USER MOD reduce.3.24.130724 H: found=0, std=0, add=478, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 479 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 183 GLN :FLIP amide:sc= -6.28! C(o=-11!,f=-5.6!) USER MOD Set 1.2: A 185 ASN : amide:sc= 0.629 K(o=-5.6,f=-15!) USER MOD Set 2.1: A 174 THR OG1 : rot 30:sc= 0.0224 USER MOD Set 2.2: A 230 SER OG : rot 33:sc= 0.141 USER MOD Single : A 170 SER OG : rot 180:sc= 0.121 USER MOD Single : A 180 TYR OH : rot 180:sc= 0 USER MOD Single : A 182 TYR OH : rot -151:sc= 1.27 USER MOD Single : A 184 THR OG1 : rot 31:sc= -5.46! USER MOD Single : A 188 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 194 CYS SG : rot 56:sc= 1.27 USER MOD Single : A 198 TYR OH : rot -124:sc= -0.067 USER MOD Single : A 199 TYR OH : rot 180:sc= 0 USER MOD Single : A 203 SER OG : rot 180:sc= 0 USER MOD Single : A 204 SER OG : rot 180:sc= 0 USER MOD Single : A 207 HIS :FLIP no HD1:sc= -2.45 F(o=-3.2!,f=-2.4) USER MOD Single : A 212 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 214 LYS NZ :NH3+ -160:sc= -2.38! (180deg=-3.5!) USER MOD Single : A 215 ASN : amide:sc= -0.0534 K(o=-0.053,f=-1.9!) USER MOD Single : A 217 HIS : no HD1:sc= -0.0283 X(o=-0.028,f=-0.13) USER MOD Single : A 220 TYR OH : rot 180:sc= 0.835 USER MOD Single : A 223 SER OG : rot 180:sc= 0 USER MOD Single : A 224 SER OG : rot 180:sc= 0 USER MOD Single : A 225 TYR OH : rot 180:sc= 0 USER MOD Single : A 229 LYS NZ :NH3+ -164:sc= -2.07 (180deg=-2.68!) USER MOD Single : A 232 ASN : amide:sc= -1.88! C(o=-1.9!,f=-7.4!) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 169 59.038 -17.466 7.521 1.00 1.00 N ATOM 2 CA GLY A 169 57.599 -17.837 7.634 1.00 1.00 C ATOM 3 C GLY A 169 57.077 -18.283 6.271 1.00 1.00 C ATOM 4 O GLY A 169 57.766 -18.987 5.533 1.00 1.00 O ATOM 0 HA2 GLY A 169 57.476 -18.639 8.362 1.00 1.00 H new ATOM 0 HA3 GLY A 169 57.021 -16.987 7.996 1.00 1.00 H new ATOM 10 N SER A 170 55.855 -17.874 5.947 1.00 1.00 N ATOM 11 CA SER A 170 55.248 -18.241 4.672 1.00 1.00 C ATOM 12 C SER A 170 56.168 -17.850 3.510 1.00 1.00 C ATOM 13 O SER A 170 57.100 -17.064 3.682 1.00 1.00 O ATOM 14 CB SER A 170 53.871 -17.550 4.535 1.00 1.00 C ATOM 15 OG SER A 170 53.646 -16.734 5.678 1.00 1.00 O ATOM 0 H SER A 170 55.268 -17.292 6.545 1.00 1.00 H new ATOM 0 HA SER A 170 55.105 -19.321 4.641 1.00 1.00 H new ATOM 0 HB2 SER A 170 53.842 -16.945 3.629 1.00 1.00 H new ATOM 0 HB3 SER A 170 53.082 -18.297 4.445 1.00 1.00 H new ATOM 0 HG SER A 170 52.775 -16.291 5.598 1.00 1.00 H new ATOM 21 N PRO A 171 55.913 -18.376 2.335 1.00 1.00 N ATOM 22 CA PRO A 171 56.725 -18.069 1.123 1.00 1.00 C ATOM 23 C PRO A 171 56.373 -16.701 0.550 1.00 1.00 C ATOM 24 O PRO A 171 55.627 -15.941 1.163 1.00 1.00 O ATOM 25 CB PRO A 171 56.334 -19.185 0.150 1.00 1.00 C ATOM 26 CG PRO A 171 54.922 -19.522 0.512 1.00 1.00 C ATOM 27 CD PRO A 171 54.823 -19.323 2.032 1.00 1.00 C ATOM 0 HA PRO A 171 57.795 -18.030 1.329 1.00 1.00 H new ATOM 0 HB2 PRO A 171 56.410 -18.853 -0.885 1.00 1.00 H new ATOM 0 HB3 PRO A 171 56.988 -20.051 0.256 1.00 1.00 H new ATOM 0 HG2 PRO A 171 54.218 -18.877 -0.014 1.00 1.00 H new ATOM 0 HG3 PRO A 171 54.681 -20.548 0.235 1.00 1.00 H new ATOM 0 HD2 PRO A 171 53.852 -18.921 2.320 1.00 1.00 H new ATOM 0 HD3 PRO A 171 54.950 -20.264 2.568 1.00 1.00 H new ATOM 35 N GLU A 172 56.910 -16.408 -0.628 1.00 1.00 N ATOM 36 CA GLU A 172 56.641 -15.137 -1.294 1.00 1.00 C ATOM 37 C GLU A 172 55.134 -14.934 -1.405 1.00 1.00 C ATOM 38 O GLU A 172 54.447 -14.738 -0.404 1.00 1.00 O ATOM 39 CB GLU A 172 57.256 -15.166 -2.695 1.00 1.00 C ATOM 40 CG GLU A 172 58.750 -15.455 -2.578 1.00 1.00 C ATOM 41 CD GLU A 172 59.400 -15.481 -3.958 1.00 1.00 C ATOM 42 OE1 GLU A 172 58.838 -16.092 -4.847 1.00 1.00 O ATOM 43 OE2 GLU A 172 60.460 -14.888 -4.100 1.00 1.00 O ATOM 0 H GLU A 172 57.533 -17.031 -1.142 1.00 1.00 H new ATOM 0 HA GLU A 172 57.076 -14.319 -0.719 1.00 1.00 H new ATOM 0 HB2 GLU A 172 56.772 -15.930 -3.303 1.00 1.00 H new ATOM 0 HB3 GLU A 172 57.096 -14.211 -3.196 1.00 1.00 H new ATOM 0 HG2 GLU A 172 59.226 -14.694 -1.960 1.00 1.00 H new ATOM 0 HG3 GLU A 172 58.903 -16.412 -2.080 1.00 1.00 H new ATOM 50 N GLU A 173 54.626 -15.017 -2.630 1.00 1.00 N ATOM 51 CA GLU A 173 53.201 -14.885 -2.886 1.00 1.00 C ATOM 52 C GLU A 173 52.544 -13.898 -1.929 1.00 1.00 C ATOM 53 O GLU A 173 52.163 -14.261 -0.816 1.00 1.00 O ATOM 54 CB GLU A 173 52.565 -16.263 -2.709 1.00 1.00 C ATOM 55 CG GLU A 173 53.322 -17.271 -3.563 1.00 1.00 C ATOM 56 CD GLU A 173 52.547 -18.586 -3.607 1.00 1.00 C ATOM 57 OE1 GLU A 173 51.426 -18.601 -3.125 1.00 1.00 O ATOM 58 OE2 GLU A 173 53.085 -19.552 -4.118 1.00 1.00 O ATOM 0 H GLU A 173 55.188 -15.177 -3.466 1.00 1.00 H new ATOM 0 HA GLU A 173 53.055 -14.506 -3.897 1.00 1.00 H new ATOM 0 HB2 GLU A 173 52.595 -16.560 -1.661 1.00 1.00 H new ATOM 0 HB3 GLU A 173 51.516 -16.234 -3.002 1.00 1.00 H new ATOM 0 HG2 GLU A 173 53.455 -16.881 -4.572 1.00 1.00 H new ATOM 0 HG3 GLU A 173 54.318 -17.437 -3.152 1.00 1.00 H new ATOM 65 N THR A 174 52.418 -12.651 -2.362 1.00 1.00 N ATOM 66 CA THR A 174 51.810 -11.612 -1.532 1.00 1.00 C ATOM 67 C THR A 174 50.781 -10.834 -2.332 1.00 1.00 C ATOM 68 O THR A 174 50.428 -11.218 -3.441 1.00 1.00 O ATOM 69 CB THR A 174 52.895 -10.657 -1.011 1.00 1.00 C ATOM 70 OG1 THR A 174 52.407 -9.987 0.135 1.00 1.00 O ATOM 71 CG2 THR A 174 53.279 -9.624 -2.079 1.00 1.00 C ATOM 0 H THR A 174 52.727 -12.332 -3.280 1.00 1.00 H new ATOM 0 HA THR A 174 51.313 -12.086 -0.686 1.00 1.00 H new ATOM 0 HB THR A 174 53.782 -11.239 -0.762 1.00 1.00 H new ATOM 0 HG1 THR A 174 51.768 -10.563 0.604 1.00 1.00 H new ATOM 0 HG21 THR A 174 54.049 -8.961 -1.684 1.00 1.00 H new ATOM 0 HG22 THR A 174 53.661 -10.138 -2.961 1.00 1.00 H new ATOM 0 HG23 THR A 174 52.401 -9.039 -2.352 1.00 1.00 H new ATOM 79 N LEU A 175 50.319 -9.727 -1.761 1.00 1.00 N ATOM 80 CA LEU A 175 49.342 -8.874 -2.425 1.00 1.00 C ATOM 81 C LEU A 175 49.899 -7.464 -2.546 1.00 1.00 C ATOM 82 O LEU A 175 50.821 -7.083 -1.825 1.00 1.00 O ATOM 83 CB LEU A 175 48.020 -8.850 -1.646 1.00 1.00 C ATOM 84 CG LEU A 175 47.588 -10.294 -1.282 1.00 1.00 C ATOM 85 CD1 LEU A 175 48.090 -10.658 0.127 1.00 1.00 C ATOM 86 CD2 LEU A 175 46.053 -10.404 -1.334 1.00 1.00 C ATOM 0 H LEU A 175 50.606 -9.400 -0.839 1.00 1.00 H new ATOM 0 HA LEU A 175 49.145 -9.276 -3.419 1.00 1.00 H new ATOM 0 HB2 LEU A 175 48.135 -8.257 -0.739 1.00 1.00 H new ATOM 0 HB3 LEU A 175 47.245 -8.371 -2.244 1.00 1.00 H new ATOM 0 HG LEU A 175 48.024 -10.987 -2.001 1.00 1.00 H new ATOM 0 HD11 LEU A 175 47.781 -11.674 0.372 1.00 1.00 H new ATOM 0 HD12 LEU A 175 49.178 -10.593 0.154 1.00 1.00 H new ATOM 0 HD13 LEU A 175 47.667 -9.965 0.854 1.00 1.00 H new ATOM 0 HD21 LEU A 175 45.752 -11.420 -1.078 1.00 1.00 H new ATOM 0 HD22 LEU A 175 45.614 -9.705 -0.622 1.00 1.00 H new ATOM 0 HD23 LEU A 175 45.705 -10.165 -2.339 1.00 1.00 H new ATOM 98 N VAL A 176 49.338 -6.696 -3.470 1.00 1.00 N ATOM 99 CA VAL A 176 49.779 -5.321 -3.703 1.00 1.00 C ATOM 100 C VAL A 176 48.584 -4.390 -3.719 1.00 1.00 C ATOM 101 O VAL A 176 47.448 -4.843 -3.811 1.00 1.00 O ATOM 102 CB VAL A 176 50.506 -5.229 -5.041 1.00 1.00 C ATOM 103 CG1 VAL A 176 51.780 -6.064 -4.979 1.00 1.00 C ATOM 104 CG2 VAL A 176 49.611 -5.765 -6.157 1.00 1.00 C ATOM 0 H VAL A 176 48.574 -7.000 -4.074 1.00 1.00 H new ATOM 0 HA VAL A 176 50.456 -5.029 -2.900 1.00 1.00 H new ATOM 0 HB VAL A 176 50.752 -4.187 -5.244 1.00 1.00 H new ATOM 0 HG11 VAL A 176 52.303 -6.001 -5.933 1.00 1.00 H new ATOM 0 HG12 VAL A 176 52.425 -5.685 -4.186 1.00 1.00 H new ATOM 0 HG13 VAL A 176 51.524 -7.103 -4.773 1.00 1.00 H new ATOM 0 HG21 VAL A 176 50.136 -5.696 -7.109 1.00 1.00 H new ATOM 0 HG22 VAL A 176 49.361 -6.807 -5.955 1.00 1.00 H new ATOM 0 HG23 VAL A 176 48.696 -5.175 -6.204 1.00 1.00 H new ATOM 114 N ILE A 177 48.845 -3.087 -3.620 1.00 1.00 N ATOM 115 CA ILE A 177 47.773 -2.092 -3.623 1.00 1.00 C ATOM 116 C ILE A 177 48.017 -1.048 -4.712 1.00 1.00 C ATOM 117 O ILE A 177 49.085 -0.443 -4.767 1.00 1.00 O ATOM 118 CB ILE A 177 47.714 -1.393 -2.261 1.00 1.00 C ATOM 119 CG1 ILE A 177 47.870 -2.442 -1.154 1.00 1.00 C ATOM 120 CG2 ILE A 177 46.369 -0.670 -2.112 1.00 1.00 C ATOM 121 CD1 ILE A 177 47.553 -1.819 0.208 1.00 1.00 C ATOM 0 H ILE A 177 49.784 -2.697 -3.537 1.00 1.00 H new ATOM 0 HA ILE A 177 46.829 -2.600 -3.820 1.00 1.00 H new ATOM 0 HB ILE A 177 48.519 -0.662 -2.185 1.00 1.00 H new ATOM 0 HG12 ILE A 177 47.203 -3.283 -1.342 1.00 1.00 H new ATOM 0 HG13 ILE A 177 48.887 -2.835 -1.155 1.00 1.00 H new ATOM 0 HG21 ILE A 177 46.328 -0.173 -1.143 1.00 1.00 H new ATOM 0 HG22 ILE A 177 46.265 0.071 -2.904 1.00 1.00 H new ATOM 0 HG23 ILE A 177 45.557 -1.394 -2.183 1.00 1.00 H new ATOM 0 HD11 ILE A 177 47.667 -2.572 0.988 1.00 1.00 H new ATOM 0 HD12 ILE A 177 48.238 -0.993 0.399 1.00 1.00 H new ATOM 0 HD13 ILE A 177 46.528 -1.448 0.209 1.00 1.00 H new ATOM 133 N ALA A 178 47.022 -0.847 -5.569 1.00 1.00 N ATOM 134 CA ALA A 178 47.140 0.127 -6.650 1.00 1.00 C ATOM 135 C ALA A 178 46.982 1.549 -6.113 1.00 1.00 C ATOM 136 O ALA A 178 45.882 1.968 -5.749 1.00 1.00 O ATOM 137 CB ALA A 178 46.073 -0.164 -7.714 1.00 1.00 C ATOM 0 H ALA A 178 46.130 -1.341 -5.538 1.00 1.00 H new ATOM 0 HA ALA A 178 48.130 0.044 -7.099 1.00 1.00 H new ATOM 0 HB1 ALA A 178 46.158 0.562 -8.523 1.00 1.00 H new ATOM 0 HB2 ALA A 178 46.219 -1.169 -8.111 1.00 1.00 H new ATOM 0 HB3 ALA A 178 45.082 -0.092 -7.265 1.00 1.00 H new ATOM 143 N LEU A 179 48.088 2.284 -6.067 1.00 1.00 N ATOM 144 CA LEU A 179 48.065 3.655 -5.570 1.00 1.00 C ATOM 145 C LEU A 179 47.204 4.538 -6.466 1.00 1.00 C ATOM 146 O LEU A 179 46.434 5.366 -5.981 1.00 1.00 O ATOM 147 CB LEU A 179 49.492 4.209 -5.517 1.00 1.00 C ATOM 148 CG LEU A 179 50.298 3.481 -4.430 1.00 1.00 C ATOM 149 CD1 LEU A 179 51.778 3.849 -4.571 1.00 1.00 C ATOM 150 CD2 LEU A 179 49.797 3.874 -3.024 1.00 1.00 C ATOM 0 H LEU A 179 49.006 1.956 -6.366 1.00 1.00 H new ATOM 0 HA LEU A 179 47.636 3.654 -4.568 1.00 1.00 H new ATOM 0 HB2 LEU A 179 49.976 4.083 -6.486 1.00 1.00 H new ATOM 0 HB3 LEU A 179 49.468 5.279 -5.309 1.00 1.00 H new ATOM 0 HG LEU A 179 50.168 2.406 -4.554 1.00 1.00 H new ATOM 0 HD11 LEU A 179 52.355 3.335 -3.802 1.00 1.00 H new ATOM 0 HD12 LEU A 179 52.136 3.548 -5.556 1.00 1.00 H new ATOM 0 HD13 LEU A 179 51.898 4.926 -4.456 1.00 1.00 H new ATOM 0 HD21 LEU A 179 50.381 3.347 -2.269 1.00 1.00 H new ATOM 0 HD22 LEU A 179 49.910 4.949 -2.885 1.00 1.00 H new ATOM 0 HD23 LEU A 179 48.746 3.603 -2.923 1.00 1.00 H new ATOM 162 N TYR A 180 47.340 4.355 -7.779 1.00 1.00 N ATOM 163 CA TYR A 180 46.571 5.139 -8.749 1.00 1.00 C ATOM 164 C TYR A 180 45.645 4.231 -9.546 1.00 1.00 C ATOM 165 O TYR A 180 45.956 3.064 -9.786 1.00 1.00 O ATOM 166 CB TYR A 180 47.521 5.859 -9.703 1.00 1.00 C ATOM 167 CG TYR A 180 48.442 6.756 -8.907 1.00 1.00 C ATOM 168 CD1 TYR A 180 47.996 8.012 -8.477 1.00 1.00 C ATOM 169 CD2 TYR A 180 49.741 6.331 -8.599 1.00 1.00 C ATOM 170 CE1 TYR A 180 48.849 8.842 -7.740 1.00 1.00 C ATOM 171 CE2 TYR A 180 50.593 7.161 -7.860 1.00 1.00 C ATOM 172 CZ TYR A 180 50.147 8.416 -7.430 1.00 1.00 C ATOM 173 OH TYR A 180 50.986 9.235 -6.702 1.00 1.00 O ATOM 0 H TYR A 180 47.973 3.673 -8.196 1.00 1.00 H new ATOM 0 HA TYR A 180 45.972 5.872 -8.209 1.00 1.00 H new ATOM 0 HB2 TYR A 180 48.103 5.134 -10.272 1.00 1.00 H new ATOM 0 HB3 TYR A 180 46.954 6.448 -10.424 1.00 1.00 H new ATOM 0 HD1 TYR A 180 46.995 8.340 -8.714 1.00 1.00 H new ATOM 0 HD2 TYR A 180 50.085 5.363 -8.932 1.00 1.00 H new ATOM 0 HE1 TYR A 180 48.506 9.812 -7.410 1.00 1.00 H new ATOM 0 HE2 TYR A 180 51.594 6.833 -7.622 1.00 1.00 H new ATOM 0 HH TYR A 180 51.849 8.788 -6.574 1.00 1.00 H new ATOM 183 N ASP A 181 44.505 4.774 -9.952 1.00 1.00 N ATOM 184 CA ASP A 181 43.539 4.002 -10.723 1.00 1.00 C ATOM 185 C ASP A 181 44.035 3.809 -12.150 1.00 1.00 C ATOM 186 O ASP A 181 43.828 4.664 -13.010 1.00 1.00 O ATOM 187 CB ASP A 181 42.194 4.730 -10.749 1.00 1.00 C ATOM 188 CG ASP A 181 41.161 3.897 -11.501 1.00 1.00 C ATOM 189 OD1 ASP A 181 41.540 2.877 -12.053 1.00 1.00 O ATOM 190 OD2 ASP A 181 40.008 4.294 -11.517 1.00 1.00 O ATOM 0 H ASP A 181 44.228 5.737 -9.763 1.00 1.00 H new ATOM 0 HA ASP A 181 43.418 3.027 -10.252 1.00 1.00 H new ATOM 0 HB2 ASP A 181 41.852 4.915 -9.731 1.00 1.00 H new ATOM 0 HB3 ASP A 181 42.307 5.702 -11.228 1.00 1.00 H new ATOM 195 N TYR A 182 44.686 2.673 -12.396 1.00 1.00 N ATOM 196 CA TYR A 182 45.206 2.360 -13.727 1.00 1.00 C ATOM 197 C TYR A 182 44.274 1.376 -14.430 1.00 1.00 C ATOM 198 O TYR A 182 43.806 0.410 -13.825 1.00 1.00 O ATOM 199 CB TYR A 182 46.610 1.754 -13.614 1.00 1.00 C ATOM 200 CG TYR A 182 47.147 1.486 -14.997 1.00 1.00 C ATOM 201 CD1 TYR A 182 47.695 2.531 -15.750 1.00 1.00 C ATOM 202 CD2 TYR A 182 47.093 0.194 -15.529 1.00 1.00 C ATOM 203 CE1 TYR A 182 48.189 2.282 -17.036 1.00 1.00 C ATOM 204 CE2 TYR A 182 47.584 -0.056 -16.814 1.00 1.00 C ATOM 205 CZ TYR A 182 48.131 0.988 -17.570 1.00 1.00 C ATOM 206 OH TYR A 182 48.619 0.743 -18.837 1.00 1.00 O ATOM 0 H TYR A 182 44.866 1.956 -11.694 1.00 1.00 H new ATOM 0 HA TYR A 182 45.262 3.280 -14.310 1.00 1.00 H new ATOM 0 HB2 TYR A 182 47.272 2.436 -13.080 1.00 1.00 H new ATOM 0 HB3 TYR A 182 46.575 0.829 -13.039 1.00 1.00 H new ATOM 0 HD1 TYR A 182 47.737 3.529 -15.339 1.00 1.00 H new ATOM 0 HD2 TYR A 182 46.671 -0.612 -14.947 1.00 1.00 H new ATOM 0 HE1 TYR A 182 48.615 3.087 -17.616 1.00 1.00 H new ATOM 0 HE2 TYR A 182 47.541 -1.054 -17.224 1.00 1.00 H new ATOM 0 HH TYR A 182 48.129 -0.005 -19.237 1.00 1.00 H new ATOM 216 N GLN A 183 44.000 1.631 -15.706 1.00 1.00 N ATOM 217 CA GLN A 183 43.109 0.769 -16.487 1.00 1.00 C ATOM 218 C GLN A 183 43.902 -0.329 -17.180 1.00 1.00 C ATOM 219 O GLN A 183 45.040 -0.603 -16.826 1.00 1.00 O ATOM 220 CB GLN A 183 42.383 1.609 -17.544 1.00 1.00 C ATOM 221 CG GLN A 183 43.406 2.216 -18.521 1.00 1.00 C ATOM 222 CD GLN A 183 43.788 1.206 -19.603 1.00 1.00 C ATOM 223 OE1 GLN A 183 44.910 0.547 -19.497 1.00 1.00 O flip ATOM 224 NE2 GLN A 183 43.045 1.017 -20.566 1.00 1.00 N flip ATOM 0 H GLN A 183 44.379 2.424 -16.223 1.00 1.00 H new ATOM 0 HA GLN A 183 42.386 0.312 -15.812 1.00 1.00 H new ATOM 0 HB2 GLN A 183 41.671 0.989 -18.088 1.00 1.00 H new ATOM 0 HB3 GLN A 183 41.812 2.402 -17.062 1.00 1.00 H new ATOM 0 HG2 GLN A 183 42.988 3.110 -18.983 1.00 1.00 H new ATOM 0 HG3 GLN A 183 44.297 2.526 -17.975 1.00 1.00 H new ATOM 0 HE21 GLN A 183 42.170 1.535 -20.644 1.00 1.00 H new ATOM 0 HE22 GLN A 183 43.305 0.343 -21.286 1.00 1.00 H new ATOM 233 N THR A 184 43.293 -0.960 -18.172 1.00 1.00 N ATOM 234 CA THR A 184 43.957 -2.021 -18.907 1.00 1.00 C ATOM 235 C THR A 184 43.383 -2.118 -20.318 1.00 1.00 C ATOM 236 O THR A 184 42.187 -1.919 -20.530 1.00 1.00 O ATOM 237 CB THR A 184 43.788 -3.346 -18.146 1.00 1.00 C ATOM 238 OG1 THR A 184 44.854 -3.490 -17.222 1.00 1.00 O ATOM 239 CG2 THR A 184 43.782 -4.533 -19.115 1.00 1.00 C ATOM 0 H THR A 184 42.344 -0.756 -18.484 1.00 1.00 H new ATOM 0 HA THR A 184 45.021 -1.802 -18.994 1.00 1.00 H new ATOM 0 HB THR A 184 42.835 -3.330 -17.617 1.00 1.00 H new ATOM 0 HG1 THR A 184 45.145 -2.605 -16.918 1.00 1.00 H new ATOM 0 HG21 THR A 184 43.661 -5.460 -18.554 1.00 1.00 H new ATOM 0 HG22 THR A 184 42.956 -4.424 -19.818 1.00 1.00 H new ATOM 0 HG23 THR A 184 44.724 -4.560 -19.663 1.00 1.00 H new ATOM 247 N ASN A 185 44.248 -2.448 -21.274 1.00 1.00 N ATOM 248 CA ASN A 185 43.834 -2.601 -22.665 1.00 1.00 C ATOM 249 C ASN A 185 43.850 -4.070 -23.039 1.00 1.00 C ATOM 250 O ASN A 185 44.858 -4.595 -23.512 1.00 1.00 O ATOM 251 CB ASN A 185 44.774 -1.833 -23.590 1.00 1.00 C ATOM 252 CG ASN A 185 44.542 -0.337 -23.440 1.00 1.00 C ATOM 253 OD1 ASN A 185 43.492 0.085 -22.954 1.00 1.00 O ATOM 254 ND2 ASN A 185 45.466 0.493 -23.830 1.00 1.00 N ATOM 0 H ASN A 185 45.241 -2.615 -21.110 1.00 1.00 H new ATOM 0 HA ASN A 185 42.826 -2.201 -22.776 1.00 1.00 H new ATOM 0 HB2 ASN A 185 45.810 -2.075 -23.352 1.00 1.00 H new ATOM 0 HB3 ASN A 185 44.606 -2.134 -24.624 1.00 1.00 H new ATOM 0 HD21 ASN A 185 45.322 1.498 -23.734 1.00 1.00 H new ATOM 0 HD22 ASN A 185 46.334 0.138 -24.232 1.00 1.00 H new ATOM 261 N ASP A 186 42.717 -4.721 -22.824 1.00 1.00 N ATOM 262 CA ASP A 186 42.561 -6.137 -23.134 1.00 1.00 C ATOM 263 C ASP A 186 43.133 -7.003 -21.996 1.00 1.00 C ATOM 264 O ASP A 186 44.185 -6.670 -21.462 1.00 1.00 O ATOM 265 CB ASP A 186 43.284 -6.465 -24.457 1.00 1.00 C ATOM 266 CG ASP A 186 42.553 -7.570 -25.219 1.00 1.00 C ATOM 267 OD1 ASP A 186 41.486 -7.294 -25.745 1.00 1.00 O ATOM 268 OD2 ASP A 186 43.067 -8.675 -25.261 1.00 1.00 O ATOM 0 H ASP A 186 41.882 -4.286 -22.431 1.00 1.00 H new ATOM 0 HA ASP A 186 41.499 -6.357 -23.239 1.00 1.00 H new ATOM 0 HB2 ASP A 186 43.343 -5.569 -25.075 1.00 1.00 H new ATOM 0 HB3 ASP A 186 44.307 -6.777 -24.249 1.00 1.00 H new ATOM 273 N PRO A 187 42.477 -8.098 -21.629 1.00 1.00 N ATOM 274 CA PRO A 187 42.962 -9.015 -20.552 1.00 1.00 C ATOM 275 C PRO A 187 44.478 -9.266 -20.604 1.00 1.00 C ATOM 276 O PRO A 187 44.932 -10.339 -20.998 1.00 1.00 O ATOM 277 CB PRO A 187 42.185 -10.313 -20.806 1.00 1.00 C ATOM 278 CG PRO A 187 40.927 -9.917 -21.512 1.00 1.00 C ATOM 279 CD PRO A 187 41.194 -8.568 -22.187 1.00 1.00 C ATOM 0 HA PRO A 187 42.795 -8.589 -19.563 1.00 1.00 H new ATOM 0 HB2 PRO A 187 42.770 -11.004 -21.412 1.00 1.00 H new ATOM 0 HB3 PRO A 187 41.961 -10.822 -19.869 1.00 1.00 H new ATOM 0 HG2 PRO A 187 40.647 -10.668 -22.250 1.00 1.00 H new ATOM 0 HG3 PRO A 187 40.099 -9.838 -20.808 1.00 1.00 H new ATOM 0 HD2 PRO A 187 41.252 -8.675 -23.270 1.00 1.00 H new ATOM 0 HD3 PRO A 187 40.392 -7.859 -21.980 1.00 1.00 H new ATOM 287 N GLN A 188 45.254 -8.263 -20.210 1.00 1.00 N ATOM 288 CA GLN A 188 46.712 -8.362 -20.213 1.00 1.00 C ATOM 289 C GLN A 188 47.302 -7.543 -19.084 1.00 1.00 C ATOM 290 O GLN A 188 48.139 -8.032 -18.326 1.00 1.00 O ATOM 291 CB GLN A 188 47.274 -7.848 -21.537 1.00 1.00 C ATOM 292 CG GLN A 188 46.942 -8.843 -22.637 1.00 1.00 C ATOM 293 CD GLN A 188 47.488 -8.360 -23.974 1.00 1.00 C ATOM 294 OE1 GLN A 188 47.138 -7.274 -24.435 1.00 1.00 O ATOM 295 NE2 GLN A 188 48.326 -9.113 -24.634 1.00 1.00 N ATOM 0 H GLN A 188 44.897 -7.366 -19.882 1.00 1.00 H new ATOM 0 HA GLN A 188 46.978 -9.411 -20.081 1.00 1.00 H new ATOM 0 HB2 GLN A 188 46.850 -6.872 -21.772 1.00 1.00 H new ATOM 0 HB3 GLN A 188 48.353 -7.717 -21.462 1.00 1.00 H new ATOM 0 HG2 GLN A 188 47.366 -9.817 -22.395 1.00 1.00 H new ATOM 0 HG3 GLN A 188 45.862 -8.973 -22.704 1.00 1.00 H new ATOM 0 HE21 GLN A 188 48.615 -10.013 -24.250 1.00 1.00 H new ATOM 0 HE22 GLN A 188 48.692 -8.801 -25.534 1.00 1.00 H new ATOM 304 N GLU A 189 46.882 -6.286 -18.982 1.00 1.00 N ATOM 305 CA GLU A 189 47.406 -5.409 -17.935 1.00 1.00 C ATOM 306 C GLU A 189 46.522 -5.446 -16.690 1.00 1.00 C ATOM 307 O GLU A 189 46.851 -4.845 -15.668 1.00 1.00 O ATOM 308 CB GLU A 189 47.492 -3.973 -18.440 1.00 1.00 C ATOM 309 CG GLU A 189 48.543 -3.883 -19.541 1.00 1.00 C ATOM 310 CD GLU A 189 48.590 -2.467 -20.097 1.00 1.00 C ATOM 311 OE1 GLU A 189 47.838 -1.636 -19.613 1.00 1.00 O ATOM 312 OE2 GLU A 189 49.376 -2.232 -20.999 1.00 1.00 O ATOM 0 H GLU A 189 46.193 -5.855 -19.598 1.00 1.00 H new ATOM 0 HA GLU A 189 48.401 -5.768 -17.673 1.00 1.00 H new ATOM 0 HB2 GLU A 189 46.523 -3.652 -18.821 1.00 1.00 H new ATOM 0 HB3 GLU A 189 47.751 -3.303 -17.620 1.00 1.00 H new ATOM 0 HG2 GLU A 189 49.520 -4.161 -19.146 1.00 1.00 H new ATOM 0 HG3 GLU A 189 48.309 -4.589 -20.338 1.00 1.00 H new ATOM 319 N LEU A 190 45.401 -6.149 -16.796 1.00 1.00 N ATOM 320 CA LEU A 190 44.445 -6.266 -15.694 1.00 1.00 C ATOM 321 C LEU A 190 44.069 -4.884 -15.162 1.00 1.00 C ATOM 322 O LEU A 190 44.902 -4.176 -14.599 1.00 1.00 O ATOM 323 CB LEU A 190 45.044 -7.103 -14.558 1.00 1.00 C ATOM 324 CG LEU A 190 43.969 -7.417 -13.500 1.00 1.00 C ATOM 325 CD1 LEU A 190 43.048 -8.544 -13.988 1.00 1.00 C ATOM 326 CD2 LEU A 190 44.643 -7.856 -12.198 1.00 1.00 C ATOM 0 H LEU A 190 45.127 -6.652 -17.640 1.00 1.00 H new ATOM 0 HA LEU A 190 43.549 -6.758 -16.072 1.00 1.00 H new ATOM 0 HB2 LEU A 190 45.453 -8.031 -14.958 1.00 1.00 H new ATOM 0 HB3 LEU A 190 45.871 -6.563 -14.097 1.00 1.00 H new ATOM 0 HG LEU A 190 43.377 -6.518 -13.331 1.00 1.00 H new ATOM 0 HD11 LEU A 190 42.295 -8.753 -13.228 1.00 1.00 H new ATOM 0 HD12 LEU A 190 42.557 -8.238 -14.912 1.00 1.00 H new ATOM 0 HD13 LEU A 190 43.638 -9.442 -14.171 1.00 1.00 H new ATOM 0 HD21 LEU A 190 43.881 -8.078 -11.451 1.00 1.00 H new ATOM 0 HD22 LEU A 190 45.242 -8.748 -12.381 1.00 1.00 H new ATOM 0 HD23 LEU A 190 45.287 -7.055 -11.834 1.00 1.00 H new ATOM 338 N ALA A 191 42.806 -4.503 -15.335 1.00 1.00 N ATOM 339 CA ALA A 191 42.351 -3.205 -14.856 1.00 1.00 C ATOM 340 C ALA A 191 42.566 -3.101 -13.350 1.00 1.00 C ATOM 341 O ALA A 191 42.169 -3.987 -12.593 1.00 1.00 O ATOM 342 CB ALA A 191 40.866 -3.023 -15.178 1.00 1.00 C ATOM 0 H ALA A 191 42.091 -5.066 -15.796 1.00 1.00 H new ATOM 0 HA ALA A 191 42.925 -2.423 -15.354 1.00 1.00 H new ATOM 0 HB1 ALA A 191 40.532 -2.050 -14.817 1.00 1.00 H new ATOM 0 HB2 ALA A 191 40.718 -3.080 -16.256 1.00 1.00 H new ATOM 0 HB3 ALA A 191 40.289 -3.809 -14.690 1.00 1.00 H new ATOM 348 N LEU A 192 43.207 -2.014 -12.920 1.00 1.00 N ATOM 349 CA LEU A 192 43.489 -1.797 -11.501 1.00 1.00 C ATOM 350 C LEU A 192 42.644 -0.650 -10.966 1.00 1.00 C ATOM 351 O LEU A 192 42.262 0.249 -11.716 1.00 1.00 O ATOM 352 CB LEU A 192 44.968 -1.459 -11.315 1.00 1.00 C ATOM 353 CG LEU A 192 45.831 -2.500 -12.040 1.00 1.00 C ATOM 354 CD1 LEU A 192 47.312 -2.123 -11.905 1.00 1.00 C ATOM 355 CD2 LEU A 192 45.597 -3.895 -11.428 1.00 1.00 C ATOM 0 H LEU A 192 43.541 -1.271 -13.534 1.00 1.00 H new ATOM 0 HA LEU A 192 43.247 -2.708 -10.954 1.00 1.00 H new ATOM 0 HB2 LEU A 192 45.176 -0.463 -11.707 1.00 1.00 H new ATOM 0 HB3 LEU A 192 45.216 -1.442 -10.254 1.00 1.00 H new ATOM 0 HG LEU A 192 45.555 -2.521 -13.094 1.00 1.00 H new ATOM 0 HD11 LEU A 192 47.924 -2.863 -12.420 1.00 1.00 H new ATOM 0 HD12 LEU A 192 47.479 -1.141 -12.348 1.00 1.00 H new ATOM 0 HD13 LEU A 192 47.586 -2.096 -10.850 1.00 1.00 H new ATOM 0 HD21 LEU A 192 46.213 -4.628 -11.948 1.00 1.00 H new ATOM 0 HD22 LEU A 192 45.866 -3.879 -10.372 1.00 1.00 H new ATOM 0 HD23 LEU A 192 44.546 -4.166 -11.531 1.00 1.00 H new ATOM 367 N ARG A 193 42.347 -0.683 -9.666 1.00 1.00 N ATOM 368 CA ARG A 193 41.533 0.365 -9.041 1.00 1.00 C ATOM 369 C ARG A 193 42.270 0.952 -7.844 1.00 1.00 C ATOM 370 O ARG A 193 42.978 0.243 -7.130 1.00 1.00 O ATOM 371 CB ARG A 193 40.174 -0.215 -8.587 1.00 1.00 C ATOM 372 CG ARG A 193 39.836 -1.444 -9.427 1.00 1.00 C ATOM 373 CD ARG A 193 38.334 -1.731 -9.361 1.00 1.00 C ATOM 374 NE ARG A 193 37.602 -0.732 -10.127 1.00 1.00 N ATOM 375 CZ ARG A 193 36.275 -0.705 -10.127 1.00 1.00 C ATOM 376 NH1 ARG A 193 35.606 -1.575 -9.421 1.00 1.00 N ATOM 377 NH2 ARG A 193 35.640 0.192 -10.830 1.00 1.00 N ATOM 0 H ARG A 193 42.654 -1.417 -9.028 1.00 1.00 H new ATOM 0 HA ARG A 193 41.354 1.153 -9.772 1.00 1.00 H new ATOM 0 HB2 ARG A 193 40.216 -0.484 -7.531 1.00 1.00 H new ATOM 0 HB3 ARG A 193 39.392 0.537 -8.693 1.00 1.00 H new ATOM 0 HG2 ARG A 193 40.138 -1.281 -10.462 1.00 1.00 H new ATOM 0 HG3 ARG A 193 40.395 -2.307 -9.064 1.00 1.00 H new ATOM 0 HD2 ARG A 193 38.128 -2.726 -9.755 1.00 1.00 H new ATOM 0 HD3 ARG A 193 37.999 -1.723 -8.324 1.00 1.00 H new ATOM 0 HE ARG A 193 38.118 -0.042 -10.673 1.00 1.00 H new ATOM 0 HH11 ARG A 193 36.103 -2.275 -8.870 1.00 1.00 H new ATOM 0 HH12 ARG A 193 34.586 -1.555 -9.420 1.00 1.00 H new ATOM 0 HH21 ARG A 193 36.163 0.873 -11.380 1.00 1.00 H new ATOM 0 HH22 ARG A 193 34.620 0.212 -10.830 1.00 1.00 H new ATOM 391 N CYS A 194 42.099 2.246 -7.631 1.00 1.00 N ATOM 392 CA CYS A 194 42.755 2.915 -6.519 1.00 1.00 C ATOM 393 C CYS A 194 42.237 2.386 -5.190 1.00 1.00 C ATOM 394 O CYS A 194 41.028 2.287 -4.988 1.00 1.00 O ATOM 395 CB CYS A 194 42.488 4.415 -6.584 1.00 1.00 C ATOM 396 SG CYS A 194 43.529 5.264 -5.372 1.00 1.00 S ATOM 0 H CYS A 194 41.516 2.851 -8.209 1.00 1.00 H new ATOM 0 HA CYS A 194 43.825 2.720 -6.592 1.00 1.00 H new ATOM 0 HB2 CYS A 194 42.698 4.790 -7.586 1.00 1.00 H new ATOM 0 HB3 CYS A 194 41.436 4.617 -6.382 1.00 1.00 H new ATOM 0 HG CYS A 194 44.776 4.964 -5.585 1.00 1.00 H new ATOM 402 N ASP A 195 43.166 2.037 -4.301 1.00 1.00 N ATOM 403 CA ASP A 195 42.821 1.506 -2.981 1.00 1.00 C ATOM 404 C ASP A 195 42.644 -0.007 -3.047 1.00 1.00 C ATOM 405 O ASP A 195 42.837 -0.705 -2.051 1.00 1.00 O ATOM 406 CB ASP A 195 41.527 2.163 -2.448 1.00 1.00 C ATOM 407 CG ASP A 195 41.520 2.197 -0.920 1.00 1.00 C ATOM 408 OD1 ASP A 195 42.542 2.536 -0.347 1.00 1.00 O ATOM 409 OD2 ASP A 195 40.487 1.885 -0.347 1.00 1.00 O ATOM 0 H ASP A 195 44.169 2.113 -4.471 1.00 1.00 H new ATOM 0 HA ASP A 195 43.638 1.739 -2.298 1.00 1.00 H new ATOM 0 HB2 ASP A 195 41.442 3.177 -2.838 1.00 1.00 H new ATOM 0 HB3 ASP A 195 40.659 1.610 -2.807 1.00 1.00 H new ATOM 414 N GLU A 196 42.281 -0.514 -4.223 1.00 1.00 N ATOM 415 CA GLU A 196 42.088 -1.943 -4.395 1.00 1.00 C ATOM 416 C GLU A 196 43.425 -2.670 -4.386 1.00 1.00 C ATOM 417 O GLU A 196 44.480 -2.057 -4.555 1.00 1.00 O ATOM 418 CB GLU A 196 41.340 -2.216 -5.711 1.00 1.00 C ATOM 419 CG GLU A 196 41.272 -3.721 -5.957 1.00 1.00 C ATOM 420 CD GLU A 196 40.250 -4.036 -7.042 1.00 1.00 C ATOM 421 OE1 GLU A 196 39.335 -3.249 -7.209 1.00 1.00 O ATOM 422 OE2 GLU A 196 40.397 -5.060 -7.689 1.00 1.00 O ATOM 0 H GLU A 196 42.117 0.042 -5.062 1.00 1.00 H new ATOM 0 HA GLU A 196 41.491 -2.317 -3.563 1.00 1.00 H new ATOM 0 HB2 GLU A 196 40.334 -1.799 -5.663 1.00 1.00 H new ATOM 0 HB3 GLU A 196 41.849 -1.724 -6.540 1.00 1.00 H new ATOM 0 HG2 GLU A 196 42.253 -4.092 -6.254 1.00 1.00 H new ATOM 0 HG3 GLU A 196 41.002 -4.235 -5.034 1.00 1.00 H new ATOM 429 N GLU A 197 43.373 -3.984 -4.194 1.00 1.00 N ATOM 430 CA GLU A 197 44.580 -4.802 -4.172 1.00 1.00 C ATOM 431 C GLU A 197 44.379 -6.058 -5.002 1.00 1.00 C ATOM 432 O GLU A 197 43.265 -6.377 -5.416 1.00 1.00 O ATOM 433 CB GLU A 197 44.941 -5.182 -2.735 1.00 1.00 C ATOM 434 CG GLU A 197 43.678 -5.608 -1.999 1.00 1.00 C ATOM 435 CD GLU A 197 44.043 -6.272 -0.677 1.00 1.00 C ATOM 436 OE1 GLU A 197 45.074 -6.921 -0.625 1.00 1.00 O ATOM 437 OE2 GLU A 197 43.287 -6.119 0.269 1.00 1.00 O ATOM 0 H GLU A 197 42.508 -4.505 -4.051 1.00 1.00 H new ATOM 0 HA GLU A 197 45.398 -4.221 -4.599 1.00 1.00 H new ATOM 0 HB2 GLU A 197 45.669 -5.993 -2.732 1.00 1.00 H new ATOM 0 HB3 GLU A 197 45.404 -4.336 -2.228 1.00 1.00 H new ATOM 0 HG2 GLU A 197 43.044 -4.741 -1.817 1.00 1.00 H new ATOM 0 HG3 GLU A 197 43.103 -6.299 -2.616 1.00 1.00 H new ATOM 444 N TYR A 198 45.476 -6.764 -5.244 1.00 1.00 N ATOM 445 CA TYR A 198 45.439 -7.996 -6.034 1.00 1.00 C ATOM 446 C TYR A 198 46.440 -9.010 -5.494 1.00 1.00 C ATOM 447 O TYR A 198 47.213 -8.709 -4.590 1.00 1.00 O ATOM 448 CB TYR A 198 45.782 -7.688 -7.486 1.00 1.00 C ATOM 449 CG TYR A 198 44.760 -6.735 -8.058 1.00 1.00 C ATOM 450 CD1 TYR A 198 44.820 -5.376 -7.738 1.00 1.00 C ATOM 451 CD2 TYR A 198 43.751 -7.214 -8.899 1.00 1.00 C ATOM 452 CE1 TYR A 198 43.870 -4.489 -8.259 1.00 1.00 C ATOM 453 CE2 TYR A 198 42.798 -6.327 -9.422 1.00 1.00 C ATOM 454 CZ TYR A 198 42.859 -4.964 -9.102 1.00 1.00 C ATOM 455 OH TYR A 198 41.921 -4.092 -9.614 1.00 1.00 O ATOM 0 H TYR A 198 46.404 -6.508 -4.906 1.00 1.00 H new ATOM 0 HA TYR A 198 44.435 -8.415 -5.969 1.00 1.00 H new ATOM 0 HB2 TYR A 198 46.778 -7.250 -7.550 1.00 1.00 H new ATOM 0 HB3 TYR A 198 45.801 -8.609 -8.069 1.00 1.00 H new ATOM 0 HD1 TYR A 198 45.600 -5.009 -7.088 1.00 1.00 H new ATOM 0 HD2 TYR A 198 43.705 -8.264 -9.146 1.00 1.00 H new ATOM 0 HE1 TYR A 198 43.917 -3.439 -8.010 1.00 1.00 H new ATOM 0 HE2 TYR A 198 42.017 -6.695 -10.071 1.00 1.00 H new ATOM 0 HH TYR A 198 41.022 -4.398 -9.370 1.00 1.00 H new ATOM 465 N TYR A 199 46.418 -10.212 -6.064 1.00 1.00 N ATOM 466 CA TYR A 199 47.329 -11.283 -5.650 1.00 1.00 C ATOM 467 C TYR A 199 48.598 -11.256 -6.485 1.00 1.00 C ATOM 468 O TYR A 199 48.539 -11.322 -7.703 1.00 1.00 O ATOM 469 CB TYR A 199 46.630 -12.654 -5.824 1.00 1.00 C ATOM 470 CG TYR A 199 46.273 -13.221 -4.474 1.00 1.00 C ATOM 471 CD1 TYR A 199 47.299 -13.582 -3.597 1.00 1.00 C ATOM 472 CD2 TYR A 199 44.936 -13.375 -4.100 1.00 1.00 C ATOM 473 CE1 TYR A 199 46.996 -14.096 -2.338 1.00 1.00 C ATOM 474 CE2 TYR A 199 44.623 -13.893 -2.841 1.00 1.00 C ATOM 475 CZ TYR A 199 45.654 -14.253 -1.956 1.00 1.00 C ATOM 476 OH TYR A 199 45.346 -14.756 -0.708 1.00 1.00 O ATOM 0 H TYR A 199 45.779 -10.472 -6.815 1.00 1.00 H new ATOM 0 HA TYR A 199 47.592 -11.131 -4.603 1.00 1.00 H new ATOM 0 HB2 TYR A 199 45.731 -12.540 -6.430 1.00 1.00 H new ATOM 0 HB3 TYR A 199 47.287 -13.342 -6.355 1.00 1.00 H new ATOM 0 HD1 TYR A 199 48.330 -13.462 -3.896 1.00 1.00 H new ATOM 0 HD2 TYR A 199 44.147 -13.095 -4.782 1.00 1.00 H new ATOM 0 HE1 TYR A 199 47.789 -14.372 -1.659 1.00 1.00 H new ATOM 0 HE2 TYR A 199 43.591 -14.017 -2.548 1.00 1.00 H new ATOM 0 HH TYR A 199 44.373 -14.799 -0.604 1.00 1.00 H new ATOM 486 N LEU A 200 49.741 -11.169 -5.817 1.00 1.00 N ATOM 487 CA LEU A 200 51.019 -11.136 -6.515 1.00 1.00 C ATOM 488 C LEU A 200 51.460 -12.543 -6.890 1.00 1.00 C ATOM 489 O LEU A 200 51.546 -13.429 -6.040 1.00 1.00 O ATOM 490 CB LEU A 200 52.089 -10.499 -5.616 1.00 1.00 C ATOM 491 CG LEU A 200 53.332 -10.110 -6.441 1.00 1.00 C ATOM 492 CD1 LEU A 200 52.980 -9.014 -7.454 1.00 1.00 C ATOM 493 CD2 LEU A 200 54.412 -9.590 -5.487 1.00 1.00 C ATOM 0 H LEU A 200 49.809 -11.120 -4.800 1.00 1.00 H new ATOM 0 HA LEU A 200 50.898 -10.545 -7.423 1.00 1.00 H new ATOM 0 HB2 LEU A 200 51.680 -9.615 -5.126 1.00 1.00 H new ATOM 0 HB3 LEU A 200 52.373 -11.198 -4.829 1.00 1.00 H new ATOM 0 HG LEU A 200 53.693 -10.984 -6.983 1.00 1.00 H new ATOM 0 HD11 LEU A 200 53.868 -8.751 -8.028 1.00 1.00 H new ATOM 0 HD12 LEU A 200 52.206 -9.378 -8.129 1.00 1.00 H new ATOM 0 HD13 LEU A 200 52.616 -8.133 -6.925 1.00 1.00 H new ATOM 0 HD21 LEU A 200 55.298 -9.311 -6.058 1.00 1.00 H new ATOM 0 HD22 LEU A 200 54.036 -8.718 -4.952 1.00 1.00 H new ATOM 0 HD23 LEU A 200 54.672 -10.370 -4.772 1.00 1.00 H new ATOM 505 N LEU A 201 51.742 -12.737 -8.174 1.00 1.00 N ATOM 506 CA LEU A 201 52.182 -14.039 -8.680 1.00 1.00 C ATOM 507 C LEU A 201 53.665 -14.007 -9.020 1.00 1.00 C ATOM 508 O LEU A 201 54.465 -14.718 -8.411 1.00 1.00 O ATOM 509 CB LEU A 201 51.375 -14.416 -9.925 1.00 1.00 C ATOM 510 CG LEU A 201 49.883 -14.605 -9.551 1.00 1.00 C ATOM 511 CD1 LEU A 201 49.120 -13.275 -9.691 1.00 1.00 C ATOM 512 CD2 LEU A 201 49.254 -15.661 -10.468 1.00 1.00 C ATOM 0 H LEU A 201 51.675 -12.010 -8.887 1.00 1.00 H new ATOM 0 HA LEU A 201 52.017 -14.785 -7.903 1.00 1.00 H new ATOM 0 HB2 LEU A 201 51.473 -13.638 -10.682 1.00 1.00 H new ATOM 0 HB3 LEU A 201 51.769 -15.335 -10.360 1.00 1.00 H new ATOM 0 HG LEU A 201 49.819 -14.936 -8.514 1.00 1.00 H new ATOM 0 HD11 LEU A 201 48.074 -13.426 -9.425 1.00 1.00 H new ATOM 0 HD12 LEU A 201 49.560 -12.531 -9.027 1.00 1.00 H new ATOM 0 HD13 LEU A 201 49.185 -12.925 -10.721 1.00 1.00 H new ATOM 0 HD21 LEU A 201 48.205 -15.793 -10.204 1.00 1.00 H new ATOM 0 HD22 LEU A 201 49.329 -15.334 -11.505 1.00 1.00 H new ATOM 0 HD23 LEU A 201 49.781 -16.608 -10.347 1.00 1.00 H new ATOM 524 N ASP A 202 54.032 -13.177 -9.994 1.00 1.00 N ATOM 525 CA ASP A 202 55.431 -13.061 -10.406 1.00 1.00 C ATOM 526 C ASP A 202 56.100 -11.909 -9.676 1.00 1.00 C ATOM 527 O ASP A 202 56.105 -10.775 -10.152 1.00 1.00 O ATOM 528 CB ASP A 202 55.508 -12.819 -11.911 1.00 1.00 C ATOM 529 CG ASP A 202 56.957 -12.872 -12.374 1.00 1.00 C ATOM 530 OD1 ASP A 202 57.828 -12.954 -11.524 1.00 1.00 O ATOM 531 OD2 ASP A 202 57.177 -12.830 -13.574 1.00 1.00 O ATOM 0 H ASP A 202 53.387 -12.579 -10.510 1.00 1.00 H new ATOM 0 HA ASP A 202 55.947 -13.989 -10.158 1.00 1.00 H new ATOM 0 HB2 ASP A 202 54.921 -13.571 -12.439 1.00 1.00 H new ATOM 0 HB3 ASP A 202 55.075 -11.849 -12.154 1.00 1.00 H new ATOM 536 N SER A 203 56.660 -12.206 -8.510 1.00 1.00 N ATOM 537 CA SER A 203 57.330 -11.192 -7.702 1.00 1.00 C ATOM 538 C SER A 203 58.840 -11.261 -7.903 1.00 1.00 C ATOM 539 O SER A 203 59.597 -10.553 -7.239 1.00 1.00 O ATOM 540 CB SER A 203 57.005 -11.422 -6.237 1.00 1.00 C ATOM 541 OG SER A 203 57.842 -12.447 -5.721 1.00 1.00 O ATOM 0 H SER A 203 56.664 -13.141 -8.102 1.00 1.00 H new ATOM 0 HA SER A 203 56.980 -10.207 -8.011 1.00 1.00 H new ATOM 0 HB2 SER A 203 57.150 -10.501 -5.672 1.00 1.00 H new ATOM 0 HB3 SER A 203 55.958 -11.703 -6.126 1.00 1.00 H new ATOM 0 HG SER A 203 57.633 -12.594 -4.775 1.00 1.00 H new ATOM 547 N SER A 204 59.269 -12.126 -8.816 1.00 1.00 N ATOM 548 CA SER A 204 60.690 -12.289 -9.088 1.00 1.00 C ATOM 549 C SER A 204 61.310 -10.949 -9.462 1.00 1.00 C ATOM 550 O SER A 204 62.528 -10.781 -9.416 1.00 1.00 O ATOM 551 CB SER A 204 60.892 -13.288 -10.229 1.00 1.00 C ATOM 552 OG SER A 204 60.603 -14.599 -9.763 1.00 1.00 O ATOM 0 H SER A 204 58.657 -12.720 -9.376 1.00 1.00 H new ATOM 0 HA SER A 204 61.178 -12.667 -8.190 1.00 1.00 H new ATOM 0 HB2 SER A 204 60.242 -13.036 -11.067 1.00 1.00 H new ATOM 0 HB3 SER A 204 61.918 -13.238 -10.594 1.00 1.00 H new ATOM 0 HG SER A 204 60.730 -15.241 -10.493 1.00 1.00 H new ATOM 558 N GLU A 205 60.461 -9.995 -9.829 1.00 1.00 N ATOM 559 CA GLU A 205 60.936 -8.671 -10.205 1.00 1.00 C ATOM 560 C GLU A 205 62.024 -8.788 -11.260 1.00 1.00 C ATOM 561 O GLU A 205 63.199 -8.926 -10.930 1.00 1.00 O ATOM 562 CB GLU A 205 61.499 -7.948 -8.977 1.00 1.00 C ATOM 563 CG GLU A 205 61.877 -6.513 -9.356 1.00 1.00 C ATOM 564 CD GLU A 205 62.401 -5.771 -8.131 1.00 1.00 C ATOM 565 OE1 GLU A 205 62.684 -6.427 -7.142 1.00 1.00 O ATOM 566 OE2 GLU A 205 62.514 -4.559 -8.201 1.00 1.00 O ATOM 0 H GLU A 205 59.449 -10.113 -9.874 1.00 1.00 H new ATOM 0 HA GLU A 205 60.099 -8.102 -10.609 1.00 1.00 H new ATOM 0 HB2 GLU A 205 60.760 -7.941 -8.176 1.00 1.00 H new ATOM 0 HB3 GLU A 205 62.374 -8.478 -8.599 1.00 1.00 H new ATOM 0 HG2 GLU A 205 62.636 -6.523 -10.138 1.00 1.00 H new ATOM 0 HG3 GLU A 205 61.008 -5.994 -9.762 1.00 1.00 H new ATOM 573 N ILE A 206 61.623 -8.728 -12.529 1.00 1.00 N ATOM 574 CA ILE A 206 62.566 -8.839 -13.640 1.00 1.00 C ATOM 575 C ILE A 206 62.032 -8.091 -14.858 1.00 1.00 C ATOM 576 O ILE A 206 62.755 -7.305 -15.470 1.00 1.00 O ATOM 577 CB ILE A 206 62.772 -10.308 -14.021 1.00 1.00 C ATOM 578 CG1 ILE A 206 63.130 -11.109 -12.764 1.00 1.00 C ATOM 579 CG2 ILE A 206 63.917 -10.415 -15.042 1.00 1.00 C ATOM 580 CD1 ILE A 206 63.556 -12.514 -13.156 1.00 1.00 C ATOM 0 H ILE A 206 60.651 -8.603 -12.813 1.00 1.00 H new ATOM 0 HA ILE A 206 63.515 -8.406 -13.324 1.00 1.00 H new ATOM 0 HB ILE A 206 61.857 -10.706 -14.460 1.00 1.00 H new ATOM 0 HG12 ILE A 206 63.935 -10.613 -12.222 1.00 1.00 H new ATOM 0 HG13 ILE A 206 62.273 -11.153 -12.092 1.00 1.00 H new ATOM 0 HG21 ILE A 206 64.065 -11.460 -15.314 1.00 1.00 H new ATOM 0 HG22 ILE A 206 63.665 -9.840 -15.933 1.00 1.00 H new ATOM 0 HG23 ILE A 206 64.834 -10.021 -14.603 1.00 1.00 H new ATOM 0 HD11 ILE A 206 63.810 -13.081 -12.260 1.00 1.00 H new ATOM 0 HD12 ILE A 206 62.738 -13.010 -13.679 1.00 1.00 H new ATOM 0 HD13 ILE A 206 64.426 -12.461 -13.810 1.00 1.00 H new ATOM 592 N HIS A 207 60.765 -8.326 -15.205 1.00 1.00 N ATOM 593 CA HIS A 207 60.149 -7.651 -16.354 1.00 1.00 C ATOM 594 C HIS A 207 58.884 -6.913 -15.920 1.00 1.00 C ATOM 595 O HIS A 207 58.786 -5.692 -16.053 1.00 1.00 O ATOM 596 CB HIS A 207 59.798 -8.679 -17.444 1.00 1.00 C ATOM 597 CG HIS A 207 60.831 -9.777 -17.445 1.00 1.00 C ATOM 598 ND1 HIS A 207 60.852 -11.017 -16.855 1.00 1.00 N flip ATOM 599 CD2 HIS A 207 62.038 -9.659 -18.118 1.00 1.00 C flip ATOM 600 CE1 HIS A 207 62.050 -11.659 -17.155 1.00 1.00 C flip ATOM 601 NE2 HIS A 207 62.727 -10.797 -17.917 1.00 1.00 N flip ATOM 0 H HIS A 207 60.148 -8.972 -14.713 1.00 1.00 H new ATOM 0 HA HIS A 207 60.861 -6.930 -16.755 1.00 1.00 H new ATOM 0 HB2 HIS A 207 58.808 -9.096 -17.261 1.00 1.00 H new ATOM 0 HB3 HIS A 207 59.765 -8.194 -18.420 1.00 1.00 H new ATOM 0 HD2 HIS A 207 62.365 -8.809 -18.698 1.00 1.00 H new ATOM 0 HE1 HIS A 207 62.364 -12.643 -16.839 1.00 1.00 H new ATOM 0 HE2 HIS A 207 63.654 -10.979 -18.300 1.00 1.00 H new ATOM 609 N TRP A 208 57.915 -7.667 -15.407 1.00 1.00 N ATOM 610 CA TRP A 208 56.652 -7.088 -14.959 1.00 1.00 C ATOM 611 C TRP A 208 56.059 -7.908 -13.820 1.00 1.00 C ATOM 612 O TRP A 208 56.305 -9.110 -13.712 1.00 1.00 O ATOM 613 CB TRP A 208 55.669 -7.052 -16.127 1.00 1.00 C ATOM 614 CG TRP A 208 56.050 -5.962 -17.071 1.00 1.00 C ATOM 615 CD1 TRP A 208 56.944 -6.080 -18.076 1.00 1.00 C ATOM 616 CD2 TRP A 208 55.560 -4.596 -17.110 1.00 1.00 C ATOM 617 NE1 TRP A 208 57.037 -4.869 -18.732 1.00 1.00 N ATOM 618 CE2 TRP A 208 56.199 -3.919 -18.174 1.00 1.00 C ATOM 619 CE3 TRP A 208 54.630 -3.887 -16.331 1.00 1.00 C ATOM 620 CZ2 TRP A 208 55.922 -2.579 -18.455 1.00 1.00 C ATOM 621 CZ3 TRP A 208 54.349 -2.544 -16.610 1.00 1.00 C ATOM 622 CH2 TRP A 208 54.991 -1.891 -17.669 1.00 1.00 C ATOM 0 H TRP A 208 57.980 -8.678 -15.291 1.00 1.00 H new ATOM 0 HA TRP A 208 56.838 -6.076 -14.599 1.00 1.00 H new ATOM 0 HB2 TRP A 208 55.669 -8.011 -16.645 1.00 1.00 H new ATOM 0 HB3 TRP A 208 54.656 -6.889 -15.758 1.00 1.00 H new ATOM 0 HD1 TRP A 208 57.495 -6.974 -18.325 1.00 1.00 H new ATOM 0 HE1 TRP A 208 57.648 -4.695 -19.530 1.00 1.00 H new ATOM 0 HE3 TRP A 208 54.129 -4.381 -15.512 1.00 1.00 H new ATOM 0 HZ2 TRP A 208 56.422 -2.079 -19.271 1.00 1.00 H new ATOM 0 HZ3 TRP A 208 53.633 -2.009 -16.005 1.00 1.00 H new ATOM 0 HH2 TRP A 208 54.768 -0.856 -17.879 1.00 1.00 H new ATOM 633 N TRP A 209 55.272 -7.252 -12.976 1.00 1.00 N ATOM 634 CA TRP A 209 54.637 -7.926 -11.846 1.00 1.00 C ATOM 635 C TRP A 209 53.259 -8.429 -12.246 1.00 1.00 C ATOM 636 O TRP A 209 52.350 -7.651 -12.544 1.00 1.00 O ATOM 637 CB TRP A 209 54.532 -6.945 -10.653 1.00 1.00 C ATOM 638 CG TRP A 209 55.684 -7.114 -9.691 1.00 1.00 C ATOM 639 CD1 TRP A 209 56.891 -7.684 -9.961 1.00 1.00 C ATOM 640 CD2 TRP A 209 55.743 -6.705 -8.296 1.00 1.00 C ATOM 641 NE1 TRP A 209 57.658 -7.670 -8.814 1.00 1.00 N ATOM 642 CE2 TRP A 209 57.002 -7.069 -7.768 1.00 1.00 C ATOM 643 CE3 TRP A 209 54.829 -6.066 -7.445 1.00 1.00 C ATOM 644 CZ2 TRP A 209 57.344 -6.805 -6.446 1.00 1.00 C ATOM 645 CZ3 TRP A 209 55.168 -5.794 -6.114 1.00 1.00 C ATOM 646 CH2 TRP A 209 56.425 -6.165 -5.616 1.00 1.00 C ATOM 0 H TRP A 209 55.058 -6.258 -13.050 1.00 1.00 H new ATOM 0 HA TRP A 209 55.242 -8.783 -11.548 1.00 1.00 H new ATOM 0 HB2 TRP A 209 54.515 -5.920 -11.024 1.00 1.00 H new ATOM 0 HB3 TRP A 209 53.591 -7.110 -10.128 1.00 1.00 H new ATOM 0 HD1 TRP A 209 57.198 -8.082 -10.917 1.00 1.00 H new ATOM 0 HE1 TRP A 209 58.599 -8.059 -8.751 1.00 1.00 H new ATOM 0 HE3 TRP A 209 53.857 -5.782 -7.819 1.00 1.00 H new ATOM 0 HZ2 TRP A 209 58.313 -7.093 -6.066 1.00 1.00 H new ATOM 0 HZ3 TRP A 209 54.459 -5.297 -5.469 1.00 1.00 H new ATOM 0 HH2 TRP A 209 56.682 -5.955 -4.588 1.00 1.00 H new ATOM 657 N ARG A 210 53.122 -9.749 -12.229 1.00 1.00 N ATOM 658 CA ARG A 210 51.864 -10.384 -12.567 1.00 1.00 C ATOM 659 C ARG A 210 50.964 -10.403 -11.351 1.00 1.00 C ATOM 660 O ARG A 210 51.366 -10.848 -10.275 1.00 1.00 O ATOM 661 CB ARG A 210 52.100 -11.821 -13.037 1.00 1.00 C ATOM 662 CG ARG A 210 52.730 -11.812 -14.428 1.00 1.00 C ATOM 663 CD ARG A 210 52.899 -13.250 -14.919 1.00 1.00 C ATOM 664 NE ARG A 210 53.479 -13.258 -16.255 1.00 1.00 N ATOM 665 CZ ARG A 210 53.810 -14.396 -16.854 1.00 1.00 C ATOM 666 NH1 ARG A 210 53.615 -15.535 -16.247 1.00 1.00 N ATOM 667 NH2 ARG A 210 54.327 -14.375 -18.051 1.00 1.00 N ATOM 0 H ARG A 210 53.870 -10.397 -11.984 1.00 1.00 H new ATOM 0 HA ARG A 210 51.393 -9.818 -13.371 1.00 1.00 H new ATOM 0 HB2 ARG A 210 52.753 -12.341 -12.335 1.00 1.00 H new ATOM 0 HB3 ARG A 210 51.156 -12.366 -13.058 1.00 1.00 H new ATOM 0 HG2 ARG A 210 52.102 -11.251 -15.120 1.00 1.00 H new ATOM 0 HG3 ARG A 210 53.697 -11.310 -14.398 1.00 1.00 H new ATOM 0 HD2 ARG A 210 53.540 -13.804 -14.233 1.00 1.00 H new ATOM 0 HD3 ARG A 210 51.933 -13.754 -14.931 1.00 1.00 H new ATOM 0 HE ARG A 210 53.634 -12.374 -16.739 1.00 1.00 H new ATOM 0 HH11 ARG A 210 53.208 -15.551 -15.312 1.00 1.00 H new ATOM 0 HH12 ARG A 210 53.870 -16.409 -16.708 1.00 1.00 H new ATOM 0 HH21 ARG A 210 54.477 -13.485 -18.526 1.00 1.00 H new ATOM 0 HH22 ARG A 210 54.582 -15.249 -18.512 1.00 1.00 H new ATOM 681 N VAL A 211 49.743 -9.906 -11.519 1.00 1.00 N ATOM 682 CA VAL A 211 48.779 -9.858 -10.427 1.00 1.00 C ATOM 683 C VAL A 211 47.522 -10.638 -10.804 1.00 1.00 C ATOM 684 O VAL A 211 47.268 -10.877 -11.985 1.00 1.00 O ATOM 685 CB VAL A 211 48.407 -8.407 -10.137 1.00 1.00 C ATOM 686 CG1 VAL A 211 49.591 -7.701 -9.479 1.00 1.00 C ATOM 687 CG2 VAL A 211 48.056 -7.703 -11.448 1.00 1.00 C ATOM 0 H VAL A 211 49.398 -9.530 -12.402 1.00 1.00 H new ATOM 0 HA VAL A 211 49.226 -10.306 -9.540 1.00 1.00 H new ATOM 0 HB VAL A 211 47.548 -8.376 -9.466 1.00 1.00 H new ATOM 0 HG11 VAL A 211 49.327 -6.664 -9.271 1.00 1.00 H new ATOM 0 HG12 VAL A 211 49.843 -8.205 -8.546 1.00 1.00 H new ATOM 0 HG13 VAL A 211 50.450 -7.729 -10.150 1.00 1.00 H new ATOM 0 HG21 VAL A 211 47.790 -6.666 -11.244 1.00 1.00 H new ATOM 0 HG22 VAL A 211 48.915 -7.732 -12.118 1.00 1.00 H new ATOM 0 HG23 VAL A 211 47.212 -8.209 -11.918 1.00 1.00 H new ATOM 697 N GLN A 212 46.730 -11.031 -9.804 1.00 1.00 N ATOM 698 CA GLN A 212 45.494 -11.782 -10.052 1.00 1.00 C ATOM 699 C GLN A 212 44.376 -11.246 -9.171 1.00 1.00 C ATOM 700 O GLN A 212 44.566 -11.026 -7.975 1.00 1.00 O ATOM 701 CB GLN A 212 45.711 -13.269 -9.760 1.00 1.00 C ATOM 702 CG GLN A 212 44.415 -14.043 -10.008 1.00 1.00 C ATOM 703 CD GLN A 212 44.683 -15.540 -9.905 1.00 1.00 C ATOM 704 OE1 GLN A 212 45.123 -16.022 -8.862 1.00 1.00 O ATOM 705 NE2 GLN A 212 44.446 -16.309 -10.933 1.00 1.00 N ATOM 0 H GLN A 212 46.920 -10.844 -8.819 1.00 1.00 H new ATOM 0 HA GLN A 212 45.216 -11.662 -11.099 1.00 1.00 H new ATOM 0 HB2 GLN A 212 46.506 -13.661 -10.395 1.00 1.00 H new ATOM 0 HB3 GLN A 212 46.033 -13.403 -8.727 1.00 1.00 H new ATOM 0 HG2 GLN A 212 43.659 -13.748 -9.280 1.00 1.00 H new ATOM 0 HG3 GLN A 212 44.019 -13.802 -10.994 1.00 1.00 H new ATOM 0 HE21 GLN A 212 44.081 -15.908 -11.797 1.00 1.00 H new ATOM 0 HE22 GLN A 212 44.626 -17.311 -10.872 1.00 1.00 H new ATOM 714 N ASP A 213 43.202 -11.050 -9.766 1.00 1.00 N ATOM 715 CA ASP A 213 42.049 -10.550 -9.025 1.00 1.00 C ATOM 716 C ASP A 213 41.246 -11.709 -8.457 1.00 1.00 C ATOM 717 O ASP A 213 41.364 -12.846 -8.912 1.00 1.00 O ATOM 718 CB ASP A 213 41.157 -9.714 -9.943 1.00 1.00 C ATOM 719 CG ASP A 213 40.071 -9.021 -9.126 1.00 1.00 C ATOM 720 OD1 ASP A 213 40.272 -8.846 -7.936 1.00 1.00 O ATOM 721 OD2 ASP A 213 39.053 -8.674 -9.705 1.00 1.00 O ATOM 0 H ASP A 213 43.025 -11.229 -10.754 1.00 1.00 H new ATOM 0 HA ASP A 213 42.408 -9.927 -8.205 1.00 1.00 H new ATOM 0 HB2 ASP A 213 41.757 -8.972 -10.469 1.00 1.00 H new ATOM 0 HB3 ASP A 213 40.702 -10.352 -10.701 1.00 1.00 H new ATOM 726 N LYS A 214 40.436 -11.406 -7.456 1.00 1.00 N ATOM 727 CA LYS A 214 39.610 -12.421 -6.815 1.00 1.00 C ATOM 728 C LYS A 214 38.558 -12.945 -7.792 1.00 1.00 C ATOM 729 O LYS A 214 37.899 -13.951 -7.528 1.00 1.00 O ATOM 730 CB LYS A 214 38.915 -11.834 -5.583 1.00 1.00 C ATOM 731 CG LYS A 214 39.873 -10.906 -4.824 1.00 1.00 C ATOM 732 CD LYS A 214 41.153 -11.657 -4.455 1.00 1.00 C ATOM 733 CE LYS A 214 42.034 -10.759 -3.590 1.00 1.00 C ATOM 734 NZ LYS A 214 43.238 -11.522 -3.170 1.00 1.00 N ATOM 0 H LYS A 214 40.331 -10.468 -7.069 1.00 1.00 H new ATOM 0 HA LYS A 214 40.254 -13.245 -6.508 1.00 1.00 H new ATOM 0 HB2 LYS A 214 38.026 -11.281 -5.887 1.00 1.00 H new ATOM 0 HB3 LYS A 214 38.581 -12.638 -4.927 1.00 1.00 H new ATOM 0 HG2 LYS A 214 40.115 -10.040 -5.439 1.00 1.00 H new ATOM 0 HG3 LYS A 214 39.390 -10.531 -3.922 1.00 1.00 H new ATOM 0 HD2 LYS A 214 40.909 -12.573 -3.917 1.00 1.00 H new ATOM 0 HD3 LYS A 214 41.689 -11.951 -5.358 1.00 1.00 H new ATOM 0 HE2 LYS A 214 42.328 -9.870 -4.148 1.00 1.00 H new ATOM 0 HE3 LYS A 214 41.480 -10.418 -2.715 1.00 1.00 H new ATOM 0 HZ1 LYS A 214 43.662 -11.069 -2.335 1.00 1.00 H new ATOM 0 HZ2 LYS A 214 42.966 -12.498 -2.934 1.00 1.00 H new ATOM 0 HZ3 LYS A 214 43.930 -11.534 -3.946 1.00 1.00 H new ATOM 748 N ASN A 215 38.395 -12.245 -8.916 1.00 1.00 N ATOM 749 CA ASN A 215 37.408 -12.639 -9.918 1.00 1.00 C ATOM 750 C ASN A 215 38.005 -13.632 -10.906 1.00 1.00 C ATOM 751 O ASN A 215 37.306 -14.145 -11.781 1.00 1.00 O ATOM 752 CB ASN A 215 36.912 -11.402 -10.669 1.00 1.00 C ATOM 753 CG ASN A 215 36.052 -10.545 -9.745 1.00 1.00 C ATOM 754 OD1 ASN A 215 35.605 -11.016 -8.698 1.00 1.00 O ATOM 755 ND2 ASN A 215 35.787 -9.310 -10.071 1.00 1.00 N ATOM 0 H ASN A 215 38.930 -11.409 -9.153 1.00 1.00 H new ATOM 0 HA ASN A 215 36.572 -13.118 -9.408 1.00 1.00 H new ATOM 0 HB2 ASN A 215 37.760 -10.822 -11.033 1.00 1.00 H new ATOM 0 HB3 ASN A 215 36.334 -11.703 -11.543 1.00 1.00 H new ATOM 0 HD21 ASN A 215 35.209 -8.734 -9.459 1.00 1.00 H new ATOM 0 HD22 ASN A 215 36.157 -8.921 -10.938 1.00 1.00 H new ATOM 762 N GLY A 216 39.301 -13.899 -10.767 1.00 1.00 N ATOM 763 CA GLY A 216 39.985 -14.836 -11.657 1.00 1.00 C ATOM 764 C GLY A 216 40.609 -14.116 -12.846 1.00 1.00 C ATOM 765 O GLY A 216 40.907 -14.734 -13.868 1.00 1.00 O ATOM 0 H GLY A 216 39.897 -13.483 -10.051 1.00 1.00 H new ATOM 0 HA2 GLY A 216 40.759 -15.367 -11.104 1.00 1.00 H new ATOM 0 HA3 GLY A 216 39.278 -15.585 -12.013 1.00 1.00 H new ATOM 769 N HIS A 217 40.800 -12.804 -12.713 1.00 1.00 N ATOM 770 CA HIS A 217 41.389 -12.002 -13.787 1.00 1.00 C ATOM 771 C HIS A 217 42.841 -11.660 -13.465 1.00 1.00 C ATOM 772 O HIS A 217 43.143 -11.122 -12.401 1.00 1.00 O ATOM 773 CB HIS A 217 40.591 -10.712 -13.973 1.00 1.00 C ATOM 774 CG HIS A 217 39.206 -11.044 -14.439 1.00 1.00 C ATOM 775 ND1 HIS A 217 38.972 -11.896 -15.505 1.00 1.00 N ATOM 776 CD2 HIS A 217 37.970 -10.639 -14.002 1.00 1.00 C ATOM 777 CE1 HIS A 217 37.640 -11.975 -15.674 1.00 1.00 C ATOM 778 NE2 HIS A 217 36.981 -11.228 -14.784 1.00 1.00 N ATOM 0 H HIS A 217 40.557 -12.275 -11.876 1.00 1.00 H new ATOM 0 HA HIS A 217 41.359 -12.584 -14.708 1.00 1.00 H new ATOM 0 HB2 HIS A 217 40.548 -10.160 -13.034 1.00 1.00 H new ATOM 0 HB3 HIS A 217 41.086 -10.067 -14.699 1.00 1.00 H new ATOM 0 HD2 HIS A 217 37.792 -9.966 -13.177 1.00 1.00 H new ATOM 0 HE1 HIS A 217 37.161 -12.570 -16.437 1.00 1.00 H new ATOM 0 HE2 HIS A 217 35.971 -11.114 -14.697 1.00 1.00 H new ATOM 786 N GLU A 218 43.735 -11.989 -14.397 1.00 1.00 N ATOM 787 CA GLU A 218 45.168 -11.733 -14.219 1.00 1.00 C ATOM 788 C GLU A 218 45.722 -10.895 -15.361 1.00 1.00 C ATOM 789 O GLU A 218 45.144 -10.841 -16.446 1.00 1.00 O ATOM 790 CB GLU A 218 45.919 -13.061 -14.148 1.00 1.00 C ATOM 791 CG GLU A 218 45.496 -13.954 -15.318 1.00 1.00 C ATOM 792 CD GLU A 218 46.308 -15.246 -15.313 1.00 1.00 C ATOM 793 OE1 GLU A 218 47.457 -15.198 -14.906 1.00 1.00 O ATOM 794 OE2 GLU A 218 45.770 -16.261 -15.721 1.00 1.00 O ATOM 0 H GLU A 218 43.495 -12.433 -15.283 1.00 1.00 H new ATOM 0 HA GLU A 218 45.304 -11.179 -13.291 1.00 1.00 H new ATOM 0 HB2 GLU A 218 46.994 -12.885 -14.182 1.00 1.00 H new ATOM 0 HB3 GLU A 218 45.708 -13.560 -13.202 1.00 1.00 H new ATOM 0 HG2 GLU A 218 44.433 -14.183 -15.245 1.00 1.00 H new ATOM 0 HG3 GLU A 218 45.644 -13.426 -16.260 1.00 1.00 H new ATOM 801 N GLY A 219 46.863 -10.255 -15.113 1.00 1.00 N ATOM 802 CA GLY A 219 47.510 -9.430 -16.127 1.00 1.00 C ATOM 803 C GLY A 219 48.649 -8.633 -15.503 1.00 1.00 C ATOM 804 O GLY A 219 48.732 -8.507 -14.280 1.00 1.00 O ATOM 0 H GLY A 219 47.356 -10.293 -14.221 1.00 1.00 H new ATOM 0 HA2 GLY A 219 47.893 -10.060 -16.930 1.00 1.00 H new ATOM 0 HA3 GLY A 219 46.783 -8.752 -16.574 1.00 1.00 H new ATOM 808 N TYR A 220 49.527 -8.105 -16.341 1.00 1.00 N ATOM 809 CA TYR A 220 50.661 -7.333 -15.859 1.00 1.00 C ATOM 810 C TYR A 220 50.200 -6.042 -15.200 1.00 1.00 C ATOM 811 O TYR A 220 49.294 -5.376 -15.683 1.00 1.00 O ATOM 812 CB TYR A 220 51.573 -6.997 -17.041 1.00 1.00 C ATOM 813 CG TYR A 220 52.209 -8.266 -17.568 1.00 1.00 C ATOM 814 CD1 TYR A 220 53.067 -9.016 -16.752 1.00 1.00 C ATOM 815 CD2 TYR A 220 51.942 -8.693 -18.878 1.00 1.00 C ATOM 816 CE1 TYR A 220 53.652 -10.187 -17.242 1.00 1.00 C ATOM 817 CE2 TYR A 220 52.531 -9.865 -19.366 1.00 1.00 C ATOM 818 CZ TYR A 220 53.385 -10.613 -18.547 1.00 1.00 C ATOM 819 OH TYR A 220 53.963 -11.770 -19.026 1.00 1.00 O ATOM 0 H TYR A 220 49.477 -8.197 -17.356 1.00 1.00 H new ATOM 0 HA TYR A 220 51.198 -7.926 -15.119 1.00 1.00 H new ATOM 0 HB2 TYR A 220 50.999 -6.511 -17.830 1.00 1.00 H new ATOM 0 HB3 TYR A 220 52.345 -6.293 -16.729 1.00 1.00 H new ATOM 0 HD1 TYR A 220 53.276 -8.689 -15.744 1.00 1.00 H new ATOM 0 HD2 TYR A 220 51.282 -8.117 -19.510 1.00 1.00 H new ATOM 0 HE1 TYR A 220 54.312 -10.764 -16.611 1.00 1.00 H new ATOM 0 HE2 TYR A 220 52.327 -10.192 -20.375 1.00 1.00 H new ATOM 0 HH TYR A 220 53.672 -11.923 -19.949 1.00 1.00 H new ATOM 829 N ALA A 221 50.824 -5.687 -14.082 1.00 1.00 N ATOM 830 CA ALA A 221 50.455 -4.463 -13.373 1.00 1.00 C ATOM 831 C ALA A 221 51.712 -3.702 -12.935 1.00 1.00 C ATOM 832 O ALA A 221 52.539 -4.250 -12.206 1.00 1.00 O ATOM 833 CB ALA A 221 49.608 -4.811 -12.156 1.00 1.00 C ATOM 0 H ALA A 221 51.579 -6.220 -13.650 1.00 1.00 H new ATOM 0 HA ALA A 221 49.878 -3.826 -14.044 1.00 1.00 H new ATOM 0 HB1 ALA A 221 49.335 -3.897 -11.630 1.00 1.00 H new ATOM 0 HB2 ALA A 221 48.704 -5.329 -12.478 1.00 1.00 H new ATOM 0 HB3 ALA A 221 50.178 -5.457 -11.489 1.00 1.00 H new ATOM 839 N PRO A 222 51.889 -2.463 -13.355 1.00 1.00 N ATOM 840 CA PRO A 222 53.090 -1.669 -12.969 1.00 1.00 C ATOM 841 C PRO A 222 53.406 -1.775 -11.469 1.00 1.00 C ATOM 842 O PRO A 222 52.626 -1.333 -10.632 1.00 1.00 O ATOM 843 CB PRO A 222 52.703 -0.228 -13.336 1.00 1.00 C ATOM 844 CG PRO A 222 51.683 -0.339 -14.427 1.00 1.00 C ATOM 845 CD PRO A 222 50.984 -1.688 -14.237 1.00 1.00 C ATOM 0 HA PRO A 222 53.989 -2.024 -13.474 1.00 1.00 H new ATOM 0 HB2 PRO A 222 52.295 0.298 -12.473 1.00 1.00 H new ATOM 0 HB3 PRO A 222 53.573 0.336 -13.671 1.00 1.00 H new ATOM 0 HG2 PRO A 222 50.966 0.480 -14.372 1.00 1.00 H new ATOM 0 HG3 PRO A 222 52.156 -0.283 -15.407 1.00 1.00 H new ATOM 0 HD2 PRO A 222 50.001 -1.564 -13.783 1.00 1.00 H new ATOM 0 HD3 PRO A 222 50.833 -2.193 -15.191 1.00 1.00 H new ATOM 853 N SER A 223 54.563 -2.350 -11.158 1.00 1.00 N ATOM 854 CA SER A 223 55.008 -2.511 -9.769 1.00 1.00 C ATOM 855 C SER A 223 55.340 -1.151 -9.151 1.00 1.00 C ATOM 856 O SER A 223 55.540 -1.037 -7.942 1.00 1.00 O ATOM 857 CB SER A 223 56.249 -3.404 -9.711 1.00 1.00 C ATOM 858 OG SER A 223 57.313 -2.773 -10.411 1.00 1.00 O ATOM 0 H SER A 223 55.216 -2.716 -11.850 1.00 1.00 H new ATOM 0 HA SER A 223 54.198 -2.974 -9.205 1.00 1.00 H new ATOM 0 HB2 SER A 223 56.535 -3.582 -8.674 1.00 1.00 H new ATOM 0 HB3 SER A 223 56.033 -4.376 -10.154 1.00 1.00 H new ATOM 0 HG SER A 223 58.111 -3.341 -10.375 1.00 1.00 H new ATOM 864 N SER A 224 55.389 -0.130 -9.998 1.00 1.00 N ATOM 865 CA SER A 224 55.694 1.228 -9.545 1.00 1.00 C ATOM 866 C SER A 224 54.446 1.950 -9.037 1.00 1.00 C ATOM 867 O SER A 224 54.509 2.702 -8.066 1.00 1.00 O ATOM 868 CB SER A 224 56.308 2.032 -10.683 1.00 1.00 C ATOM 869 OG SER A 224 57.645 1.601 -10.896 1.00 1.00 O ATOM 0 H SER A 224 55.222 -0.213 -11.001 1.00 1.00 H new ATOM 0 HA SER A 224 56.402 1.145 -8.720 1.00 1.00 H new ATOM 0 HB2 SER A 224 55.722 1.901 -11.593 1.00 1.00 H new ATOM 0 HB3 SER A 224 56.291 3.095 -10.443 1.00 1.00 H new ATOM 0 HG SER A 224 58.042 2.116 -11.629 1.00 1.00 H new ATOM 875 N TYR A 225 53.321 1.741 -9.715 1.00 1.00 N ATOM 876 CA TYR A 225 52.076 2.412 -9.338 1.00 1.00 C ATOM 877 C TYR A 225 51.364 1.646 -8.235 1.00 1.00 C ATOM 878 O TYR A 225 50.160 1.800 -8.032 1.00 1.00 O ATOM 879 CB TYR A 225 51.156 2.522 -10.554 1.00 1.00 C ATOM 880 CG TYR A 225 51.748 3.502 -11.547 1.00 1.00 C ATOM 881 CD1 TYR A 225 52.925 3.179 -12.237 1.00 1.00 C ATOM 882 CD2 TYR A 225 51.124 4.735 -11.775 1.00 1.00 C ATOM 883 CE1 TYR A 225 53.473 4.086 -13.152 1.00 1.00 C ATOM 884 CE2 TYR A 225 51.673 5.641 -12.690 1.00 1.00 C ATOM 885 CZ TYR A 225 52.847 5.317 -13.379 1.00 1.00 C ATOM 886 OH TYR A 225 53.387 6.211 -14.280 1.00 1.00 O ATOM 0 H TYR A 225 53.243 1.120 -10.520 1.00 1.00 H new ATOM 0 HA TYR A 225 52.322 3.409 -8.972 1.00 1.00 H new ATOM 0 HB2 TYR A 225 51.033 1.544 -11.020 1.00 1.00 H new ATOM 0 HB3 TYR A 225 50.165 2.855 -10.245 1.00 1.00 H new ATOM 0 HD1 TYR A 225 53.409 2.230 -12.063 1.00 1.00 H new ATOM 0 HD2 TYR A 225 50.218 4.987 -11.244 1.00 1.00 H new ATOM 0 HE1 TYR A 225 54.379 3.836 -13.683 1.00 1.00 H new ATOM 0 HE2 TYR A 225 51.190 6.591 -12.864 1.00 1.00 H new ATOM 0 HH TYR A 225 52.828 7.015 -14.318 1.00 1.00 H new ATOM 896 N LEU A 226 52.122 0.824 -7.518 1.00 1.00 N ATOM 897 CA LEU A 226 51.567 0.040 -6.422 1.00 1.00 C ATOM 898 C LEU A 226 52.635 -0.250 -5.377 1.00 1.00 C ATOM 899 O LEU A 226 53.812 0.042 -5.584 1.00 1.00 O ATOM 900 CB LEU A 226 50.982 -1.261 -6.954 1.00 1.00 C ATOM 901 CG LEU A 226 52.062 -2.060 -7.701 1.00 1.00 C ATOM 902 CD1 LEU A 226 53.046 -2.738 -6.717 1.00 1.00 C ATOM 903 CD2 LEU A 226 51.366 -3.106 -8.584 1.00 1.00 C ATOM 0 H LEU A 226 53.120 0.684 -7.676 1.00 1.00 H new ATOM 0 HA LEU A 226 50.772 0.617 -5.950 1.00 1.00 H new ATOM 0 HB2 LEU A 226 50.585 -1.854 -6.130 1.00 1.00 H new ATOM 0 HB3 LEU A 226 50.149 -1.047 -7.623 1.00 1.00 H new ATOM 0 HG LEU A 226 52.650 -1.382 -8.319 1.00 1.00 H new ATOM 0 HD11 LEU A 226 53.796 -3.294 -7.278 1.00 1.00 H new ATOM 0 HD12 LEU A 226 53.537 -1.977 -6.111 1.00 1.00 H new ATOM 0 HD13 LEU A 226 52.498 -3.421 -6.068 1.00 1.00 H new ATOM 0 HD21 LEU A 226 52.116 -3.684 -9.123 1.00 1.00 H new ATOM 0 HD22 LEU A 226 50.774 -3.774 -7.959 1.00 1.00 H new ATOM 0 HD23 LEU A 226 50.713 -2.603 -9.298 1.00 1.00 H new ATOM 915 N VAL A 227 52.219 -0.832 -4.256 1.00 1.00 N ATOM 916 CA VAL A 227 53.150 -1.172 -3.176 1.00 1.00 C ATOM 917 C VAL A 227 52.839 -2.552 -2.614 1.00 1.00 C ATOM 918 O VAL A 227 51.719 -3.046 -2.738 1.00 1.00 O ATOM 919 CB VAL A 227 53.064 -0.136 -2.057 1.00 1.00 C ATOM 920 CG1 VAL A 227 53.669 1.183 -2.534 1.00 1.00 C ATOM 921 CG2 VAL A 227 51.597 0.083 -1.680 1.00 1.00 C ATOM 0 H VAL A 227 51.247 -1.079 -4.069 1.00 1.00 H new ATOM 0 HA VAL A 227 54.159 -1.176 -3.587 1.00 1.00 H new ATOM 0 HB VAL A 227 53.615 -0.494 -1.187 1.00 1.00 H new ATOM 0 HG11 VAL A 227 53.607 1.922 -1.735 1.00 1.00 H new ATOM 0 HG12 VAL A 227 54.713 1.028 -2.804 1.00 1.00 H new ATOM 0 HG13 VAL A 227 53.119 1.542 -3.404 1.00 1.00 H new ATOM 0 HG21 VAL A 227 51.533 0.822 -0.881 1.00 1.00 H new ATOM 0 HG22 VAL A 227 51.047 0.441 -2.550 1.00 1.00 H new ATOM 0 HG23 VAL A 227 51.165 -0.858 -1.339 1.00 1.00 H new ATOM 931 N GLU A 228 53.839 -3.166 -1.993 1.00 1.00 N ATOM 932 CA GLU A 228 53.664 -4.491 -1.408 1.00 1.00 C ATOM 933 C GLU A 228 52.732 -4.433 -0.208 1.00 1.00 C ATOM 934 O GLU A 228 52.544 -3.376 0.393 1.00 1.00 O ATOM 935 CB GLU A 228 55.015 -5.064 -0.969 1.00 1.00 C ATOM 936 CG GLU A 228 55.841 -5.425 -2.201 1.00 1.00 C ATOM 937 CD GLU A 228 57.224 -5.910 -1.779 1.00 1.00 C ATOM 938 OE1 GLU A 228 57.458 -6.005 -0.585 1.00 1.00 O ATOM 939 OE2 GLU A 228 58.028 -6.181 -2.655 1.00 1.00 O ATOM 0 H GLU A 228 54.773 -2.772 -1.882 1.00 1.00 H new ATOM 0 HA GLU A 228 53.225 -5.136 -2.169 1.00 1.00 H new ATOM 0 HB2 GLU A 228 55.550 -4.335 -0.360 1.00 1.00 H new ATOM 0 HB3 GLU A 228 54.863 -5.947 -0.349 1.00 1.00 H new ATOM 0 HG2 GLU A 228 55.334 -6.201 -2.774 1.00 1.00 H new ATOM 0 HG3 GLU A 228 55.935 -4.557 -2.853 1.00 1.00 H new ATOM 946 N LYS A 229 52.147 -5.579 0.135 1.00 1.00 N ATOM 947 CA LYS A 229 51.229 -5.663 1.273 1.00 1.00 C ATOM 948 C LYS A 229 51.602 -6.837 2.176 1.00 1.00 C ATOM 949 O LYS A 229 50.872 -7.169 3.108 1.00 1.00 O ATOM 950 CB LYS A 229 49.785 -5.834 0.770 1.00 1.00 C ATOM 951 CG LYS A 229 48.800 -5.372 1.848 1.00 1.00 C ATOM 952 CD LYS A 229 47.383 -5.421 1.287 1.00 1.00 C ATOM 953 CE LYS A 229 46.392 -5.074 2.398 1.00 1.00 C ATOM 954 NZ LYS A 229 46.615 -3.666 2.834 1.00 1.00 N ATOM 0 H LYS A 229 52.291 -6.461 -0.356 1.00 1.00 H new ATOM 0 HA LYS A 229 51.305 -4.740 1.848 1.00 1.00 H new ATOM 0 HB2 LYS A 229 49.637 -5.256 -0.142 1.00 1.00 H new ATOM 0 HB3 LYS A 229 49.599 -6.878 0.519 1.00 1.00 H new ATOM 0 HG2 LYS A 229 48.878 -6.012 2.727 1.00 1.00 H new ATOM 0 HG3 LYS A 229 49.042 -4.359 2.169 1.00 1.00 H new ATOM 0 HD2 LYS A 229 47.282 -4.718 0.460 1.00 1.00 H new ATOM 0 HD3 LYS A 229 47.170 -6.413 0.890 1.00 1.00 H new ATOM 0 HE2 LYS A 229 45.370 -5.199 2.041 1.00 1.00 H new ATOM 0 HE3 LYS A 229 46.521 -5.753 3.241 1.00 1.00 H new ATOM 0 HZ1 LYS A 229 46.148 -3.508 3.750 1.00 1.00 H new ATOM 0 HZ2 LYS A 229 47.635 -3.490 2.931 1.00 1.00 H new ATOM 0 HZ3 LYS A 229 46.217 -3.016 2.126 1.00 1.00 H new ATOM 968 N SER A 230 52.744 -7.462 1.894 1.00 1.00 N ATOM 969 CA SER A 230 53.201 -8.599 2.690 1.00 1.00 C ATOM 970 C SER A 230 52.937 -8.354 4.183 1.00 1.00 C ATOM 971 O SER A 230 52.753 -7.215 4.608 1.00 1.00 O ATOM 972 CB SER A 230 54.701 -8.835 2.436 1.00 1.00 C ATOM 973 OG SER A 230 54.869 -10.093 1.797 1.00 1.00 O ATOM 0 H SER A 230 53.365 -7.203 1.127 1.00 1.00 H new ATOM 0 HA SER A 230 52.646 -9.488 2.392 1.00 1.00 H new ATOM 0 HB2 SER A 230 55.107 -8.039 1.812 1.00 1.00 H new ATOM 0 HB3 SER A 230 55.250 -8.814 3.377 1.00 1.00 H new ATOM 0 HG SER A 230 54.099 -10.271 1.218 1.00 1.00 H new ATOM 979 N PRO A 231 52.924 -9.397 4.971 1.00 1.00 N ATOM 980 CA PRO A 231 52.688 -9.291 6.440 1.00 1.00 C ATOM 981 C PRO A 231 53.844 -8.586 7.152 1.00 1.00 C ATOM 982 O PRO A 231 54.999 -8.698 6.741 1.00 1.00 O ATOM 983 CB PRO A 231 52.553 -10.756 6.892 1.00 1.00 C ATOM 984 CG PRO A 231 53.303 -11.547 5.866 1.00 1.00 C ATOM 985 CD PRO A 231 53.136 -10.790 4.548 1.00 1.00 C ATOM 0 HA PRO A 231 51.809 -8.693 6.680 1.00 1.00 H new ATOM 0 HB2 PRO A 231 52.972 -10.902 7.887 1.00 1.00 H new ATOM 0 HB3 PRO A 231 51.507 -11.060 6.938 1.00 1.00 H new ATOM 0 HG2 PRO A 231 54.356 -11.636 6.134 1.00 1.00 H new ATOM 0 HG3 PRO A 231 52.907 -12.560 5.788 1.00 1.00 H new ATOM 0 HD2 PRO A 231 54.019 -10.887 3.916 1.00 1.00 H new ATOM 0 HD3 PRO A 231 52.290 -11.167 3.974 1.00 1.00 H new ATOM 993 N ASN A 232 53.523 -7.861 8.218 1.00 1.00 N ATOM 994 CA ASN A 232 54.541 -7.144 8.979 1.00 1.00 C ATOM 995 C ASN A 232 53.951 -6.599 10.275 1.00 1.00 C ATOM 996 O ASN A 232 53.237 -7.338 10.933 1.00 1.00 O ATOM 997 CB ASN A 232 55.105 -5.990 8.146 1.00 1.00 C ATOM 998 CG ASN A 232 54.001 -4.985 7.832 1.00 1.00 C ATOM 999 OD1 ASN A 232 52.915 -5.056 8.405 1.00 1.00 O ATOM 1000 ND2 ASN A 232 54.219 -4.046 6.952 1.00 1.00 N ATOM 1001 OXT ASN A 232 54.221 -5.452 10.590 1.00 1.00 O ATOM 0 H ASN A 232 52.573 -7.754 8.573 1.00 1.00 H new ATOM 0 HA ASN A 232 55.345 -7.840 9.221 1.00 1.00 H new ATOM 0 HB2 ASN A 232 55.912 -5.498 8.690 1.00 1.00 H new ATOM 0 HB3 ASN A 232 55.533 -6.374 7.220 1.00 1.00 H new ATOM 0 HD21 ASN A 232 53.488 -3.368 6.738 1.00 1.00 H new ATOM 0 HD22 ASN A 232 55.121 -3.990 6.479 1.00 1.00 H new TER 1008 ASN A 232