USER MOD reduce.3.24.130724 H: found=0, std=0, add=795, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 793 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 134 MET CE :methyl -116:sc= -1.61 (180deg=-5.93!) USER MOD Set 1.2: A 163 TYR OH : rot 90:sc= -0.151 USER MOD Set 1.3: A 217 GLN : amide:sc= -0.611 K(o=-2.4,f=-5.4) USER MOD Set 2.1: A 187 HIS : no HD1:sc= 0.191 K(o=-0.25,f=-6.1!) USER MOD Set 2.2: A 188 THR OG1 : rot -110:sc= -0.354 USER MOD Set 2.3: A 206 MET CE :methyl -144:sc= -0.082 (180deg=-2.76!) USER MOD Set 3.1: A 171 ASN :FLIP amide:sc= -0.0823 F(o=-0.34,f=0.95) USER MOD Set 3.2: A 174 ASN : amide:sc= 1.04 K(o=0.95,f=-0.13) USER MOD Single : A 128 TYR OH : rot 30:sc= 0 USER MOD Single : A 129 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 132 SER OG : rot 180:sc= 0 USER MOD Single : A 135 SER OG : rot 180:sc= 0 USER MOD Single : A 138 MET CE :methyl 148:sc= -0.561 (180deg=-1.19) USER MOD Single : A 140 HIS : no HE2:sc= 0.172 K(o=0.17,f=-3!) USER MOD Single : A 143 ASN : amide:sc= 1.1 K(o=1.1,f=-0.029) USER MOD Single : A 149 TYR OH : rot 180:sc= 0 USER MOD Single : A 150 TYR OH : rot -148:sc= 1.23 USER MOD Single : A 153 ASN : amide:sc= 0.516 K(o=0.52,f=-3.2!) USER MOD Single : A 154 MET CE :methyl -168:sc= -0.985 (180deg=-1.35) USER MOD Single : A 155 TYR OH : rot 180:sc= 0 USER MOD Single : A 157 TYR OH : rot -21:sc= 1.29 USER MOD Single : A 159 ASN : amide:sc= -0.784 K(o=-0.78,f=-5!) USER MOD Single : A 160 GLN : amide:sc= -1.18 K(o=-1.2,f=-4.7!) USER MOD Single : A 162 TYR OH : rot 180:sc= 0 USER MOD Single : A 168 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 170 SER OG : rot -129:sc= 0.537 USER MOD Single : A 172 GLN :FLIP amide:sc=-0.00883 F(o=-1.1,f=-0.0088) USER MOD Single : A 173 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 177 HIS : no HD1:sc= -0.404 X(o=-0.4,f=-0.018) USER MOD Single : A 181 ASN : amide:sc= -0.0491 K(o=-0.049,f=-0.97) USER MOD Single : A 183 THR OG1 : rot 85:sc= 1.62 USER MOD Single : A 185 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 186 GLN :FLIP amide:sc= -0.609 F(o=-1.6,f=-0.61) USER MOD Single : A 190 THR OG1 : rot 180:sc= -0.179 USER MOD Single : A 191 THR OG1 : rot 103:sc= 0.469 USER MOD Single : A 192 THR OG1 : rot 180:sc=-0.00774 USER MOD Single : A 193 THR OG1 : rot 180:sc= 0 USER MOD Single : A 194 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 197 ASN : amide:sc= -0.682 X(o=-0.68,f=-0.25) USER MOD Single : A 199 THR OG1 : rot 180:sc= 0.0585 USER MOD Single : A 201 THR OG1 : rot 180:sc= 0.0336 USER MOD Single : A 204 LYS NZ :NH3+ -112:sc= 0.981 (180deg=-0.182) USER MOD Single : A 205 MET CE :methyl -133:sc= -0.583 (180deg=-4.1!) USER MOD Single : A 212 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 213 MET CE :methyl -170:sc= -0.646 (180deg=-0.953) USER MOD Single : A 216 THR OG1 : rot 180:sc= 0 USER MOD Single : A 218 TYR OH : rot 180:sc= 0 USER MOD Single : A 219 GLN : amide:sc=-0.00824 K(o=-0.0082,f=-0.8) USER MOD Single : A 220 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 222 SER OG : rot 180:sc= -0.0524 USER MOD Single : A 223 GLN :FLIP amide:sc= 0 F(o=-0.58,f=0) USER MOD Single : A 225 TYR OH : rot 180:sc= 0 USER MOD Single : A 226 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 65 N LEU A 125 5.681 -13.408 -1.839 1.00 0.00 N ATOM 66 CA LEU A 125 6.214 -12.885 -0.580 1.00 0.00 C ATOM 67 C LEU A 125 7.474 -13.631 -0.126 1.00 0.00 C ATOM 68 O LEU A 125 7.821 -13.584 1.053 1.00 0.00 O ATOM 69 CB LEU A 125 5.118 -13.024 0.514 1.00 0.00 C ATOM 70 CG LEU A 125 3.973 -11.994 0.527 1.00 0.00 C ATOM 71 CD1 LEU A 125 4.420 -10.651 1.108 1.00 0.00 C ATOM 72 CD2 LEU A 125 3.342 -11.796 -0.855 1.00 0.00 C ATOM 0 HA LEU A 125 6.490 -11.842 -0.736 1.00 0.00 H new ATOM 0 HB2 LEU A 125 4.674 -14.015 0.418 1.00 0.00 H new ATOM 0 HB3 LEU A 125 5.610 -12.988 1.486 1.00 0.00 H new ATOM 0 HG LEU A 125 3.206 -12.410 1.180 1.00 0.00 H new ATOM 0 HD11 LEU A 125 3.582 -9.954 1.099 1.00 0.00 H new ATOM 0 HD12 LEU A 125 4.762 -10.794 2.133 1.00 0.00 H new ATOM 0 HD13 LEU A 125 5.235 -10.248 0.507 1.00 0.00 H new ATOM 0 HD21 LEU A 125 2.541 -11.060 -0.787 1.00 0.00 H new ATOM 0 HD22 LEU A 125 4.100 -11.444 -1.554 1.00 0.00 H new ATOM 0 HD23 LEU A 125 2.935 -12.743 -1.208 1.00 0.00 H new ATOM 84 N GLY A 126 8.148 -14.343 -1.030 1.00 0.00 N ATOM 85 CA GLY A 126 9.279 -15.234 -0.775 1.00 0.00 C ATOM 86 C GLY A 126 10.267 -14.712 0.268 1.00 0.00 C ATOM 87 O GLY A 126 10.682 -15.476 1.143 1.00 0.00 O ATOM 0 H GLY A 126 7.903 -14.311 -2.020 1.00 0.00 H new ATOM 0 HA2 GLY A 126 8.898 -16.201 -0.446 1.00 0.00 H new ATOM 0 HA3 GLY A 126 9.812 -15.403 -1.711 1.00 0.00 H new ATOM 91 N GLY A 127 10.569 -13.414 0.251 1.00 0.00 N ATOM 92 CA GLY A 127 11.509 -12.764 1.147 1.00 0.00 C ATOM 93 C GLY A 127 11.091 -11.324 1.390 1.00 0.00 C ATOM 94 O GLY A 127 11.932 -10.477 1.680 1.00 0.00 O ATOM 0 H GLY A 127 10.146 -12.767 -0.415 1.00 0.00 H new ATOM 0 HA2 GLY A 127 11.552 -13.303 2.094 1.00 0.00 H new ATOM 0 HA3 GLY A 127 12.511 -12.792 0.718 1.00 0.00 H new ATOM 98 N TYR A 128 9.806 -11.031 1.198 1.00 0.00 N ATOM 99 CA TYR A 128 9.263 -9.717 1.435 1.00 0.00 C ATOM 100 C TYR A 128 9.186 -9.455 2.944 1.00 0.00 C ATOM 101 O TYR A 128 9.054 -10.400 3.732 1.00 0.00 O ATOM 102 CB TYR A 128 7.874 -9.744 0.820 1.00 0.00 C ATOM 103 CG TYR A 128 7.801 -9.513 -0.677 1.00 0.00 C ATOM 104 CD1 TYR A 128 8.389 -10.407 -1.599 1.00 0.00 C ATOM 105 CD2 TYR A 128 7.081 -8.399 -1.145 1.00 0.00 C ATOM 106 CE1 TYR A 128 8.225 -10.205 -2.982 1.00 0.00 C ATOM 107 CE2 TYR A 128 6.905 -8.202 -2.525 1.00 0.00 C ATOM 108 CZ TYR A 128 7.474 -9.104 -3.448 1.00 0.00 C ATOM 109 OH TYR A 128 7.311 -8.909 -4.782 1.00 0.00 O ATOM 0 H TYR A 128 9.118 -11.710 0.872 1.00 0.00 H new ATOM 0 HA TYR A 128 9.876 -8.926 1.003 1.00 0.00 H new ATOM 0 HB2 TYR A 128 7.420 -10.710 1.040 1.00 0.00 H new ATOM 0 HB3 TYR A 128 7.266 -8.986 1.314 1.00 0.00 H new ATOM 0 HD1 TYR A 128 8.966 -11.247 -1.242 1.00 0.00 H new ATOM 0 HD2 TYR A 128 6.663 -7.694 -0.442 1.00 0.00 H new ATOM 0 HE1 TYR A 128 8.673 -10.891 -3.686 1.00 0.00 H new ATOM 0 HE2 TYR A 128 6.333 -7.358 -2.880 1.00 0.00 H new ATOM 0 HH TYR A 128 7.325 -9.774 -5.243 1.00 0.00 H new ATOM 119 N MET A 129 9.166 -8.183 3.336 1.00 0.00 N ATOM 120 CA MET A 129 8.932 -7.718 4.704 1.00 0.00 C ATOM 121 C MET A 129 7.690 -6.846 4.757 1.00 0.00 C ATOM 122 O MET A 129 6.996 -6.651 3.758 1.00 0.00 O ATOM 123 CB MET A 129 10.171 -7.016 5.287 1.00 0.00 C ATOM 124 CG MET A 129 11.216 -8.011 5.812 1.00 0.00 C ATOM 125 SD MET A 129 12.950 -7.609 5.451 1.00 0.00 S ATOM 126 CE MET A 129 13.195 -8.717 4.044 1.00 0.00 C ATOM 0 H MET A 129 9.319 -7.415 2.683 1.00 0.00 H new ATOM 0 HA MET A 129 8.753 -8.586 5.338 1.00 0.00 H new ATOM 0 HB2 MET A 129 10.624 -6.389 4.519 1.00 0.00 H new ATOM 0 HB3 MET A 129 9.863 -6.356 6.098 1.00 0.00 H new ATOM 0 HG2 MET A 129 11.100 -8.093 6.893 1.00 0.00 H new ATOM 0 HG3 MET A 129 10.997 -8.993 5.393 1.00 0.00 H new ATOM 0 HE1 MET A 129 14.215 -8.616 3.674 1.00 0.00 H new ATOM 0 HE2 MET A 129 13.023 -9.747 4.358 1.00 0.00 H new ATOM 0 HE3 MET A 129 12.494 -8.458 3.250 1.00 0.00 H new ATOM 136 N LEU A 130 7.389 -6.390 5.970 1.00 0.00 N ATOM 137 CA LEU A 130 6.240 -5.601 6.341 1.00 0.00 C ATOM 138 C LEU A 130 6.750 -4.346 7.052 1.00 0.00 C ATOM 139 O LEU A 130 7.742 -4.442 7.781 1.00 0.00 O ATOM 140 CB LEU A 130 5.362 -6.482 7.244 1.00 0.00 C ATOM 141 CG LEU A 130 4.123 -5.806 7.844 1.00 0.00 C ATOM 142 CD1 LEU A 130 3.173 -5.316 6.744 1.00 0.00 C ATOM 143 CD2 LEU A 130 3.421 -6.806 8.770 1.00 0.00 C ATOM 0 H LEU A 130 7.992 -6.582 6.770 1.00 0.00 H new ATOM 0 HA LEU A 130 5.641 -5.280 5.489 1.00 0.00 H new ATOM 0 HB2 LEU A 130 5.036 -7.347 6.667 1.00 0.00 H new ATOM 0 HB3 LEU A 130 5.978 -6.858 8.061 1.00 0.00 H new ATOM 0 HG LEU A 130 4.428 -4.929 8.415 1.00 0.00 H new ATOM 0 HD11 LEU A 130 2.304 -4.841 7.199 1.00 0.00 H new ATOM 0 HD12 LEU A 130 3.690 -4.595 6.111 1.00 0.00 H new ATOM 0 HD13 LEU A 130 2.849 -6.163 6.139 1.00 0.00 H new ATOM 0 HD21 LEU A 130 2.537 -6.340 9.205 1.00 0.00 H new ATOM 0 HD22 LEU A 130 3.124 -7.685 8.198 1.00 0.00 H new ATOM 0 HD23 LEU A 130 4.103 -7.105 9.566 1.00 0.00 H new ATOM 155 N GLY A 131 6.084 -3.204 6.868 1.00 0.00 N ATOM 156 CA GLY A 131 6.468 -1.927 7.460 1.00 0.00 C ATOM 157 C GLY A 131 6.077 -1.815 8.935 1.00 0.00 C ATOM 158 O GLY A 131 6.356 -2.701 9.750 1.00 0.00 O ATOM 0 H GLY A 131 5.245 -3.143 6.291 1.00 0.00 H new ATOM 0 HA2 GLY A 131 7.546 -1.797 7.364 1.00 0.00 H new ATOM 0 HA3 GLY A 131 5.998 -1.117 6.902 1.00 0.00 H new ATOM 162 N SER A 132 5.442 -0.698 9.288 1.00 0.00 N ATOM 163 CA SER A 132 4.796 -0.423 10.547 1.00 0.00 C ATOM 164 C SER A 132 3.469 0.268 10.287 1.00 0.00 C ATOM 165 O SER A 132 3.328 0.928 9.255 1.00 0.00 O ATOM 166 CB SER A 132 5.674 0.490 11.383 1.00 0.00 C ATOM 167 OG SER A 132 6.618 1.239 10.625 1.00 0.00 O ATOM 0 H SER A 132 5.367 0.090 8.645 1.00 0.00 H new ATOM 0 HA SER A 132 4.631 -1.359 11.081 1.00 0.00 H new ATOM 0 HB2 SER A 132 5.038 1.181 11.937 1.00 0.00 H new ATOM 0 HB3 SER A 132 6.209 -0.111 12.119 1.00 0.00 H new ATOM 0 HG SER A 132 7.146 1.804 11.227 1.00 0.00 H new ATOM 173 N ALA A 133 2.515 0.150 11.209 1.00 0.00 N ATOM 174 CA ALA A 133 1.191 0.754 11.114 1.00 0.00 C ATOM 175 C ALA A 133 1.316 2.270 11.004 1.00 0.00 C ATOM 176 O ALA A 133 1.983 2.879 11.849 1.00 0.00 O ATOM 177 CB ALA A 133 0.379 0.342 12.341 1.00 0.00 C ATOM 0 H ALA A 133 2.648 -0.385 12.067 1.00 0.00 H new ATOM 0 HA ALA A 133 0.676 0.405 10.219 1.00 0.00 H new ATOM 0 HB1 ALA A 133 -0.615 0.786 12.285 1.00 0.00 H new ATOM 0 HB2 ALA A 133 0.290 -0.744 12.371 1.00 0.00 H new ATOM 0 HB3 ALA A 133 0.882 0.690 13.243 1.00 0.00 H new ATOM 183 N MET A 134 0.705 2.874 9.982 1.00 0.00 N ATOM 184 CA MET A 134 0.716 4.325 9.765 1.00 0.00 C ATOM 185 C MET A 134 -0.671 4.932 9.828 1.00 0.00 C ATOM 186 O MET A 134 -1.688 4.226 9.886 1.00 0.00 O ATOM 187 CB MET A 134 1.432 4.760 8.478 1.00 0.00 C ATOM 188 CG MET A 134 1.213 3.896 7.243 1.00 0.00 C ATOM 189 SD MET A 134 2.566 2.741 6.935 1.00 0.00 S ATOM 190 CE MET A 134 3.631 3.817 5.972 1.00 0.00 C ATOM 0 H MET A 134 0.181 2.363 9.271 1.00 0.00 H new ATOM 0 HA MET A 134 1.302 4.716 10.597 1.00 0.00 H new ATOM 0 HB2 MET A 134 1.117 5.776 8.241 1.00 0.00 H new ATOM 0 HB3 MET A 134 2.502 4.797 8.681 1.00 0.00 H new ATOM 0 HG2 MET A 134 0.285 3.336 7.359 1.00 0.00 H new ATOM 0 HG3 MET A 134 1.089 4.541 6.373 1.00 0.00 H new ATOM 0 HE1 MET A 134 3.731 3.421 4.962 1.00 0.00 H new ATOM 0 HE2 MET A 134 3.196 4.816 5.929 1.00 0.00 H new ATOM 0 HE3 MET A 134 4.614 3.869 6.440 1.00 0.00 H new ATOM 200 N SER A 135 -0.699 6.266 9.839 1.00 0.00 N ATOM 201 CA SER A 135 -1.937 6.983 9.672 1.00 0.00 C ATOM 202 C SER A 135 -2.337 6.963 8.202 1.00 0.00 C ATOM 203 O SER A 135 -1.502 6.741 7.318 1.00 0.00 O ATOM 204 CB SER A 135 -1.853 8.410 10.226 1.00 0.00 C ATOM 205 OG SER A 135 -3.113 8.792 10.742 1.00 0.00 O ATOM 0 H SER A 135 0.123 6.857 9.962 1.00 0.00 H new ATOM 0 HA SER A 135 -2.713 6.483 10.252 1.00 0.00 H new ATOM 0 HB2 SER A 135 -1.096 8.463 11.009 1.00 0.00 H new ATOM 0 HB3 SER A 135 -1.547 9.099 9.439 1.00 0.00 H new ATOM 0 HG SER A 135 -3.058 9.704 11.098 1.00 0.00 H new ATOM 211 N ARG A 136 -3.618 7.218 7.953 1.00 0.00 N ATOM 212 CA ARG A 136 -4.224 7.097 6.634 1.00 0.00 C ATOM 213 C ARG A 136 -4.294 8.485 5.970 1.00 0.00 C ATOM 214 O ARG A 136 -4.876 9.399 6.561 1.00 0.00 O ATOM 215 CB ARG A 136 -5.517 6.277 6.709 1.00 0.00 C ATOM 216 CG ARG A 136 -6.572 6.635 7.762 1.00 0.00 C ATOM 217 CD ARG A 136 -7.598 7.644 7.266 1.00 0.00 C ATOM 218 NE ARG A 136 -7.332 9.017 7.714 1.00 0.00 N ATOM 219 CZ ARG A 136 -7.860 9.660 8.760 1.00 0.00 C ATOM 220 NH1 ARG A 136 -8.588 9.007 9.660 1.00 0.00 N ATOM 221 NH2 ARG A 136 -7.659 10.967 8.870 1.00 0.00 N ATOM 0 H ARG A 136 -4.273 7.519 8.674 1.00 0.00 H new ATOM 0 HA ARG A 136 -3.608 6.511 5.952 1.00 0.00 H new ATOM 0 HB2 ARG A 136 -5.997 6.332 5.732 1.00 0.00 H new ATOM 0 HB3 ARG A 136 -5.236 5.236 6.868 1.00 0.00 H new ATOM 0 HG2 ARG A 136 -7.087 5.726 8.074 1.00 0.00 H new ATOM 0 HG3 ARG A 136 -6.073 7.037 8.644 1.00 0.00 H new ATOM 0 HD2 ARG A 136 -7.619 7.623 6.176 1.00 0.00 H new ATOM 0 HD3 ARG A 136 -8.588 7.343 7.610 1.00 0.00 H new ATOM 0 HE ARG A 136 -6.661 9.546 7.157 1.00 0.00 H new ATOM 0 HH11 ARG A 136 -8.749 8.005 9.556 1.00 0.00 H new ATOM 0 HH12 ARG A 136 -8.986 9.508 10.454 1.00 0.00 H new ATOM 0 HH21 ARG A 136 -7.111 11.460 8.165 1.00 0.00 H new ATOM 0 HH22 ARG A 136 -8.052 11.479 9.660 1.00 0.00 H new ATOM 235 N PRO A 137 -3.660 8.715 4.807 1.00 0.00 N ATOM 236 CA PRO A 137 -3.646 10.025 4.158 1.00 0.00 C ATOM 237 C PRO A 137 -5.019 10.414 3.674 1.00 0.00 C ATOM 238 O PRO A 137 -5.858 9.546 3.433 1.00 0.00 O ATOM 239 CB PRO A 137 -2.678 9.924 2.979 1.00 0.00 C ATOM 240 CG PRO A 137 -2.519 8.424 2.729 1.00 0.00 C ATOM 241 CD PRO A 137 -2.907 7.745 4.037 1.00 0.00 C ATOM 0 HA PRO A 137 -3.332 10.793 4.865 1.00 0.00 H new ATOM 0 HB2 PRO A 137 -3.073 10.432 2.099 1.00 0.00 H new ATOM 0 HB3 PRO A 137 -1.720 10.389 3.213 1.00 0.00 H new ATOM 0 HG2 PRO A 137 -3.159 8.093 1.911 1.00 0.00 H new ATOM 0 HG3 PRO A 137 -1.494 8.180 2.450 1.00 0.00 H new ATOM 0 HD2 PRO A 137 -3.506 6.854 3.847 1.00 0.00 H new ATOM 0 HD3 PRO A 137 -2.020 7.423 4.583 1.00 0.00 H new ATOM 249 N MET A 138 -5.246 11.711 3.491 1.00 0.00 N ATOM 250 CA MET A 138 -6.429 12.158 2.814 1.00 0.00 C ATOM 251 C MET A 138 -6.157 12.169 1.321 1.00 0.00 C ATOM 252 O MET A 138 -5.039 12.459 0.881 1.00 0.00 O ATOM 253 CB MET A 138 -6.848 13.523 3.341 1.00 0.00 C ATOM 254 CG MET A 138 -8.131 14.002 2.680 1.00 0.00 C ATOM 255 SD MET A 138 -9.581 12.910 2.626 1.00 0.00 S ATOM 256 CE MET A 138 -9.553 12.153 4.264 1.00 0.00 C ATOM 0 H MET A 138 -4.623 12.456 3.804 1.00 0.00 H new ATOM 0 HA MET A 138 -7.262 11.481 3.003 1.00 0.00 H new ATOM 0 HB2 MET A 138 -6.991 13.470 4.420 1.00 0.00 H new ATOM 0 HB3 MET A 138 -6.052 14.245 3.160 1.00 0.00 H new ATOM 0 HG2 MET A 138 -8.434 14.920 3.185 1.00 0.00 H new ATOM 0 HG3 MET A 138 -7.887 14.269 1.652 1.00 0.00 H new ATOM 0 HE1 MET A 138 -10.573 11.947 4.587 1.00 0.00 H new ATOM 0 HE2 MET A 138 -8.990 11.220 4.224 1.00 0.00 H new ATOM 0 HE3 MET A 138 -9.079 12.833 4.971 1.00 0.00 H new ATOM 266 N ILE A 139 -7.177 11.811 0.551 1.00 0.00 N ATOM 267 CA ILE A 139 -7.086 11.635 -0.878 1.00 0.00 C ATOM 268 C ILE A 139 -8.421 12.079 -1.408 1.00 0.00 C ATOM 269 O ILE A 139 -9.455 11.529 -1.031 1.00 0.00 O ATOM 270 CB ILE A 139 -6.787 10.172 -1.258 1.00 0.00 C ATOM 271 CG1 ILE A 139 -5.639 9.583 -0.410 1.00 0.00 C ATOM 272 CG2 ILE A 139 -6.468 10.090 -2.762 1.00 0.00 C ATOM 273 CD1 ILE A 139 -5.379 8.137 -0.775 1.00 0.00 C ATOM 0 H ILE A 139 -8.111 11.632 0.921 1.00 0.00 H new ATOM 0 HA ILE A 139 -6.265 12.212 -1.303 1.00 0.00 H new ATOM 0 HB ILE A 139 -7.671 9.571 -1.047 1.00 0.00 H new ATOM 0 HG12 ILE A 139 -4.732 10.169 -0.563 1.00 0.00 H new ATOM 0 HG13 ILE A 139 -5.890 9.655 0.648 1.00 0.00 H new ATOM 0 HG21 ILE A 139 -6.256 9.056 -3.033 1.00 0.00 H new ATOM 0 HG22 ILE A 139 -7.323 10.448 -3.335 1.00 0.00 H new ATOM 0 HG23 ILE A 139 -5.598 10.709 -2.984 1.00 0.00 H new ATOM 0 HD11 ILE A 139 -4.566 7.748 -0.162 1.00 0.00 H new ATOM 0 HD12 ILE A 139 -6.280 7.549 -0.598 1.00 0.00 H new ATOM 0 HD13 ILE A 139 -5.104 8.071 -1.828 1.00 0.00 H new ATOM 285 N HIS A 140 -8.367 13.107 -2.236 1.00 0.00 N ATOM 286 CA HIS A 140 -9.516 13.606 -2.944 1.00 0.00 C ATOM 287 C HIS A 140 -9.547 12.937 -4.306 1.00 0.00 C ATOM 288 O HIS A 140 -8.502 12.586 -4.859 1.00 0.00 O ATOM 289 CB HIS A 140 -9.395 15.126 -3.030 1.00 0.00 C ATOM 290 CG HIS A 140 -9.300 15.714 -1.649 1.00 0.00 C ATOM 291 ND1 HIS A 140 -10.173 15.467 -0.611 1.00 0.00 N ATOM 292 CD2 HIS A 140 -8.201 16.343 -1.136 1.00 0.00 C ATOM 293 CE1 HIS A 140 -9.591 15.926 0.506 1.00 0.00 C ATOM 294 NE2 HIS A 140 -8.418 16.519 0.233 1.00 0.00 N ATOM 0 H HIS A 140 -7.508 13.621 -2.433 1.00 0.00 H new ATOM 0 HA HIS A 140 -10.455 13.379 -2.439 1.00 0.00 H new ATOM 0 HB2 HIS A 140 -8.513 15.396 -3.611 1.00 0.00 H new ATOM 0 HB3 HIS A 140 -10.259 15.539 -3.551 1.00 0.00 H new ATOM 0 HD1 HIS A 140 -11.087 15.020 -0.680 1.00 0.00 H new ATOM 0 HD2 HIS A 140 -7.324 16.648 -1.688 1.00 0.00 H new ATOM 0 HE1 HIS A 140 -10.011 15.831 1.496 1.00 0.00 H new ATOM 302 N PHE A 141 -10.744 12.762 -4.849 1.00 0.00 N ATOM 303 CA PHE A 141 -10.941 12.213 -6.187 1.00 0.00 C ATOM 304 C PHE A 141 -11.833 13.135 -7.021 1.00 0.00 C ATOM 305 O PHE A 141 -11.915 12.996 -8.238 1.00 0.00 O ATOM 306 CB PHE A 141 -11.565 10.818 -6.112 1.00 0.00 C ATOM 307 CG PHE A 141 -10.931 9.807 -5.170 1.00 0.00 C ATOM 308 CD1 PHE A 141 -11.258 9.812 -3.801 1.00 0.00 C ATOM 309 CD2 PHE A 141 -10.106 8.791 -5.683 1.00 0.00 C ATOM 310 CE1 PHE A 141 -10.754 8.801 -2.950 1.00 0.00 C ATOM 311 CE2 PHE A 141 -9.657 7.754 -4.846 1.00 0.00 C ATOM 312 CZ PHE A 141 -9.993 7.742 -3.483 1.00 0.00 C ATOM 0 H PHE A 141 -11.613 12.998 -4.371 1.00 0.00 H new ATOM 0 HA PHE A 141 -9.965 12.137 -6.667 1.00 0.00 H new ATOM 0 HB2 PHE A 141 -12.610 10.934 -5.825 1.00 0.00 H new ATOM 0 HB3 PHE A 141 -11.555 10.393 -7.115 1.00 0.00 H new ATOM 0 HD1 PHE A 141 -11.894 10.588 -3.400 1.00 0.00 H new ATOM 0 HD2 PHE A 141 -9.816 8.807 -6.723 1.00 0.00 H new ATOM 0 HE1 PHE A 141 -10.953 8.841 -1.889 1.00 0.00 H new ATOM 0 HE2 PHE A 141 -9.049 6.961 -5.255 1.00 0.00 H new ATOM 0 HZ PHE A 141 -9.671 6.929 -2.849 1.00 0.00 H new ATOM 322 N GLY A 142 -12.508 14.099 -6.393 1.00 0.00 N ATOM 323 CA GLY A 142 -13.431 15.030 -7.020 1.00 0.00 C ATOM 324 C GLY A 142 -14.824 14.431 -7.166 1.00 0.00 C ATOM 325 O GLY A 142 -15.757 15.174 -7.474 1.00 0.00 O ATOM 0 H GLY A 142 -12.418 14.254 -5.389 1.00 0.00 H new ATOM 0 HA2 GLY A 142 -13.488 15.942 -6.426 1.00 0.00 H new ATOM 0 HA3 GLY A 142 -13.052 15.313 -8.002 1.00 0.00 H new ATOM 329 N ASN A 143 -15.001 13.125 -6.923 1.00 0.00 N ATOM 330 CA ASN A 143 -16.340 12.555 -6.848 1.00 0.00 C ATOM 331 C ASN A 143 -16.735 12.667 -5.391 1.00 0.00 C ATOM 332 O ASN A 143 -16.059 12.083 -4.545 1.00 0.00 O ATOM 333 CB ASN A 143 -16.358 11.076 -7.247 1.00 0.00 C ATOM 334 CG ASN A 143 -16.553 10.834 -8.733 1.00 0.00 C ATOM 335 OD1 ASN A 143 -17.587 11.172 -9.298 1.00 0.00 O ATOM 336 ND2 ASN A 143 -15.593 10.233 -9.408 1.00 0.00 N ATOM 0 H ASN A 143 -14.243 12.458 -6.778 1.00 0.00 H new ATOM 0 HA ASN A 143 -17.014 13.077 -7.527 1.00 0.00 H new ATOM 0 HB2 ASN A 143 -15.420 10.616 -6.935 1.00 0.00 H new ATOM 0 HB3 ASN A 143 -17.156 10.574 -6.701 1.00 0.00 H new ATOM 0 HD21 ASN A 143 -15.709 10.048 -10.404 1.00 0.00 H new ATOM 0 HD22 ASN A 143 -14.734 9.953 -8.934 1.00 0.00 H new ATOM 343 N ASP A 144 -17.841 13.343 -5.096 1.00 0.00 N ATOM 344 CA ASP A 144 -18.394 13.431 -3.745 1.00 0.00 C ATOM 345 C ASP A 144 -18.600 12.038 -3.187 1.00 0.00 C ATOM 346 O ASP A 144 -18.389 11.828 -1.991 1.00 0.00 O ATOM 347 CB ASP A 144 -19.741 14.174 -3.722 1.00 0.00 C ATOM 348 CG ASP A 144 -19.656 15.692 -3.838 1.00 0.00 C ATOM 349 OD1 ASP A 144 -18.595 16.215 -4.254 1.00 0.00 O ATOM 350 OD2 ASP A 144 -20.703 16.344 -3.631 1.00 0.00 O ATOM 0 H ASP A 144 -18.385 13.851 -5.793 1.00 0.00 H new ATOM 0 HA ASP A 144 -17.682 13.990 -3.137 1.00 0.00 H new ATOM 0 HB2 ASP A 144 -20.357 13.799 -4.539 1.00 0.00 H new ATOM 0 HB3 ASP A 144 -20.257 13.926 -2.794 1.00 0.00 H new ATOM 355 N TRP A 145 -18.978 11.093 -4.048 1.00 0.00 N ATOM 356 CA TRP A 145 -19.251 9.745 -3.622 1.00 0.00 C ATOM 357 C TRP A 145 -17.965 9.016 -3.263 1.00 0.00 C ATOM 358 O TRP A 145 -17.999 8.217 -2.340 1.00 0.00 O ATOM 359 CB TRP A 145 -20.070 8.964 -4.664 1.00 0.00 C ATOM 360 CG TRP A 145 -19.347 8.446 -5.877 1.00 0.00 C ATOM 361 CD1 TRP A 145 -19.399 8.984 -7.116 1.00 0.00 C ATOM 362 CD2 TRP A 145 -18.455 7.288 -5.996 1.00 0.00 C ATOM 363 NE1 TRP A 145 -18.658 8.215 -7.987 1.00 0.00 N ATOM 364 CE2 TRP A 145 -17.989 7.217 -7.342 1.00 0.00 C ATOM 365 CE3 TRP A 145 -17.971 6.292 -5.118 1.00 0.00 C ATOM 366 CZ2 TRP A 145 -17.033 6.298 -7.781 1.00 0.00 C ATOM 367 CZ3 TRP A 145 -16.979 5.390 -5.533 1.00 0.00 C ATOM 368 CH2 TRP A 145 -16.495 5.404 -6.852 1.00 0.00 C ATOM 0 H TRP A 145 -19.099 11.251 -5.048 1.00 0.00 H new ATOM 0 HA TRP A 145 -19.864 9.807 -2.723 1.00 0.00 H new ATOM 0 HB2 TRP A 145 -20.531 8.114 -4.160 1.00 0.00 H new ATOM 0 HB3 TRP A 145 -20.879 9.609 -5.006 1.00 0.00 H new ATOM 0 HD1 TRP A 145 -19.939 9.880 -7.383 1.00 0.00 H new ATOM 0 HE1 TRP A 145 -18.615 8.373 -8.994 1.00 0.00 H new ATOM 0 HE3 TRP A 145 -18.369 6.224 -4.116 1.00 0.00 H new ATOM 0 HZ2 TRP A 145 -16.717 6.279 -8.814 1.00 0.00 H new ATOM 0 HZ3 TRP A 145 -16.582 4.675 -4.828 1.00 0.00 H new ATOM 0 HH2 TRP A 145 -15.709 4.725 -7.147 1.00 0.00 H new ATOM 379 N GLU A 146 -16.853 9.281 -3.953 1.00 0.00 N ATOM 380 CA GLU A 146 -15.573 8.650 -3.658 1.00 0.00 C ATOM 381 C GLU A 146 -15.041 9.220 -2.353 1.00 0.00 C ATOM 382 O GLU A 146 -14.677 8.498 -1.431 1.00 0.00 O ATOM 383 CB GLU A 146 -14.545 8.913 -4.770 1.00 0.00 C ATOM 384 CG GLU A 146 -14.850 8.096 -6.020 1.00 0.00 C ATOM 385 CD GLU A 146 -13.738 8.176 -7.067 1.00 0.00 C ATOM 386 OE1 GLU A 146 -13.632 9.210 -7.759 1.00 0.00 O ATOM 387 OE2 GLU A 146 -12.971 7.194 -7.226 1.00 0.00 O ATOM 0 H GLU A 146 -16.819 9.940 -4.731 1.00 0.00 H new ATOM 0 HA GLU A 146 -15.727 7.574 -3.584 1.00 0.00 H new ATOM 0 HB2 GLU A 146 -14.542 9.974 -5.020 1.00 0.00 H new ATOM 0 HB3 GLU A 146 -13.546 8.667 -4.409 1.00 0.00 H new ATOM 0 HG2 GLU A 146 -15.004 7.054 -5.739 1.00 0.00 H new ATOM 0 HG3 GLU A 146 -15.783 8.448 -6.460 1.00 0.00 H new ATOM 394 N ASP A 147 -15.022 10.543 -2.274 1.00 0.00 N ATOM 395 CA ASP A 147 -14.471 11.263 -1.150 1.00 0.00 C ATOM 396 C ASP A 147 -15.180 10.854 0.151 1.00 0.00 C ATOM 397 O ASP A 147 -14.524 10.520 1.139 1.00 0.00 O ATOM 398 CB ASP A 147 -14.583 12.742 -1.467 1.00 0.00 C ATOM 399 CG ASP A 147 -13.723 13.574 -0.526 1.00 0.00 C ATOM 400 OD1 ASP A 147 -14.215 13.904 0.580 1.00 0.00 O ATOM 401 OD2 ASP A 147 -12.687 14.082 -1.005 1.00 0.00 O ATOM 0 H ASP A 147 -15.396 11.150 -3.004 1.00 0.00 H new ATOM 0 HA ASP A 147 -13.420 11.022 -0.988 1.00 0.00 H new ATOM 0 HB2 ASP A 147 -14.276 12.920 -2.498 1.00 0.00 H new ATOM 0 HB3 ASP A 147 -15.624 13.056 -1.386 1.00 0.00 H new ATOM 406 N ARG A 148 -16.519 10.756 0.121 1.00 0.00 N ATOM 407 CA ARG A 148 -17.299 10.258 1.253 1.00 0.00 C ATOM 408 C ARG A 148 -17.078 8.768 1.462 1.00 0.00 C ATOM 409 O ARG A 148 -17.025 8.348 2.611 1.00 0.00 O ATOM 410 CB ARG A 148 -18.801 10.591 1.141 1.00 0.00 C ATOM 411 CG ARG A 148 -19.606 9.610 0.281 1.00 0.00 C ATOM 412 CD ARG A 148 -21.069 9.996 0.078 1.00 0.00 C ATOM 413 NE ARG A 148 -21.902 9.481 1.176 1.00 0.00 N ATOM 414 CZ ARG A 148 -23.009 8.747 1.045 1.00 0.00 C ATOM 415 NH1 ARG A 148 -23.696 8.719 -0.095 1.00 0.00 N ATOM 416 NH2 ARG A 148 -23.400 7.991 2.056 1.00 0.00 N ATOM 0 H ARG A 148 -17.084 11.020 -0.686 1.00 0.00 H new ATOM 0 HA ARG A 148 -16.933 10.784 2.135 1.00 0.00 H new ATOM 0 HB2 ARG A 148 -19.231 10.614 2.142 1.00 0.00 H new ATOM 0 HB3 ARG A 148 -18.908 11.593 0.725 1.00 0.00 H new ATOM 0 HG2 ARG A 148 -19.127 9.525 -0.695 1.00 0.00 H new ATOM 0 HG3 ARG A 148 -19.565 8.624 0.743 1.00 0.00 H new ATOM 0 HD2 ARG A 148 -21.160 11.081 0.025 1.00 0.00 H new ATOM 0 HD3 ARG A 148 -21.426 9.599 -0.872 1.00 0.00 H new ATOM 0 HE ARG A 148 -21.606 9.706 2.126 1.00 0.00 H new ATOM 0 HH11 ARG A 148 -23.379 9.267 -0.895 1.00 0.00 H new ATOM 0 HH12 ARG A 148 -24.539 8.149 -0.169 1.00 0.00 H new ATOM 0 HH21 ARG A 148 -22.858 7.975 2.920 1.00 0.00 H new ATOM 0 HH22 ARG A 148 -24.244 7.424 1.972 1.00 0.00 H new ATOM 430 N TYR A 149 -17.007 7.967 0.392 1.00 0.00 N ATOM 431 CA TYR A 149 -16.885 6.519 0.509 1.00 0.00 C ATOM 432 C TYR A 149 -15.635 6.184 1.294 1.00 0.00 C ATOM 433 O TYR A 149 -15.672 5.323 2.176 1.00 0.00 O ATOM 434 CB TYR A 149 -16.741 5.831 -0.853 1.00 0.00 C ATOM 435 CG TYR A 149 -17.965 5.199 -1.458 1.00 0.00 C ATOM 436 CD1 TYR A 149 -19.272 5.535 -1.064 1.00 0.00 C ATOM 437 CD2 TYR A 149 -17.751 4.199 -2.414 1.00 0.00 C ATOM 438 CE1 TYR A 149 -20.354 4.808 -1.577 1.00 0.00 C ATOM 439 CE2 TYR A 149 -18.829 3.507 -2.970 1.00 0.00 C ATOM 440 CZ TYR A 149 -20.130 3.764 -2.499 1.00 0.00 C ATOM 441 OH TYR A 149 -21.151 2.947 -2.854 1.00 0.00 O ATOM 0 H TYR A 149 -17.033 8.306 -0.570 1.00 0.00 H new ATOM 0 HA TYR A 149 -17.794 6.168 0.998 1.00 0.00 H new ATOM 0 HB2 TYR A 149 -16.361 6.568 -1.561 1.00 0.00 H new ATOM 0 HB3 TYR A 149 -15.979 5.058 -0.758 1.00 0.00 H new ATOM 0 HD1 TYR A 149 -19.440 6.347 -0.372 1.00 0.00 H new ATOM 0 HD2 TYR A 149 -16.744 3.961 -2.724 1.00 0.00 H new ATOM 0 HE1 TYR A 149 -21.360 5.047 -1.266 1.00 0.00 H new ATOM 0 HE2 TYR A 149 -18.666 2.782 -3.754 1.00 0.00 H new ATOM 0 HH TYR A 149 -20.829 2.282 -3.498 1.00 0.00 H new ATOM 451 N TYR A 150 -14.536 6.859 0.955 1.00 0.00 N ATOM 452 CA TYR A 150 -13.292 6.712 1.656 1.00 0.00 C ATOM 453 C TYR A 150 -13.522 7.089 3.124 1.00 0.00 C ATOM 454 O TYR A 150 -13.261 6.290 4.023 1.00 0.00 O ATOM 455 CB TYR A 150 -12.203 7.562 0.989 1.00 0.00 C ATOM 456 CG TYR A 150 -10.847 7.474 1.665 1.00 0.00 C ATOM 457 CD1 TYR A 150 -10.548 6.417 2.550 1.00 0.00 C ATOM 458 CD2 TYR A 150 -9.882 8.466 1.415 1.00 0.00 C ATOM 459 CE1 TYR A 150 -9.312 6.362 3.201 1.00 0.00 C ATOM 460 CE2 TYR A 150 -8.643 8.429 2.081 1.00 0.00 C ATOM 461 CZ TYR A 150 -8.362 7.380 2.989 1.00 0.00 C ATOM 462 OH TYR A 150 -7.222 7.376 3.722 1.00 0.00 O ATOM 0 H TYR A 150 -14.500 7.522 0.181 1.00 0.00 H new ATOM 0 HA TYR A 150 -12.941 5.681 1.617 1.00 0.00 H new ATOM 0 HB2 TYR A 150 -12.100 7.250 -0.050 1.00 0.00 H new ATOM 0 HB3 TYR A 150 -12.525 8.603 0.979 1.00 0.00 H new ATOM 0 HD1 TYR A 150 -11.281 5.643 2.726 1.00 0.00 H new ATOM 0 HD2 TYR A 150 -10.092 9.257 0.711 1.00 0.00 H new ATOM 0 HE1 TYR A 150 -9.086 5.541 3.865 1.00 0.00 H new ATOM 0 HE2 TYR A 150 -7.908 9.199 1.900 1.00 0.00 H new ATOM 0 HH TYR A 150 -6.924 8.298 3.868 1.00 0.00 H new ATOM 472 N ARG A 151 -14.039 8.297 3.370 1.00 0.00 N ATOM 473 CA ARG A 151 -14.314 8.807 4.712 1.00 0.00 C ATOM 474 C ARG A 151 -15.332 7.989 5.511 1.00 0.00 C ATOM 475 O ARG A 151 -15.456 8.223 6.713 1.00 0.00 O ATOM 476 CB ARG A 151 -14.730 10.283 4.613 1.00 0.00 C ATOM 477 CG ARG A 151 -13.531 11.198 4.789 1.00 0.00 C ATOM 478 CD ARG A 151 -13.167 11.260 6.276 1.00 0.00 C ATOM 479 NE ARG A 151 -13.015 12.645 6.706 1.00 0.00 N ATOM 480 CZ ARG A 151 -13.972 13.574 6.775 1.00 0.00 C ATOM 481 NH1 ARG A 151 -15.254 13.237 6.676 1.00 0.00 N ATOM 482 NH2 ARG A 151 -13.624 14.844 6.919 1.00 0.00 N ATOM 0 H ARG A 151 -14.281 8.956 2.630 1.00 0.00 H new ATOM 0 HA ARG A 151 -13.390 8.711 5.282 1.00 0.00 H new ATOM 0 HB2 ARG A 151 -15.196 10.469 3.645 1.00 0.00 H new ATOM 0 HB3 ARG A 151 -15.477 10.506 5.374 1.00 0.00 H new ATOM 0 HG2 ARG A 151 -12.686 10.827 4.209 1.00 0.00 H new ATOM 0 HG3 ARG A 151 -13.760 12.196 4.415 1.00 0.00 H new ATOM 0 HD2 ARG A 151 -13.942 10.772 6.867 1.00 0.00 H new ATOM 0 HD3 ARG A 151 -12.240 10.714 6.453 1.00 0.00 H new ATOM 0 HE ARG A 151 -12.077 12.935 6.984 1.00 0.00 H new ATOM 0 HH11 ARG A 151 -15.516 12.260 6.546 1.00 0.00 H new ATOM 0 HH12 ARG A 151 -15.976 13.956 6.730 1.00 0.00 H new ATOM 0 HH21 ARG A 151 -12.638 15.099 6.975 1.00 0.00 H new ATOM 0 HH22 ARG A 151 -14.342 15.566 6.973 1.00 0.00 H new ATOM 496 N GLU A 152 -16.036 7.040 4.907 1.00 0.00 N ATOM 497 CA GLU A 152 -16.747 5.995 5.612 1.00 0.00 C ATOM 498 C GLU A 152 -15.792 4.820 5.851 1.00 0.00 C ATOM 499 O GLU A 152 -15.444 4.530 6.997 1.00 0.00 O ATOM 500 CB GLU A 152 -17.996 5.584 4.809 1.00 0.00 C ATOM 501 CG GLU A 152 -19.108 6.644 4.841 1.00 0.00 C ATOM 502 CD GLU A 152 -20.000 6.505 6.082 1.00 0.00 C ATOM 503 OE1 GLU A 152 -19.488 6.710 7.212 1.00 0.00 O ATOM 504 OE2 GLU A 152 -21.213 6.232 5.929 1.00 0.00 O ATOM 0 H GLU A 152 -16.127 6.979 3.893 1.00 0.00 H new ATOM 0 HA GLU A 152 -17.093 6.350 6.583 1.00 0.00 H new ATOM 0 HB2 GLU A 152 -17.710 5.397 3.774 1.00 0.00 H new ATOM 0 HB3 GLU A 152 -18.384 4.646 5.207 1.00 0.00 H new ATOM 0 HG2 GLU A 152 -18.662 7.638 4.825 1.00 0.00 H new ATOM 0 HG3 GLU A 152 -19.720 6.555 3.943 1.00 0.00 H new ATOM 511 N ASN A 153 -15.372 4.118 4.793 1.00 0.00 N ATOM 512 CA ASN A 153 -14.920 2.721 4.864 1.00 0.00 C ATOM 513 C ASN A 153 -13.428 2.604 5.149 1.00 0.00 C ATOM 514 O ASN A 153 -12.904 1.500 5.174 1.00 0.00 O ATOM 515 CB ASN A 153 -15.259 1.970 3.564 1.00 0.00 C ATOM 516 CG ASN A 153 -16.758 1.885 3.319 1.00 0.00 C ATOM 517 OD1 ASN A 153 -17.434 1.038 3.902 1.00 0.00 O ATOM 518 ND2 ASN A 153 -17.301 2.768 2.495 1.00 0.00 N ATOM 0 H ASN A 153 -15.335 4.507 3.851 1.00 0.00 H new ATOM 0 HA ASN A 153 -15.454 2.265 5.698 1.00 0.00 H new ATOM 0 HB2 ASN A 153 -14.784 2.473 2.722 1.00 0.00 H new ATOM 0 HB3 ASN A 153 -14.843 0.963 3.610 1.00 0.00 H new ATOM 0 HD21 ASN A 153 -18.307 2.759 2.328 1.00 0.00 H new ATOM 0 HD22 ASN A 153 -16.713 3.458 2.027 1.00 0.00 H new ATOM 525 N MET A 154 -12.739 3.707 5.411 1.00 0.00 N ATOM 526 CA MET A 154 -11.328 3.786 5.782 1.00 0.00 C ATOM 527 C MET A 154 -10.874 2.699 6.766 1.00 0.00 C ATOM 528 O MET A 154 -9.794 2.147 6.596 1.00 0.00 O ATOM 529 CB MET A 154 -11.060 5.185 6.354 1.00 0.00 C ATOM 530 CG MET A 154 -11.938 5.502 7.579 1.00 0.00 C ATOM 531 SD MET A 154 -12.657 7.153 7.604 1.00 0.00 S ATOM 532 CE MET A 154 -11.161 8.143 7.578 1.00 0.00 C ATOM 0 H MET A 154 -13.175 4.628 5.368 1.00 0.00 H new ATOM 0 HA MET A 154 -10.741 3.609 4.881 1.00 0.00 H new ATOM 0 HB2 MET A 154 -10.010 5.264 6.634 1.00 0.00 H new ATOM 0 HB3 MET A 154 -11.240 5.931 5.580 1.00 0.00 H new ATOM 0 HG2 MET A 154 -12.745 4.771 7.626 1.00 0.00 H new ATOM 0 HG3 MET A 154 -11.338 5.371 8.479 1.00 0.00 H new ATOM 0 HE1 MET A 154 -11.407 9.181 7.803 1.00 0.00 H new ATOM 0 HE2 MET A 154 -10.462 7.766 8.325 1.00 0.00 H new ATOM 0 HE3 MET A 154 -10.703 8.085 6.590 1.00 0.00 H new ATOM 542 N TYR A 155 -11.685 2.354 7.771 1.00 0.00 N ATOM 543 CA TYR A 155 -11.347 1.351 8.781 1.00 0.00 C ATOM 544 C TYR A 155 -11.292 -0.084 8.230 1.00 0.00 C ATOM 545 O TYR A 155 -10.830 -1.002 8.912 1.00 0.00 O ATOM 546 CB TYR A 155 -12.342 1.462 9.945 1.00 0.00 C ATOM 547 CG TYR A 155 -13.802 1.298 9.564 1.00 0.00 C ATOM 548 CD1 TYR A 155 -14.365 0.014 9.464 1.00 0.00 C ATOM 549 CD2 TYR A 155 -14.603 2.427 9.310 1.00 0.00 C ATOM 550 CE1 TYR A 155 -15.716 -0.140 9.111 1.00 0.00 C ATOM 551 CE2 TYR A 155 -15.961 2.277 8.980 1.00 0.00 C ATOM 552 CZ TYR A 155 -16.525 0.990 8.860 1.00 0.00 C ATOM 553 OH TYR A 155 -17.825 0.852 8.486 1.00 0.00 O ATOM 0 H TYR A 155 -12.606 2.770 7.906 1.00 0.00 H new ATOM 0 HA TYR A 155 -10.336 1.561 9.129 1.00 0.00 H new ATOM 0 HB2 TYR A 155 -12.090 0.707 10.690 1.00 0.00 H new ATOM 0 HB3 TYR A 155 -12.214 2.435 10.420 1.00 0.00 H new ATOM 0 HD1 TYR A 155 -13.757 -0.857 9.659 1.00 0.00 H new ATOM 0 HD2 TYR A 155 -14.171 3.415 9.369 1.00 0.00 H new ATOM 0 HE1 TYR A 155 -16.139 -1.130 9.031 1.00 0.00 H new ATOM 0 HE2 TYR A 155 -16.575 3.151 8.818 1.00 0.00 H new ATOM 0 HH TYR A 155 -18.224 1.738 8.358 1.00 0.00 H new ATOM 563 N ARG A 156 -11.779 -0.300 7.007 1.00 0.00 N ATOM 564 CA ARG A 156 -11.706 -1.573 6.306 1.00 0.00 C ATOM 565 C ARG A 156 -10.382 -1.684 5.549 1.00 0.00 C ATOM 566 O ARG A 156 -9.954 -2.798 5.248 1.00 0.00 O ATOM 567 CB ARG A 156 -12.907 -1.708 5.345 1.00 0.00 C ATOM 568 CG ARG A 156 -14.186 -1.864 6.178 1.00 0.00 C ATOM 569 CD ARG A 156 -15.523 -1.497 5.547 1.00 0.00 C ATOM 570 NE ARG A 156 -16.583 -1.962 6.460 1.00 0.00 N ATOM 571 CZ ARG A 156 -17.904 -1.930 6.266 1.00 0.00 C ATOM 572 NH1 ARG A 156 -18.402 -1.356 5.177 1.00 0.00 N ATOM 573 NH2 ARG A 156 -18.711 -2.468 7.174 1.00 0.00 N ATOM 0 H ARG A 156 -12.246 0.428 6.467 1.00 0.00 H new ATOM 0 HA ARG A 156 -11.749 -2.387 7.030 1.00 0.00 H new ATOM 0 HB2 ARG A 156 -12.978 -0.830 4.703 1.00 0.00 H new ATOM 0 HB3 ARG A 156 -12.774 -2.570 4.692 1.00 0.00 H new ATOM 0 HG2 ARG A 156 -14.247 -2.904 6.498 1.00 0.00 H new ATOM 0 HG3 ARG A 156 -14.069 -1.260 7.078 1.00 0.00 H new ATOM 0 HD2 ARG A 156 -15.593 -0.420 5.395 1.00 0.00 H new ATOM 0 HD3 ARG A 156 -15.627 -1.965 4.568 1.00 0.00 H new ATOM 0 HE ARG A 156 -16.270 -2.356 7.347 1.00 0.00 H new ATOM 0 HH11 ARG A 156 -17.776 -0.939 4.488 1.00 0.00 H new ATOM 0 HH12 ARG A 156 -19.411 -1.332 5.029 1.00 0.00 H new ATOM 0 HH21 ARG A 156 -18.320 -2.901 8.011 1.00 0.00 H new ATOM 0 HH22 ARG A 156 -19.721 -2.448 7.034 1.00 0.00 H new ATOM 587 N TYR A 157 -9.746 -0.561 5.214 1.00 0.00 N ATOM 588 CA TYR A 157 -8.561 -0.523 4.367 1.00 0.00 C ATOM 589 C TYR A 157 -7.303 -0.823 5.201 1.00 0.00 C ATOM 590 O TYR A 157 -7.356 -0.747 6.430 1.00 0.00 O ATOM 591 CB TYR A 157 -8.504 0.854 3.680 1.00 0.00 C ATOM 592 CG TYR A 157 -9.690 1.235 2.799 1.00 0.00 C ATOM 593 CD1 TYR A 157 -10.653 0.293 2.366 1.00 0.00 C ATOM 594 CD2 TYR A 157 -9.808 2.576 2.387 1.00 0.00 C ATOM 595 CE1 TYR A 157 -11.747 0.702 1.581 1.00 0.00 C ATOM 596 CE2 TYR A 157 -10.898 2.988 1.602 1.00 0.00 C ATOM 597 CZ TYR A 157 -11.888 2.058 1.208 1.00 0.00 C ATOM 598 OH TYR A 157 -12.966 2.469 0.484 1.00 0.00 O ATOM 0 H TYR A 157 -10.047 0.361 5.530 1.00 0.00 H new ATOM 0 HA TYR A 157 -8.608 -1.291 3.595 1.00 0.00 H new ATOM 0 HB2 TYR A 157 -8.397 1.615 4.453 1.00 0.00 H new ATOM 0 HB3 TYR A 157 -7.602 0.892 3.069 1.00 0.00 H new ATOM 0 HD1 TYR A 157 -10.548 -0.746 2.640 1.00 0.00 H new ATOM 0 HD2 TYR A 157 -9.055 3.294 2.677 1.00 0.00 H new ATOM 0 HE1 TYR A 157 -12.482 -0.023 1.262 1.00 0.00 H new ATOM 0 HE2 TYR A 157 -10.980 4.021 1.298 1.00 0.00 H new ATOM 0 HH TYR A 157 -13.359 1.702 0.018 1.00 0.00 H new ATOM 608 N PRO A 158 -6.168 -1.178 4.566 1.00 0.00 N ATOM 609 CA PRO A 158 -4.929 -1.440 5.274 1.00 0.00 C ATOM 610 C PRO A 158 -4.390 -0.176 5.955 1.00 0.00 C ATOM 611 O PRO A 158 -4.664 0.951 5.533 1.00 0.00 O ATOM 612 CB PRO A 158 -3.957 -2.023 4.235 1.00 0.00 C ATOM 613 CG PRO A 158 -4.590 -1.831 2.864 1.00 0.00 C ATOM 614 CD PRO A 158 -6.025 -1.418 3.144 1.00 0.00 C ATOM 0 HA PRO A 158 -5.076 -2.149 6.089 1.00 0.00 H new ATOM 0 HB2 PRO A 158 -2.992 -1.519 4.287 1.00 0.00 H new ATOM 0 HB3 PRO A 158 -3.775 -3.080 4.430 1.00 0.00 H new ATOM 0 HG2 PRO A 158 -4.065 -1.067 2.291 1.00 0.00 H new ATOM 0 HG3 PRO A 158 -4.551 -2.750 2.280 1.00 0.00 H new ATOM 0 HD2 PRO A 158 -6.276 -0.519 2.581 1.00 0.00 H new ATOM 0 HD3 PRO A 158 -6.713 -2.199 2.821 1.00 0.00 H new ATOM 622 N ASN A 159 -3.551 -0.361 6.973 1.00 0.00 N ATOM 623 CA ASN A 159 -2.707 0.678 7.575 1.00 0.00 C ATOM 624 C ASN A 159 -1.226 0.333 7.454 1.00 0.00 C ATOM 625 O ASN A 159 -0.384 1.131 7.875 1.00 0.00 O ATOM 626 CB ASN A 159 -3.105 0.972 9.027 1.00 0.00 C ATOM 627 CG ASN A 159 -2.721 -0.105 10.041 1.00 0.00 C ATOM 628 OD1 ASN A 159 -1.784 -0.872 9.885 1.00 0.00 O ATOM 629 ND2 ASN A 159 -3.422 -0.150 11.149 1.00 0.00 N ATOM 0 H ASN A 159 -3.434 -1.270 7.420 1.00 0.00 H new ATOM 0 HA ASN A 159 -2.875 1.595 7.010 1.00 0.00 H new ATOM 0 HB2 ASN A 159 -2.645 1.913 9.329 1.00 0.00 H new ATOM 0 HB3 ASN A 159 -4.184 1.118 9.068 1.00 0.00 H new ATOM 0 HD21 ASN A 159 -3.183 -0.824 11.876 1.00 0.00 H new ATOM 0 HD22 ASN A 159 -4.206 0.489 11.283 1.00 0.00 H new ATOM 636 N GLN A 160 -0.897 -0.811 6.858 1.00 0.00 N ATOM 637 CA GLN A 160 0.456 -1.284 6.666 1.00 0.00 C ATOM 638 C GLN A 160 0.695 -1.716 5.227 1.00 0.00 C ATOM 639 O GLN A 160 -0.237 -2.165 4.551 1.00 0.00 O ATOM 640 CB GLN A 160 0.719 -2.450 7.614 1.00 0.00 C ATOM 641 CG GLN A 160 1.242 -1.981 8.974 1.00 0.00 C ATOM 642 CD GLN A 160 2.481 -2.764 9.341 1.00 0.00 C ATOM 643 OE1 GLN A 160 3.438 -2.695 8.585 1.00 0.00 O ATOM 644 NE2 GLN A 160 2.537 -3.433 10.474 1.00 0.00 N ATOM 0 H GLN A 160 -1.597 -1.452 6.485 1.00 0.00 H new ATOM 0 HA GLN A 160 1.143 -0.466 6.883 1.00 0.00 H new ATOM 0 HB2 GLN A 160 -0.202 -3.016 7.756 1.00 0.00 H new ATOM 0 HB3 GLN A 160 1.443 -3.128 7.162 1.00 0.00 H new ATOM 0 HG2 GLN A 160 1.470 -0.916 8.939 1.00 0.00 H new ATOM 0 HG3 GLN A 160 0.475 -2.117 9.736 1.00 0.00 H new ATOM 0 HE21 GLN A 160 1.721 -3.472 11.084 1.00 0.00 H new ATOM 0 HE22 GLN A 160 3.397 -3.912 10.741 1.00 0.00 H new ATOM 653 N VAL A 161 1.959 -1.655 4.800 1.00 0.00 N ATOM 654 CA VAL A 161 2.392 -2.118 3.495 1.00 0.00 C ATOM 655 C VAL A 161 3.474 -3.187 3.633 1.00 0.00 C ATOM 656 O VAL A 161 4.331 -3.102 4.514 1.00 0.00 O ATOM 657 CB VAL A 161 2.879 -0.935 2.655 1.00 0.00 C ATOM 658 CG1 VAL A 161 1.709 -0.055 2.203 1.00 0.00 C ATOM 659 CG2 VAL A 161 3.939 -0.059 3.338 1.00 0.00 C ATOM 0 H VAL A 161 2.717 -1.275 5.367 1.00 0.00 H new ATOM 0 HA VAL A 161 1.545 -2.574 2.982 1.00 0.00 H new ATOM 0 HB VAL A 161 3.362 -1.394 1.793 1.00 0.00 H new ATOM 0 HG11 VAL A 161 2.088 0.776 1.609 1.00 0.00 H new ATOM 0 HG12 VAL A 161 1.020 -0.647 1.601 1.00 0.00 H new ATOM 0 HG13 VAL A 161 1.186 0.333 3.077 1.00 0.00 H new ATOM 0 HG21 VAL A 161 4.225 0.754 2.670 1.00 0.00 H new ATOM 0 HG22 VAL A 161 3.530 0.355 4.259 1.00 0.00 H new ATOM 0 HG23 VAL A 161 4.816 -0.663 3.570 1.00 0.00 H new ATOM 669 N TYR A 162 3.428 -4.175 2.745 1.00 0.00 N ATOM 670 CA TYR A 162 4.496 -5.124 2.487 1.00 0.00 C ATOM 671 C TYR A 162 5.394 -4.533 1.405 1.00 0.00 C ATOM 672 O TYR A 162 4.922 -3.777 0.551 1.00 0.00 O ATOM 673 CB TYR A 162 3.871 -6.450 2.033 1.00 0.00 C ATOM 674 CG TYR A 162 3.142 -7.179 3.148 1.00 0.00 C ATOM 675 CD1 TYR A 162 3.850 -8.070 3.978 1.00 0.00 C ATOM 676 CD2 TYR A 162 1.788 -6.892 3.418 1.00 0.00 C ATOM 677 CE1 TYR A 162 3.228 -8.635 5.104 1.00 0.00 C ATOM 678 CE2 TYR A 162 1.161 -7.441 4.550 1.00 0.00 C ATOM 679 CZ TYR A 162 1.889 -8.299 5.408 1.00 0.00 C ATOM 680 OH TYR A 162 1.335 -8.731 6.574 1.00 0.00 O ATOM 0 H TYR A 162 2.607 -4.340 2.162 1.00 0.00 H new ATOM 0 HA TYR A 162 5.093 -5.315 3.379 1.00 0.00 H new ATOM 0 HB2 TYR A 162 3.174 -6.256 1.218 1.00 0.00 H new ATOM 0 HB3 TYR A 162 4.654 -7.096 1.636 1.00 0.00 H new ATOM 0 HD1 TYR A 162 4.875 -8.320 3.748 1.00 0.00 H new ATOM 0 HD2 TYR A 162 1.231 -6.248 2.753 1.00 0.00 H new ATOM 0 HE1 TYR A 162 3.771 -9.323 5.735 1.00 0.00 H new ATOM 0 HE2 TYR A 162 0.128 -7.209 4.764 1.00 0.00 H new ATOM 0 HH TYR A 162 0.409 -8.415 6.633 1.00 0.00 H new ATOM 690 N TYR A 163 6.665 -4.919 1.370 1.00 0.00 N ATOM 691 CA TYR A 163 7.624 -4.530 0.339 1.00 0.00 C ATOM 692 C TYR A 163 8.711 -5.597 0.228 1.00 0.00 C ATOM 693 O TYR A 163 8.880 -6.403 1.148 1.00 0.00 O ATOM 694 CB TYR A 163 8.218 -3.155 0.672 1.00 0.00 C ATOM 695 CG TYR A 163 8.542 -2.895 2.137 1.00 0.00 C ATOM 696 CD1 TYR A 163 9.750 -3.347 2.704 1.00 0.00 C ATOM 697 CD2 TYR A 163 7.631 -2.171 2.930 1.00 0.00 C ATOM 698 CE1 TYR A 163 10.092 -2.994 4.021 1.00 0.00 C ATOM 699 CE2 TYR A 163 7.967 -1.813 4.244 1.00 0.00 C ATOM 700 CZ TYR A 163 9.219 -2.185 4.779 1.00 0.00 C ATOM 701 OH TYR A 163 9.571 -1.727 6.011 1.00 0.00 O ATOM 0 H TYR A 163 7.070 -5.530 2.079 1.00 0.00 H new ATOM 0 HA TYR A 163 7.122 -4.452 -0.625 1.00 0.00 H new ATOM 0 HB2 TYR A 163 9.132 -3.028 0.092 1.00 0.00 H new ATOM 0 HB3 TYR A 163 7.518 -2.390 0.336 1.00 0.00 H new ATOM 0 HD1 TYR A 163 10.417 -3.968 2.124 1.00 0.00 H new ATOM 0 HD2 TYR A 163 6.670 -1.890 2.525 1.00 0.00 H new ATOM 0 HE1 TYR A 163 11.020 -3.341 4.451 1.00 0.00 H new ATOM 0 HE2 TYR A 163 7.267 -1.253 4.846 1.00 0.00 H new ATOM 0 HH TYR A 163 10.022 -0.862 5.922 1.00 0.00 H new ATOM 711 N ARG A 164 9.479 -5.605 -0.866 1.00 0.00 N ATOM 712 CA ARG A 164 10.810 -6.221 -0.827 1.00 0.00 C ATOM 713 C ARG A 164 11.847 -5.216 -0.335 1.00 0.00 C ATOM 714 O ARG A 164 11.609 -4.006 -0.440 1.00 0.00 O ATOM 715 CB ARG A 164 11.222 -6.787 -2.197 1.00 0.00 C ATOM 716 CG ARG A 164 10.946 -8.290 -2.231 1.00 0.00 C ATOM 717 CD ARG A 164 11.768 -9.070 -3.254 1.00 0.00 C ATOM 718 NE ARG A 164 11.489 -8.666 -4.639 1.00 0.00 N ATOM 719 CZ ARG A 164 12.374 -8.176 -5.515 1.00 0.00 C ATOM 720 NH1 ARG A 164 13.551 -7.700 -5.125 1.00 0.00 N ATOM 721 NH2 ARG A 164 12.053 -8.182 -6.801 1.00 0.00 N ATOM 0 H ARG A 164 9.213 -5.204 -1.766 1.00 0.00 H new ATOM 0 HA ARG A 164 10.763 -7.056 -0.128 1.00 0.00 H new ATOM 0 HB2 ARG A 164 10.668 -6.287 -2.991 1.00 0.00 H new ATOM 0 HB3 ARG A 164 12.280 -6.596 -2.378 1.00 0.00 H new ATOM 0 HG2 ARG A 164 11.138 -8.703 -1.241 1.00 0.00 H new ATOM 0 HG3 ARG A 164 9.888 -8.446 -2.441 1.00 0.00 H new ATOM 0 HD2 ARG A 164 12.828 -8.927 -3.046 1.00 0.00 H new ATOM 0 HD3 ARG A 164 11.562 -10.135 -3.143 1.00 0.00 H new ATOM 0 HE ARG A 164 10.528 -8.769 -4.964 1.00 0.00 H new ATOM 0 HH11 ARG A 164 13.799 -7.702 -4.136 1.00 0.00 H new ATOM 0 HH12 ARG A 164 14.206 -7.333 -5.815 1.00 0.00 H new ATOM 0 HH21 ARG A 164 11.151 -8.554 -7.100 1.00 0.00 H new ATOM 0 HH22 ARG A 164 12.708 -7.815 -7.492 1.00 0.00 H new ATOM 735 N PRO A 165 13.009 -5.717 0.124 1.00 0.00 N ATOM 736 CA PRO A 165 14.013 -4.881 0.748 1.00 0.00 C ATOM 737 C PRO A 165 14.561 -3.924 -0.286 1.00 0.00 C ATOM 738 O PRO A 165 14.533 -4.195 -1.490 1.00 0.00 O ATOM 739 CB PRO A 165 15.065 -5.819 1.350 1.00 0.00 C ATOM 740 CG PRO A 165 14.888 -7.127 0.580 1.00 0.00 C ATOM 741 CD PRO A 165 13.426 -7.112 0.129 1.00 0.00 C ATOM 0 HA PRO A 165 13.617 -4.261 1.552 1.00 0.00 H new ATOM 0 HB2 PRO A 165 16.071 -5.419 1.228 1.00 0.00 H new ATOM 0 HB3 PRO A 165 14.906 -5.962 2.419 1.00 0.00 H new ATOM 0 HG2 PRO A 165 15.566 -7.181 -0.272 1.00 0.00 H new ATOM 0 HG3 PRO A 165 15.100 -7.990 1.211 1.00 0.00 H new ATOM 0 HD2 PRO A 165 13.322 -7.552 -0.863 1.00 0.00 H new ATOM 0 HD3 PRO A 165 12.805 -7.700 0.805 1.00 0.00 H new ATOM 749 N VAL A 166 15.021 -2.773 0.188 1.00 0.00 N ATOM 750 CA VAL A 166 15.526 -1.758 -0.702 1.00 0.00 C ATOM 751 C VAL A 166 16.895 -2.242 -1.162 1.00 0.00 C ATOM 752 O VAL A 166 17.826 -2.416 -0.373 1.00 0.00 O ATOM 753 CB VAL A 166 15.469 -0.361 -0.070 1.00 0.00 C ATOM 754 CG1 VAL A 166 15.980 0.714 -1.031 1.00 0.00 C ATOM 755 CG2 VAL A 166 14.004 0.004 0.214 1.00 0.00 C ATOM 0 H VAL A 166 15.051 -2.528 1.178 1.00 0.00 H new ATOM 0 HA VAL A 166 14.904 -1.622 -1.587 1.00 0.00 H new ATOM 0 HB VAL A 166 16.082 -0.392 0.831 1.00 0.00 H new ATOM 0 HG11 VAL A 166 15.924 1.690 -0.548 1.00 0.00 H new ATOM 0 HG12 VAL A 166 17.015 0.500 -1.299 1.00 0.00 H new ATOM 0 HG13 VAL A 166 15.366 0.719 -1.931 1.00 0.00 H new ATOM 0 HG21 VAL A 166 13.957 0.996 0.663 1.00 0.00 H new ATOM 0 HG22 VAL A 166 13.441 0.001 -0.719 1.00 0.00 H new ATOM 0 HG23 VAL A 166 13.574 -0.726 0.900 1.00 0.00 H new ATOM 765 N ASP A 167 16.971 -2.531 -2.452 1.00 0.00 N ATOM 766 CA ASP A 167 18.173 -2.850 -3.194 1.00 0.00 C ATOM 767 C ASP A 167 18.420 -1.743 -4.228 1.00 0.00 C ATOM 768 O ASP A 167 17.685 -0.752 -4.308 1.00 0.00 O ATOM 769 CB ASP A 167 18.108 -4.285 -3.771 1.00 0.00 C ATOM 770 CG ASP A 167 17.221 -4.480 -5.006 1.00 0.00 C ATOM 771 OD1 ASP A 167 17.428 -3.766 -6.006 1.00 0.00 O ATOM 772 OD2 ASP A 167 16.383 -5.411 -5.046 1.00 0.00 O ATOM 0 H ASP A 167 16.140 -2.549 -3.043 1.00 0.00 H new ATOM 0 HA ASP A 167 19.044 -2.868 -2.540 1.00 0.00 H new ATOM 0 HB2 ASP A 167 19.121 -4.598 -4.024 1.00 0.00 H new ATOM 0 HB3 ASP A 167 17.754 -4.954 -2.986 1.00 0.00 H new ATOM 777 N GLN A 168 19.478 -1.916 -5.016 1.00 0.00 N ATOM 778 CA GLN A 168 19.958 -1.066 -6.112 1.00 0.00 C ATOM 779 C GLN A 168 18.883 -0.639 -7.133 1.00 0.00 C ATOM 780 O GLN A 168 19.104 0.288 -7.914 1.00 0.00 O ATOM 781 CB GLN A 168 21.114 -1.814 -6.798 1.00 0.00 C ATOM 782 CG GLN A 168 20.662 -3.159 -7.403 1.00 0.00 C ATOM 783 CD GLN A 168 21.770 -4.197 -7.404 1.00 0.00 C ATOM 784 OE1 GLN A 168 22.079 -4.742 -6.345 1.00 0.00 O ATOM 785 NE2 GLN A 168 22.395 -4.439 -8.540 1.00 0.00 N ATOM 0 H GLN A 168 20.080 -2.730 -4.895 1.00 0.00 H new ATOM 0 HA GLN A 168 20.285 -0.120 -5.679 1.00 0.00 H new ATOM 0 HB2 GLN A 168 21.534 -1.187 -7.584 1.00 0.00 H new ATOM 0 HB3 GLN A 168 21.909 -1.992 -6.074 1.00 0.00 H new ATOM 0 HG2 GLN A 168 19.812 -3.540 -6.838 1.00 0.00 H new ATOM 0 HG3 GLN A 168 20.319 -2.997 -8.425 1.00 0.00 H new ATOM 0 HE21 GLN A 168 22.104 -3.963 -9.394 1.00 0.00 H new ATOM 0 HE22 GLN A 168 23.170 -5.102 -8.565 1.00 0.00 H new ATOM 794 N ALA A 169 17.735 -1.305 -7.165 1.00 0.00 N ATOM 795 CA ALA A 169 16.664 -1.192 -8.151 1.00 0.00 C ATOM 796 C ALA A 169 15.286 -1.028 -7.503 1.00 0.00 C ATOM 797 O ALA A 169 14.299 -0.873 -8.224 1.00 0.00 O ATOM 798 CB ALA A 169 16.673 -2.400 -9.093 1.00 0.00 C ATOM 0 H ALA A 169 17.510 -1.993 -6.446 1.00 0.00 H new ATOM 0 HA ALA A 169 16.855 -0.287 -8.728 1.00 0.00 H new ATOM 0 HB1 ALA A 169 15.868 -2.299 -9.821 1.00 0.00 H new ATOM 0 HB2 ALA A 169 17.630 -2.449 -9.613 1.00 0.00 H new ATOM 0 HB3 ALA A 169 16.527 -3.313 -8.515 1.00 0.00 H new ATOM 804 N SER A 170 15.195 -0.973 -6.176 1.00 0.00 N ATOM 805 CA SER A 170 13.963 -0.744 -5.426 1.00 0.00 C ATOM 806 C SER A 170 13.518 0.715 -5.479 1.00 0.00 C ATOM 807 O SER A 170 13.013 1.234 -4.492 1.00 0.00 O ATOM 808 CB SER A 170 14.200 -1.137 -3.971 1.00 0.00 C ATOM 809 OG SER A 170 14.323 -2.537 -3.860 1.00 0.00 O ATOM 0 H SER A 170 16.008 -1.091 -5.571 1.00 0.00 H new ATOM 0 HA SER A 170 13.175 -1.347 -5.877 1.00 0.00 H new ATOM 0 HB2 SER A 170 15.104 -0.654 -3.599 1.00 0.00 H new ATOM 0 HB3 SER A 170 13.374 -0.787 -3.353 1.00 0.00 H new ATOM 0 HG SER A 170 13.722 -2.864 -3.159 1.00 0.00 H new ATOM 815 N ASN A 171 13.722 1.406 -6.601 1.00 0.00 N ATOM 816 CA ASN A 171 13.303 2.791 -6.785 1.00 0.00 C ATOM 817 C ASN A 171 11.844 2.923 -6.378 1.00 0.00 C ATOM 818 O ASN A 171 11.084 1.979 -6.602 1.00 0.00 O ATOM 819 CB ASN A 171 13.319 3.208 -8.277 1.00 0.00 C ATOM 820 CG ASN A 171 14.526 2.862 -9.126 1.00 0.00 C ATOM 821 OD1 ASN A 171 14.633 1.621 -9.565 1.00 0.00 O flip ATOM 822 ND2 ASN A 171 15.322 3.713 -9.507 1.00 0.00 N flip ATOM 0 H ASN A 171 14.190 1.012 -7.417 1.00 0.00 H new ATOM 0 HA ASN A 171 13.987 3.404 -6.197 1.00 0.00 H new ATOM 0 HB2 ASN A 171 12.445 2.763 -8.752 1.00 0.00 H new ATOM 0 HB3 ASN A 171 13.188 4.289 -8.317 1.00 0.00 H new ATOM 0 HD21 ASN A 171 15.243 4.673 -9.170 1.00 0.00 H new ATOM 0 HD22 ASN A 171 16.063 3.461 -10.161 1.00 0.00 H new ATOM 829 N GLN A 172 11.426 4.118 -5.941 1.00 0.00 N ATOM 830 CA GLN A 172 10.063 4.332 -5.465 1.00 0.00 C ATOM 831 C GLN A 172 9.039 3.817 -6.473 1.00 0.00 C ATOM 832 O GLN A 172 8.089 3.183 -6.049 1.00 0.00 O ATOM 833 CB GLN A 172 9.807 5.794 -5.078 1.00 0.00 C ATOM 834 CG GLN A 172 8.388 6.007 -4.538 1.00 0.00 C ATOM 835 CD GLN A 172 8.215 7.325 -3.790 1.00 0.00 C ATOM 836 OE1 GLN A 172 8.322 7.318 -2.472 1.00 0.00 O flip ATOM 837 NE2 GLN A 172 7.990 8.379 -4.382 1.00 0.00 N flip ATOM 0 H GLN A 172 12.017 4.949 -5.909 1.00 0.00 H new ATOM 0 HA GLN A 172 9.943 3.749 -4.552 1.00 0.00 H new ATOM 0 HB2 GLN A 172 10.531 6.101 -4.324 1.00 0.00 H new ATOM 0 HB3 GLN A 172 9.963 6.432 -5.948 1.00 0.00 H new ATOM 0 HG2 GLN A 172 7.683 5.974 -5.368 1.00 0.00 H new ATOM 0 HG3 GLN A 172 8.134 5.183 -3.871 1.00 0.00 H new ATOM 0 HE21 GLN A 172 7.907 8.385 -5.399 1.00 0.00 H new ATOM 0 HE22 GLN A 172 7.886 9.247 -3.856 1.00 0.00 H new ATOM 846 N ASN A 173 9.275 3.979 -7.777 1.00 0.00 N ATOM 847 CA ASN A 173 8.453 3.433 -8.843 1.00 0.00 C ATOM 848 C ASN A 173 8.183 1.938 -8.651 1.00 0.00 C ATOM 849 O ASN A 173 7.037 1.506 -8.560 1.00 0.00 O ATOM 850 CB ASN A 173 9.166 3.675 -10.183 1.00 0.00 C ATOM 851 CG ASN A 173 8.422 4.638 -11.093 1.00 0.00 C ATOM 852 OD1 ASN A 173 8.839 5.782 -11.249 1.00 0.00 O ATOM 853 ND2 ASN A 173 7.320 4.248 -11.693 1.00 0.00 N ATOM 0 H ASN A 173 10.072 4.513 -8.124 1.00 0.00 H new ATOM 0 HA ASN A 173 7.486 3.935 -8.829 1.00 0.00 H new ATOM 0 HB2 ASN A 173 10.165 4.066 -9.990 1.00 0.00 H new ATOM 0 HB3 ASN A 173 9.291 2.722 -10.698 1.00 0.00 H new ATOM 0 HD21 ASN A 173 6.808 4.897 -12.291 1.00 0.00 H new ATOM 0 HD22 ASN A 173 6.977 3.297 -11.561 1.00 0.00 H new ATOM 860 N ASN A 174 9.244 1.127 -8.617 1.00 0.00 N ATOM 861 CA ASN A 174 9.120 -0.329 -8.555 1.00 0.00 C ATOM 862 C ASN A 174 8.741 -0.802 -7.171 1.00 0.00 C ATOM 863 O ASN A 174 8.170 -1.875 -7.040 1.00 0.00 O ATOM 864 CB ASN A 174 10.436 -1.039 -8.883 1.00 0.00 C ATOM 865 CG ASN A 174 11.036 -0.565 -10.178 1.00 0.00 C ATOM 866 OD1 ASN A 174 10.350 -0.311 -11.160 1.00 0.00 O ATOM 867 ND2 ASN A 174 12.329 -0.344 -10.175 1.00 0.00 N ATOM 0 H ASN A 174 10.208 1.461 -8.632 1.00 0.00 H new ATOM 0 HA ASN A 174 8.350 -0.572 -9.287 1.00 0.00 H new ATOM 0 HB2 ASN A 174 11.147 -0.872 -8.074 1.00 0.00 H new ATOM 0 HB3 ASN A 174 10.262 -2.114 -8.938 1.00 0.00 H new ATOM 0 HD21 ASN A 174 12.782 0.047 -11.001 1.00 0.00 H new ATOM 0 HD22 ASN A 174 12.882 -0.563 -9.346 1.00 0.00 H new ATOM 874 N PHE A 175 9.127 -0.038 -6.160 1.00 0.00 N ATOM 875 CA PHE A 175 8.868 -0.302 -4.763 1.00 0.00 C ATOM 876 C PHE A 175 7.379 -0.155 -4.561 1.00 0.00 C ATOM 877 O PHE A 175 6.742 -1.089 -4.120 1.00 0.00 O ATOM 878 CB PHE A 175 9.651 0.675 -3.884 1.00 0.00 C ATOM 879 CG PHE A 175 9.556 0.432 -2.391 1.00 0.00 C ATOM 880 CD1 PHE A 175 8.493 0.974 -1.639 1.00 0.00 C ATOM 881 CD2 PHE A 175 10.581 -0.277 -1.735 1.00 0.00 C ATOM 882 CE1 PHE A 175 8.473 0.822 -0.240 1.00 0.00 C ATOM 883 CE2 PHE A 175 10.552 -0.436 -0.339 1.00 0.00 C ATOM 884 CZ PHE A 175 9.503 0.122 0.412 1.00 0.00 C ATOM 0 H PHE A 175 9.654 0.823 -6.305 1.00 0.00 H new ATOM 0 HA PHE A 175 9.190 -1.304 -4.481 1.00 0.00 H new ATOM 0 HB2 PHE A 175 10.701 0.636 -4.174 1.00 0.00 H new ATOM 0 HB3 PHE A 175 9.300 1.686 -4.093 1.00 0.00 H new ATOM 0 HD1 PHE A 175 7.695 1.505 -2.136 1.00 0.00 H new ATOM 0 HD2 PHE A 175 11.393 -0.700 -2.307 1.00 0.00 H new ATOM 0 HE1 PHE A 175 7.663 1.245 0.335 1.00 0.00 H new ATOM 0 HE2 PHE A 175 11.337 -0.988 0.157 1.00 0.00 H new ATOM 0 HZ PHE A 175 9.488 0.013 1.486 1.00 0.00 H new ATOM 894 N VAL A 176 6.798 0.986 -4.926 1.00 0.00 N ATOM 895 CA VAL A 176 5.366 1.237 -4.919 1.00 0.00 C ATOM 896 C VAL A 176 4.659 0.207 -5.811 1.00 0.00 C ATOM 897 O VAL A 176 3.603 -0.286 -5.416 1.00 0.00 O ATOM 898 CB VAL A 176 5.130 2.712 -5.310 1.00 0.00 C ATOM 899 CG1 VAL A 176 3.674 3.050 -5.600 1.00 0.00 C ATOM 900 CG2 VAL A 176 5.597 3.641 -4.169 1.00 0.00 C ATOM 0 H VAL A 176 7.337 1.790 -5.247 1.00 0.00 H new ATOM 0 HA VAL A 176 4.928 1.105 -3.930 1.00 0.00 H new ATOM 0 HB VAL A 176 5.702 2.862 -6.226 1.00 0.00 H new ATOM 0 HG11 VAL A 176 3.591 4.104 -5.867 1.00 0.00 H new ATOM 0 HG12 VAL A 176 3.316 2.437 -6.427 1.00 0.00 H new ATOM 0 HG13 VAL A 176 3.071 2.852 -4.714 1.00 0.00 H new ATOM 0 HG21 VAL A 176 5.427 4.680 -4.453 1.00 0.00 H new ATOM 0 HG22 VAL A 176 5.034 3.416 -3.263 1.00 0.00 H new ATOM 0 HG23 VAL A 176 6.660 3.485 -3.984 1.00 0.00 H new ATOM 910 N HIS A 177 5.232 -0.164 -6.964 1.00 0.00 N ATOM 911 CA HIS A 177 4.686 -1.243 -7.780 1.00 0.00 C ATOM 912 C HIS A 177 4.622 -2.554 -6.990 1.00 0.00 C ATOM 913 O HIS A 177 3.542 -3.109 -6.849 1.00 0.00 O ATOM 914 CB HIS A 177 5.433 -1.357 -9.110 1.00 0.00 C ATOM 915 CG HIS A 177 4.678 -2.228 -10.072 1.00 0.00 C ATOM 916 ND1 HIS A 177 3.758 -1.803 -10.995 1.00 0.00 N ATOM 917 CD2 HIS A 177 4.612 -3.587 -10.015 1.00 0.00 C ATOM 918 CE1 HIS A 177 3.162 -2.899 -11.493 1.00 0.00 C ATOM 919 NE2 HIS A 177 3.685 -4.027 -10.964 1.00 0.00 N ATOM 0 H HIS A 177 6.072 0.270 -7.347 1.00 0.00 H new ATOM 0 HA HIS A 177 3.655 -1.003 -8.038 1.00 0.00 H new ATOM 0 HB2 HIS A 177 5.571 -0.365 -9.541 1.00 0.00 H new ATOM 0 HB3 HIS A 177 6.427 -1.771 -8.940 1.00 0.00 H new ATOM 0 HD2 HIS A 177 5.180 -4.219 -9.348 1.00 0.00 H new ATOM 0 HE1 HIS A 177 2.366 -2.881 -12.223 1.00 0.00 H new ATOM 0 HE2 HIS A 177 3.453 -4.991 -11.205 1.00 0.00 H new ATOM 927 N ASP A 178 5.738 -3.079 -6.475 1.00 0.00 N ATOM 928 CA ASP A 178 5.781 -4.320 -5.695 1.00 0.00 C ATOM 929 C ASP A 178 4.853 -4.222 -4.502 1.00 0.00 C ATOM 930 O ASP A 178 4.014 -5.089 -4.294 1.00 0.00 O ATOM 931 CB ASP A 178 7.229 -4.708 -5.295 1.00 0.00 C ATOM 932 CG ASP A 178 7.721 -4.516 -3.846 1.00 0.00 C ATOM 933 OD1 ASP A 178 7.052 -5.039 -2.934 1.00 0.00 O ATOM 934 OD2 ASP A 178 8.841 -3.988 -3.646 1.00 0.00 O ATOM 0 H ASP A 178 6.654 -2.645 -6.591 1.00 0.00 H new ATOM 0 HA ASP A 178 5.423 -5.133 -6.327 1.00 0.00 H new ATOM 0 HB2 ASP A 178 7.359 -5.762 -5.541 1.00 0.00 H new ATOM 0 HB3 ASP A 178 7.903 -4.144 -5.940 1.00 0.00 H new ATOM 939 N CYS A 179 4.956 -3.106 -3.808 1.00 0.00 N ATOM 940 CA CYS A 179 4.226 -2.791 -2.605 1.00 0.00 C ATOM 941 C CYS A 179 2.720 -2.835 -2.797 1.00 0.00 C ATOM 942 O CYS A 179 2.042 -3.619 -2.132 1.00 0.00 O ATOM 943 CB CYS A 179 4.679 -1.425 -2.128 1.00 0.00 C ATOM 944 SG CYS A 179 3.807 -0.811 -0.703 1.00 0.00 S ATOM 0 H CYS A 179 5.588 -2.356 -4.088 1.00 0.00 H new ATOM 0 HA CYS A 179 4.443 -3.551 -1.854 1.00 0.00 H new ATOM 0 HB2 CYS A 179 5.743 -1.470 -1.895 1.00 0.00 H new ATOM 0 HB3 CYS A 179 4.562 -0.712 -2.944 1.00 0.00 H new ATOM 949 N VAL A 180 2.175 -1.982 -3.661 1.00 0.00 N ATOM 950 CA VAL A 180 0.738 -1.873 -3.857 1.00 0.00 C ATOM 951 C VAL A 180 0.206 -3.201 -4.404 1.00 0.00 C ATOM 952 O VAL A 180 -0.894 -3.612 -4.055 1.00 0.00 O ATOM 953 CB VAL A 180 0.419 -0.671 -4.772 1.00 0.00 C ATOM 954 CG1 VAL A 180 -1.090 -0.502 -4.951 1.00 0.00 C ATOM 955 CG2 VAL A 180 0.961 0.690 -4.288 1.00 0.00 C ATOM 0 H VAL A 180 2.721 -1.348 -4.244 1.00 0.00 H new ATOM 0 HA VAL A 180 0.233 -1.683 -2.910 1.00 0.00 H new ATOM 0 HB VAL A 180 0.925 -0.924 -5.704 1.00 0.00 H new ATOM 0 HG11 VAL A 180 -1.286 0.352 -5.600 1.00 0.00 H new ATOM 0 HG12 VAL A 180 -1.506 -1.403 -5.401 1.00 0.00 H new ATOM 0 HG13 VAL A 180 -1.555 -0.334 -3.980 1.00 0.00 H new ATOM 0 HG21 VAL A 180 0.683 1.467 -5.000 1.00 0.00 H new ATOM 0 HG22 VAL A 180 0.537 0.924 -3.312 1.00 0.00 H new ATOM 0 HG23 VAL A 180 2.047 0.642 -4.209 1.00 0.00 H new ATOM 965 N ASN A 181 0.991 -3.899 -5.219 1.00 0.00 N ATOM 966 CA ASN A 181 0.654 -5.185 -5.812 1.00 0.00 C ATOM 967 C ASN A 181 0.523 -6.239 -4.712 1.00 0.00 C ATOM 968 O ASN A 181 -0.540 -6.835 -4.535 1.00 0.00 O ATOM 969 CB ASN A 181 1.775 -5.475 -6.807 1.00 0.00 C ATOM 970 CG ASN A 181 1.725 -6.742 -7.621 1.00 0.00 C ATOM 971 OD1 ASN A 181 0.897 -7.632 -7.484 1.00 0.00 O ATOM 972 ND2 ASN A 181 2.715 -6.859 -8.485 1.00 0.00 N ATOM 0 H ASN A 181 1.916 -3.569 -5.494 1.00 0.00 H new ATOM 0 HA ASN A 181 -0.305 -5.190 -6.330 1.00 0.00 H new ATOM 0 HB2 ASN A 181 1.819 -4.638 -7.504 1.00 0.00 H new ATOM 0 HB3 ASN A 181 2.713 -5.478 -6.252 1.00 0.00 H new ATOM 0 HD21 ASN A 181 2.799 -7.702 -9.053 1.00 0.00 H new ATOM 0 HD22 ASN A 181 3.396 -6.106 -8.585 1.00 0.00 H new ATOM 979 N ILE A 182 1.587 -6.450 -3.934 1.00 0.00 N ATOM 980 CA ILE A 182 1.648 -7.512 -2.944 1.00 0.00 C ATOM 981 C ILE A 182 0.789 -7.197 -1.714 1.00 0.00 C ATOM 982 O ILE A 182 0.145 -8.111 -1.207 1.00 0.00 O ATOM 983 CB ILE A 182 3.116 -7.890 -2.635 1.00 0.00 C ATOM 984 CG1 ILE A 182 3.609 -9.026 -3.558 1.00 0.00 C ATOM 985 CG2 ILE A 182 3.355 -8.274 -1.170 1.00 0.00 C ATOM 986 CD1 ILE A 182 3.912 -8.540 -4.969 1.00 0.00 C ATOM 0 H ILE A 182 2.433 -5.882 -3.978 1.00 0.00 H new ATOM 0 HA ILE A 182 1.197 -8.412 -3.361 1.00 0.00 H new ATOM 0 HB ILE A 182 3.694 -6.986 -2.828 1.00 0.00 H new ATOM 0 HG12 ILE A 182 4.506 -9.474 -3.131 1.00 0.00 H new ATOM 0 HG13 ILE A 182 2.852 -9.809 -3.601 1.00 0.00 H new ATOM 0 HG21 ILE A 182 4.406 -8.527 -1.027 1.00 0.00 H new ATOM 0 HG22 ILE A 182 3.093 -7.434 -0.526 1.00 0.00 H new ATOM 0 HG23 ILE A 182 2.737 -9.134 -0.914 1.00 0.00 H new ATOM 0 HD11 ILE A 182 4.255 -9.378 -5.577 1.00 0.00 H new ATOM 0 HD12 ILE A 182 3.009 -8.117 -5.410 1.00 0.00 H new ATOM 0 HD13 ILE A 182 4.689 -7.777 -4.932 1.00 0.00 H new ATOM 998 N THR A 183 0.741 -5.957 -1.221 1.00 0.00 N ATOM 999 CA THR A 183 -0.044 -5.601 -0.032 1.00 0.00 C ATOM 1000 C THR A 183 -1.529 -5.904 -0.260 1.00 0.00 C ATOM 1001 O THR A 183 -2.224 -6.394 0.636 1.00 0.00 O ATOM 1002 CB THR A 183 0.176 -4.114 0.299 1.00 0.00 C ATOM 1003 OG1 THR A 183 1.547 -3.884 0.534 1.00 0.00 O ATOM 1004 CG2 THR A 183 -0.591 -3.650 1.540 1.00 0.00 C ATOM 0 H THR A 183 1.244 -5.171 -1.633 1.00 0.00 H new ATOM 0 HA THR A 183 0.288 -6.201 0.815 1.00 0.00 H new ATOM 0 HB THR A 183 -0.194 -3.552 -0.559 1.00 0.00 H new ATOM 0 HG1 THR A 183 2.004 -3.731 -0.319 1.00 0.00 H new ATOM 0 HG21 THR A 183 -0.392 -2.593 1.717 1.00 0.00 H new ATOM 0 HG22 THR A 183 -1.660 -3.796 1.383 1.00 0.00 H new ATOM 0 HG23 THR A 183 -0.268 -4.230 2.405 1.00 0.00 H new ATOM 1012 N ILE A 184 -2.000 -5.630 -1.474 1.00 0.00 N ATOM 1013 CA ILE A 184 -3.313 -6.008 -1.975 1.00 0.00 C ATOM 1014 C ILE A 184 -3.311 -7.537 -2.020 1.00 0.00 C ATOM 1015 O ILE A 184 -3.987 -8.143 -1.198 1.00 0.00 O ATOM 1016 CB ILE A 184 -3.567 -5.246 -3.296 1.00 0.00 C ATOM 1017 CG1 ILE A 184 -3.743 -3.772 -2.867 1.00 0.00 C ATOM 1018 CG2 ILE A 184 -4.787 -5.692 -4.114 1.00 0.00 C ATOM 1019 CD1 ILE A 184 -3.874 -2.739 -3.978 1.00 0.00 C ATOM 0 H ILE A 184 -1.451 -5.116 -2.163 1.00 0.00 H new ATOM 0 HA ILE A 184 -4.163 -5.724 -1.355 1.00 0.00 H new ATOM 0 HB ILE A 184 -2.731 -5.437 -3.969 1.00 0.00 H new ATOM 0 HG12 ILE A 184 -4.630 -3.706 -2.237 1.00 0.00 H new ATOM 0 HG13 ILE A 184 -2.890 -3.496 -2.247 1.00 0.00 H new ATOM 0 HG21 ILE A 184 -4.861 -5.086 -5.017 1.00 0.00 H new ATOM 0 HG22 ILE A 184 -4.677 -6.741 -4.390 1.00 0.00 H new ATOM 0 HG23 ILE A 184 -5.691 -5.567 -3.517 1.00 0.00 H new ATOM 0 HD11 ILE A 184 -3.992 -1.747 -3.541 1.00 0.00 H new ATOM 0 HD12 ILE A 184 -2.979 -2.758 -4.600 1.00 0.00 H new ATOM 0 HD13 ILE A 184 -4.746 -2.971 -4.590 1.00 0.00 H new ATOM 1031 N LYS A 185 -2.484 -8.195 -2.844 1.00 0.00 N ATOM 1032 CA LYS A 185 -2.429 -9.649 -2.981 1.00 0.00 C ATOM 1033 C LYS A 185 -2.268 -10.443 -1.678 1.00 0.00 C ATOM 1034 O LYS A 185 -2.434 -11.658 -1.696 1.00 0.00 O ATOM 1035 CB LYS A 185 -1.324 -10.000 -3.968 1.00 0.00 C ATOM 1036 CG LYS A 185 -1.836 -9.868 -5.401 1.00 0.00 C ATOM 1037 CD LYS A 185 -0.725 -10.128 -6.407 1.00 0.00 C ATOM 1038 CE LYS A 185 -0.398 -11.619 -6.530 1.00 0.00 C ATOM 1039 NZ LYS A 185 0.629 -11.863 -7.560 1.00 0.00 N ATOM 0 H LYS A 185 -1.818 -7.713 -3.448 1.00 0.00 H new ATOM 0 HA LYS A 185 -3.410 -9.954 -3.346 1.00 0.00 H new ATOM 0 HB2 LYS A 185 -0.469 -9.341 -3.817 1.00 0.00 H new ATOM 0 HB3 LYS A 185 -0.977 -11.018 -3.790 1.00 0.00 H new ATOM 0 HG2 LYS A 185 -2.651 -10.573 -5.565 1.00 0.00 H new ATOM 0 HG3 LYS A 185 -2.243 -8.868 -5.554 1.00 0.00 H new ATOM 0 HD2 LYS A 185 -1.021 -9.740 -7.382 1.00 0.00 H new ATOM 0 HD3 LYS A 185 0.171 -9.584 -6.106 1.00 0.00 H new ATOM 0 HE2 LYS A 185 -0.048 -11.996 -5.569 1.00 0.00 H new ATOM 0 HE3 LYS A 185 -1.304 -12.172 -6.779 1.00 0.00 H new ATOM 0 HZ1 LYS A 185 0.827 -12.882 -7.618 1.00 0.00 H new ATOM 0 HZ2 LYS A 185 0.284 -11.524 -8.481 1.00 0.00 H new ATOM 0 HZ3 LYS A 185 1.501 -11.355 -7.308 1.00 0.00 H new ATOM 1053 N GLN A 186 -1.923 -9.821 -0.552 1.00 0.00 N ATOM 1054 CA GLN A 186 -2.227 -10.344 0.767 1.00 0.00 C ATOM 1055 C GLN A 186 -3.731 -10.208 0.989 1.00 0.00 C ATOM 1056 O GLN A 186 -4.471 -11.098 0.572 1.00 0.00 O ATOM 1057 CB GLN A 186 -1.307 -9.695 1.831 1.00 0.00 C ATOM 1058 CG GLN A 186 0.190 -10.028 1.670 1.00 0.00 C ATOM 1059 CD GLN A 186 0.443 -11.513 1.421 1.00 0.00 C ATOM 1060 OE1 GLN A 186 0.220 -11.968 0.196 1.00 0.00 O flip ATOM 1061 NE2 GLN A 186 0.803 -12.275 2.309 1.00 0.00 N flip ATOM 0 H GLN A 186 -1.421 -8.933 -0.536 1.00 0.00 H new ATOM 0 HA GLN A 186 -2.004 -11.407 0.861 1.00 0.00 H new ATOM 0 HB2 GLN A 186 -1.432 -8.613 1.790 1.00 0.00 H new ATOM 0 HB3 GLN A 186 -1.633 -10.016 2.820 1.00 0.00 H new ATOM 0 HG2 GLN A 186 0.599 -9.451 0.841 1.00 0.00 H new ATOM 0 HG3 GLN A 186 0.725 -9.719 2.568 1.00 0.00 H new ATOM 0 HE21 GLN A 186 0.973 -11.918 3.249 1.00 0.00 H new ATOM 0 HE22 GLN A 186 0.933 -13.267 2.108 1.00 0.00 H new ATOM 1070 N HIS A 187 -4.207 -9.123 1.601 1.00 0.00 N ATOM 1071 CA HIS A 187 -5.546 -9.094 2.194 1.00 0.00 C ATOM 1072 C HIS A 187 -6.707 -9.047 1.178 1.00 0.00 C ATOM 1073 O HIS A 187 -7.876 -9.055 1.554 1.00 0.00 O ATOM 1074 CB HIS A 187 -5.582 -8.031 3.298 1.00 0.00 C ATOM 1075 CG HIS A 187 -6.182 -6.690 2.982 1.00 0.00 C ATOM 1076 ND1 HIS A 187 -6.785 -5.888 3.925 1.00 0.00 N ATOM 1077 CD2 HIS A 187 -6.209 -6.032 1.778 1.00 0.00 C ATOM 1078 CE1 HIS A 187 -7.200 -4.780 3.302 1.00 0.00 C ATOM 1079 NE2 HIS A 187 -6.867 -4.827 2.004 1.00 0.00 N ATOM 0 H HIS A 187 -3.686 -8.252 1.699 1.00 0.00 H new ATOM 0 HA HIS A 187 -5.736 -10.059 2.664 1.00 0.00 H new ATOM 0 HB2 HIS A 187 -6.130 -8.449 4.143 1.00 0.00 H new ATOM 0 HB3 HIS A 187 -4.558 -7.866 3.633 1.00 0.00 H new ATOM 0 HD2 HIS A 187 -5.801 -6.380 0.841 1.00 0.00 H new ATOM 0 HE1 HIS A 187 -7.727 -3.965 3.776 1.00 0.00 H new ATOM 0 HE2 HIS A 187 -7.061 -4.108 1.307 1.00 0.00 H new ATOM 1087 N THR A 188 -6.394 -9.038 -0.111 1.00 0.00 N ATOM 1088 CA THR A 188 -7.295 -9.124 -1.248 1.00 0.00 C ATOM 1089 C THR A 188 -7.397 -10.560 -1.756 1.00 0.00 C ATOM 1090 O THR A 188 -8.360 -10.877 -2.444 1.00 0.00 O ATOM 1091 CB THR A 188 -6.731 -8.191 -2.328 1.00 0.00 C ATOM 1092 OG1 THR A 188 -6.591 -6.899 -1.772 1.00 0.00 O ATOM 1093 CG2 THR A 188 -7.548 -8.109 -3.608 1.00 0.00 C ATOM 0 H THR A 188 -5.422 -8.964 -0.411 1.00 0.00 H new ATOM 0 HA THR A 188 -8.305 -8.824 -0.969 1.00 0.00 H new ATOM 0 HB THR A 188 -5.775 -8.618 -2.631 1.00 0.00 H new ATOM 0 HG1 THR A 188 -7.253 -6.297 -2.172 1.00 0.00 H new ATOM 0 HG21 THR A 188 -7.065 -7.424 -4.305 1.00 0.00 H new ATOM 0 HG22 THR A 188 -7.617 -9.099 -4.060 1.00 0.00 H new ATOM 0 HG23 THR A 188 -8.549 -7.745 -3.378 1.00 0.00 H new ATOM 1101 N VAL A 189 -6.469 -11.460 -1.431 1.00 0.00 N ATOM 1102 CA VAL A 189 -6.570 -12.873 -1.793 1.00 0.00 C ATOM 1103 C VAL A 189 -6.904 -13.679 -0.539 1.00 0.00 C ATOM 1104 O VAL A 189 -7.734 -14.583 -0.552 1.00 0.00 O ATOM 1105 CB VAL A 189 -5.286 -13.328 -2.524 1.00 0.00 C ATOM 1106 CG1 VAL A 189 -5.415 -14.762 -3.056 1.00 0.00 C ATOM 1107 CG2 VAL A 189 -4.949 -12.426 -3.732 1.00 0.00 C ATOM 0 H VAL A 189 -5.624 -11.229 -0.908 1.00 0.00 H new ATOM 0 HA VAL A 189 -7.380 -13.045 -2.502 1.00 0.00 H new ATOM 0 HB VAL A 189 -4.494 -13.264 -1.778 1.00 0.00 H new ATOM 0 HG11 VAL A 189 -4.493 -15.046 -3.563 1.00 0.00 H new ATOM 0 HG12 VAL A 189 -5.597 -15.443 -2.225 1.00 0.00 H new ATOM 0 HG13 VAL A 189 -6.247 -14.816 -3.758 1.00 0.00 H new ATOM 0 HG21 VAL A 189 -4.039 -12.786 -4.212 1.00 0.00 H new ATOM 0 HG22 VAL A 189 -5.772 -12.453 -4.447 1.00 0.00 H new ATOM 0 HG23 VAL A 189 -4.798 -11.402 -3.391 1.00 0.00 H new ATOM 1117 N THR A 190 -6.380 -13.272 0.607 1.00 0.00 N ATOM 1118 CA THR A 190 -6.504 -13.999 1.867 1.00 0.00 C ATOM 1119 C THR A 190 -7.850 -13.686 2.535 1.00 0.00 C ATOM 1120 O THR A 190 -7.964 -13.722 3.758 1.00 0.00 O ATOM 1121 CB THR A 190 -5.281 -13.726 2.771 1.00 0.00 C ATOM 1122 OG1 THR A 190 -5.188 -12.373 3.168 1.00 0.00 O ATOM 1123 CG2 THR A 190 -3.964 -14.110 2.075 1.00 0.00 C ATOM 0 H THR A 190 -5.844 -12.408 0.692 1.00 0.00 H new ATOM 0 HA THR A 190 -6.503 -15.072 1.675 1.00 0.00 H new ATOM 0 HB THR A 190 -5.433 -14.346 3.654 1.00 0.00 H new ATOM 0 HG1 THR A 190 -4.400 -12.253 3.738 1.00 0.00 H new ATOM 0 HG21 THR A 190 -3.127 -13.904 2.742 1.00 0.00 H new ATOM 0 HG22 THR A 190 -3.979 -15.172 1.829 1.00 0.00 H new ATOM 0 HG23 THR A 190 -3.852 -13.527 1.161 1.00 0.00 H new ATOM 1131 N THR A 191 -8.877 -13.301 1.778 1.00 0.00 N ATOM 1132 CA THR A 191 -10.178 -12.939 2.321 1.00 0.00 C ATOM 1133 C THR A 191 -11.223 -12.953 1.226 1.00 0.00 C ATOM 1134 O THR A 191 -12.322 -13.412 1.483 1.00 0.00 O ATOM 1135 CB THR A 191 -10.187 -11.560 3.018 1.00 0.00 C ATOM 1136 OG1 THR A 191 -8.885 -11.103 3.302 1.00 0.00 O ATOM 1137 CG2 THR A 191 -10.874 -11.661 4.386 1.00 0.00 C ATOM 0 H THR A 191 -8.825 -13.232 0.762 1.00 0.00 H new ATOM 0 HA THR A 191 -10.411 -13.686 3.080 1.00 0.00 H new ATOM 0 HB THR A 191 -10.701 -10.885 2.334 1.00 0.00 H new ATOM 0 HG1 THR A 191 -8.626 -10.423 2.645 1.00 0.00 H new ATOM 0 HG21 THR A 191 -10.874 -10.683 4.866 1.00 0.00 H new ATOM 0 HG22 THR A 191 -11.902 -12.000 4.253 1.00 0.00 H new ATOM 0 HG23 THR A 191 -10.336 -12.373 5.012 1.00 0.00 H new ATOM 1145 N THR A 192 -10.915 -12.549 -0.005 1.00 0.00 N ATOM 1146 CA THR A 192 -11.898 -12.589 -1.089 1.00 0.00 C ATOM 1147 C THR A 192 -12.431 -14.015 -1.334 1.00 0.00 C ATOM 1148 O THR A 192 -13.479 -14.178 -1.944 1.00 0.00 O ATOM 1149 CB THR A 192 -11.293 -11.906 -2.322 1.00 0.00 C ATOM 1150 OG1 THR A 192 -12.271 -11.386 -3.206 1.00 0.00 O ATOM 1151 CG2 THR A 192 -10.424 -12.872 -3.131 1.00 0.00 C ATOM 0 H THR A 192 -9.999 -12.192 -0.277 1.00 0.00 H new ATOM 0 HA THR A 192 -12.791 -12.028 -0.813 1.00 0.00 H new ATOM 0 HB THR A 192 -10.697 -11.087 -1.920 1.00 0.00 H new ATOM 0 HG1 THR A 192 -11.828 -10.962 -3.971 1.00 0.00 H new ATOM 0 HG21 THR A 192 -10.012 -12.353 -3.997 1.00 0.00 H new ATOM 0 HG22 THR A 192 -9.609 -13.239 -2.506 1.00 0.00 H new ATOM 0 HG23 THR A 192 -11.031 -13.713 -3.467 1.00 0.00 H new ATOM 1159 N THR A 193 -11.749 -15.049 -0.834 1.00 0.00 N ATOM 1160 CA THR A 193 -12.209 -16.429 -0.823 1.00 0.00 C ATOM 1161 C THR A 193 -12.547 -16.922 0.596 1.00 0.00 C ATOM 1162 O THR A 193 -13.053 -18.028 0.764 1.00 0.00 O ATOM 1163 CB THR A 193 -11.127 -17.242 -1.553 1.00 0.00 C ATOM 1164 OG1 THR A 193 -11.617 -18.470 -2.031 1.00 0.00 O ATOM 1165 CG2 THR A 193 -9.893 -17.481 -0.676 1.00 0.00 C ATOM 0 H THR A 193 -10.827 -14.937 -0.411 1.00 0.00 H new ATOM 0 HA THR A 193 -13.159 -16.547 -1.344 1.00 0.00 H new ATOM 0 HB THR A 193 -10.828 -16.636 -2.408 1.00 0.00 H new ATOM 0 HG1 THR A 193 -10.898 -18.953 -2.489 1.00 0.00 H new ATOM 0 HG21 THR A 193 -9.156 -18.059 -1.234 1.00 0.00 H new ATOM 0 HG22 THR A 193 -9.460 -16.523 -0.388 1.00 0.00 H new ATOM 0 HG23 THR A 193 -10.184 -18.031 0.219 1.00 0.00 H new ATOM 1173 N LYS A 194 -12.267 -16.118 1.632 1.00 0.00 N ATOM 1174 CA LYS A 194 -12.435 -16.489 3.037 1.00 0.00 C ATOM 1175 C LYS A 194 -13.342 -15.575 3.846 1.00 0.00 C ATOM 1176 O LYS A 194 -13.298 -15.650 5.074 1.00 0.00 O ATOM 1177 CB LYS A 194 -11.066 -16.641 3.713 1.00 0.00 C ATOM 1178 CG LYS A 194 -10.037 -17.432 2.907 1.00 0.00 C ATOM 1179 CD LYS A 194 -8.867 -17.884 3.776 1.00 0.00 C ATOM 1180 CE LYS A 194 -8.269 -16.687 4.524 1.00 0.00 C ATOM 1181 NZ LYS A 194 -7.016 -16.997 5.227 1.00 0.00 N ATOM 0 H LYS A 194 -11.909 -15.171 1.509 1.00 0.00 H new ATOM 0 HA LYS A 194 -12.955 -17.447 3.022 1.00 0.00 H new ATOM 0 HB2 LYS A 194 -10.664 -15.648 3.914 1.00 0.00 H new ATOM 0 HB3 LYS A 194 -11.205 -17.130 4.677 1.00 0.00 H new ATOM 0 HG2 LYS A 194 -10.516 -18.303 2.460 1.00 0.00 H new ATOM 0 HG3 LYS A 194 -9.665 -16.817 2.087 1.00 0.00 H new ATOM 0 HD2 LYS A 194 -9.204 -18.636 4.489 1.00 0.00 H new ATOM 0 HD3 LYS A 194 -8.103 -18.353 3.155 1.00 0.00 H new ATOM 0 HE2 LYS A 194 -8.087 -15.880 3.814 1.00 0.00 H new ATOM 0 HE3 LYS A 194 -8.999 -16.319 5.245 1.00 0.00 H new ATOM 0 HZ1 LYS A 194 -6.669 -16.144 5.710 1.00 0.00 H new ATOM 0 HZ2 LYS A 194 -7.187 -17.746 5.928 1.00 0.00 H new ATOM 0 HZ3 LYS A 194 -6.304 -17.321 4.541 1.00 0.00 H new ATOM 1195 N GLY A 195 -14.172 -14.768 3.208 1.00 0.00 N ATOM 1196 CA GLY A 195 -15.192 -13.984 3.884 1.00 0.00 C ATOM 1197 C GLY A 195 -15.237 -12.541 3.450 1.00 0.00 C ATOM 1198 O GLY A 195 -15.806 -11.691 4.136 1.00 0.00 O ATOM 0 H GLY A 195 -14.157 -14.637 2.197 1.00 0.00 H new ATOM 0 HA2 GLY A 195 -16.166 -14.439 3.703 1.00 0.00 H new ATOM 0 HA3 GLY A 195 -15.016 -14.025 4.959 1.00 0.00 H new ATOM 1202 N GLU A 196 -14.699 -12.279 2.272 1.00 0.00 N ATOM 1203 CA GLU A 196 -14.626 -10.971 1.677 1.00 0.00 C ATOM 1204 C GLU A 196 -14.936 -11.068 0.189 1.00 0.00 C ATOM 1205 O GLU A 196 -15.254 -12.148 -0.323 1.00 0.00 O ATOM 1206 CB GLU A 196 -13.222 -10.417 1.967 1.00 0.00 C ATOM 1207 CG GLU A 196 -13.063 -9.084 2.693 1.00 0.00 C ATOM 1208 CD GLU A 196 -13.696 -7.930 1.942 1.00 0.00 C ATOM 1209 OE1 GLU A 196 -13.454 -7.881 0.725 1.00 0.00 O ATOM 1210 OE2 GLU A 196 -14.421 -7.121 2.565 1.00 0.00 O ATOM 0 H GLU A 196 -14.287 -13.005 1.687 1.00 0.00 H new ATOM 0 HA GLU A 196 -15.363 -10.286 2.096 1.00 0.00 H new ATOM 0 HB2 GLU A 196 -12.691 -11.169 2.550 1.00 0.00 H new ATOM 0 HB3 GLU A 196 -12.704 -10.330 1.012 1.00 0.00 H new ATOM 0 HG2 GLU A 196 -13.513 -9.158 3.683 1.00 0.00 H new ATOM 0 HG3 GLU A 196 -12.003 -8.879 2.839 1.00 0.00 H new ATOM 1217 N ASN A 197 -14.838 -9.933 -0.490 1.00 0.00 N ATOM 1218 CA ASN A 197 -15.148 -9.716 -1.896 1.00 0.00 C ATOM 1219 C ASN A 197 -14.889 -8.266 -2.335 1.00 0.00 C ATOM 1220 O ASN A 197 -15.755 -7.645 -2.953 1.00 0.00 O ATOM 1221 CB ASN A 197 -16.606 -10.089 -2.210 1.00 0.00 C ATOM 1222 CG ASN A 197 -16.891 -10.173 -3.715 1.00 0.00 C ATOM 1223 OD1 ASN A 197 -17.969 -9.812 -4.175 1.00 0.00 O ATOM 1224 ND2 ASN A 197 -15.988 -10.702 -4.524 1.00 0.00 N ATOM 0 H ASN A 197 -14.516 -9.077 -0.039 1.00 0.00 H new ATOM 0 HA ASN A 197 -14.479 -10.367 -2.458 1.00 0.00 H new ATOM 0 HB2 ASN A 197 -16.838 -11.048 -1.748 1.00 0.00 H new ATOM 0 HB3 ASN A 197 -17.269 -9.350 -1.761 1.00 0.00 H new ATOM 0 HD21 ASN A 197 -16.192 -10.806 -5.518 1.00 0.00 H new ATOM 0 HD22 ASN A 197 -15.088 -11.006 -4.154 1.00 0.00 H new ATOM 1231 N PHE A 198 -13.746 -7.694 -1.960 1.00 0.00 N ATOM 1232 CA PHE A 198 -13.371 -6.307 -2.180 1.00 0.00 C ATOM 1233 C PHE A 198 -13.711 -5.872 -3.603 1.00 0.00 C ATOM 1234 O PHE A 198 -13.135 -6.404 -4.554 1.00 0.00 O ATOM 1235 CB PHE A 198 -11.869 -6.163 -1.933 1.00 0.00 C ATOM 1236 CG PHE A 198 -11.440 -5.665 -0.568 1.00 0.00 C ATOM 1237 CD1 PHE A 198 -11.663 -4.322 -0.223 1.00 0.00 C ATOM 1238 CD2 PHE A 198 -10.684 -6.483 0.291 1.00 0.00 C ATOM 1239 CE1 PHE A 198 -11.175 -3.807 0.986 1.00 0.00 C ATOM 1240 CE2 PHE A 198 -10.168 -5.970 1.489 1.00 0.00 C ATOM 1241 CZ PHE A 198 -10.423 -4.633 1.834 1.00 0.00 C ATOM 0 H PHE A 198 -13.021 -8.217 -1.469 1.00 0.00 H new ATOM 0 HA PHE A 198 -13.927 -5.669 -1.493 1.00 0.00 H new ATOM 0 HB2 PHE A 198 -11.404 -7.134 -2.101 1.00 0.00 H new ATOM 0 HB3 PHE A 198 -11.466 -5.483 -2.683 1.00 0.00 H new ATOM 0 HD1 PHE A 198 -12.215 -3.681 -0.894 1.00 0.00 H new ATOM 0 HD2 PHE A 198 -10.500 -7.514 0.026 1.00 0.00 H new ATOM 0 HE1 PHE A 198 -11.376 -2.783 1.262 1.00 0.00 H new ATOM 0 HE2 PHE A 198 -9.579 -6.598 2.141 1.00 0.00 H new ATOM 0 HZ PHE A 198 -10.036 -4.237 2.761 1.00 0.00 H new ATOM 1251 N THR A 199 -14.628 -4.923 -3.743 1.00 0.00 N ATOM 1252 CA THR A 199 -15.105 -4.464 -5.043 1.00 0.00 C ATOM 1253 C THR A 199 -14.041 -3.601 -5.698 1.00 0.00 C ATOM 1254 O THR A 199 -13.300 -2.947 -4.963 1.00 0.00 O ATOM 1255 CB THR A 199 -16.389 -3.648 -4.847 1.00 0.00 C ATOM 1256 OG1 THR A 199 -16.308 -2.780 -3.723 1.00 0.00 O ATOM 1257 CG2 THR A 199 -17.570 -4.595 -4.645 1.00 0.00 C ATOM 0 H THR A 199 -15.065 -4.447 -2.954 1.00 0.00 H new ATOM 0 HA THR A 199 -15.313 -5.321 -5.684 1.00 0.00 H new ATOM 0 HB THR A 199 -16.525 -3.039 -5.741 1.00 0.00 H new ATOM 0 HG1 THR A 199 -17.145 -2.278 -3.636 1.00 0.00 H new ATOM 0 HG21 THR A 199 -18.482 -4.015 -4.506 1.00 0.00 H new ATOM 0 HG22 THR A 199 -17.677 -5.235 -5.521 1.00 0.00 H new ATOM 0 HG23 THR A 199 -17.395 -5.212 -3.764 1.00 0.00 H new ATOM 1265 N GLU A 200 -14.032 -3.489 -7.031 1.00 0.00 N ATOM 1266 CA GLU A 200 -13.107 -2.635 -7.740 1.00 0.00 C ATOM 1267 C GLU A 200 -13.226 -1.218 -7.186 1.00 0.00 C ATOM 1268 O GLU A 200 -12.201 -0.601 -6.942 1.00 0.00 O ATOM 1269 CB GLU A 200 -13.356 -2.737 -9.258 1.00 0.00 C ATOM 1270 CG GLU A 200 -12.868 -1.479 -9.985 1.00 0.00 C ATOM 1271 CD GLU A 200 -12.666 -1.611 -11.496 1.00 0.00 C ATOM 1272 OE1 GLU A 200 -13.565 -2.124 -12.205 1.00 0.00 O ATOM 1273 OE2 GLU A 200 -11.589 -1.171 -11.963 1.00 0.00 O ATOM 0 H GLU A 200 -14.674 -3.996 -7.640 1.00 0.00 H new ATOM 0 HA GLU A 200 -12.076 -2.953 -7.587 1.00 0.00 H new ATOM 0 HB2 GLU A 200 -12.842 -3.612 -9.656 1.00 0.00 H new ATOM 0 HB3 GLU A 200 -14.420 -2.879 -9.446 1.00 0.00 H new ATOM 0 HG2 GLU A 200 -13.584 -0.678 -9.803 1.00 0.00 H new ATOM 0 HG3 GLU A 200 -11.923 -1.169 -9.538 1.00 0.00 H new ATOM 1280 N THR A 201 -14.437 -0.734 -6.910 1.00 0.00 N ATOM 1281 CA THR A 201 -14.665 0.594 -6.364 1.00 0.00 C ATOM 1282 C THR A 201 -13.929 0.803 -5.035 1.00 0.00 C ATOM 1283 O THR A 201 -13.397 1.884 -4.800 1.00 0.00 O ATOM 1284 CB THR A 201 -16.177 0.790 -6.186 1.00 0.00 C ATOM 1285 OG1 THR A 201 -16.869 0.282 -7.318 1.00 0.00 O ATOM 1286 CG2 THR A 201 -16.490 2.271 -6.027 1.00 0.00 C ATOM 0 H THR A 201 -15.295 -1.264 -7.063 1.00 0.00 H new ATOM 0 HA THR A 201 -14.267 1.335 -7.057 1.00 0.00 H new ATOM 0 HB THR A 201 -16.499 0.252 -5.295 1.00 0.00 H new ATOM 0 HG1 THR A 201 -17.833 0.409 -7.196 1.00 0.00 H new ATOM 0 HG21 THR A 201 -17.564 2.404 -5.901 1.00 0.00 H new ATOM 0 HG22 THR A 201 -15.971 2.661 -5.151 1.00 0.00 H new ATOM 0 HG23 THR A 201 -16.159 2.810 -6.915 1.00 0.00 H new ATOM 1294 N ASP A 202 -13.863 -0.224 -4.181 1.00 0.00 N ATOM 1295 CA ASP A 202 -13.159 -0.118 -2.906 1.00 0.00 C ATOM 1296 C ASP A 202 -11.668 -0.181 -3.171 1.00 0.00 C ATOM 1297 O ASP A 202 -10.929 0.654 -2.661 1.00 0.00 O ATOM 1298 CB ASP A 202 -13.547 -1.223 -1.904 1.00 0.00 C ATOM 1299 CG ASP A 202 -14.448 -0.741 -0.768 1.00 0.00 C ATOM 1300 OD1 ASP A 202 -14.428 0.460 -0.418 1.00 0.00 O ATOM 1301 OD2 ASP A 202 -15.204 -1.573 -0.220 1.00 0.00 O ATOM 0 H ASP A 202 -14.289 -1.135 -4.352 1.00 0.00 H new ATOM 0 HA ASP A 202 -13.444 0.831 -2.452 1.00 0.00 H new ATOM 0 HB2 ASP A 202 -14.054 -2.025 -2.441 1.00 0.00 H new ATOM 0 HB3 ASP A 202 -12.638 -1.649 -1.478 1.00 0.00 H new ATOM 1306 N VAL A 203 -11.215 -1.146 -3.980 1.00 0.00 N ATOM 1307 CA VAL A 203 -9.802 -1.281 -4.303 1.00 0.00 C ATOM 1308 C VAL A 203 -9.297 0.003 -4.963 1.00 0.00 C ATOM 1309 O VAL A 203 -8.194 0.412 -4.651 1.00 0.00 O ATOM 1310 CB VAL A 203 -9.532 -2.526 -5.178 1.00 0.00 C ATOM 1311 CG1 VAL A 203 -8.032 -2.699 -5.466 1.00 0.00 C ATOM 1312 CG2 VAL A 203 -10.030 -3.792 -4.469 1.00 0.00 C ATOM 0 H VAL A 203 -11.814 -1.844 -4.421 1.00 0.00 H new ATOM 0 HA VAL A 203 -9.246 -1.432 -3.378 1.00 0.00 H new ATOM 0 HB VAL A 203 -10.064 -2.378 -6.118 1.00 0.00 H new ATOM 0 HG11 VAL A 203 -7.880 -3.584 -6.084 1.00 0.00 H new ATOM 0 HG12 VAL A 203 -7.659 -1.821 -5.993 1.00 0.00 H new ATOM 0 HG13 VAL A 203 -7.492 -2.815 -4.526 1.00 0.00 H new ATOM 0 HG21 VAL A 203 -9.834 -4.661 -5.096 1.00 0.00 H new ATOM 0 HG22 VAL A 203 -9.509 -3.905 -3.518 1.00 0.00 H new ATOM 0 HG23 VAL A 203 -11.102 -3.710 -4.288 1.00 0.00 H new ATOM 1322 N LYS A 204 -10.080 0.695 -5.791 1.00 0.00 N ATOM 1323 CA LYS A 204 -9.705 1.971 -6.392 1.00 0.00 C ATOM 1324 C LYS A 204 -9.295 2.984 -5.335 1.00 0.00 C ATOM 1325 O LYS A 204 -8.316 3.696 -5.537 1.00 0.00 O ATOM 1326 CB LYS A 204 -10.875 2.506 -7.228 1.00 0.00 C ATOM 1327 CG LYS A 204 -11.018 1.762 -8.562 1.00 0.00 C ATOM 1328 CD LYS A 204 -10.567 2.627 -9.746 1.00 0.00 C ATOM 1329 CE LYS A 204 -10.694 1.830 -11.046 1.00 0.00 C ATOM 1330 NZ LYS A 204 -9.694 0.753 -11.152 1.00 0.00 N ATOM 0 H LYS A 204 -11.009 0.377 -6.067 1.00 0.00 H new ATOM 0 HA LYS A 204 -8.843 1.809 -7.039 1.00 0.00 H new ATOM 0 HB2 LYS A 204 -11.800 2.411 -6.659 1.00 0.00 H new ATOM 0 HB3 LYS A 204 -10.727 3.569 -7.420 1.00 0.00 H new ATOM 0 HG2 LYS A 204 -10.426 0.847 -8.534 1.00 0.00 H new ATOM 0 HG3 LYS A 204 -12.057 1.465 -8.703 1.00 0.00 H new ATOM 0 HD2 LYS A 204 -11.175 3.530 -9.801 1.00 0.00 H new ATOM 0 HD3 LYS A 204 -9.535 2.946 -9.603 1.00 0.00 H new ATOM 0 HE2 LYS A 204 -11.694 1.400 -11.107 1.00 0.00 H new ATOM 0 HE3 LYS A 204 -10.585 2.506 -11.894 1.00 0.00 H new ATOM 0 HZ1 LYS A 204 -9.021 0.978 -11.912 1.00 0.00 H new ATOM 0 HZ2 LYS A 204 -9.182 0.665 -10.251 1.00 0.00 H new ATOM 0 HZ3 LYS A 204 -10.172 -0.145 -11.368 1.00 0.00 H new ATOM 1344 N MET A 205 -10.011 3.041 -4.215 1.00 0.00 N ATOM 1345 CA MET A 205 -9.692 3.953 -3.122 1.00 0.00 C ATOM 1346 C MET A 205 -8.477 3.422 -2.384 1.00 0.00 C ATOM 1347 O MET A 205 -7.576 4.176 -2.006 1.00 0.00 O ATOM 1348 CB MET A 205 -10.847 4.121 -2.115 1.00 0.00 C ATOM 1349 CG MET A 205 -12.228 3.804 -2.680 1.00 0.00 C ATOM 1350 SD MET A 205 -13.543 4.811 -2.013 1.00 0.00 S ATOM 1351 CE MET A 205 -13.325 6.046 -3.291 1.00 0.00 C ATOM 0 H MET A 205 -10.828 2.456 -4.040 1.00 0.00 H new ATOM 0 HA MET A 205 -9.503 4.932 -3.563 1.00 0.00 H new ATOM 0 HB2 MET A 205 -10.662 3.474 -1.257 1.00 0.00 H new ATOM 0 HB3 MET A 205 -10.845 5.147 -1.747 1.00 0.00 H new ATOM 0 HG2 MET A 205 -12.203 3.930 -3.762 1.00 0.00 H new ATOM 0 HG3 MET A 205 -12.455 2.756 -2.487 1.00 0.00 H new ATOM 0 HE1 MET A 205 -13.303 7.038 -2.839 1.00 0.00 H new ATOM 0 HE2 MET A 205 -12.386 5.866 -3.815 1.00 0.00 H new ATOM 0 HE3 MET A 205 -14.152 5.988 -3.998 1.00 0.00 H new ATOM 1361 N MET A 206 -8.500 2.118 -2.140 1.00 0.00 N ATOM 1362 CA MET A 206 -7.525 1.394 -1.388 1.00 0.00 C ATOM 1363 C MET A 206 -6.152 1.544 -2.042 1.00 0.00 C ATOM 1364 O MET A 206 -5.216 1.870 -1.322 1.00 0.00 O ATOM 1365 CB MET A 206 -7.987 -0.064 -1.259 1.00 0.00 C ATOM 1366 CG MET A 206 -7.452 -0.630 0.050 1.00 0.00 C ATOM 1367 SD MET A 206 -7.004 -2.376 0.110 1.00 0.00 S ATOM 1368 CE MET A 206 -8.336 -3.203 -0.770 1.00 0.00 C ATOM 0 H MET A 206 -9.248 1.518 -2.488 1.00 0.00 H new ATOM 0 HA MET A 206 -7.426 1.794 -0.379 1.00 0.00 H new ATOM 0 HB2 MET A 206 -9.075 -0.119 -1.278 1.00 0.00 H new ATOM 0 HB3 MET A 206 -7.624 -0.652 -2.102 1.00 0.00 H new ATOM 0 HG2 MET A 206 -6.570 -0.051 0.326 1.00 0.00 H new ATOM 0 HG3 MET A 206 -8.203 -0.453 0.820 1.00 0.00 H new ATOM 0 HE1 MET A 206 -8.542 -4.164 -0.299 1.00 0.00 H new ATOM 0 HE2 MET A 206 -9.233 -2.584 -0.738 1.00 0.00 H new ATOM 0 HE3 MET A 206 -8.042 -3.363 -1.807 1.00 0.00 H new ATOM 1378 N GLU A 207 -6.034 1.407 -3.371 1.00 0.00 N ATOM 1379 CA GLU A 207 -4.776 1.425 -4.103 1.00 0.00 C ATOM 1380 C GLU A 207 -4.063 2.727 -3.795 1.00 0.00 C ATOM 1381 O GLU A 207 -2.875 2.704 -3.497 1.00 0.00 O ATOM 1382 CB GLU A 207 -4.970 1.307 -5.628 1.00 0.00 C ATOM 1383 CG GLU A 207 -5.475 -0.059 -6.116 1.00 0.00 C ATOM 1384 CD GLU A 207 -4.731 -0.600 -7.344 1.00 0.00 C ATOM 1385 OE1 GLU A 207 -3.591 -1.117 -7.212 1.00 0.00 O ATOM 1386 OE2 GLU A 207 -5.299 -0.526 -8.460 1.00 0.00 O ATOM 0 H GLU A 207 -6.843 1.277 -3.978 1.00 0.00 H new ATOM 0 HA GLU A 207 -4.193 0.561 -3.785 1.00 0.00 H new ATOM 0 HB2 GLU A 207 -5.675 2.074 -5.950 1.00 0.00 H new ATOM 0 HB3 GLU A 207 -4.020 1.522 -6.117 1.00 0.00 H new ATOM 0 HG2 GLU A 207 -5.384 -0.779 -5.303 1.00 0.00 H new ATOM 0 HG3 GLU A 207 -6.536 0.022 -6.354 1.00 0.00 H new ATOM 1393 N ARG A 208 -4.802 3.844 -3.814 1.00 0.00 N ATOM 1394 CA ARG A 208 -4.275 5.172 -3.502 1.00 0.00 C ATOM 1395 C ARG A 208 -3.762 5.193 -2.076 1.00 0.00 C ATOM 1396 O ARG A 208 -2.751 5.805 -1.769 1.00 0.00 O ATOM 1397 CB ARG A 208 -5.323 6.287 -3.578 1.00 0.00 C ATOM 1398 CG ARG A 208 -6.499 6.139 -4.507 1.00 0.00 C ATOM 1399 CD ARG A 208 -6.137 5.803 -5.933 1.00 0.00 C ATOM 1400 NE ARG A 208 -5.501 6.951 -6.583 1.00 0.00 N ATOM 1401 CZ ARG A 208 -5.997 7.694 -7.575 1.00 0.00 C ATOM 1402 NH1 ARG A 208 -7.123 7.373 -8.209 1.00 0.00 N ATOM 1403 NH2 ARG A 208 -5.331 8.786 -7.896 1.00 0.00 N ATOM 0 H ARG A 208 -5.794 3.847 -4.050 1.00 0.00 H new ATOM 0 HA ARG A 208 -3.500 5.355 -4.246 1.00 0.00 H new ATOM 0 HB2 ARG A 208 -5.718 6.433 -2.573 1.00 0.00 H new ATOM 0 HB3 ARG A 208 -4.804 7.205 -3.853 1.00 0.00 H new ATOM 0 HG2 ARG A 208 -7.155 5.359 -4.120 1.00 0.00 H new ATOM 0 HG3 ARG A 208 -7.069 7.068 -4.500 1.00 0.00 H new ATOM 0 HD2 ARG A 208 -5.462 4.947 -5.951 1.00 0.00 H new ATOM 0 HD3 ARG A 208 -7.032 5.515 -6.484 1.00 0.00 H new ATOM 0 HE ARG A 208 -4.577 7.212 -6.240 1.00 0.00 H new ATOM 0 HH11 ARG A 208 -7.638 6.534 -7.941 1.00 0.00 H new ATOM 0 HH12 ARG A 208 -7.471 7.966 -8.963 1.00 0.00 H new ATOM 0 HH21 ARG A 208 -4.478 9.029 -7.393 1.00 0.00 H new ATOM 0 HH22 ARG A 208 -5.669 9.387 -8.647 1.00 0.00 H new ATOM 1417 N VAL A 209 -4.541 4.610 -1.180 1.00 0.00 N ATOM 1418 CA VAL A 209 -4.249 4.585 0.236 1.00 0.00 C ATOM 1419 C VAL A 209 -2.909 3.879 0.447 1.00 0.00 C ATOM 1420 O VAL A 209 -1.977 4.508 0.957 1.00 0.00 O ATOM 1421 CB VAL A 209 -5.492 4.065 1.002 1.00 0.00 C ATOM 1422 CG1 VAL A 209 -5.330 2.793 1.840 1.00 0.00 C ATOM 1423 CG2 VAL A 209 -6.004 5.199 1.893 1.00 0.00 C ATOM 0 H VAL A 209 -5.409 4.133 -1.425 1.00 0.00 H new ATOM 0 HA VAL A 209 -4.088 5.570 0.674 1.00 0.00 H new ATOM 0 HB VAL A 209 -6.194 3.764 0.224 1.00 0.00 H new ATOM 0 HG11 VAL A 209 -6.279 2.549 2.318 1.00 0.00 H new ATOM 0 HG12 VAL A 209 -5.026 1.969 1.195 1.00 0.00 H new ATOM 0 HG13 VAL A 209 -4.570 2.955 2.604 1.00 0.00 H new ATOM 0 HG21 VAL A 209 -6.881 4.860 2.445 1.00 0.00 H new ATOM 0 HG22 VAL A 209 -5.223 5.491 2.595 1.00 0.00 H new ATOM 0 HG23 VAL A 209 -6.273 6.055 1.274 1.00 0.00 H new ATOM 1433 N VAL A 210 -2.771 2.627 -0.005 1.00 0.00 N ATOM 1434 CA VAL A 210 -1.518 1.892 0.131 1.00 0.00 C ATOM 1435 C VAL A 210 -0.393 2.626 -0.576 1.00 0.00 C ATOM 1436 O VAL A 210 0.657 2.791 0.019 1.00 0.00 O ATOM 1437 CB VAL A 210 -1.633 0.406 -0.269 1.00 0.00 C ATOM 1438 CG1 VAL A 210 -2.860 0.007 -1.048 1.00 0.00 C ATOM 1439 CG2 VAL A 210 -0.383 -0.239 -0.864 1.00 0.00 C ATOM 0 H VAL A 210 -3.515 2.105 -0.468 1.00 0.00 H new ATOM 0 HA VAL A 210 -1.269 1.860 1.192 1.00 0.00 H new ATOM 0 HB VAL A 210 -1.754 -0.019 0.727 1.00 0.00 H new ATOM 0 HG11 VAL A 210 -2.821 -1.060 -1.267 1.00 0.00 H new ATOM 0 HG12 VAL A 210 -3.751 0.224 -0.459 1.00 0.00 H new ATOM 0 HG13 VAL A 210 -2.896 0.568 -1.982 1.00 0.00 H new ATOM 0 HG21 VAL A 210 -0.591 -1.282 -1.104 1.00 0.00 H new ATOM 0 HG22 VAL A 210 -0.097 0.292 -1.772 1.00 0.00 H new ATOM 0 HG23 VAL A 210 0.432 -0.188 -0.142 1.00 0.00 H new ATOM 1449 N GLU A 211 -0.625 3.084 -1.799 1.00 0.00 N ATOM 1450 CA GLU A 211 0.279 3.926 -2.591 1.00 0.00 C ATOM 1451 C GLU A 211 0.856 5.044 -1.718 1.00 0.00 C ATOM 1452 O GLU A 211 2.059 5.081 -1.474 1.00 0.00 O ATOM 1453 CB GLU A 211 -0.460 4.437 -3.849 1.00 0.00 C ATOM 1454 CG GLU A 211 0.081 5.690 -4.534 1.00 0.00 C ATOM 1455 CD GLU A 211 -0.864 6.207 -5.633 1.00 0.00 C ATOM 1456 OE1 GLU A 211 -1.889 6.868 -5.328 1.00 0.00 O ATOM 1457 OE2 GLU A 211 -0.554 5.998 -6.829 1.00 0.00 O ATOM 0 H GLU A 211 -1.490 2.871 -2.295 1.00 0.00 H new ATOM 0 HA GLU A 211 1.132 3.347 -2.943 1.00 0.00 H new ATOM 0 HB2 GLU A 211 -0.468 3.631 -4.583 1.00 0.00 H new ATOM 0 HB3 GLU A 211 -1.497 4.627 -3.574 1.00 0.00 H new ATOM 0 HG2 GLU A 211 0.232 6.472 -3.790 1.00 0.00 H new ATOM 0 HG3 GLU A 211 1.056 5.472 -4.969 1.00 0.00 H new ATOM 1464 N GLN A 212 0.014 5.945 -1.218 1.00 0.00 N ATOM 1465 CA GLN A 212 0.427 7.158 -0.524 1.00 0.00 C ATOM 1466 C GLN A 212 1.107 6.834 0.812 1.00 0.00 C ATOM 1467 O GLN A 212 1.981 7.578 1.269 1.00 0.00 O ATOM 1468 CB GLN A 212 -0.818 8.030 -0.299 1.00 0.00 C ATOM 1469 CG GLN A 212 -1.456 8.566 -1.597 1.00 0.00 C ATOM 1470 CD GLN A 212 -0.693 9.725 -2.209 1.00 0.00 C ATOM 1471 OE1 GLN A 212 -0.147 9.640 -3.305 1.00 0.00 O ATOM 1472 NE2 GLN A 212 -0.614 10.850 -1.530 1.00 0.00 N ATOM 0 H GLN A 212 -0.999 5.848 -1.287 1.00 0.00 H new ATOM 0 HA GLN A 212 1.157 7.693 -1.132 1.00 0.00 H new ATOM 0 HB2 GLN A 212 -1.562 7.448 0.245 1.00 0.00 H new ATOM 0 HB3 GLN A 212 -0.547 8.874 0.335 1.00 0.00 H new ATOM 0 HG2 GLN A 212 -1.517 7.756 -2.324 1.00 0.00 H new ATOM 0 HG3 GLN A 212 -2.477 8.884 -1.387 1.00 0.00 H new ATOM 0 HE21 GLN A 212 -1.065 10.928 -0.619 1.00 0.00 H new ATOM 0 HE22 GLN A 212 -0.102 11.643 -1.915 1.00 0.00 H new ATOM 1481 N MET A 213 0.709 5.741 1.459 1.00 0.00 N ATOM 1482 CA MET A 213 1.386 5.212 2.636 1.00 0.00 C ATOM 1483 C MET A 213 2.739 4.583 2.252 1.00 0.00 C ATOM 1484 O MET A 213 3.723 4.753 2.970 1.00 0.00 O ATOM 1485 CB MET A 213 0.445 4.207 3.319 1.00 0.00 C ATOM 1486 CG MET A 213 -0.727 4.917 4.029 1.00 0.00 C ATOM 1487 SD MET A 213 -2.389 4.167 4.016 1.00 0.00 S ATOM 1488 CE MET A 213 -2.055 2.396 4.164 1.00 0.00 C ATOM 0 H MET A 213 -0.103 5.193 1.175 1.00 0.00 H new ATOM 0 HA MET A 213 1.614 6.014 3.338 1.00 0.00 H new ATOM 0 HB2 MET A 213 0.054 3.512 2.576 1.00 0.00 H new ATOM 0 HB3 MET A 213 1.006 3.617 4.044 1.00 0.00 H new ATOM 0 HG2 MET A 213 -0.440 5.052 5.072 1.00 0.00 H new ATOM 0 HG3 MET A 213 -0.817 5.911 3.592 1.00 0.00 H new ATOM 0 HE1 MET A 213 -2.974 1.837 3.989 1.00 0.00 H new ATOM 0 HE2 MET A 213 -1.306 2.104 3.428 1.00 0.00 H new ATOM 0 HE3 MET A 213 -1.683 2.178 5.165 1.00 0.00 H new ATOM 1498 N CYS A 214 2.839 3.882 1.126 1.00 0.00 N ATOM 1499 CA CYS A 214 4.048 3.195 0.700 1.00 0.00 C ATOM 1500 C CYS A 214 5.096 4.174 0.205 1.00 0.00 C ATOM 1501 O CYS A 214 6.284 3.952 0.410 1.00 0.00 O ATOM 1502 CB CYS A 214 3.768 2.152 -0.379 1.00 0.00 C ATOM 1503 SG CYS A 214 4.926 0.787 -0.204 1.00 0.00 S ATOM 0 H CYS A 214 2.063 3.775 0.472 1.00 0.00 H new ATOM 0 HA CYS A 214 4.433 2.679 1.579 1.00 0.00 H new ATOM 0 HB2 CYS A 214 2.744 1.788 -0.292 1.00 0.00 H new ATOM 0 HB3 CYS A 214 3.864 2.601 -1.368 1.00 0.00 H new ATOM 1508 N VAL A 215 4.666 5.284 -0.390 1.00 0.00 N ATOM 1509 CA VAL A 215 5.516 6.406 -0.739 1.00 0.00 C ATOM 1510 C VAL A 215 6.286 6.838 0.527 1.00 0.00 C ATOM 1511 O VAL A 215 7.509 6.966 0.480 1.00 0.00 O ATOM 1512 CB VAL A 215 4.620 7.481 -1.399 1.00 0.00 C ATOM 1513 CG1 VAL A 215 5.297 8.837 -1.565 1.00 0.00 C ATOM 1514 CG2 VAL A 215 4.145 7.067 -2.804 1.00 0.00 C ATOM 0 H VAL A 215 3.689 5.426 -0.647 1.00 0.00 H new ATOM 0 HA VAL A 215 6.287 6.173 -1.473 1.00 0.00 H new ATOM 0 HB VAL A 215 3.785 7.568 -0.704 1.00 0.00 H new ATOM 0 HG11 VAL A 215 4.604 9.535 -2.035 1.00 0.00 H new ATOM 0 HG12 VAL A 215 5.590 9.219 -0.587 1.00 0.00 H new ATOM 0 HG13 VAL A 215 6.182 8.728 -2.192 1.00 0.00 H new ATOM 0 HG21 VAL A 215 3.520 7.855 -3.224 1.00 0.00 H new ATOM 0 HG22 VAL A 215 5.010 6.908 -3.448 1.00 0.00 H new ATOM 0 HG23 VAL A 215 3.569 6.144 -2.736 1.00 0.00 H new ATOM 1524 N THR A 216 5.610 6.970 1.677 1.00 0.00 N ATOM 1525 CA THR A 216 6.253 7.213 2.968 1.00 0.00 C ATOM 1526 C THR A 216 7.209 6.071 3.358 1.00 0.00 C ATOM 1527 O THR A 216 8.351 6.358 3.731 1.00 0.00 O ATOM 1528 CB THR A 216 5.173 7.485 4.034 1.00 0.00 C ATOM 1529 OG1 THR A 216 4.549 8.722 3.734 1.00 0.00 O ATOM 1530 CG2 THR A 216 5.711 7.482 5.473 1.00 0.00 C ATOM 0 H THR A 216 4.593 6.910 1.734 1.00 0.00 H new ATOM 0 HA THR A 216 6.882 8.100 2.893 1.00 0.00 H new ATOM 0 HB THR A 216 4.454 6.667 3.994 1.00 0.00 H new ATOM 0 HG1 THR A 216 3.857 8.910 4.402 1.00 0.00 H new ATOM 0 HG21 THR A 216 4.894 7.680 6.167 1.00 0.00 H new ATOM 0 HG22 THR A 216 6.149 6.509 5.696 1.00 0.00 H new ATOM 0 HG23 THR A 216 6.472 8.255 5.578 1.00 0.00 H new ATOM 1538 N GLN A 217 6.765 4.805 3.321 1.00 0.00 N ATOM 1539 CA GLN A 217 7.587 3.664 3.742 1.00 0.00 C ATOM 1540 C GLN A 217 8.859 3.543 2.890 1.00 0.00 C ATOM 1541 O GLN A 217 9.899 3.219 3.456 1.00 0.00 O ATOM 1542 CB GLN A 217 6.801 2.332 3.696 1.00 0.00 C ATOM 1543 CG GLN A 217 6.343 1.708 5.028 1.00 0.00 C ATOM 1544 CD GLN A 217 7.253 1.868 6.241 1.00 0.00 C ATOM 1545 OE1 GLN A 217 6.885 2.548 7.194 1.00 0.00 O ATOM 1546 NE2 GLN A 217 8.419 1.247 6.268 1.00 0.00 N ATOM 0 H GLN A 217 5.832 4.546 3.000 1.00 0.00 H new ATOM 0 HA GLN A 217 7.872 3.857 4.776 1.00 0.00 H new ATOM 0 HB2 GLN A 217 5.915 2.490 3.081 1.00 0.00 H new ATOM 0 HB3 GLN A 217 7.420 1.598 3.181 1.00 0.00 H new ATOM 0 HG2 GLN A 217 5.372 2.134 5.280 1.00 0.00 H new ATOM 0 HG3 GLN A 217 6.190 0.641 4.863 1.00 0.00 H new ATOM 0 HE21 GLN A 217 8.716 0.684 5.471 1.00 0.00 H new ATOM 0 HE22 GLN A 217 9.022 1.330 7.086 1.00 0.00 H new ATOM 1555 N TYR A 218 8.812 3.832 1.581 1.00 0.00 N ATOM 1556 CA TYR A 218 9.984 3.835 0.707 1.00 0.00 C ATOM 1557 C TYR A 218 11.041 4.741 1.318 1.00 0.00 C ATOM 1558 O TYR A 218 12.144 4.277 1.562 1.00 0.00 O ATOM 1559 CB TYR A 218 9.653 4.292 -0.724 1.00 0.00 C ATOM 1560 CG TYR A 218 10.885 4.581 -1.566 1.00 0.00 C ATOM 1561 CD1 TYR A 218 11.673 3.527 -2.077 1.00 0.00 C ATOM 1562 CD2 TYR A 218 11.245 5.916 -1.833 1.00 0.00 C ATOM 1563 CE1 TYR A 218 12.814 3.822 -2.850 1.00 0.00 C ATOM 1564 CE2 TYR A 218 12.362 6.205 -2.635 1.00 0.00 C ATOM 1565 CZ TYR A 218 13.175 5.154 -3.120 1.00 0.00 C ATOM 1566 OH TYR A 218 14.285 5.388 -3.872 1.00 0.00 O ATOM 0 H TYR A 218 7.946 4.073 1.098 1.00 0.00 H new ATOM 0 HA TYR A 218 10.353 2.812 0.627 1.00 0.00 H new ATOM 0 HB2 TYR A 218 9.059 3.521 -1.215 1.00 0.00 H new ATOM 0 HB3 TYR A 218 9.035 5.189 -0.677 1.00 0.00 H new ATOM 0 HD1 TYR A 218 11.403 2.501 -1.877 1.00 0.00 H new ATOM 0 HD2 TYR A 218 10.659 6.723 -1.419 1.00 0.00 H new ATOM 0 HE1 TYR A 218 13.418 3.016 -3.239 1.00 0.00 H new ATOM 0 HE2 TYR A 218 12.600 7.229 -2.881 1.00 0.00 H new ATOM 0 HH TYR A 218 14.411 6.354 -3.978 1.00 0.00 H new ATOM 1576 N GLN A 219 10.701 5.999 1.629 1.00 0.00 N ATOM 1577 CA GLN A 219 11.683 6.937 2.167 1.00 0.00 C ATOM 1578 C GLN A 219 12.224 6.501 3.535 1.00 0.00 C ATOM 1579 O GLN A 219 13.317 6.921 3.905 1.00 0.00 O ATOM 1580 CB GLN A 219 11.114 8.354 2.295 1.00 0.00 C ATOM 1581 CG GLN A 219 10.448 8.954 1.053 1.00 0.00 C ATOM 1582 CD GLN A 219 11.293 9.054 -0.216 1.00 0.00 C ATOM 1583 OE1 GLN A 219 12.501 8.836 -0.240 1.00 0.00 O ATOM 1584 NE2 GLN A 219 10.635 9.381 -1.313 1.00 0.00 N ATOM 0 H GLN A 219 9.763 6.383 1.517 1.00 0.00 H new ATOM 0 HA GLN A 219 12.502 6.939 1.448 1.00 0.00 H new ATOM 0 HB2 GLN A 219 10.383 8.353 3.104 1.00 0.00 H new ATOM 0 HB3 GLN A 219 11.924 9.017 2.598 1.00 0.00 H new ATOM 0 HG2 GLN A 219 9.564 8.359 0.824 1.00 0.00 H new ATOM 0 HG3 GLN A 219 10.101 9.956 1.307 1.00 0.00 H new ATOM 0 HE21 GLN A 219 9.631 9.558 -1.272 1.00 0.00 H new ATOM 0 HE22 GLN A 219 11.130 9.456 -2.201 1.00 0.00 H new ATOM 1593 N LYS A 220 11.467 5.713 4.315 1.00 0.00 N ATOM 1594 CA LYS A 220 11.984 5.153 5.561 1.00 0.00 C ATOM 1595 C LYS A 220 13.066 4.124 5.252 1.00 0.00 C ATOM 1596 O LYS A 220 14.194 4.261 5.726 1.00 0.00 O ATOM 1597 CB LYS A 220 10.890 4.511 6.427 1.00 0.00 C ATOM 1598 CG LYS A 220 9.861 5.521 6.931 1.00 0.00 C ATOM 1599 CD LYS A 220 9.061 4.954 8.100 1.00 0.00 C ATOM 1600 CE LYS A 220 7.838 5.833 8.343 1.00 0.00 C ATOM 1601 NZ LYS A 220 7.016 5.324 9.457 1.00 0.00 N ATOM 0 H LYS A 220 10.504 5.454 4.102 1.00 0.00 H new ATOM 0 HA LYS A 220 12.400 5.981 6.135 1.00 0.00 H new ATOM 0 HB2 LYS A 220 10.381 3.740 5.848 1.00 0.00 H new ATOM 0 HB3 LYS A 220 11.353 4.016 7.280 1.00 0.00 H new ATOM 0 HG2 LYS A 220 10.366 6.435 7.242 1.00 0.00 H new ATOM 0 HG3 LYS A 220 9.184 5.791 6.120 1.00 0.00 H new ATOM 0 HD2 LYS A 220 8.752 3.932 7.883 1.00 0.00 H new ATOM 0 HD3 LYS A 220 9.681 4.916 8.996 1.00 0.00 H new ATOM 0 HE2 LYS A 220 8.159 6.851 8.563 1.00 0.00 H new ATOM 0 HE3 LYS A 220 7.235 5.877 7.436 1.00 0.00 H new ATOM 0 HZ1 LYS A 220 6.194 5.946 9.594 1.00 0.00 H new ATOM 0 HZ2 LYS A 220 6.690 4.362 9.236 1.00 0.00 H new ATOM 0 HZ3 LYS A 220 7.585 5.305 10.328 1.00 0.00 H new ATOM 1615 N GLU A 221 12.708 3.075 4.510 1.00 0.00 N ATOM 1616 CA GLU A 221 13.612 1.959 4.275 1.00 0.00 C ATOM 1617 C GLU A 221 14.797 2.400 3.427 1.00 0.00 C ATOM 1618 O GLU A 221 15.902 1.941 3.685 1.00 0.00 O ATOM 1619 CB GLU A 221 12.906 0.795 3.569 1.00 0.00 C ATOM 1620 CG GLU A 221 12.638 -0.428 4.445 1.00 0.00 C ATOM 1621 CD GLU A 221 13.900 -1.040 5.077 1.00 0.00 C ATOM 1622 OE1 GLU A 221 14.598 -1.817 4.387 1.00 0.00 O ATOM 1623 OE2 GLU A 221 14.157 -0.804 6.281 1.00 0.00 O ATOM 0 H GLU A 221 11.796 2.979 4.063 1.00 0.00 H new ATOM 0 HA GLU A 221 13.958 1.620 5.251 1.00 0.00 H new ATOM 0 HB2 GLU A 221 11.956 1.154 3.172 1.00 0.00 H new ATOM 0 HB3 GLU A 221 13.511 0.486 2.717 1.00 0.00 H new ATOM 0 HG2 GLU A 221 11.947 -0.147 5.240 1.00 0.00 H new ATOM 0 HG3 GLU A 221 12.140 -1.189 3.844 1.00 0.00 H new ATOM 1630 N SER A 222 14.612 3.274 2.432 1.00 0.00 N ATOM 1631 CA SER A 222 15.715 3.739 1.608 1.00 0.00 C ATOM 1632 C SER A 222 16.746 4.403 2.506 1.00 0.00 C ATOM 1633 O SER A 222 17.929 4.103 2.360 1.00 0.00 O ATOM 1634 CB SER A 222 15.240 4.638 0.458 1.00 0.00 C ATOM 1635 OG SER A 222 14.685 5.856 0.902 1.00 0.00 O ATOM 0 H SER A 222 13.705 3.670 2.184 1.00 0.00 H new ATOM 0 HA SER A 222 16.187 2.890 1.114 1.00 0.00 H new ATOM 0 HB2 SER A 222 16.081 4.848 -0.202 1.00 0.00 H new ATOM 0 HB3 SER A 222 14.498 4.101 -0.132 1.00 0.00 H new ATOM 0 HG SER A 222 14.402 6.388 0.129 1.00 0.00 H new ATOM 1641 N GLN A 223 16.316 5.220 3.477 1.00 0.00 N ATOM 1642 CA GLN A 223 17.215 5.815 4.450 1.00 0.00 C ATOM 1643 C GLN A 223 17.996 4.753 5.209 1.00 0.00 C ATOM 1644 O GLN A 223 19.201 4.923 5.368 1.00 0.00 O ATOM 1645 CB GLN A 223 16.453 6.722 5.433 1.00 0.00 C ATOM 1646 CG GLN A 223 16.828 8.192 5.230 1.00 0.00 C ATOM 1647 CD GLN A 223 18.167 8.614 5.853 1.00 0.00 C ATOM 1648 OE1 GLN A 223 19.169 7.745 5.974 1.00 0.00 O flip ATOM 1649 NE2 GLN A 223 18.299 9.772 6.239 1.00 0.00 N flip ATOM 0 H GLN A 223 15.338 5.480 3.602 1.00 0.00 H new ATOM 0 HA GLN A 223 17.926 6.429 3.897 1.00 0.00 H new ATOM 0 HB2 GLN A 223 15.380 6.595 5.293 1.00 0.00 H new ATOM 0 HB3 GLN A 223 16.678 6.424 6.457 1.00 0.00 H new ATOM 0 HG2 GLN A 223 16.862 8.398 4.160 1.00 0.00 H new ATOM 0 HG3 GLN A 223 16.037 8.814 5.650 1.00 0.00 H new ATOM 0 HE21 GLN A 223 17.528 10.433 6.143 1.00 0.00 H new ATOM 0 HE22 GLN A 223 19.180 10.074 6.655 1.00 0.00 H new ATOM 1658 N ALA A 224 17.347 3.686 5.669 1.00 0.00 N ATOM 1659 CA ALA A 224 17.996 2.643 6.442 1.00 0.00 C ATOM 1660 C ALA A 224 18.906 1.792 5.553 1.00 0.00 C ATOM 1661 O ALA A 224 19.802 1.113 6.067 1.00 0.00 O ATOM 1662 CB ALA A 224 16.928 1.779 7.123 1.00 0.00 C ATOM 0 H ALA A 224 16.352 3.525 5.513 1.00 0.00 H new ATOM 0 HA ALA A 224 18.623 3.101 7.207 1.00 0.00 H new ATOM 0 HB1 ALA A 224 17.411 0.994 7.705 1.00 0.00 H new ATOM 0 HB2 ALA A 224 16.324 2.401 7.784 1.00 0.00 H new ATOM 0 HB3 ALA A 224 16.288 1.327 6.365 1.00 0.00 H new ATOM 1668 N TYR A 225 18.700 1.822 4.233 1.00 0.00 N ATOM 1669 CA TYR A 225 19.455 1.045 3.286 1.00 0.00 C ATOM 1670 C TYR A 225 20.713 1.853 3.039 1.00 0.00 C ATOM 1671 O TYR A 225 21.810 1.440 3.418 1.00 0.00 O ATOM 1672 CB TYR A 225 18.604 0.784 2.025 1.00 0.00 C ATOM 1673 CG TYR A 225 19.315 0.730 0.683 1.00 0.00 C ATOM 1674 CD1 TYR A 225 19.962 -0.449 0.269 1.00 0.00 C ATOM 1675 CD2 TYR A 225 19.245 1.833 -0.195 1.00 0.00 C ATOM 1676 CE1 TYR A 225 20.502 -0.546 -1.027 1.00 0.00 C ATOM 1677 CE2 TYR A 225 19.793 1.742 -1.489 1.00 0.00 C ATOM 1678 CZ TYR A 225 20.433 0.552 -1.905 1.00 0.00 C ATOM 1679 OH TYR A 225 20.998 0.447 -3.137 1.00 0.00 O ATOM 0 H TYR A 225 17.984 2.405 3.799 1.00 0.00 H new ATOM 0 HA TYR A 225 19.726 0.050 3.640 1.00 0.00 H new ATOM 0 HB2 TYR A 225 18.082 -0.163 2.165 1.00 0.00 H new ATOM 0 HB3 TYR A 225 17.843 1.562 1.969 1.00 0.00 H new ATOM 0 HD1 TYR A 225 20.045 -1.284 0.949 1.00 0.00 H new ATOM 0 HD2 TYR A 225 18.770 2.748 0.126 1.00 0.00 H new ATOM 0 HE1 TYR A 225 20.970 -1.465 -1.348 1.00 0.00 H new ATOM 0 HE2 TYR A 225 19.724 2.582 -2.164 1.00 0.00 H new ATOM 0 HH TYR A 225 20.868 1.285 -3.629 1.00 0.00 H new ATOM 1689 N TYR A 226 20.522 3.034 2.456 1.00 0.00 N ATOM 1690 CA TYR A 226 21.548 3.904 1.933 1.00 0.00 C ATOM 1691 C TYR A 226 22.422 4.495 3.032 1.00 0.00 C ATOM 1692 O TYR A 226 23.532 4.933 2.742 1.00 0.00 O ATOM 1693 CB TYR A 226 20.893 4.944 1.018 1.00 0.00 C ATOM 1694 CG TYR A 226 20.678 6.344 1.555 1.00 0.00 C ATOM 1695 CD1 TYR A 226 21.762 7.199 1.832 1.00 0.00 C ATOM 1696 CD2 TYR A 226 19.369 6.821 1.698 1.00 0.00 C ATOM 1697 CE1 TYR A 226 21.540 8.465 2.406 1.00 0.00 C ATOM 1698 CE2 TYR A 226 19.136 8.091 2.244 1.00 0.00 C ATOM 1699 CZ TYR A 226 20.217 8.901 2.650 1.00 0.00 C ATOM 1700 OH TYR A 226 19.950 10.111 3.214 1.00 0.00 O ATOM 0 H TYR A 226 19.587 3.424 2.334 1.00 0.00 H new ATOM 0 HA TYR A 226 22.249 3.328 1.329 1.00 0.00 H new ATOM 0 HB2 TYR A 226 21.502 5.024 0.117 1.00 0.00 H new ATOM 0 HB3 TYR A 226 19.922 4.553 0.713 1.00 0.00 H new ATOM 0 HD1 TYR A 226 22.769 6.882 1.603 1.00 0.00 H new ATOM 0 HD2 TYR A 226 18.536 6.208 1.387 1.00 0.00 H new ATOM 0 HE1 TYR A 226 22.376 9.100 2.659 1.00 0.00 H new ATOM 0 HE2 TYR A 226 18.124 8.451 2.354 1.00 0.00 H new ATOM 0 HH TYR A 226 18.980 10.226 3.298 1.00 0.00 H new