00 C ATOM 565 C LYS A 39 21.844 28.129 9.133 1.00 25.00 C ATOM 566 O LYS A 39 22.284 27.294 9.909 1.00 25.00 O ATOM 567 CB LYS A 39 23.135 30.293 9.293 1.00 25.00 C ATOM 568 CG LYS A 39 22.077 31.389 9.311 1.00 25.00 C ATOM 569 CD LYS A 39 22.331 32.453 10.360 1.00 25.00 C ATOM 570 CE LYS A 39 23.466 33.380 9.941 1.00 25.00 C ATOM 571 NZ LYS A 39 23.623 34.503 10.922 1.00 25.00 N ATOM 0 H LYS A 39 22.021 30.433 6.983 1.00 25.00 H new ATOM 0 HA LYS A 39 23.733 28.544 8.241 1.00 25.00 H new ATOM 0 HB2 LYS A 39 23.299 29.951 10.315 1.00 25.00 H new ATOM 0 HB3 LYS A 39 24.075 30.722 8.946 1.00 25.00 H new ATOM 0 HG2 LYS A 39 22.036 31.860 8.329 1.00 25.00 H new ATOM 0 HG3 LYS A 39 21.101 30.939 9.490 1.00 25.00 H new ATOM 0 HD2 LYS A 39 21.423 33.035 10.519 1.00 25.00 H new ATOM 0 HD3 LYS A 39 22.577 31.979 11.310 1.00 25.00 H new ATOM 0 HE2 LYS A 39 24.397 32.816 9.874 1.00 25.00 H new ATOM 0 HE3 LYS A 39 23.265 33.783 8.948 1.00 25.00 H new ATOM 0 HZ1 LYS A 39 24.401 35.123 10.619 1.00 25.00 H new ATOM 0 HZ2 LYS A 39 22.740 35.051 10.966 1.00 25.00 H new ATOM 0 HZ3 LYS A 39 23.837 34.115 11.863 1.00 25.00 H new ATOM 585 N GLU A 40 20.560 28.224 8.831 1.00 25.00 N ATOM 586 CA GLU A 40 19.571 27.327 9.427 1.00 25.00 C ATOM 587 C GLU A 40 19.593 25.932 8.779 1.00 25.00 C ATOM 588 O GLU A 40 19.670 24.916 9.461 1.00 25.00 O ATOM 589 CB GLU A 40 18.176 27.944 9.273 1.00 25.00 C ATOM 590 CG GLU A 40 17.933 29.152 10.185 1.00 25.00 C ATOM 591 CD GLU A 40 18.096 28.819 11.660 1.00 25.00 C ATOM 592 OE1 GLU A 40 17.400 27.904 12.151 1.00 25.00 O ATOM 593 OE2 GLU A 40 18.918 29.484 12.331 1.00 25.00 O ATOM 0 H GLU A 40 20.174 28.908 8.180 1.00 25.00 H new ATOM 0 HA GLU A 40 19.820 27.203 10.481 1.00 25.00 H new ATOM 0 HB2 GLU A 40 18.036 28.249 8.236 1.00 25.00 H new ATOM 0 HB3 GLU A 40 17.426 27.182 9.486 1.00 25.00 H new ATOM 0 HG2 GLU A 40 18.628 29.949 9.918 1.00 25.00 H new ATOM 0 HG3 GLU A 40 16.927 29.535 10.013 1.00 25.00 H new ATOM 600 N ARG A 41 19.508 25.883 7.455 1.00 25.00 N ATOM 601 CA ARG A 41 19.467 24.603 6.724 1.00 25.00 C ATOM 602 C ARG A 41 20.826 23.932 6.563 1.00 25.00 C ATOM 603 O ARG A 41 20.919 22.710 6.488 1.00 25.00 O ATOM 604 CB ARG A 41 18.890 24.828 5.322 1.00 25.00 C ATOM 605 CG ARG A 41 17.483 25.390 5.330 1.00 25.00 C ATOM 606 CD ARG A 41 16.916 25.481 3.911 1.00 25.00 C ATOM 607 NE ARG A 41 15.665 26.264 3.859 1.00 25.00 N ATOM 608 CZ ARG A 41 15.071 26.696 2.745 1.00 25.00 C ATOM 609 NH1 ARG A 41 15.556 26.462 1.550 1.00 25.00 N ATOM 610 NH2 ARG A 41 13.971 27.388 2.836 1.00 25.00 N ATOM 0 H ARG A 41 19.466 26.709 6.858 1.00 25.00 H new ATOM 0 HA ARG A 41 18.843 23.943 7.327 1.00 25.00 H new ATOM 0 HB2 ARG A 41 19.542 25.509 4.775 1.00 25.00 H new ATOM 0 HB3 ARG A 41 18.892 23.882 4.781 1.00 25.00 H new ATOM 0 HG2 ARG A 41 16.839 24.758 5.942 1.00 25.00 H new ATOM 0 HG3 ARG A 41 17.486 26.379 5.787 1.00 25.00 H new ATOM 0 HD2 ARG A 41 17.656 25.938 3.254 1.00 25.00 H new ATOM 0 HD3 ARG A 41 16.730 24.477 3.531 1.00 25.00 H new ATOM 0 HE ARG A 41 15.219 26.493 4.747 1.00 25.00 H new ATOM 0 HH11 ARG A 41 16.420 25.931 1.445 1.00 25.00 H new ATOM 0 HH12 ARG A 41 15.069 26.811 0.725 1.00 25.00 H new ATOM 0 HH21 ARG A 41 13.573 27.594 3.752 1.00 25.00 H new ATOM 0 HH22 ARG A 41 13.508 27.723 1.991 1.00 25.00 H new ATOM 624 N ASN A 42 21.860 24.742 6.411 1.00 25.00 N ATOM 625 CA ASN A 42 23.217 24.250 6.114 1.00 25.00 C ATOM 626 C ASN A 42 24.341 24.990 6.862 1.00 25.00 C ATOM 627 O ASN A 42 25.134 25.715 6.242 1.00 25.00 O ATOM 628 CB ASN A 42 23.487 24.396 4.613 1.00 25.00 C ATOM 629 CG ASN A 42 24.614 23.519 4.142 1.00 25.00 C ATOM 630 OD1 ASN A 42 25.345 22.946 4.923 1.00 25.00 O ATOM 631 ND2 ASN A 42 24.754 23.411 2.859 1.00 25.00 N ATOM 0 H ASN A 42 21.795 25.757 6.487 1.00 25.00 H new ATOM 0 HA ASN A 42 23.234 23.212 6.447 1.00 25.00 H new ATOM 0 HB2 ASN A 42 22.582 24.148 4.059 1.00 25.00 H new ATOM 0 HB3 ASN A 42 23.723 25.436 4.389 1.00 25.00 H new ATOM 0 HD21 ASN A 42 25.498 22.829 2.474 1.00 25.00 H new ATOM 0 HD22 ASN A 42 24.120 23.908 2.233 1.00 25.00 H new ATOM 638 N PRO A 43 24.455 24.798 8.187 1.00 25.00 N ATOM 639 CA PRO A 43 25.531 25.541 8.864 1.00 25.00 C ATOM 640 C PRO A 43 26.982 25.395 8.328 1.00 25.00 C ATOM 641 O PRO A 43 27.697 26.396 8.292 1.00 25.00 O ATOM 642 CB PRO A 43 25.402 25.099 10.329 1.00 25.00 C ATOM 643 CG PRO A 43 24.597 23.838 10.299 1.00 25.00 C ATOM 644 CD PRO A 43 23.668 23.990 9.137 1.00 25.00 C ATOM 0 HA PRO A 43 25.388 26.607 8.685 1.00 25.00 H new ATOM 0 HB2 PRO A 43 26.382 24.928 10.775 1.00 25.00 H new ATOM 0 HB3 PRO A 43 24.909 25.865 10.928 1.00 25.00 H new ATOM 0 HG2 PRO A 43 25.238 22.965 10.178 1.00 25.00 H new ATOM 0 HG3 PRO A 43 24.045 23.702 11.229 1.00 25.00 H new ATOM 0 HD2 PRO A 43 23.391 23.025 8.713 1.00 25.00 H new ATOM 0 HD3 PRO A 43 22.743 24.490 9.423 1.00 25.00 H new ATOM 652 N PRO A 44 27.428 24.199 7.859 1.00 25.00 N ATOM 653 CA PRO A 44 28.810 24.270 7.350 1.00 25.00 C ATOM 654 C PRO A 44 29.010 25.056 6.035 1.00 25.00 C ATOM 655 O PRO A 44 30.076 25.631 5.825 1.00 25.00 O ATOM 656 CB PRO A 44 29.184 22.797 7.171 1.00 25.00 C ATOM 657 CG PRO A 44 27.916 22.138 6.867 1.00 25.00 C ATOM 658 CD PRO A 44 26.911 22.818 7.762 1.00 25.00 C ATOM 0 HA PRO A 44 29.438 24.829 8.044 1.00 25.00 H new ATOM 0 HB2 PRO A 44 29.905 22.665 6.364 1.00 25.00 H new ATOM 0 HB3 PRO A 44 29.638 22.389 8.074 1.00 25.00 H new ATOM 0 HG2 PRO A 44 27.652 22.252 5.816 1.00 25.00 H new ATOM 0 HG3 PRO A 44 27.967 21.068 7.069 1.00 25.00 H new ATOM 0 HD2 PRO A 44 25.909 22.792 7.335 1.00 25.00 H new ATOM 0 HD3 PRO A 44 26.853 22.340 8.740 1.00 25.00 H new ATOM 666 N LEU A 45 28.014 25.129 5.153 1.00 25.00 N ATOM 667 CA LEU A 45 28.173 25.975 3.961 1.00 25.00 C ATOM 668 C LEU A 45 28.018 27.420 4.393 1.00 25.00 C ATOM 669 O LEU A 45 28.657 28.323 3.855 1.00 25.00 O ATOM 670 CB LEU A 45 27.160 25.628 2.866 1.00 25.00 C ATOM 671 CG LEU A 45 27.226 26.442 1.550 1.00 25.00 C ATOM 672 CD1 LEU A 45 28.610 26.451 0.897 1.00 25.00 C ATOM 673 CD2 LEU A 45 26.229 25.854 0.551 1.00 25.00 C ATOM 0 H LEU A 45 27.123 24.638 5.229 1.00 25.00 H new ATOM 0 HA LEU A 45 29.160 25.804 3.530 1.00 25.00 H new ATOM 0 HB2 LEU A 45 27.282 24.574 2.616 1.00 25.00 H new ATOM 0 HB3 LEU A 45 26.160 25.743 3.284 1.00 25.00 H new ATOM 0 HG LEU A 45 26.987 27.473 1.813 1.00 25.00 H new ATOM 0 HD11 LEU A 45 28.576 27.041 -0.019 1.00 25.00 H new ATOM 0 HD12 LEU A 45 29.334 26.889 1.584 1.00 25.00 H new ATOM 0 HD13 LEU A 45 28.907 25.429 0.660 1.00 25.00 H new ATOM 0 HD21 LEU A 45 26.268 26.421 -0.379 1.00 25.00 H new ATOM 0 HD22 LEU A 45 26.484 24.813 0.352 1.00 25.00 H new ATOM 0 HD23 LEU A 45 25.223 25.908 0.966 1.00 25.00 H new ATOM 685 N ALA A 46 27.186 27.636 5.395 1.00 25.00 N ATOM 686 CA ALA A 46 26.975 28.975 5.898 1.00 25.00 C ATOM 687 C ALA A 46 28.228 29.564 6.524 1.00 25.00 C ATOM 688 O ALA A 46 28.584 30.665 6.187 1.00 25.00 O ATOM 689 CB ALA A 46 25.864 28.984 6.896 1.00 25.00 C ATOM 0 H ALA A 46 26.652 26.909 5.870 1.00 25.00 H new ATOM 0 HA ALA A 46 26.710 29.597 5.043 1.00 25.00 H new ATOM 0 HB1 ALA A 46 25.716 29.998 7.267 1.00 25.00 H new ATOM 0 HB2 ALA A 46 24.947 28.633 6.423 1.00 25.00 H new ATOM 0 HB3 ALA A 46 26.117 28.327 7.728 1.00 25.00 H new ATOM 695 N GLU A 47 28.902 28.849 7.417 1.00 25.00 N ATOM 696 CA GLU A 47 30.077 29.411 8.109 1.00 25.00 C ATOM 697 C GLU A 47 31.167 29.797 7.109 1.00 25.00 C ATOM 698 O GLU A 47 31.876 30.797 7.284 1.00 25.00 O ATOM 699 CB GLU A 47 30.619 28.446 9.177 1.00 25.00 C ATOM 700 CG GLU A 47 31.240 27.166 8.625 1.00 25.00 C ATOM 701 CD GLU A 47 31.716 26.218 9.713 1.00 25.00 C ATOM 702 OE1 GLU A 47 32.155 25.098 9.368 1.00 25.00 O ATOM 703 OE2 GLU A 47 31.686 26.595 10.904 1.00 25.00 O ATOM 0 H GLU A 47 28.667 27.893 7.683 1.00 25.00 H new ATOM 0 HA GLU A 47 29.755 30.317 8.623 1.00 25.00 H new ATOM 0 HB2 GLU A 47 31.367 28.969 9.773 1.00 25.00 H new ATOM 0 HB3 GLU A 47 29.805 28.177 9.851 1.00 25.00 H new ATOM 0 HG2 GLU A 47 30.508 26.654 8.000 1.00 25.00 H new ATOM 0 HG3 GLU A 47 32.082 27.425 7.983 1.00 25.00 H new ATOM 710 N ALA A 48 31.240 29.051 6.018 1.00 25.00 N ATOM 711 CA ALA A 48 32.125 29.365 4.934 1.00 25.00 C ATOM 712 C ALA A 48 31.766 30.694 4.288 1.00 25.00 C ATOM 713 O ALA A 48 32.632 31.525 4.019 1.00 25.00 O ATOM 714 CB ALA A 48 32.054 28.252 3.923 1.00 25.00 C ATOM 0 H ALA A 48 30.681 28.211 5.870 1.00 25.00 H new ATOM 0 HA ALA A 48 33.141 29.460 5.318 1.00 25.00 H new ATOM 0 HB1 ALA A 48 32.721 28.474 3.090 1.00 25.00 H new ATOM 0 HB2 ALA A 48 32.357 27.315 4.391 1.00 25.00 H new ATOM 0 HB3 ALA A 48 31.032 28.160 3.554 1.00 25.00 H new ATOM 720 N LEU A 49 30.478 30.885 4.061 1.00 25.00 N ATOM 721 CA LEU A 49 29.971 32.092 3.442 1.00 25.00 C ATOM 722 C LEU A 49 30.216 33.289 4.340 1.00 25.00 C ATOM 723 O LEU A 49 30.618 34.349 3.874 1.00 25.00 O ATOM 724 CB LEU A 49 28.464 31.921 3.194 1.00 25.00 C ATOM 725 CG LEU A 49 27.692 32.983 2.406 1.00 25.00 C ATOM 726 CD1 LEU A 49 27.269 34.169 3.233 1.00 25.00 C ATOM 727 CD2 LEU A 49 28.475 33.449 1.209 1.00 25.00 C ATOM 0 H LEU A 49 29.756 30.206 4.302 1.00 25.00 H new ATOM 0 HA LEU A 49 30.487 32.263 2.497 1.00 25.00 H new ATOM 0 HB2 LEU A 49 28.326 30.971 2.678 1.00 25.00 H new ATOM 0 HB3 LEU A 49 27.984 31.827 4.168 1.00 25.00 H new ATOM 0 HG LEU A 49 26.779 32.488 2.077 1.00 25.00 H new ATOM 0 HD11 LEU A 49 26.728 34.876 2.605 1.00 25.00 H new ATOM 0 HD12 LEU A 49 26.621 33.835 4.044 1.00 25.00 H new ATOM 0 HD13 LEU A 49 28.151 34.655 3.650 1.00 25.00 H new ATOM 0 HD21 LEU A 49 27.901 34.203 0.670 1.00 25.00 H new ATOM 0 HD22 LEU A 49 29.421 33.880 1.538 1.00 25.00 H new ATOM 0 HD23 LEU A 49 28.671 32.603 0.551 1.00 25.00 H new ATOM 739 N LEU A 50 29.977 33.111 5.633 1.00 25.00 N ATOM 740 CA LEU A 50 30.063 34.219 6.585 1.00 25.00 C ATOM 741 C LEU A 50 31.475 34.778 6.633 1.00 25.00 C ATOM 742 O LEU A 50 31.689 35.950 6.909 1.00 25.00 O ATOM 743 CB LEU A 50 29.695 33.774 8.013 1.00 25.00 C ATOM 744 CG LEU A 50 28.402 32.990 8.282 1.00 25.00 C ATOM 745 CD1 LEU A 50 28.139 32.905 9.764 1.00 25.00 C ATOM 746 CD2 LEU A 50 27.188 33.524 7.532 1.00 25.00 C ATOM 0 H LEU A 50 29.723 32.215 6.049 1.00 25.00 H new ATOM 0 HA LEU A 50 29.358 34.976 6.241 1.00 25.00 H new ATOM 0 HB2 LEU A 50 30.521 33.166 8.382 1.00 25.00 H new ATOM 0 HB3 LEU A 50 29.659 34.672 8.630 1.00 25.00 H new ATOM 0 HG LEU A 50 28.563 31.986 7.888 1.00 25.00 H new ATOM 0 HD11 LEU A 50 27.219 32.347 9.939 1.00 25.00 H new ATOM 0 HD12 LEU A 50 28.970 32.397 10.253 1.00 25.00 H new ATOM 0 HD13 LEU A 50 28.037 33.910 10.174 1.00 25.00 H new ATOM 0 HD21 LEU A 50 26.315 32.918 7.774 1.00 25.00 H new ATOM 0 HD22 LEU A 50 27.005 34.558 7.825 1.00 25.00 H new ATOM 0 HD23 LEU A 50 27.374 33.479 6.459 1.00 25.00 H new ATOM 758 N SER A 51 32.441 33.903 6.393 1.00 25.00 N ATOM 759 CA SER A 51 33.843 34.266 6.437 1.00 25.00 C ATOM 760 C SER A 51 34.280 35.065 5.209 1.00 25.00 C ATOM 761 O SER A 51 35.296 35.749 5.239 1.00 25.00 O ATOM 762 CB SER A 51 34.650 32.994 6.491 1.00 25.00 C ATOM 763 OG SER A 51 34.308 32.201 7.620 1.00 25.00 O ATOM 0 H SER A 51 32.271 32.924 6.163 1.00 25.00 H new ATOM 0 HA SER A 51 34.004 34.894 7.313 1.00 25.00 H new ATOM 0 HB2 SER A 51 34.485 32.420 5.580 1.00 25.00 H new ATOM 0 HB3 SER A 51 35.712 33.238 6.526 1.00 25.00 H new ATOM 0 HG SER A 51 33.460 31.740 7.451 1.00 25.00 H new ATOM 769 N GLY A 52 33.541 34.930 4.116 1.00 25.00 N ATOM 770 CA GLY A 52 33.849 35.647 2.882 1.00 25.00 C ATOM 771 C GLY A 52 34.853 34.930 1.999 1.00 25.00 C ATOM 772 O GLY A 52 34.972 35.224 0.807 1.00 25.00 O ATOM 0 H GLY A 52 32.720 34.328 4.057 1.00 25.00 H new ATOM 0 HA2 GLY A 52 32.927 35.800 2.320 1.00 25.00 H new ATOM 0 HA3 GLY A 52 34.237 36.634 3.132 1.00 25.00 H new ATOM 776 N ASP A 53 35.570 33.980 2.580 1.00 25.00 N ATOM 777 CA ASP A 53 36.572 33.198 1.854 1.00 25.00 C ATOM 778 C ASP A 53 35.929 32.362 0.758 1.00 25.00 C ATOM 779 O ASP A 53 35.147 31.449 1.035 1.00 25.00 O ATOM 780 CB ASP A 53 37.274 32.230 2.788 1.00 25.00 C ATOM 781 CG ASP A 53 38.399 31.503 2.114 1.00 25.00 C ATOM 782 OD1 ASP A 53 38.752 30.414 2.596 1.00 25.00 O ATOM 783 OD2 ASP A 53 38.870 31.966 1.057 1.00 25.00 O ATOM 0 H ASP A 53 35.478 33.726 3.564 1.00 25.00 H new ATOM 0 HA ASP A 53 37.276 33.912 1.427 1.00 25.00 H new ATOM 0 HB2 ASP A 53 37.661 32.775 3.649 1.00 25.00 H new ATOM 0 HB3 ASP A 53 36.552 31.506 3.167 1.00 25.00 H new ATOM 788 N LEU A 54 36.282 32.633 -0.486 1.00 25.00 N ATOM 789 CA LEU A 54 35.759 31.844 -1.587 1.00 25.00 C ATOM 790 C LEU A 54 36.305 30.429 -1.511 1.00 25.00 C ATOM 791 O LEU A 54 35.601 29.490 -1.807 1.00 25.00 O ATOM 792 CB LEU A 54 36.134 32.475 -2.928 1.00 25.00 C ATOM 793 CG LEU A 54 35.564 31.836 -4.212 1.00 25.00 C ATOM 794 CD1 LEU A 54 36.473 30.739 -4.779 1.00 25.00 C ATOM 795 CD2 LEU A 54 34.129 31.307 -4.068 1.00 25.00 C ATOM 0 H LEU A 54 36.919 33.382 -0.757 1.00 25.00 H new ATOM 0 HA LEU A 54 34.672 31.817 -1.509 1.00 25.00 H new ATOM 0 HB2 LEU A 54 35.820 33.518 -2.906 1.00 25.00 H new ATOM 0 HB3 LEU A 54 37.221 32.471 -3.007 1.00 25.00 H new ATOM 0 HG LEU A 54 35.528 32.662 -4.923 1.00 25.00 H new ATOM 0 HD11 LEU A 54 36.023 30.324 -5.681 1.00 25.00 H new ATOM 0 HD12 LEU A 54 37.448 31.163 -5.021 1.00 25.00 H new ATOM 0 HD13 LEU A 54 36.595 29.949 -4.038 1.00 25.00 H new ATOM 0 HD21 LEU A 54 33.804 30.874 -5.014 1.00 25.00 H new ATOM 0 HD22 LEU A 54 34.099 30.544 -3.291 1.00 25.00 H new ATOM 0 HD23 LEU A 54 33.464 32.127 -3.797 1.00 25.00 H new ATOM 807 N GLU A 55 37.549 30.266 -1.104 1.00 25.00 N ATOM 808 CA GLU A 55 38.153 28.934 -1.058 1.00 25.00 C ATOM 809 C GLU A 55 37.362 28.005 -0.154 1.00 25.00 C ATOM 810 O GLU A 55 36.939 26.922 -0.568 1.00 25.00 O ATOM 811 CB GLU A 55 39.583 29.010 -0.541 1.00 25.00 C ATOM 812 CG GLU A 55 40.453 29.950 -1.312 1.00 25.00 C ATOM 813 CD GLU A 55 40.604 29.535 -2.768 1.00 25.00 C ATOM 814 OE1 GLU A 55 40.239 30.339 -3.656 1.00 25.00 O ATOM 815 OE2 GLU A 55 41.040 28.393 -3.028 1.00 25.00 O ATOM 0 H GLU A 55 38.161 31.024 -0.802 1.00 25.00 H new ATOM 0 HA GLU A 55 38.147 28.542 -2.075 1.00 25.00 H new ATOM 0 HB2 GLU A 55 39.566 29.320 0.504 1.00 25.00 H new ATOM 0 HB3 GLU A 55 40.024 28.014 -0.571 1.00 25.00 H new ATOM 0 HG2 GLU A 55 40.031 30.954 -1.265 1.00 25.00 H new ATOM 0 HG3 GLU A 55 41.437 29.996 -0.846 1.00 25.00 H new ATOM 822 N LYS A 56 37.126 28.436 1.078 1.00 25.00 N ATOM 823 CA LYS A 56 36.372 27.619 2.022 1.00 25.00 C ATOM 824 C LYS A 56 34.958 27.436 1.508 1.00 25.00 C ATOM 825 O LYS A 56 34.436 26.340 1.613 1.00 25.00 O ATOM 826 CB LYS A 56 36.431 28.168 3.471 1.00 25.00 C ATOM 827 CG LYS A 56 35.508 29.221 3.848 1.00 25.00 C ATOM 828 CD LYS A 56 36.015 29.930 5.118 1.00 25.00 C ATOM 829 CE LYS A 56 35.647 29.204 6.419 1.00 25.00 C ATOM 830 NZ LYS A 56 36.177 29.927 7.623 1.00 25.00 N ATOM 0 H LYS A 56 37.441 29.334 1.445 1.00 25.00 H new ATOM 0 HA LYS A 56 36.840 26.637 2.086 1.00 25.00 H new ATOM 0 HB2 LYS A 56 36.274 27.330 4.150 1.00 25.00 H new ATOM 0 HB3 LYS A 56 37.442 28.535 3.646 1.00 25.00 H new ATOM 0 HG2 LYS A 56 35.410 29.939 3.034 1.00 25.00 H new ATOM 0 HG3 LYS A 56 34.517 28.802 4.025 1.00 25.00 H new ATOM 0 HD2 LYS A 56 37.099 30.027 5.061 1.00 25.00 H new ATOM 0 HD3 LYS A 56 35.606 30.940 5.148 1.00 25.00 H new ATOM 0 HE2 LYS A 56 34.563 29.117 6.494 1.00 25.00 H new ATOM 0 HE3 LYS A 56 36.047 28.190 6.397 1.00 25.00 H new ATOM 0 HZ1 LYS A 56 36.107 29.310 8.457 1.00 25.00 H new ATOM 0 HZ2 LYS A 56 37.172 30.183 7.464 1.00 25.00 H new ATOM 0 HZ3 LYS A 56 35.619 30.790 7.783 1.00 25.00 H new ATOM 844 N PHE A 57 34.372 28.465 0.898 1.00 25.00 N ATOM 845 CA PHE A 57 33.013 28.371 0.355 1.00 25.00 C ATOM 846 C PHE A 57 32.918 27.370 -0.792 1.00 25.00 C ATOM 847 O PHE A 57 32.080 26.494 -0.763 1.00 25.00 O ATOM 848 CB PHE A 57 32.524 29.750 -0.103 1.00 25.00 C ATOM 849 CG PHE A 57 31.087 29.765 -0.546 1.00 25.00 C ATOM 850 CD1 PHE A 57 30.757 29.629 -1.907 1.00 25.00 C ATOM 851 CD2 PHE A 57 30.051 29.920 0.394 1.00 25.00 C ATOM 852 CE1 PHE A 57 29.403 29.641 -2.326 1.00 25.00 C ATOM 853 CE2 PHE A 57 28.695 29.939 -0.018 1.00 25.00 C ATOM 854 CZ PHE A 57 28.377 29.794 -1.379 1.00 25.00 C ATOM 0 H PHE A 57 34.815 29.374 0.766 1.00 25.00 H new ATOM 0 HA PHE A 57 32.370 28.009 1.157 1.00 25.00 H new ATOM 0 HB2 PHE A 57 32.651 30.460 0.714 1.00 25.00 H new ATOM 0 HB3 PHE A 57 33.152 30.094 -0.925 1.00 25.00 H new ATOM 0 HD1 PHE A 57 31.543 29.514 -2.639 1.00 25.00 H new ATOM 0 HD2 PHE A 57 30.292 30.026 1.441 1.00 25.00 H new ATOM 0 HE1 PHE A 57 29.160 29.533 -3.373 1.00 25.00 H new ATOM 0 HE2 PHE A 57 27.909 30.065 0.712 1.00 25.00 H new ATOM 0 HZ PHE A 57 27.345 29.800 -1.697 1.00 25.00 H new ATOM 864 N SER A 58 33.795 27.474 -1.775 1.00 25.00 N ATOM 865 CA SER A 58 33.811 26.568 -2.921 1.00 25.00 C ATOM 866 C SER A 58 34.077 25.131 -2.493 1.00 25.00 C ATOM 867 O SER A 58 33.467 24.186 -2.999 1.00 25.00 O ATOM 868 CB SER A 58 34.912 27.007 -3.891 1.00 25.00 C ATOM 869 OG SER A 58 34.937 26.185 -5.043 1.00 25.00 O ATOM 0 H SER A 58 34.521 28.190 -1.805 1.00 25.00 H new ATOM 0 HA SER A 58 32.833 26.609 -3.400 1.00 25.00 H new ATOM 0 HB2 SER A 58 34.749 28.044 -4.185 1.00 25.00 H new ATOM 0 HB3 SER A 58 35.879 26.965 -3.390 1.00 25.00 H new ATOM 0 HG SER A 58 35.648 26.488 -5.646 1.00 25.00 H new ATOM 875 N ARG A 59 34.980 24.965 -1.539 1.00 25.00 N ATOM 876 CA ARG A 59 35.351 23.629 -1.082 1.00 25.00 C ATOM 877 C ARG A 59 34.173 22.979 -0.394 1.00 25.00 C ATOM 878 O ARG A 59 33.849 21.835 -0.662 1.00 25.00 O ATOM 879 CB ARG A 59 36.548 23.699 -0.127 1.00 25.00 C ATOM 880 CG ARG A 59 36.966 22.328 0.435 1.00 25.00 C ATOM 881 CD ARG A 59 36.581 22.186 1.908 1.00 25.00 C ATOM 882 NE ARG A 59 36.415 20.775 2.307 1.00 25.00 N ATOM 883 CZ ARG A 59 36.379 20.332 3.559 1.00 25.00 C ATOM 884 NH1 ARG A 59 36.519 21.131 4.590 1.00 25.00 N ATOM 885 NH2 ARG A 59 36.195 19.064 3.781 1.00 25.00 N ATOM 0 H ARG A 59 35.467 25.728 -1.069 1.00 25.00 H new ATOM 0 HA ARG A 59 35.637 23.030 -1.946 1.00 25.00 H new ATOM 0 HB2 ARG A 59 37.395 24.142 -0.651 1.00 25.00 H new ATOM 0 HB3 ARG A 59 36.303 24.363 0.702 1.00 25.00 H new ATOM 0 HG2 ARG A 59 36.491 21.536 -0.144 1.00 25.00 H new ATOM 0 HG3 ARG A 59 38.043 22.202 0.325 1.00 25.00 H new ATOM 0 HD2 ARG A 59 37.348 22.650 2.529 1.00 25.00 H new ATOM 0 HD3 ARG A 59 35.652 22.726 2.093 1.00 25.00 H new ATOM 0 HE ARG A 59 36.320 20.085 1.562 1.00 25.00 H new ATOM 0 HH11 ARG A 59 36.661 22.131 4.445 1.00 25.00 H new ATOM 0 HH12 ARG A 59 36.485 20.753 5.537 1.00 25.00 H new ATOM 0 HH21 ARG A 59 36.080 18.421 2.998 1.00 25.00 H new ATOM 0 HH22 ARG A 59 36.166 18.713 4.738 1.00 25.00 H new ATOM 899 N VAL A 60 33.523 23.701 0.498 1.00 25.00 N ATOM 900 CA VAL A 60 32.404 23.127 1.224 1.00 25.00 C ATOM 901 C VAL A 60 31.225 22.958 0.255 1.00 25.00 C ATOM 902 O VAL A 60 30.436 22.040 0.408 1.00 25.00 O ATOM 903 CB VAL A 60 32.058 23.941 2.519 1.00 25.00 C ATOM 904 CG1 VAL A 60 31.503 25.251 2.209 1.00 25.00 C ATOM 905 CG2 VAL A 60 31.115 23.146 3.425 1.00 25.00 C ATOM 0 H VAL A 60 33.744 24.668 0.735 1.00 25.00 H new ATOM 0 HA VAL A 60 32.672 22.139 1.599 1.00 25.00 H new ATOM 0 HB VAL A 60 32.992 24.108 3.056 1.00 25.00 H new ATOM 0 HG11 VAL A 60 31.278 25.779 3.135 1.00 25.00 H new ATOM 0 HG12 VAL A 60 32.227 25.825 1.630 1.00 25.00 H new ATOM 0 HG13 VAL A 60 30.588 25.131 1.629 1.00 25.00 H new ATOM 0 HG21 VAL A 60 30.889 23.730 4.317 1.00 25.00 H new ATOM 0 HG22 VAL A 60 30.191 22.930 2.889 1.00 25.00 H new ATOM 0 HG23 VAL A 60 31.593 22.210 3.716 1.00 25.00 H new ATOM 915 N LEU A 61 31.116 23.824 -0.749 1.00 25.00 N ATOM 916 CA LEU A 61 30.025 23.750 -1.724 1.00 25.00 C ATOM 917 C LEU A 61 29.997 22.406 -2.442 1.00 25.00 C ATOM 918 O LEU A 61 28.948 21.781 -2.540 1.00 25.00 O ATOM 919 CB LEU A 61 30.171 24.869 -2.770 1.00 25.00 C ATOM 920 CG LEU A 61 28.964 25.117 -3.688 1.00 25.00 C ATOM 921 CD1 LEU A 61 28.158 26.258 -3.136 1.00 25.00 C ATOM 922 CD2 LEU A 61 29.366 25.483 -5.112 1.00 25.00 C ATOM 0 H LEU A 61 31.771 24.589 -0.911 1.00 25.00 H new ATOM 0 HA LEU A 61 29.092 23.868 -1.173 1.00 25.00 H new ATOM 0 HB2 LEU A 61 30.396 25.798 -2.246 1.00 25.00 H new ATOM 0 HB3 LEU A 61 31.033 24.639 -3.396 1.00 25.00 H new ATOM 0 HG LEU A 61 28.396 24.188 -3.722 1.00 25.00 H new ATOM 0 HD11 LEU A 61 27.299 26.442 -3.781 1.00 25.00 H new ATOM 0 HD12 LEU A 61 27.812 26.007 -2.133 1.00 25.00 H new ATOM 0 HD13 LEU A 61 28.778 27.154 -3.093 1.00 25.00 H new ATOM 0 HD21 LEU A 61 28.471 25.646 -5.712 1.00 25.00 H new ATOM 0 HD22 LEU A 61 29.965 26.394 -5.098 1.00 25.00 H new ATOM 0 HD23 LEU A 61 29.950 24.671 -5.545 1.00 25.00 H new ATOM 934 N VAL A 62 31.140 21.944 -2.932 1.00 25.00 N ATOM 935 CA VAL A 62 31.167 20.674 -3.665 1.00 25.00 C ATOM 936 C VAL A 62 30.972 19.495 -2.710 1.00 25.00 C ATOM 937 O VAL A 62 30.290 18.528 -3.039 1.00 25.00 O ATOM 938 CB VAL A 62 32.461 20.520 -4.536 1.00 25.00 C ATOM 939 CG1 VAL A 62 33.740 20.456 -3.687 1.00 25.00 C ATOM 940 CG2 VAL A 62 32.360 19.281 -5.431 1.00 25.00 C ATOM 0 H VAL A 62 32.042 22.411 -2.842 1.00 25.00 H new ATOM 0 HA VAL A 62 30.331 20.678 -4.364 1.00 25.00 H new ATOM 0 HB VAL A 62 32.531 21.413 -5.158 1.00 25.00 H new ATOM 0 HG11 VAL A 62 34.606 20.349 -4.341 1.00 25.00 H new ATOM 0 HG12 VAL A 62 33.836 21.372 -3.104 1.00 25.00 H new ATOM 0 HG13 VAL A 62 33.687 19.601 -3.013 1.00 25.00 H new ATOM 0 HG21 VAL A 62 33.267 19.189 -6.029 1.00 25.00 H new ATOM 0 HG22 VAL A 62 32.243 18.393 -4.811 1.00 25.00 H new ATOM 0 HG23 VAL A 62 31.498 19.378 -6.091 1.00 25.00 H new ATOM 950 N GLU A 63 31.502 19.600 -1.503 1.00 25.00 N ATOM 951 CA GLU A 63 31.332 18.546 -0.498 1.00 25.00 C ATOM 952 C GLU A 63 29.847 18.412 -0.157 1.00 25.00 C ATOM 953 O GLU A 63 29.304 17.311 -0.052 1.00 25.00 O ATOM 954 CB GLU A 63 32.131 18.884 0.767 1.00 25.00 C ATOM 955 CG GLU A 63 33.641 18.963 0.543 1.00 25.00 C ATOM 956 CD GLU A 63 34.348 17.642 0.743 1.00 25.00 C ATOM 957 OE1 GLU A 63 34.026 16.667 0.037 1.00 25.00 O ATOM 958 OE2 GLU A 63 35.266 17.598 1.595 1.00 25.00 O ATOM 0 H GLU A 63 32.053 20.399 -1.189 1.00 25.00 H new ATOM 0 HA GLU A 63 31.702 17.603 -0.899 1.00 25.00 H new ATOM 0 HB2 GLU A 63 31.782 19.838 1.161 1.00 25.00 H new ATOM 0 HB3 GLU A 63 31.925 18.130 1.527 1.00 25.00 H new ATOM 0 HG2 GLU A 63 33.832 19.319 -0.469 1.00 25.00 H new ATOM 0 HG3 GLU A 63 34.064 19.700 1.226 1.00 25.00 H new ATOM 965 N GLN A 64 29.176 19.549 -0.044 1.00 25.00 N ATOM 966 CA GLN A 64 27.748 19.570 0.230 1.00 25.00 C ATOM 967 C GLN A 64 26.946 19.037 -0.943 1.00 25.00 C ATOM 968 O GLN A 64 25.963 18.355 -0.737 1.00 25.00 O ATOM 969 CB GLN A 64 27.288 20.989 0.565 1.00 25.00 C ATOM 970 CG GLN A 64 27.626 21.400 1.991 1.00 25.00 C ATOM 971 CD GLN A 64 26.873 20.574 3.009 1.00 25.00 C ATOM 972 OE1 GLN A 64 25.666 20.423 2.918 1.00 25.00 O ATOM 973 NE2 GLN A 64 27.577 20.029 3.961 1.00 25.00 N ATOM 0 H GLN A 64 29.600 20.472 -0.138 1.00 25.00 H new ATOM 0 HA GLN A 64 27.572 18.920 1.087 1.00 25.00 H new ATOM 0 HB2 GLN A 64 27.752 21.689 -0.129 1.00 25.00 H new ATOM 0 HB3 GLN A 64 26.210 21.061 0.417 1.00 25.00 H new ATOM 0 HG2 GLN A 64 28.698 21.291 2.156 1.00 25.00 H new ATOM 0 HG3 GLN A 64 27.388 22.454 2.131 1.00 25.00 H new ATOM 0 HE21 GLN A 64 28.585 20.181 4.001 1.00 25.00 H new ATOM 0 HE22 GLN A 64 27.120 19.451 4.666 1.00 25.00 H new ATOM 982 N GLN A 65 27.358 19.318 -2.172 1.00 25.00 N ATOM 983 CA GLN A 65 26.636 18.788 -3.331 1.00 25.00 C ATOM 984 C GLN A 65 26.749 17.266 -3.389 1.00 25.00 C ATOM 985 O GLN A 65 25.764 16.583 -3.668 1.00 25.00 O ATOM 986 CB GLN A 65 27.157 19.390 -4.634 1.00 25.00 C ATOM 987 CG GLN A 65 26.713 20.829 -4.851 1.00 25.00 C ATOM 988 CD GLN A 65 27.117 21.345 -6.207 1.00 25.00 C ATOM 989 OE1 GLN A 65 26.667 20.847 -7.216 1.00 25.00 O ATOM 990 NE2 GLN A 65 27.953 22.346 -6.231 1.00 25.00 N ATOM 0 H GLN A 65 28.169 19.896 -2.395 1.00 25.00 H new ATOM 0 HA GLN A 65 25.588 19.065 -3.216 1.00 25.00 H new ATOM 0 HB2 GLN A 65 28.246 19.349 -4.635 1.00 25.00 H new ATOM 0 HB3 GLN A 65 26.814 18.781 -5.470 1.00 25.00 H new ATOM 0 HG2 GLN A 65 25.630 20.894 -4.746 1.00 25.00 H new ATOM 0 HG3 GLN A 65 27.147 21.463 -4.078 1.00 25.00 H new ATOM 0 HE21 GLN A 65 28.308 22.735 -5.357 1.00 25.00 H new ATOM 0 HE22 GLN A 65 28.252 22.739 -7.123 1.00 25.00 H new ATOM 999 N GLN A 66 27.924 16.732 -3.077 1.00 25.00 N ATOM 1000 CA GLN A 66 28.117 15.282 -3.070 1.00 25.00 C ATOM 1001 C GLN A 66 27.210 14.640 -2.022 1.00 25.00 C ATOM 1002 O GLN A 66 26.571 13.617 -2.275 1.00 25.00 O ATOM 1003 CB GLN A 66 29.571 14.927 -2.750 1.00 25.00 C ATOM 1004 CG GLN A 66 30.558 15.273 -3.853 1.00 25.00 C ATOM 1005 CD GLN A 66 31.978 14.976 -3.434 1.00 25.00 C ATOM 1006 OE1 GLN A 66 32.453 13.861 -3.569 1.00 25.00 O ATOM 1007 NE2 GLN A 66 32.646 15.961 -2.898 1.00 25.00 N ATOM 0 H GLN A 66 28.752 17.273 -2.827 1.00 25.00 H new ATOM 0 HA GLN A 66 27.867 14.904 -4.062 1.00 25.00 H new ATOM 0 HB2 GLN A 66 29.867 15.446 -1.838 1.00 25.00 H new ATOM 0 HB3 GLN A 66 29.635 13.859 -2.544 1.00 25.00 H new ATOM 0 HG2 GLN A 66 30.316 14.705 -4.751 1.00 25.00 H new ATOM 0 HG3 GLN A 66 30.465 16.329 -4.108 1.00 25.00 H new ATOM 0 HE21 GLN A 66 32.212 16.879 -2.803 1.00 25.00 H new ATOM 0 HE22 GLN A 66 33.602 15.812 -2.574 1.00 25.00 H new ATOM 1016 N ASP A 67 27.133 15.245 -0.846 1.00 25.00 N ATOM 1017 CA ASP A 67 26.283 14.701 0.207 1.00 25.00 C ATOM 1018 C ASP A 67 24.810 14.877 -0.136 1.00 25.00 C ATOM 1019 O ASP A 67 24.019 13.974 0.059 1.00 25.00 O ATOM 1020 CB ASP A 67 26.563 15.376 1.541 1.00 25.00 C ATOM 1021 CG ASP A 67 25.930 14.632 2.703 1.00 25.00 C ATOM 1022 OD1 ASP A 67 26.380 13.508 3.023 1.00 25.00 O ATOM 1023 OD2 ASP A 67 24.944 15.141 3.275 1.00 25.00 O ATOM 0 H ASP A 67 27.637 16.096 -0.598 1.00 25.00 H new ATOM 0 HA ASP A 67 26.512 13.638 0.287 1.00 25.00 H new ATOM 0 HB2 ASP A 67 27.640 15.439 1.696 1.00 25.00 H new ATOM 0 HB3 ASP A 67 26.184 16.398 1.516 1.00 25.00 H new ATOM 1028 N ARG A 68 24.445 16.022 -0.693 1.00 25.00 N ATOM 1029 CA ARG A 68 23.051 16.283 -1.076 1.00 25.00 C ATOM 1030 C ARG A 68 22.561 15.254 -2.067 1.00 25.00 C ATOM 1031 O ARG A 68 21.433 14.804 -1.966 1.00 25.00 O ATOM 1032 CB ARG A 68 22.901 17.666 -1.714 1.00 25.00 C ATOM 1033 CG ARG A 68 22.747 18.802 -0.716 1.00 25.00 C ATOM 1034 CD ARG A 68 22.930 20.157 -1.401 1.00 25.00 C ATOM 1035 NE ARG A 68 21.972 20.358 -2.508 1.00 25.00 N ATOM 1036 CZ ARG A 68 21.533 21.534 -2.949 1.00 25.00 C ATOM 1037 NH1 ARG A 68 21.899 22.672 -2.407 1.00 25.00 N ATOM 1038 NH2 ARG A 68 20.708 21.566 -3.958 1.00 25.00 N ATOM 0 H ARG A 68 25.088 16.789 -0.893 1.00 25.00 H new ATOM 0 HA ARG A 68 22.459 16.233 -0.162 1.00 25.00 H new ATOM 0 HB2 ARG A 68 23.773 17.862 -2.338 1.00 25.00 H new ATOM 0 HB3 ARG A 68 22.033 17.657 -2.373 1.00 25.00 H new ATOM 0 HG2 ARG A 68 21.761 18.754 -0.253 1.00 25.00 H new ATOM 0 HG3 ARG A 68 23.480 18.692 0.083 1.00 25.00 H new ATOM 0 HD2 ARG A 68 22.806 20.953 -0.667 1.00 25.00 H new ATOM 0 HD3 ARG A 68 23.947 20.233 -1.785 1.00 25.00 H new ATOM 0 HE ARG A 68 21.617 19.523 -2.974 1.00 25.00 H new ATOM 0 HH11 ARG A 68 22.544 22.676 -1.617 1.00 25.00 H new ATOM 0 HH12 ARG A 68 21.539 23.552 -2.776 1.00 25.00 H new ATOM 0 HH21 ARG A 68 20.407 20.697 -4.399 1.00 25.00 H new ATOM 0 HH22 ARG A 68 20.363 22.460 -4.307 1.00 25.00 H new ATOM 1052 N ALA A 69 23.419 14.838 -2.984 1.00 25.00 N ATOM 1053 CA ALA A 69 23.050 13.816 -3.960 1.00 25.00 C ATOM 1054 C ALA A 69 22.660 12.492 -3.277 1.00 25.00 C ATOM 1055 O ALA A 69 21.797 11.761 -3.767 1.00 25.00 O ATOM 1056 CB ALA A 69 24.209 13.594 -4.938 1.00 25.00 C ATOM 0 H ALA A 69 24.373 15.188 -3.076 1.00 25.00 H new ATOM 0 HA ALA A 69 22.176 14.169 -4.508 1.00 25.00 H new ATOM 0 HB1 ALA A 69 23.931 12.831 -5.665 1.00 25.00 H new ATOM 0 HB2 ALA A 69 24.430 14.526 -5.457 1.00 25.00 H new ATOM 0 HB3 ALA A 69 25.091 13.267 -4.388 1.00 25.00 H new ATOM 1062 N ARG A 70 23.271 12.183 -2.138 1.00 25.00 N ATOM 1063 CA ARG A 70 22.972 10.975 -1.414 1.00 25.00 C ATOM 1064 C ARG A 70 21.641 11.143 -0.667 1.00 25.00 C ATOM 1065 O ARG A 70 20.907 10.182 -0.477 1.00 25.00 O ATOM 1066 CB ARG A 70 24.171 10.683 -0.507 1.00 25.00 C ATOM 1067 CG ARG A 70 23.949 10.951 0.940 1.00 25.00 C ATOM 1068 CD ARG A 70 25.240 10.865 1.732 1.00 25.00 C ATOM 1069 NE ARG A 70 25.940 9.578 1.580 1.00 25.00 N ATOM 1070 CZ ARG A 70 27.208 9.366 1.917 1.00 25.00 C ATOM 1071 NH1 ARG A 70 27.958 10.309 2.437 1.00 25.00 N ATOM 1072 NH2 ARG A 70 27.731 8.185 1.724 1.00 25.00 N ATOM 0 H ARG A 70 23.983 12.767 -1.701 1.00 25.00 H new ATOM 0 HA ARG A 70 22.831 10.114 -2.068 1.00 25.00 H new ATOM 0 HB2 ARG A 70 24.452 9.637 -0.628 1.00 25.00 H new ATOM 0 HB3 ARG A 70 25.017 11.281 -0.846 1.00 25.00 H new ATOM 0 HG2 ARG A 70 23.512 11.942 1.064 1.00 25.00 H new ATOM 0 HG3 ARG A 70 23.230 10.234 1.337 1.00 25.00 H new ATOM 0 HD2 ARG A 70 25.904 11.670 1.417 1.00 25.00 H new ATOM 0 HD3 ARG A 70 25.021 11.027 2.787 1.00 25.00 H new ATOM 0 HE ARG A 70 25.415 8.795 1.189 1.00 25.00 H new ATOM 0 HH11 ARG A 70 27.571 11.240 2.594 1.00 25.00 H new ATOM 0 HH12 ARG A 70 28.928 10.111 2.684 1.00 25.00 H new ATOM 0 HH21 ARG A 70 27.167 7.438 1.319 1.00 25.00 H new ATOM 0 HH22 ARG A 70 28.703 8.010 1.979 1.00 25.00 H new ATOM 1086 N ARG A 71 21.318 12.376 -0.277 1.00 25.00 N ATOM 1087 CA ARG A 71 20.043 12.669 0.404 1.00 25.00 C ATOM 1088 C ARG A 71 18.915 12.665 -0.601 1.00 25.00 C ATOM 1089 O ARG A 71 17.784 12.336 -0.279 1.00 25.00 O ATOM 1090 CB ARG A 71 20.060 14.048 1.092 1.00 25.00 C ATOM 1091 CG ARG A 71 21.265 14.324 1.984 1.00 25.00 C ATOM 1092 CD ARG A 71 21.482 13.246 3.013 1.00 25.00 C ATOM 1093 NE ARG A 71 22.738 13.463 3.744 1.00 25.00 N ATOM 1094 CZ ARG A 71 23.143 12.789 4.810 1.00 25.00 C ATOM 1095 NH1 ARG A 71 22.424 11.840 5.361 1.00 25.00 N ATOM 1096 NH2 ARG A 71 24.300 13.081 5.325 1.00 25.00 N ATOM 0 H ARG A 71 21.916 13.191 -0.417 1.00 25.00 H new ATOM 0 HA ARG A 71 19.900 11.898 1.161 1.00 25.00 H new ATOM 0 HB2 ARG A 71 20.016 14.819 0.322 1.00 25.00 H new ATOM 0 HB3 ARG A 71 19.156 14.146 1.693 1.00 25.00 H new ATOM 0 HG2 ARG A 71 22.157 14.415 1.365 1.00 25.00 H new ATOM 0 HG3 ARG A 71 21.128 15.280 2.488 1.00 25.00 H new ATOM 0 HD2 ARG A 71 20.647 13.233 3.713 1.00 25.00 H new ATOM 0 HD3 ARG A 71 21.504 12.271 2.525 1.00 25.00 H new ATOM 0 HE ARG A 71 23.354 14.199 3.399 1.00 25.00 H new ATOM 0 HH11 ARG A 71 21.515 11.596 4.969 1.00 25.00 H new ATOM 0 HH12 ARG A 71 22.774 11.346 6.182 1.00 25.00 H new ATOM 0 HH21 ARG A 71 24.873 13.815 4.908 1.00 25.00 H new ATOM 0 HH22 ARG A 71 24.635 12.577 6.146 1.00 25.00 H new ATOM 1110 N GLU A 72 19.249 13.027 -1.827 1.00 25.00 N ATOM 1111 CA GLU A 72 18.290 13.094 -2.932 1.00 25.00 C ATOM 1112 C GLU A 72 17.618 11.742 -3.131 1.00 25.00 C ATOM 1113 O GLU A 72 16.437 11.667 -3.442 1.00 25.00 O ATOM 1114 CB GLU A 72 19.006 13.505 -4.225 1.00 25.00 C ATOM 1115 CG GLU A 72 18.284 14.574 -5.039 1.00 25.00 C ATOM 1116 CD GLU A 72 18.517 15.980 -4.490 1.00 25.00 C ATOM 1117 OE1 GLU A 72 19.556 16.597 -4.800 1.00 25.00 O ATOM 1118 OE2 GLU A 72 17.663 16.459 -3.713 1.00 25.00 O ATOM 0 H GLU A 72 20.199 13.286 -2.093 1.00 25.00 H new ATOM 0 HA GLU A 72 17.531 13.837 -2.687 1.00 25.00 H new ATOM 0 HB2 GLU A 72 20.002 13.870 -3.973 1.00 25.00 H new ATOM 0 HB3 GLU A 72 19.139 12.621 -4.848 1.00 25.00 H new ATOM 0 HG2 GLU A 72 18.624 14.530 -6.074 1.00 25.00 H new ATOM 0 HG3 GLU A 72 17.215 14.362 -5.045 1.00 25.00 H new ATOM 1125 N GLN A 73 18.369 10.675 -2.890 1.00 25.00 N ATOM 1126 CA GLN A 73 17.847 9.317 -3.027 1.00 25.00 C ATOM 1127 C GLN A 73 16.655 9.090 -2.093 1.00 25.00 C ATOM 1128 O GLN A 73 15.691 8.438 -2.448 1.00 25.00 O ATOM 1129 CB GLN A 73 18.947 8.296 -2.702 1.00 25.00 C ATOM 1130 CG GLN A 73 20.257 8.516 -3.470 1.00 25.00 C ATOM 1131 CD GLN A 73 20.061 8.567 -4.969 1.00 25.00 C ATOM 1132 OE1 GLN A 73 19.512 7.655 -5.562 1.00 25.00 O ATOM 1133 NE2 GLN A 73 20.519 9.626 -5.583 1.00 25.00 N ATOM 0 H GLN A 73 19.345 10.722 -2.598 1.00 25.00 H new ATOM 0 HA GLN A 73 17.515 9.186 -4.057 1.00 25.00 H new ATOM 0 HB2 GLN A 73 19.156 8.332 -1.633 1.00 25.00 H new ATOM 0 HB3 GLN A 73 18.574 7.295 -2.921 1.00 25.00 H new ATOM 0 HG2 GLN A 73 20.715 9.447 -3.137 1.00 25.00 H new ATOM 0 HG3 GLN A 73 20.953 7.713 -3.227 1.00 25.00 H new ATOM 0 HE21 GLN A 73 20.973 10.368 -5.050 1.00 25.00 H new ATOM 0 HE22 GLN A 73 20.423 9.710 -6.595 1.00 25.00 H new ATOM 1142 N GLU A 74 16.743 9.617 -0.882 1.00 25.00 N ATOM 1143 CA GLU A 74 15.645 9.536 0.082 1.00 25.00 C ATOM 1144 C GLU A 74 14.559 10.569 -0.163 1.00 25.00 C ATOM 1145 O GLU A 74 13.397 10.328 0.131 1.00 25.00 O ATOM 1146 CB GLU A 74 16.196 9.672 1.504 1.00 25.00 C ATOM 1147 CG GLU A 74 17.278 8.638 1.817 1.00 25.00 C ATOM 1148 CD GLU A 74 17.481 8.445 3.310 1.00 25.00 C ATOM 1149 OE1 GLU A 74 17.004 7.407 3.839 1.00 25.00 O ATOM 1150 OE2 GLU A 74 18.085 9.322 3.960 1.00 25.00 O ATOM 0 H GLU A 74 17.567 10.109 -0.537 1.00 25.00 H new ATOM 0 HA GLU A 74 15.177 8.560 -0.047 1.00 25.00 H new ATOM 0 HB2 GLU A 74 16.606 10.673 1.636 1.00 25.00 H new ATOM 0 HB3 GLU A 74 15.379 9.565 2.218 1.00 25.00 H new ATOM 0 HG2 GLU A 74 17.007 7.684 1.364 1.00 25.00 H new ATOM 0 HG3 GLU A 74 18.218 8.951 1.363 1.00 25.00 H new ATOM 1157 N ARG A 75 14.939 11.725 -0.688 1.00 25.00 N ATOM 1158 CA ARG A 75 14.000 12.834 -0.912 1.00 25.00 C ATOM 1159 C ARG A 75 12.874 12.492 -1.861 1.00 25.00 C ATOM 1160 O ARG A 75 11.810 13.089 -1.783 1.00 25.00 O ATOM 1161 CB ARG A 75 14.738 14.031 -1.480 1.00 25.00 C ATOM 1162 CG ARG A 75 15.412 14.898 -0.422 1.00 25.00 C ATOM 1163 CD ARG A 75 16.208 16.004 -1.077 1.00 25.00 C ATOM 1164 NE ARG A 75 16.493 17.126 -0.170 1.00 25.00 N ATOM 1165 CZ ARG A 75 17.129 18.242 -0.516 1.00 25.00 C ATOM 1166 NH1 ARG A 75 17.608 18.437 -1.719 1.00 25.00 N ATOM 1167 NH2 ARG A 75 17.284 19.185 0.372 1.00 25.00 N ATOM 0 H ARG A 75 15.898 11.928 -0.971 1.00 25.00 H new ATOM 0 HA ARG A 75 13.564 13.053 0.063 1.00 25.00 H new ATOM 0 HB2 ARG A 75 15.493 13.680 -2.184 1.00 25.00 H new ATOM 0 HB3 ARG A 75 14.036 14.644 -2.045 1.00 25.00 H new ATOM 0 HG2 ARG A 75 14.659 15.326 0.240 1.00 25.00 H new ATOM 0 HG3 ARG A 75 16.069 14.285 0.195 1.00 25.00 H new ATOM 0 HD2 ARG A 75 17.149 15.596 -1.447 1.00 25.00 H new ATOM 0 HD3 ARG A 75 15.659 16.375 -1.942 1.00 25.00 H new ATOM 0 HE ARG A 75 16.179 17.042 0.797 1.00 25.00 H new ATOM 0 HH11 ARG A 75 17.500 17.717 -2.434 1.00 25.00 H new ATOM 0 HH12 ARG A 75 18.089 19.308 -1.941 1.00 25.00 H new ATOM 0 HH21 ARG A 75 16.920 19.061 1.317 1.00 25.00 H new ATOM 0 HH22 ARG A 75 17.770 20.046 0.122 1.00 25.00 H new ATOM 1181 N ILE A 76 13.085 11.508 -2.719 1.00 25.00 N ATOM 1182 CA ILE A 76 12.024 11.041 -3.627 1.00 25.00 C ATOM 1183 C ILE A 76 10.791 10.524 -2.867 1.00 25.00 C ATOM 1184 O ILE A 76 9.704 10.459 -3.426 1.00 25.00 O ATOM 1185 CB ILE A 76 12.529 9.944 -4.616 1.00 25.00 C ATOM 1186 CG1 ILE A 76 12.716 8.596 -3.885 1.00 25.00 C ATOM 1187 CG2 ILE A 76 13.837 10.416 -5.307 1.00 25.00 C ATOM 1188 CD1 ILE A 76 13.252 7.459 -4.767 1.00 25.00 C ATOM 0 H ILE A 76 13.972 11.013 -2.814 1.00 25.00 H new ATOM 0 HA ILE A 76 11.730 11.917 -4.206 1.00 25.00 H new ATOM 0 HB ILE A 76 11.779 9.787 -5.391 1.00 25.00 H new ATOM 0 HG12 ILE A 76 13.400 8.743 -3.049 1.00 25.00 H new ATOM 0 HG13 ILE A 76 11.758 8.290 -3.463 1.00 25.00 H new ATOM 0 HG21 ILE A 76 14.183 9.645 -5.996 1.00 25.00 H new ATOM 0 HG22 ILE A 76 13.645 11.336 -5.859 1.00 25.00 H new ATOM 0 HG23 ILE A 76 14.602 10.598 -4.552 1.00 25.00 H new ATOM 0 HD11 ILE A 76 13.352 6.552 -4.171 1.00 25.00 H new ATOM 0 HD12 ILE A 76 12.559 7.279 -5.589 1.00 25.00 H new ATOM 0 HD13 ILE A 76 14.226 7.738 -5.168 1.00 25.00 H new ATOM 1200 N ARG A 77 10.947 10.195 -1.583 1.00 25.00 N ATOM 1201 CA ARG A 77 9.802 9.792 -0.742 1.00 25.00 C ATOM 1202 C ARG A 77 8.841 10.961 -0.466 1.00 25.00 C ATOM 1203 O ARG A 77 7.753 10.744 0.050 1.00 25.00 O ATOM 1204 CB ARG A 77 10.295 9.244 0.597 1.00 25.00 C ATOM 1205 CG ARG A 77 11.170 8.001 0.476 1.00 25.00 C ATOM 1206 CD ARG A 77 11.886 7.747 1.788 1.00 25.00 C ATOM 1207 NE ARG A 77 13.015 6.817 1.617 1.00 25.00 N ATOM 1208 CZ ARG A 77 14.057 6.726 2.438 1.00 25.00 C ATOM 1209 NH1 ARG A 77 14.162 7.454 3.518 1.00 25.00 N ATOM 1210 NH2 ARG A 77 15.023 5.903 2.158 1.00 25.00 N ATOM 0 H ARG A 77 11.845 10.197 -1.099 1.00 25.00 H new ATOM 0 HA ARG A 77 9.263 9.024 -1.296 1.00 25.00 H new ATOM 0 HB2 ARG A 77 10.858 10.023 1.111 1.00 25.00 H new ATOM 0 HB3 ARG A 77 9.433 9.009 1.221 1.00 25.00 H new ATOM 0 HG2 ARG A 77 10.558 7.139 0.212 1.00 25.00 H new ATOM 0 HG3 ARG A 77 11.897 8.133 -0.326 1.00 25.00 H new ATOM 0 HD2 ARG A 77 12.250 8.691 2.194 1.00 25.00 H new ATOM 0 HD3 ARG A 77 11.183 7.338 2.514 1.00 25.00 H new ATOM 0 HE ARG A 77 12.996 6.196 0.808 1.00 25.00 H new ATOM 0 HH11 ARG A 77 13.428 8.121 3.756 1.00 25.00 H new ATOM 0 HH12 ARG A 77 14.977 7.355 4.123 1.00 25.00 H new ATOM 0 HH21 ARG A 77 14.978 5.333 1.314 1.00 25.00 H new ATOM 0 HH22 ARG A 77 15.826 5.827 2.783 1.00 25.00 H new ATOM 1224 N LEU A 78 9.282 12.163 -0.837 1.00 25.00 N ATOM 1225 CA LEU A 78 8.560 13.438 -0.736 1.00 25.00 C ATOM 1226 C LEU A 78 8.312 13.933 0.686 1.00 25.00 C ATOM 1227 O LEU A 78 7.856 13.220 1.573 1.00 25.00 O ATOM 1228 CB LEU A 78 7.285 13.357 -1.564 1.00 25.00 C ATOM 1229 CG LEU A 78 6.377 14.580 -1.841 1.00 25.00 C ATOM 1230 CD1 LEU A 78 5.521 14.983 -0.636 1.00 25.00 C ATOM 1231 CD2 LEU A 78 7.181 15.787 -2.340 1.00 25.00 C ATOM 0 H LEU A 78 10.211 12.283 -1.242 1.00 25.00 H new ATOM 0 HA LEU A 78 9.215 14.207 -1.147 1.00 25.00 H new ATOM 0 HB2 LEU A 78 7.574 12.960 -2.537 1.00 25.00 H new ATOM 0 HB3 LEU A 78 6.655 12.606 -1.088 1.00 25.00 H new ATOM 0 HG LEU A 78 5.697 14.259 -2.630 1.00 25.00 H new ATOM 0 HD11 LEU A 78 4.909 15.846 -0.897 1.00 25.00 H new ATOM 0 HD12 LEU A 78 4.875 14.151 -0.354 1.00 25.00 H new ATOM 0 HD13 LEU A 78 6.170 15.239 0.202 1.00 25.00 H new ATOM 0 HD21 LEU A 78 6.506 16.623 -2.522 1.00 25.00 H new ATOM 0 HD22 LEU A 78 7.916 16.071 -1.587 1.00 25.00 H new ATOM 0 HD23 LEU A 78 7.693 15.525 -3.266 1.00 25.00 H new ATOM 1243 N PHE A 79 8.696 15.183 0.887 1.00 25.00 N ATOM 1244 CA PHE A 79 8.642 15.834 2.185 1.00 25.00 C ATOM 1245 C PHE A 79 8.218 17.270 1.918 1.00 25.00 C ATOM 1246 O PHE A 79 8.571 17.819 0.880 1.00 25.00 O ATOM 1247 CB PHE A 79 10.035 15.834 2.831 1.00 25.00 C ATOM 1248 CG PHE A 79 10.606 14.452 3.060 1.00 25.00 C ATOM 1249 CD1 PHE A 79 10.623 13.898 4.354 1.00 25.00 C ATOM 1250 CD2 PHE A 79 11.136 13.696 1.989 1.00 25.00 C ATOM 1251 CE1 PHE A 79 11.172 12.609 4.584 1.00 25.00 C ATOM 1252 CE2 PHE A 79 11.684 12.418 2.209 1.00 25.00 C ATOM 1253 CZ PHE A 79 11.707 11.873 3.507 1.00 25.00 C ATOM 0 H PHE A 79 9.058 15.781 0.144 1.00 25.00 H new ATOM 0 HA PHE A 79 7.953 15.320 2.856 1.00 25.00 H new ATOM 0 HB2 PHE A 79 10.719 16.398 2.197 1.00 25.00 H new ATOM 0 HB3 PHE A 79 9.982 16.357 3.786 1.00 25.00 H new ATOM 0 HD1 PHE A 79 10.214 14.460 5.181 1.00 25.00 H new ATOM 0 HD2 PHE A 79 11.120 14.104 0.989 1.00 25.00 H new ATOM 0 HE1 PHE A 79 11.180 12.194 5.581 1.00 25.00 H new ATOM 0 HE2 PHE A 79 12.087 11.855 1.381 1.00 25.00 H new ATOM 0 HZ PHE A 79 12.133 10.895 3.677 1.00 25.00 H new ATOM 1263 N SER A 80 7.494 17.883 2.843 1.00 25.00 N ATOM 1264 CA SER A 80 7.074 19.276 2.684 1.00 25.00 C ATOM 1265 C SER A 80 8.206 20.225 3.071 1.00 25.00 C ATOM 1266 O SER A 80 8.324 20.637 4.225 1.00 25.00 O ATOM 1267 CB SER A 80 5.842 19.554 3.543 1.00 25.00 C ATOM 1268 OG SER A 80 4.797 18.658 3.201 1.00 25.00 O ATOM 0 H SER A 80 7.184 17.444 3.710 1.00 25.00 H new ATOM 0 HA SER A 80 6.823 19.444 1.637 1.00 25.00 H new ATOM 0 HB2 SER A 80 6.093 19.446 4.598 1.00 25.00 H new ATOM 0 HB3 SER A 80 5.512 20.583 3.397 1.00 25.00 H new ATOM 0 HG SER A 80 4.012 18.843 3.758 1.00 25.00 H new ATOM 1274 N ALA A 81 9.059 20.526 2.103 1.00 25.00 N ATOM 1275 CA ALA A 81 10.215 21.405 2.291 1.00 25.00 C ATOM 1276 C ALA A 81 10.484 22.054 0.934 1.00 25.00 C ATOM 1277 O ALA A 81 11.628 22.197 0.497 1.00 25.00 O ATOM 1278 CB ALA A 81 11.431 20.591 2.769 1.00 25.00 C ATOM 0 H ALA A 81 8.971 20.165 1.153 1.00 25.00 H new ATOM 0 HA ALA A 81 10.025 22.163 3.051 1.00 25.00 H new ATOM 0 HB1 ALA A 81 12.284 21.256 2.905 1.00 25.00 H new ATOM 0 HB2 ALA A 81 11.195 20.106 3.716 1.00 25.00 H new ATOM 0 HB3 ALA A 81 11.677 19.833 2.025 1.00 25.00 H new ATOM 1284 N ASP A 82 9.394 22.328 0.242 1.00 25.00 N ATOM 1285 CA ASP A 82 9.410 22.765 -1.149 1.00 25.00 C ATOM 1286 C ASP A 82 10.098 24.126 -1.362 1.00 25.00 C ATOM 1287 O ASP A 82 9.948 25.042 -0.545 1.00 25.00 O ATOM 1288 CB ASP A 82 7.961 22.841 -1.640 1.00 25.00 C ATOM 1289 CG ASP A 82 7.212 21.530 -1.430 1.00 25.00 C ATOM 1290 OD1 ASP A 82 6.796 21.258 -0.272 1.00 25.00 O ATOM 1291 OD2 ASP A 82 7.081 20.753 -2.394 1.00 25.00 O ATOM 0 H ASP A 82 8.455 22.253 0.634 1.00 25.00 H new ATOM 0 HA ASP A 82 9.994 22.040 -1.716 1.00 25.00 H new ATOM 0 HB2 ASP A 82 7.442 23.642 -1.113 1.00 25.00 H new ATOM 0 HB3 ASP A 82 7.951 23.097 -2.699 1.00 25.00 H new ATOM 1296 N PRO A 83 10.871 24.272 -2.458 1.00 25.00 N ATOM 1297 CA PRO A 83 11.540 25.553 -2.716 1.00 25.00 C ATOM 1298 C PRO A 83 10.620 26.603 -3.344 1.00 25.00 C ATOM 1299 O PRO A 83 9.569 26.278 -3.895 1.00 25.00 O ATOM 1300 CB PRO A 83 12.637 25.157 -3.703 1.00 25.00 C ATOM 1301 CG PRO A 83 12.013 24.081 -4.503 1.00 25.00 C ATOM 1302 CD PRO A 83 11.191 23.286 -3.512 1.00 25.00 C ATOM 0 HA PRO A 83 11.894 26.019 -1.796 1.00 25.00 H new ATOM 0 HB2 PRO A 83 12.937 25.998 -4.328 1.00 25.00 H new ATOM 0 HB3 PRO A 83 13.532 24.807 -3.189 1.00 25.00 H new ATOM 0 HG2 PRO A 83 11.388 24.490 -5.296 1.00 25.00 H new ATOM 0 HG3 PRO A 83 12.767 23.456 -4.982 1.00 25.00 H new ATOM 0 HD2 PRO A 83 10.289 22.883 -3.971 1.00 25.00 H new ATOM 0 HD3 PRO A 83 11.751 22.440 -3.113 1.00 25.00 H new ATOM 1310 N PHE A 84 11.049 27.856 -3.304 1.00 25.00 N ATOM 1311 CA PHE A 84 10.305 28.962 -3.922 1.00 25.00 C ATOM 1312 C PHE A 84 11.276 29.847 -4.690 1.00 25.00 C ATOM 1313 O PHE A 84 10.956 30.938 -5.147 1.00 25.00 O ATOM 1314 CB PHE A 84 9.591 29.771 -2.834 1.00 25.00 C ATOM 1315 CG PHE A 84 10.514 30.259 -1.741 1.00 25.00 C ATOM 1316 CD1 PHE A 84 11.248 31.452 -1.896 1.00 25.00 C ATOM 1317 CD2 PHE A 84 10.661 29.517 -0.551 1.00 25.00 C ATOM 1318 CE1 PHE A 84 12.131 31.897 -0.880 1.00 25.00 C ATOM 1319 CE2 PHE A 84 11.534 29.959 0.477 1.00 25.00 C ATOM 1320 CZ PHE A 84 12.274 31.150 0.306 1.00 25.00 C ATOM 0 H PHE A 84 11.915 28.141 -2.848 1.00 25.00 H new ATOM 0 HA PHE A 84 9.558 28.569 -4.611 1.00 25.00 H new ATOM 0 HB2 PHE A 84 9.100 30.629 -3.294 1.00 25.00 H new ATOM 0 HB3 PHE A 84 8.808 29.156 -2.390 1.00 25.00 H new ATOM 0 HD1 PHE A 84 11.137 32.034 -2.799 1.00 25.00 H new ATOM 0 HD2 PHE A 84 10.103 28.602 -0.420 1.00 25.00 H new ATOM 0 HE1 PHE A 84 12.694 32.809 -1.015 1.00 25.00 H new ATOM 0 HE2 PHE A 84 11.632 29.386 1.387 1.00 25.00 H new ATOM 0 HZ PHE A 84 12.947 31.487 1.081 1.00 25.00 H new ATOM 1330 N ASP A 85 12.490 29.348 -4.780 1.00 25.00 N ATOM 1331 CA ASP A 85 13.651 30.092 -5.258 1.00 25.00 C ATOM 1332 C ASP A 85 13.772 30.086 -6.785 1.00 25.00 C ATOM 1333 O ASP A 85 14.855 29.935 -7.338 1.00 25.00 O ATOM 1334 CB ASP A 85 14.913 29.477 -4.637 1.00 25.00 C ATOM 1335 CG ASP A 85 14.728 29.127 -3.155 1.00 25.00 C ATOM 1336 OD1 ASP A 85 15.241 29.862 -2.294 1.00 25.00 O ATOM 1337 OD2 ASP A 85 14.076 28.086 -2.856 1.00 25.00 O ATOM 0 H ASP A 85 12.710 28.387 -4.517 1.00 25.00 H new ATOM 0 HA ASP A 85 13.531 31.133 -4.957 1.00 25.00 H new ATOM 0 HB2 ASP A 85 15.184 28.577 -5.189 1.00 25.00 H new ATOM 0 HB3 ASP A 85 15.743 30.176 -4.741 1.00 25.00 H new ATOM 1342 N LEU A 86 12.649 30.231 -7.468 1.00 25.00 N ATOM 1343 CA LEU A 86 12.622 30.188 -8.933 1.00 25.00 C ATOM 1344 C LEU A 86 13.365 31.371 -9.558 1.00 25.00 C ATOM 1345 O LEU A 86 13.879 31.283 -10.666 1.00 25.00 O ATOM 1346 CB LEU A 86 11.168 30.153 -9.424 1.00 25.00 C ATOM 1347 CG LEU A 86 10.259 31.324 -9.002 1.00 25.00 C ATOM 1348 CD1 LEU A 86 9.967 32.232 -10.197 1.00 25.00 C ATOM 1349 CD2 LEU A 86 8.951 30.794 -8.420 1.00 25.00 C ATOM 0 H LEU A 86 11.737 30.380 -7.036 1.00 25.00 H new ATOM 0 HA LEU A 86 13.138 29.281 -9.248 1.00 25.00 H new ATOM 0 HB2 LEU A 86 11.179 30.108 -10.513 1.00 25.00 H new ATOM 0 HB3 LEU A 86 10.713 29.227 -9.071 1.00 25.00 H new ATOM 0 HG LEU A 86 10.777 31.905 -8.239 1.00 25.00 H new ATOM 0 HD11 LEU A 86 9.324 33.053 -9.881 1.00 25.00 H new ATOM 0 HD12 LEU A 86 10.903 32.633 -10.587 1.00 25.00 H new ATOM 0 HD13 LEU A 86 9.466 31.658 -10.976 1.00 25.00 H new ATOM 0 HD21 LEU A 86 8.318 31.631 -8.126 1.00 25.00 H new ATOM 0 HD22 LEU A 86 8.435 30.195 -9.171 1.00 25.00 H new ATOM 0 HD23 LEU A 86 9.165 30.177 -7.547 1.00 25.00 H new ATOM 1361 N GLU A 87 13.402 32.478 -8.837 1.00 25.00 N ATOM 1362 CA GLU A 87 14.088 33.695 -9.282 1.00 25.00 C ATOM 1363 C GLU A 87 15.602 33.676 -9.055 1.00 25.00 C ATOM 1364 O GLU A 87 16.323 34.546 -9.531 1.00 25.00 O ATOM 1365 CB GLU A 87 13.511 34.885 -8.537 1.00 25.00 C ATOM 1366 CG GLU A 87 12.124 35.274 -9.028 1.00 25.00 C ATOM 1367 CD GLU A 87 11.640 36.588 -8.439 1.00 25.00 C ATOM 1368 OE1 GLU A 87 11.280 37.495 -9.221 1.00 25.00 O ATOM 1369 OE2 GLU A 87 11.592 36.707 -7.196 1.00 25.00 O ATOM 0 H GLU A 87 12.958 32.566 -7.923 1.00 25.00 H new ATOM 0 HA GLU A 87 13.927 33.762 -10.358 1.00 25.00 H new ATOM 0 HB2 GLU A 87 13.463 34.653 -7.473 1.00 25.00 H new ATOM 0 HB3 GLU A 87 14.182 35.737 -8.647 1.00 25.00 H new ATOM 0 HG2 GLU A 87 12.136 35.351 -10.115 1.00 25.00 H new ATOM 0 HG3 GLU A 87 11.418 34.484 -8.772 1.00 25.00 H new ATOM 1376 N ALA A 88 16.062 32.692 -8.298 1.00 25.00 N ATOM 1377 CA ALA A 88 17.468 32.565 -7.879 1.00 25.00 C ATOM 1378 C ALA A 88 18.363 32.008 -8.997 1.00 25.00 C ATOM 1379 O ALA A 88 19.170 31.101 -8.783 1.00 25.00 O ATOM 1380 CB ALA A 88 17.560 31.678 -6.629 1.00 25.00 C ATOM 0 H ALA A 88 15.467 31.942 -7.947 1.00 25.00 H new ATOM 0 HA ALA A 88 17.834 33.565 -7.647 1.00 25.00 H new ATOM 0 HB1 ALA A 88 18.602 31.587 -6.323 1.00 25.00 H new ATOM 0 HB2 ALA A 88 16.982 32.127 -5.821 1.00 25.00 H new ATOM 0 HB3 ALA A 88 17.161 30.689 -6.854 1.00 25.00 H new ATOM 1386 N GLN A 89 18.178 32.541 -10.189 1.00 25.00 N ATOM 1387 CA GLN A 89 18.952 32.140 -11.366 1.00 25.00 C ATOM 1388 C GLN A 89 20.127 33.087 -11.623 1.00 25.00 C ATOM 1389 O GLN A 89 19.960 34.298 -11.754 1.00 25.00 O ATOM 1390 CB GLN A 89 18.058 32.117 -12.603 1.00 25.00 C ATOM 1391 CG GLN A 89 16.821 31.234 -12.449 1.00 25.00 C ATOM 1392 CD GLN A 89 15.961 31.208 -13.694 1.00 25.00 C ATOM 1393 OE1 GLN A 89 16.449 31.036 -14.798 1.00 25.00 O ATOM 1394 NE2 GLN A 89 14.678 31.363 -13.516 1.00 25.00 N ATOM 0 H GLN A 89 17.487 33.267 -10.378 1.00 25.00 H new ATOM 0 HA GLN A 89 19.346 31.143 -11.168 1.00 25.00 H new ATOM 0 HB2 GLN A 89 17.741 33.135 -12.831 1.00 25.00 H new ATOM 0 HB3 GLN A 89 18.640 31.766 -13.455 1.00 25.00 H new ATOM 0 HG2 GLN A 89 17.133 30.218 -12.207 1.00 25.00 H new ATOM 0 HG3 GLN A 89 16.226 31.593 -11.609 1.00 25.00 H new ATOM 0 HE21 GLN A 89 14.307 31.505 -12.577 1.00 25.00 H new ATOM 0 HE22 GLN A 89 14.046 31.342 -14.316 1.00 25.00 H new ATOM 1403 N ALA A 90 21.316 32.514 -11.705 1.00 25.00 N ATOM 1404 CA ALA A 90 22.542 33.263 -11.971 1.00 25.00 C ATOM 1405 C ALA A 90 22.757 33.442 -13.484 1.00 25.00 C ATOM 1406 O ALA A 90 22.111 32.781 -14.296 1.00 25.00 O ATOM 1407 CB ALA A 90 23.741 32.518 -11.347 1.00 25.00 C ATOM 0 H ALA A 90 21.463 31.511 -11.589 1.00 25.00 H new ATOM 0 HA ALA A 90 22.455 34.253 -11.524 1.00 25.00 H new ATOM 0 HB1 ALA A 90 24.657 33.074 -11.544 1.00 25.00 H new ATOM 0 HB2 ALA A 90 23.594 32.430 -10.271 1.00 25.00 H new ATOM 0 HB3 ALA A 90 23.819 31.523 -11.785 1.00 25.00 H new ATOM 1413 N LYS A 91 23.710 34.295 -13.849 1.00 25.00 N ATOM 1414 CA LYS A 91 24.084 34.515 -15.253 1.00 25.00 C ATOM 1415 C LYS A 91 25.582 34.339 -15.412 1.00 25.00 C ATOM 1416 O LYS A 91 26.334 34.582 -14.476 1.00 25.00 O ATOM 1417 CB LYS A 91 23.733 35.937 -15.699 1.00 25.00 C ATOM 1418 CG LYS A 91 22.246 36.199 -15.888 1.00 25.00 C ATOM 1419 CD LYS A 91 22.004 37.645 -16.344 1.00 25.00 C ATOM 1420 CE LYS A 91 22.335 37.839 -17.829 1.00 25.00 C ATOM 1421 NZ LYS A 91 22.518 39.288 -18.180 1.00 25.00 N ATOM 0 H LYS A 91 24.247 34.854 -13.186 1.00 25.00 H new ATOM 0 HA LYS A 91 23.536 33.795 -15.861 1.00 25.00 H new ATOM 0 HB2 LYS A 91 24.120 36.640 -14.961 1.00 25.00 H new ATOM 0 HB3 LYS A 91 24.246 36.145 -16.638 1.00 25.00 H new ATOM 0 HG2 LYS A 91 21.841 35.507 -16.626 1.00 25.00 H new ATOM 0 HG3 LYS A 91 21.717 36.014 -14.953 1.00 25.00 H new ATOM 0 HD2 LYS A 91 20.962 37.912 -16.166 1.00 25.00 H new ATOM 0 HD3 LYS A 91 22.613 38.322 -15.745 1.00 25.00 H new ATOM 0 HE2 LYS A 91 23.244 37.289 -18.073 1.00 25.00 H new ATOM 0 HE3 LYS A 91 21.535 37.417 -18.437 1.00 25.00 H new ATOM 0 HZ1 LYS A 91 22.935 39.365 -19.130 1.00 25.00 H new ATOM 0 HZ2 LYS A 91 21.595 39.768 -18.167 1.00 25.00 H new ATOM 0 HZ3 LYS A 91 23.151 39.736 -17.487 1.00 25.00 H new ATOM 1435 N ILE A 92 26.001 33.979 -16.615 1.00 25.00 N ATOM 1436 CA ILE A 92 27.417 33.875 -16.966 1.00 25.00 C ATOM 1437 C ILE A 92 27.559 34.619 -18.289 1.00 25.00 C ATOM 1438 O ILE A 92 26.910 34.263 -19.270 1.00 25.00 O ATOM 1439 CB ILE A 92 27.878 32.390 -17.148 1.00 25.00 C ATOM 1440 CG1 ILE A 92 27.630 31.582 -15.853 1.00 25.00 C ATOM 1441 CG2 ILE A 92 29.386 32.339 -17.537 1.00 25.00 C ATOM 1442 CD1 ILE A 92 27.829 30.064 -16.008 1.00 25.00 C ATOM 0 H ILE A 92 25.369 33.749 -17.382 1.00 25.00 H new ATOM 0 HA ILE A 92 28.037 34.291 -16.172 1.00 25.00 H new ATOM 0 HB ILE A 92 27.293 31.941 -17.951 1.00 25.00 H new ATOM 0 HG12 ILE A 92 28.301 31.948 -15.076 1.00 25.00 H new ATOM 0 HG13 ILE A 92 26.613 31.770 -15.510 1.00 25.00 H new ATOM 0 HG21 ILE A 92 29.695 31.301 -17.661 1.00 25.00 H new ATOM 0 HG22 ILE A 92 29.539 32.877 -18.473 1.00 25.00 H new ATOM 0 HG23 ILE A 92 29.981 32.803 -16.750 1.00 25.00 H new ATOM 0 HD11 ILE A 92 27.636 29.572 -15.055 1.00 25.00 H new ATOM 0 HD12 ILE A 92 27.139 29.681 -16.760 1.00 25.00 H new ATOM 0 HD13 ILE A 92 28.854 29.861 -16.319 1.00 25.00 H new ATOM 1454 N GLU A 93 28.350 35.681 -18.298 1.00 25.00 N ATOM 1455 CA GLU A 93 28.545 36.514 -19.475 1.00 25.00 C ATOM 1456 C GLU A 93 30.039 36.813 -19.572 1.00 25.00 C ATOM 1457 O GLU A 93 30.716 36.880 -18.547 1.00 25.00 O ATOM 1458 CB GLU A 93 27.740 37.805 -19.317 1.00 25.00 C ATOM 1459 CG GLU A 93 26.228 37.563 -19.325 1.00 25.00 C ATOM 1460 CD GLU A 93 25.409 38.835 -19.197 1.00 25.00 C ATOM 1461 OE1 GLU A 93 24.618 39.131 -20.122 1.00 25.00 O ATOM 1462 OE2 GLU A 93 25.404 39.441 -18.102 1.00 25.00 O ATOM 0 H GLU A 93 28.879 35.991 -17.483 1.00 25.00 H new ATOM 0 HA GLU A 93 28.205 36.014 -20.382 1.00 25.00 H new ATOM 0 HB2 GLU A 93 28.021 38.292 -18.383 1.00 25.00 H new ATOM 0 HB3 GLU A 93 27.998 38.491 -20.124 1.00 25.00 H new ATOM 0 HG2 GLU A 93 25.954 37.056 -20.250 1.00 25.00 H new ATOM 0 HG3 GLU A 93 25.971 36.891 -18.506 1.00 25.00 H new ATOM 1469 N GLU A 94 30.558 36.951 -20.787 1.00 25.00 N ATOM 1470 CA GLU A 94 31.992 37.160 -21.003 1.00 25.00 C ATOM 1471 C GLU A 94 32.262 38.293 -21.990 1.00 25.00 C ATOM 1472 O GLU A 94 31.452 38.562 -22.873 1.00 25.00 O ATOM 1473 CB GLU A 94 32.628 35.892 -21.588 1.00 25.00 C ATOM 1474 CG GLU A 94 32.583 34.672 -20.682 1.00 25.00 C ATOM 1475 CD GLU A 94 33.426 33.530 -21.236 1.00 25.00 C ATOM 1476 OE1 GLU A 94 34.079 32.826 -20.436 1.00 25.00 O ATOM 1477 OE2 GLU A 94 33.470 33.364 -22.475 1.00 25.00 O ATOM 0 H GLU A 94 30.006 36.922 -21.644 1.00 25.00 H new ATOM 0 HA GLU A 94 32.419 37.410 -20.032 1.00 25.00 H new ATOM 0 HB2 GLU A 94 32.124 35.650 -22.523 1.00 25.00 H new ATOM 0 HB3 GLU A 94 33.668 36.106 -21.833 1.00 25.00 H new ATOM 0 HG2 GLU A 94 32.943 34.942 -19.689 1.00 25.00 H new ATOM 0 HG3 GLU A 94 31.551 34.341 -20.568 1.00 25.00 H new ATOM 1484 N ASP A 95 33.447 38.884 -21.887 1.00 25.00 N ATOM 1485 CA ASP A 95 33.927 39.879 -22.858 1.00 25.00 C ATOM 1486 C ASP A 95 35.413 39.616 -23.122 1.00 25.00 C ATOM 1487 O ASP A 95 36.273 40.476 -22.928 1.00 25.00 O ATOM 1488 CB ASP A 95 33.713 41.314 -22.361 1.00 25.00 C ATOM 1489 CG ASP A 95 34.031 42.358 -23.438 1.00 25.00 C ATOM 1490 OD1 ASP A 95 34.214 43.546 -23.088 1.00 25.00 O ATOM 1491 OD2 ASP A 95 34.088 41.992 -24.636 1.00 25.00 O ATOM 0 H ASP A 95 34.106 38.692 -21.132 1.00 25.00 H new ATOM 0 HA ASP A 95 33.354 39.780 -23.780 1.00 25.00 H new ATOM 0 HB2 ASP A 95 32.679 41.433 -22.037 1.00 25.00 H new ATOM 0 HB3 ASP A 95 34.343 41.492 -21.489 1.00 25.00 H new ATOM 1496 N ILE A 96 35.724 38.392 -23.529 1.00 25.00 N ATOM 1497 CA ILE A 96 37.112 38.003 -23.813 1.00 25.00 C ATOM 1498 C ILE A 96 37.418 38.436 -25.256 1.00 25.00 C ATOM 1499 O ILE A 96 37.745 37.635 -26.135 1.00 25.00 O ATOM 1500 CB ILE A 96 37.365 36.468 -23.584 1.00 25.00 C ATOM 1501 CG1 ILE A 96 36.830 36.044 -22.195 1.00 25.00 C ATOM 1502 CG2 ILE A 96 38.900 36.143 -23.654 1.00 25.00 C ATOM 1503 CD1 ILE A 96 36.845 34.528 -21.938 1.00 25.00 C ATOM 0 H ILE A 96 35.040 37.648 -23.672 1.00 25.00 H new ATOM 0 HA ILE A 96 37.789 38.501 -23.119 1.00 25.00 H new ATOM 0 HB ILE A 96 36.843 35.919 -24.368 1.00 25.00 H new ATOM 0 HG12 ILE A 96 37.425 36.535 -21.426 1.00 25.00 H new ATOM 0 HG13 ILE A 96 35.808 36.407 -22.088 1.00 25.00 H new ATOM 0 HG21 ILE A 96 39.054 35.076 -23.493 1.00 25.00 H new ATOM 0 HG22 ILE A 96 39.287 36.421 -24.634 1.00 25.00 H new ATOM 0 HG23 ILE A 96 39.427 36.706 -22.883 1.00 25.00 H new ATOM 0 HD11 ILE A 96 36.453 34.324 -20.941 1.00 25.00 H new ATOM 0 HD12 ILE A 96 36.225 34.027 -22.681 1.00 25.00 H new ATOM 0 HD13 ILE A 96 37.867 34.157 -22.009 1.00 25.00 H new ATOM 1515 N ARG A 97 37.279 39.729 -25.505 1.00 25.00 N ATOM 1516 CA ARG A 97 37.467 40.306 -26.838 1.00 25.00 C ATOM 1517 C ARG A 97 38.951 40.589 -27.115 1.00 25.00 C ATOM 1518 O ARG A 97 39.337 41.624 -27.674 1.00 25.00 O ATOM 1519 CB ARG A 97 36.638 41.589 -26.926 1.00 25.00 C ATOM 1520 CG ARG A 97 36.353 42.061 -28.339 1.00 25.00 C ATOM 1521 CD ARG A 97 36.272 43.577 -28.370 1.00 25.00 C ATOM 1522 NE ARG A 97 36.462 44.099 -29.733 1.00 25.00 N ATOM 1523 CZ ARG A 97 37.639 44.264 -30.330 1.00 25.00 C ATOM 1524 NH1 ARG A 97 38.776 43.943 -29.756 1.00 25.00 N ATOM 1525 NH2 ARG A 97 37.672 44.759 -31.536 1.00 25.00 N ATOM 0 H ARG A 97 37.032 40.414 -24.791 1.00 25.00 H new ATOM 0 HA ARG A 97 37.133 39.597 -27.596 1.00 25.00 H new ATOM 0 HB2 ARG A 97 35.690 41.429 -26.412 1.00 25.00 H new ATOM 0 HB3 ARG A 97 37.161 42.381 -26.391 1.00 25.00 H new ATOM 0 HG2 ARG A 97 37.138 41.716 -29.012 1.00 25.00 H new ATOM 0 HG3 ARG A 97 35.417 41.631 -28.694 1.00 25.00 H new ATOM 0 HD2 ARG A 97 35.303 43.899 -27.988 1.00 25.00 H new ATOM 0 HD3 ARG A 97 37.031 43.997 -27.709 1.00 25.00 H new ATOM 0 HE ARG A 97 35.627 44.354 -30.260 1.00 25.00 H new ATOM 0 HH11 ARG A 97 38.779 43.550 -28.815 1.00 25.00 H new ATOM 0 HH12 ARG A 97 39.656 44.087 -30.251 1.00 25.00 H new ATOM 0 HH21 ARG A 97 36.804 45.013 -32.007 1.00 25.00 H new ATOM 0 HH22 ARG A 97 38.566 44.892 -32.008 1.00 25.00 H new ATOM 1539 N GLN A 98 39.801 39.639 -26.726 1.00 25.00 N ATOM 1540 CA GLN A 98 41.254 39.725 -26.884 1.00 25.00 C ATOM 1541 C GLN A 98 41.845 38.353 -27.239 1.00 25.00 C ATOM 1542 O GLN A 98 42.329 37.568 -26.455 1.00 25.00 O ATOM 1543 CB GLN A 98 41.898 40.386 -25.627 1.00 25.00 C ATOM 1544 CG GLN A 98 43.442 40.473 -25.711 1.00 25.00 C ATOM 1545 CD GLN A 98 43.912 41.093 -27.002 1.00 25.00 C ATOM 1546 OE1 GLN A 98 43.577 42.178 -27.402 1.00 25.00 O ATOM 1547 NE2 GLN A 98 44.728 40.344 -27.731 1.00 25.00 N ATOM 1548 OXT GLN A 98 41.787 38.110 -28.516 1.00 25.00 O ATOM 0 H GLN A 98 39.494 38.772 -26.284 1.00 25.00 H new ATOM 0 HA GLN A 98 41.494 40.376 -27.725 1.00 25.00 H new ATOM 0 HB2 GLN A 98 41.490 41.389 -25.502 1.00 25.00 H new ATOM 0 HB3 GLN A 98 41.620 39.815 -24.741 1.00 25.00 H new ATOM 0 HG2 GLN A 98 43.817 41.059 -24.872 1.00 25.00 H new ATOM 0 HG3 GLN A 98 43.865 39.473 -25.616 1.00 25.00 H new ATOM 0 HE21 GLN A 98 45.013 39.424 -27.394 1.00 25.00 H new ATOM 0 HE22 GLN A 98 45.070 40.687 -28.628 1.00 25.00 H new TER 1558 GLN A 98