USER MOD reduce.3.24.130724 H: found=0, std=0, add=718, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 717 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 -170:sc= -0.0105 (180deg=-0.0779) USER MOD Set 1.2: A 217 GLN : amide:sc= -1.27 X(o=-1.3,f=-1.2) USER MOD Set 2.1: A 186 GLN : amide:sc= 0.669 K(o=1.6,f=-0.51) USER MOD Set 2.2: A 190 THR OG1 : rot 136:sc= 0.97 USER MOD Set 3.1: A 138 MET CE :methyl 176:sc= -0.0553 (180deg=-0.0871) USER MOD Set 3.2: A 150 TYR OH : rot 169:sc= 1.25 USER MOD Set 3.3: A 154 MET CE :methyl -170:sc= -0.811 (180deg=-1.11) USER MOD Single : A 128 TYR OH : rot 3:sc= 1.22 USER MOD Single : A 129 MET CE :methyl 143:sc= -0.149 (180deg=-1.77!) USER MOD Single : A 132 SER OG : rot 180:sc= -0.0873 USER MOD Single : A 135 SER OG : rot 180:sc= 0 USER MOD Single : A 140 HIS : no HD1:sc= -0.0796 X(o=-0.08,f=0) USER MOD Single : A 143 ASN : amide:sc= 1.19 K(o=1.2,f=-0.018) USER MOD Single : A 149 TYR OH : rot -29:sc= 1.23 USER MOD Single : A 153 ASN : amide:sc= 0.584 K(o=0.58,f=0) USER MOD Single : A 155 TYR OH : rot 180:sc= 0 USER MOD Single : A 157 TYR OH : rot 21:sc= 1.23 USER MOD Single : A 159 ASN : amide:sc= 0.488 X(o=0.49,f=0) USER MOD Single : A 160 GLN : amide:sc= 0.418 K(o=0.42,f=-0.19) USER MOD Single : A 162 TYR OH : rot 180:sc= 0 USER MOD Single : A 163 TYR OH : rot 102:sc= 0.0447 USER MOD Single : A 172 GLN :FLIP amide:sc= -0.263 F(o=-0.79,f=-0.26) USER MOD Single : A 173 ASN : amide:sc=-0.00141 X(o=-0.0014,f=0) USER MOD Single : A 174 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 177 HIS :FLIP no HD1:sc= -0.081 F(o=-0.65,f=-0.081) USER MOD Single : A 181 ASN : amide:sc= 0 X(o=0,f=-0.12) USER MOD Single : A 183 THR OG1 : rot 110:sc= 0.252 USER MOD Single : A 185 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 187 HIS : no HD1:sc= 0 X(o=0,f=-0.0095) USER MOD Single : A 188 THR OG1 : rot 88:sc= 0.28 USER MOD Single : A 191 THR OG1 : rot 167:sc= 1.25 USER MOD Single : A 192 THR OG1 : rot -53:sc= 0.989 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= -1.15 X(o=-1.1,f=-0.84) USER MOD Single : A 199 THR OG1 : rot 180:sc= 0 USER MOD Single : A 201 THR OG1 : rot 180:sc= 0 USER MOD Single : A 204 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 205 MET CE :methyl -134:sc= -0.0529 (180deg=-0.499) USER MOD Single : A 206 MET CE :methyl -179:sc= -1.21 (180deg=-1.22) USER MOD Single : A 212 GLN : amide:sc= -0.023 X(o=-0.023,f=-0.15) USER MOD Single : A 213 MET CE :methyl 139:sc= -0.0089 (180deg=-0.84) USER MOD Single : A 216 THR OG1 : rot 72:sc= 1.19 USER MOD Single : A 218 TYR OH : rot 180:sc= 0 USER MOD Single : A 219 GLN :FLIP amide:sc= 0 F(o=-2.2!,f=0) USER MOD Single : A 220 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 222 SER OG : rot 143:sc= 0.315 USER MOD ----------------------------------------------------------------- ATOM 98 N TYR A 128 -9.018 -10.662 -0.699 1.00 0.00 N ATOM 99 CA TYR A 128 -8.202 -9.467 -0.874 1.00 0.00 C ATOM 100 C TYR A 128 -8.227 -9.096 -2.354 1.00 0.00 C ATOM 101 O TYR A 128 -7.562 -9.727 -3.178 1.00 0.00 O ATOM 102 CB TYR A 128 -6.774 -9.718 -0.397 1.00 0.00 C ATOM 103 CG TYR A 128 -6.596 -9.693 1.102 1.00 0.00 C ATOM 104 CD1 TYR A 128 -6.497 -8.468 1.785 1.00 0.00 C ATOM 105 CD2 TYR A 128 -6.457 -10.904 1.800 1.00 0.00 C ATOM 106 CE1 TYR A 128 -6.303 -8.466 3.176 1.00 0.00 C ATOM 107 CE2 TYR A 128 -6.338 -10.907 3.201 1.00 0.00 C ATOM 108 CZ TYR A 128 -6.290 -9.682 3.898 1.00 0.00 C ATOM 109 OH TYR A 128 -6.162 -9.668 5.253 1.00 0.00 O ATOM 0 HA TYR A 128 -8.600 -8.646 -0.279 1.00 0.00 H new ATOM 0 HB2 TYR A 128 -6.445 -10.687 -0.772 1.00 0.00 H new ATOM 0 HB3 TYR A 128 -6.120 -8.966 -0.839 1.00 0.00 H new ATOM 0 HD1 TYR A 128 -6.570 -7.536 1.244 1.00 0.00 H new ATOM 0 HD2 TYR A 128 -6.441 -11.838 1.258 1.00 0.00 H new ATOM 0 HE1 TYR A 128 -6.163 -7.531 3.697 1.00 0.00 H new ATOM 0 HE2 TYR A 128 -6.284 -11.841 3.740 1.00 0.00 H new ATOM 0 HH TYR A 128 -6.137 -8.741 5.570 1.00 0.00 H new ATOM 119 N MET A 129 -9.040 -8.106 -2.692 1.00 0.00 N ATOM 120 CA MET A 129 -9.127 -7.506 -4.005 1.00 0.00 C ATOM 121 C MET A 129 -7.846 -6.702 -4.234 1.00 0.00 C ATOM 122 O MET A 129 -7.447 -5.915 -3.380 1.00 0.00 O ATOM 123 CB MET A 129 -10.398 -6.645 -4.013 1.00 0.00 C ATOM 124 CG MET A 129 -10.527 -5.760 -5.250 1.00 0.00 C ATOM 125 SD MET A 129 -12.223 -5.285 -5.700 1.00 0.00 S ATOM 126 CE MET A 129 -12.889 -4.750 -4.102 1.00 0.00 C ATOM 0 H MET A 129 -9.685 -7.683 -2.024 1.00 0.00 H new ATOM 0 HA MET A 129 -9.202 -8.230 -4.817 1.00 0.00 H new ATOM 0 HB2 MET A 129 -11.269 -7.297 -3.950 1.00 0.00 H new ATOM 0 HB3 MET A 129 -10.406 -6.015 -3.123 1.00 0.00 H new ATOM 0 HG2 MET A 129 -9.945 -4.853 -5.088 1.00 0.00 H new ATOM 0 HG3 MET A 129 -10.078 -6.280 -6.096 1.00 0.00 H new ATOM 0 HE1 MET A 129 -13.551 -3.897 -4.251 1.00 0.00 H new ATOM 0 HE2 MET A 129 -13.449 -5.568 -3.649 1.00 0.00 H new ATOM 0 HE3 MET A 129 -12.069 -4.463 -3.444 1.00 0.00 H new ATOM 136 N LEU A 130 -7.185 -6.887 -5.376 1.00 0.00 N ATOM 137 CA LEU A 130 -5.976 -6.146 -5.728 1.00 0.00 C ATOM 138 C LEU A 130 -6.297 -5.251 -6.908 1.00 0.00 C ATOM 139 O LEU A 130 -6.777 -5.745 -7.930 1.00 0.00 O ATOM 140 CB LEU A 130 -4.830 -7.120 -6.004 1.00 0.00 C ATOM 141 CG LEU A 130 -3.537 -6.488 -6.572 1.00 0.00 C ATOM 142 CD1 LEU A 130 -2.379 -6.548 -5.573 1.00 0.00 C ATOM 143 CD2 LEU A 130 -3.117 -7.276 -7.810 1.00 0.00 C ATOM 0 H LEU A 130 -7.475 -7.559 -6.086 1.00 0.00 H new ATOM 0 HA LEU A 130 -5.644 -5.512 -4.906 1.00 0.00 H new ATOM 0 HB2 LEU A 130 -4.584 -7.635 -5.076 1.00 0.00 H new ATOM 0 HB3 LEU A 130 -5.181 -7.877 -6.705 1.00 0.00 H new ATOM 0 HG LEU A 130 -3.750 -5.443 -6.798 1.00 0.00 H new ATOM 0 HD11 LEU A 130 -1.493 -6.093 -6.015 1.00 0.00 H new ATOM 0 HD12 LEU A 130 -2.651 -6.006 -4.667 1.00 0.00 H new ATOM 0 HD13 LEU A 130 -2.167 -7.588 -5.324 1.00 0.00 H new ATOM 0 HD21 LEU A 130 -2.206 -6.844 -8.224 1.00 0.00 H new ATOM 0 HD22 LEU A 130 -2.934 -8.315 -7.535 1.00 0.00 H new ATOM 0 HD23 LEU A 130 -3.911 -7.233 -8.556 1.00 0.00 H new ATOM 155 N GLY A 131 -6.075 -3.949 -6.742 1.00 0.00 N ATOM 156 CA GLY A 131 -6.408 -2.939 -7.735 1.00 0.00 C ATOM 157 C GLY A 131 -5.396 -2.934 -8.872 1.00 0.00 C ATOM 158 O GLY A 131 -4.352 -3.589 -8.792 1.00 0.00 O ATOM 0 H GLY A 131 -5.651 -3.563 -5.898 1.00 0.00 H new ATOM 0 HA2 GLY A 131 -7.405 -3.130 -8.132 1.00 0.00 H new ATOM 0 HA3 GLY A 131 -6.435 -1.956 -7.264 1.00 0.00 H new ATOM 162 N SER A 132 -5.672 -2.158 -9.921 1.00 0.00 N ATOM 163 CA SER A 132 -4.644 -1.901 -10.921 1.00 0.00 C ATOM 164 C SER A 132 -3.560 -1.014 -10.322 1.00 0.00 C ATOM 165 O SER A 132 -3.704 -0.380 -9.273 1.00 0.00 O ATOM 166 CB SER A 132 -5.238 -1.336 -12.215 1.00 0.00 C ATOM 167 OG SER A 132 -4.302 -0.973 -13.214 1.00 0.00 O ATOM 0 H SER A 132 -6.572 -1.710 -10.095 1.00 0.00 H new ATOM 0 HA SER A 132 -4.179 -2.844 -11.207 1.00 0.00 H new ATOM 0 HB2 SER A 132 -5.920 -2.076 -12.634 1.00 0.00 H new ATOM 0 HB3 SER A 132 -5.835 -0.458 -11.966 1.00 0.00 H new ATOM 0 HG SER A 132 -4.778 -0.627 -13.998 1.00 0.00 H new ATOM 173 N ALA A 133 -2.452 -1.012 -11.035 1.00 0.00 N ATOM 174 CA ALA A 133 -1.233 -0.326 -10.726 1.00 0.00 C ATOM 175 C ALA A 133 -1.410 1.194 -10.729 1.00 0.00 C ATOM 176 O ALA A 133 -2.269 1.749 -11.426 1.00 0.00 O ATOM 177 CB ALA A 133 -0.269 -0.811 -11.799 1.00 0.00 C ATOM 0 H ALA A 133 -2.385 -1.532 -11.910 1.00 0.00 H new ATOM 0 HA ALA A 133 -0.870 -0.539 -9.721 1.00 0.00 H new ATOM 0 HB1 ALA A 133 0.704 -0.342 -11.653 1.00 0.00 H new ATOM 0 HB2 ALA A 133 -0.164 -1.894 -11.731 1.00 0.00 H new ATOM 0 HB3 ALA A 133 -0.656 -0.545 -12.783 1.00 0.00 H new ATOM 183 N MET A 134 -0.562 1.870 -9.956 1.00 0.00 N ATOM 184 CA MET A 134 -0.589 3.313 -9.761 1.00 0.00 C ATOM 185 C MET A 134 0.829 3.885 -9.860 1.00 0.00 C ATOM 186 O MET A 134 1.819 3.146 -9.939 1.00 0.00 O ATOM 187 CB MET A 134 -1.270 3.650 -8.423 1.00 0.00 C ATOM 188 CG MET A 134 -2.717 3.138 -8.354 1.00 0.00 C ATOM 189 SD MET A 134 -3.731 3.844 -7.024 1.00 0.00 S ATOM 190 CE MET A 134 -3.403 2.692 -5.670 1.00 0.00 C ATOM 0 H MET A 134 0.185 1.412 -9.433 1.00 0.00 H new ATOM 0 HA MET A 134 -1.178 3.781 -10.550 1.00 0.00 H new ATOM 0 HB2 MET A 134 -0.695 3.214 -7.606 1.00 0.00 H new ATOM 0 HB3 MET A 134 -1.263 4.730 -8.277 1.00 0.00 H new ATOM 0 HG2 MET A 134 -3.203 3.345 -9.307 1.00 0.00 H new ATOM 0 HG3 MET A 134 -2.696 2.055 -8.235 1.00 0.00 H new ATOM 0 HE1 MET A 134 -4.089 2.893 -4.847 1.00 0.00 H new ATOM 0 HE2 MET A 134 -3.545 1.669 -6.020 1.00 0.00 H new ATOM 0 HE3 MET A 134 -2.377 2.818 -5.325 1.00 0.00 H new ATOM 200 N SER A 135 0.916 5.211 -9.917 1.00 0.00 N ATOM 201 CA SER A 135 2.055 5.969 -10.393 1.00 0.00 C ATOM 202 C SER A 135 2.844 6.565 -9.227 1.00 0.00 C ATOM 203 O SER A 135 2.227 7.193 -8.364 1.00 0.00 O ATOM 204 CB SER A 135 1.487 7.112 -11.240 1.00 0.00 C ATOM 205 OG SER A 135 0.455 6.691 -12.113 1.00 0.00 O ATOM 0 H SER A 135 0.149 5.812 -9.615 1.00 0.00 H new ATOM 0 HA SER A 135 2.729 5.325 -10.959 1.00 0.00 H new ATOM 0 HB2 SER A 135 1.103 7.890 -10.580 1.00 0.00 H new ATOM 0 HB3 SER A 135 2.291 7.558 -11.825 1.00 0.00 H new ATOM 0 HG SER A 135 0.128 7.459 -12.627 1.00 0.00 H new ATOM 211 N ARG A 136 4.179 6.427 -9.263 1.00 0.00 N ATOM 212 CA ARG A 136 5.182 6.845 -8.271 1.00 0.00 C ATOM 213 C ARG A 136 4.706 8.003 -7.393 1.00 0.00 C ATOM 214 O ARG A 136 4.853 9.166 -7.790 1.00 0.00 O ATOM 215 CB ARG A 136 6.498 7.207 -8.978 1.00 0.00 C ATOM 216 CG ARG A 136 7.273 5.967 -9.434 1.00 0.00 C ATOM 217 CD ARG A 136 8.247 6.275 -10.584 1.00 0.00 C ATOM 218 NE ARG A 136 7.929 5.476 -11.778 1.00 0.00 N ATOM 219 CZ ARG A 136 6.844 5.555 -12.554 1.00 0.00 C ATOM 220 NH1 ARG A 136 5.998 6.580 -12.478 1.00 0.00 N ATOM 221 NH2 ARG A 136 6.610 4.584 -13.427 1.00 0.00 N ATOM 0 H ARG A 136 4.625 5.978 -10.063 1.00 0.00 H new ATOM 0 HA ARG A 136 5.345 5.999 -7.603 1.00 0.00 H new ATOM 0 HB2 ARG A 136 6.283 7.836 -9.842 1.00 0.00 H new ATOM 0 HB3 ARG A 136 7.121 7.794 -8.303 1.00 0.00 H new ATOM 0 HG2 ARG A 136 7.829 5.559 -8.590 1.00 0.00 H new ATOM 0 HG3 ARG A 136 6.569 5.199 -9.754 1.00 0.00 H new ATOM 0 HD2 ARG A 136 8.200 7.336 -10.830 1.00 0.00 H new ATOM 0 HD3 ARG A 136 9.268 6.067 -10.265 1.00 0.00 H new ATOM 0 HE ARG A 136 8.621 4.776 -12.046 1.00 0.00 H new ATOM 0 HH11 ARG A 136 6.169 7.334 -11.813 1.00 0.00 H new ATOM 0 HH12 ARG A 136 5.178 6.611 -13.084 1.00 0.00 H new ATOM 0 HH21 ARG A 136 7.253 3.795 -13.497 1.00 0.00 H new ATOM 0 HH22 ARG A 136 5.787 4.626 -14.028 1.00 0.00 H new ATOM 235 N PRO A 137 4.134 7.724 -6.217 1.00 0.00 N ATOM 236 CA PRO A 137 3.723 8.772 -5.313 1.00 0.00 C ATOM 237 C PRO A 137 4.976 9.337 -4.655 1.00 0.00 C ATOM 238 O PRO A 137 5.767 8.579 -4.084 1.00 0.00 O ATOM 239 CB PRO A 137 2.807 8.100 -4.302 1.00 0.00 C ATOM 240 CG PRO A 137 3.273 6.648 -4.270 1.00 0.00 C ATOM 241 CD PRO A 137 3.900 6.407 -5.640 1.00 0.00 C ATOM 0 HA PRO A 137 3.201 9.596 -5.799 1.00 0.00 H new ATOM 0 HB2 PRO A 137 2.891 8.565 -3.320 1.00 0.00 H new ATOM 0 HB3 PRO A 137 1.762 8.175 -4.602 1.00 0.00 H new ATOM 0 HG2 PRO A 137 3.995 6.482 -3.470 1.00 0.00 H new ATOM 0 HG3 PRO A 137 2.439 5.969 -4.092 1.00 0.00 H new ATOM 0 HD2 PRO A 137 4.833 5.851 -5.549 1.00 0.00 H new ATOM 0 HD3 PRO A 137 3.237 5.817 -6.273 1.00 0.00 H new ATOM 249 N MET A 138 5.181 10.649 -4.727 1.00 0.00 N ATOM 250 CA MET A 138 6.198 11.276 -3.898 1.00 0.00 C ATOM 251 C MET A 138 5.658 11.330 -2.478 1.00 0.00 C ATOM 252 O MET A 138 4.482 11.649 -2.289 1.00 0.00 O ATOM 253 CB MET A 138 6.553 12.663 -4.449 1.00 0.00 C ATOM 254 CG MET A 138 7.927 13.117 -3.946 1.00 0.00 C ATOM 255 SD MET A 138 9.307 11.969 -4.261 1.00 0.00 S ATOM 256 CE MET A 138 9.297 11.935 -6.072 1.00 0.00 C ATOM 0 H MET A 138 4.668 11.285 -5.338 1.00 0.00 H new ATOM 0 HA MET A 138 7.125 10.703 -3.903 1.00 0.00 H new ATOM 0 HB2 MET A 138 6.551 12.637 -5.539 1.00 0.00 H new ATOM 0 HB3 MET A 138 5.794 13.384 -4.146 1.00 0.00 H new ATOM 0 HG2 MET A 138 8.164 14.075 -4.409 1.00 0.00 H new ATOM 0 HG3 MET A 138 7.861 13.289 -2.872 1.00 0.00 H new ATOM 0 HE1 MET A 138 10.131 11.331 -6.429 1.00 0.00 H new ATOM 0 HE2 MET A 138 8.359 11.503 -6.423 1.00 0.00 H new ATOM 0 HE3 MET A 138 9.395 12.951 -6.456 1.00 0.00 H new ATOM 266 N ILE A 139 6.473 10.969 -1.492 1.00 0.00 N ATOM 267 CA ILE A 139 6.123 11.139 -0.091 1.00 0.00 C ATOM 268 C ILE A 139 6.888 12.401 0.362 1.00 0.00 C ATOM 269 O ILE A 139 7.762 12.892 -0.358 1.00 0.00 O ATOM 270 CB ILE A 139 6.431 9.842 0.713 1.00 0.00 C ATOM 271 CG1 ILE A 139 6.259 8.538 -0.128 1.00 0.00 C ATOM 272 CG2 ILE A 139 5.570 9.776 1.993 1.00 0.00 C ATOM 273 CD1 ILE A 139 6.043 7.247 0.663 1.00 0.00 C ATOM 0 H ILE A 139 7.391 10.552 -1.644 1.00 0.00 H new ATOM 0 HA ILE A 139 5.058 11.290 0.084 1.00 0.00 H new ATOM 0 HB ILE A 139 7.484 9.897 0.988 1.00 0.00 H new ATOM 0 HG12 ILE A 139 5.412 8.673 -0.800 1.00 0.00 H new ATOM 0 HG13 ILE A 139 7.144 8.413 -0.752 1.00 0.00 H new ATOM 0 HG21 ILE A 139 5.801 8.862 2.540 1.00 0.00 H new ATOM 0 HG22 ILE A 139 5.786 10.640 2.622 1.00 0.00 H new ATOM 0 HG23 ILE A 139 4.514 9.780 1.722 1.00 0.00 H new ATOM 0 HD11 ILE A 139 5.937 6.411 -0.028 1.00 0.00 H new ATOM 0 HD12 ILE A 139 6.899 7.073 1.315 1.00 0.00 H new ATOM 0 HD13 ILE A 139 5.139 7.337 1.266 1.00 0.00 H new ATOM 285 N HIS A 140 6.571 12.968 1.523 1.00 0.00 N ATOM 286 CA HIS A 140 7.290 14.111 2.071 1.00 0.00 C ATOM 287 C HIS A 140 7.645 13.781 3.514 1.00 0.00 C ATOM 288 O HIS A 140 7.246 14.471 4.456 1.00 0.00 O ATOM 289 CB HIS A 140 6.540 15.437 1.836 1.00 0.00 C ATOM 290 CG HIS A 140 5.046 15.409 2.060 1.00 0.00 C ATOM 291 ND1 HIS A 140 4.362 15.967 3.116 1.00 0.00 N ATOM 292 CD2 HIS A 140 4.118 14.912 1.185 1.00 0.00 C ATOM 293 CE1 HIS A 140 3.051 15.798 2.889 1.00 0.00 C ATOM 294 NE2 HIS A 140 2.842 15.161 1.716 1.00 0.00 N ATOM 0 H HIS A 140 5.804 12.644 2.112 1.00 0.00 H new ATOM 0 HA HIS A 140 8.228 14.288 1.544 1.00 0.00 H new ATOM 0 HB2 HIS A 140 6.970 16.194 2.491 1.00 0.00 H new ATOM 0 HB3 HIS A 140 6.727 15.759 0.811 1.00 0.00 H new ATOM 0 HD2 HIS A 140 4.330 14.415 0.250 1.00 0.00 H new ATOM 0 HE1 HIS A 140 2.267 16.127 3.555 1.00 0.00 H new ATOM 0 HE2 HIS A 140 1.944 14.912 1.302 1.00 0.00 H new ATOM 302 N PHE A 141 8.462 12.728 3.667 1.00 0.00 N ATOM 303 CA PHE A 141 9.079 12.359 4.932 1.00 0.00 C ATOM 304 C PHE A 141 9.921 13.527 5.458 1.00 0.00 C ATOM 305 O PHE A 141 10.142 13.650 6.665 1.00 0.00 O ATOM 306 CB PHE A 141 10.004 11.150 4.754 1.00 0.00 C ATOM 307 CG PHE A 141 9.440 9.897 4.116 1.00 0.00 C ATOM 308 CD1 PHE A 141 8.909 8.861 4.913 1.00 0.00 C ATOM 309 CD2 PHE A 141 9.606 9.691 2.732 1.00 0.00 C ATOM 310 CE1 PHE A 141 8.685 7.597 4.355 1.00 0.00 C ATOM 311 CE2 PHE A 141 9.295 8.443 2.166 1.00 0.00 C ATOM 312 CZ PHE A 141 8.893 7.385 2.989 1.00 0.00 C ATOM 0 H PHE A 141 8.711 12.105 2.899 1.00 0.00 H new ATOM 0 HA PHE A 141 8.283 12.111 5.634 1.00 0.00 H new ATOM 0 HB2 PHE A 141 10.858 11.471 4.157 1.00 0.00 H new ATOM 0 HB3 PHE A 141 10.387 10.878 5.738 1.00 0.00 H new ATOM 0 HD1 PHE A 141 8.676 9.043 5.952 1.00 0.00 H new ATOM 0 HD2 PHE A 141 9.972 10.492 2.107 1.00 0.00 H new ATOM 0 HE1 PHE A 141 8.351 6.783 4.981 1.00 0.00 H new ATOM 0 HE2 PHE A 141 9.366 8.301 1.098 1.00 0.00 H new ATOM 0 HZ PHE A 141 8.743 6.402 2.568 1.00 0.00 H new ATOM 322 N GLY A 142 10.407 14.380 4.556 1.00 0.00 N ATOM 323 CA GLY A 142 10.966 15.685 4.850 1.00 0.00 C ATOM 324 C GLY A 142 12.481 15.692 4.886 1.00 0.00 C ATOM 325 O GLY A 142 13.085 16.745 4.712 1.00 0.00 O ATOM 0 H GLY A 142 10.419 14.164 3.559 1.00 0.00 H new ATOM 0 HA2 GLY A 142 10.624 16.397 4.099 1.00 0.00 H new ATOM 0 HA3 GLY A 142 10.585 16.028 5.812 1.00 0.00 H new ATOM 329 N ASN A 143 13.096 14.528 5.073 1.00 0.00 N ATOM 330 CA ASN A 143 14.536 14.386 4.998 1.00 0.00 C ATOM 331 C ASN A 143 14.898 14.323 3.525 1.00 0.00 C ATOM 332 O ASN A 143 14.493 13.378 2.845 1.00 0.00 O ATOM 333 CB ASN A 143 14.998 13.109 5.691 1.00 0.00 C ATOM 334 CG ASN A 143 15.048 13.216 7.204 1.00 0.00 C ATOM 335 OD1 ASN A 143 15.760 14.061 7.744 1.00 0.00 O ATOM 336 ND2 ASN A 143 14.350 12.348 7.914 1.00 0.00 N ATOM 0 H ASN A 143 12.604 13.659 5.281 1.00 0.00 H new ATOM 0 HA ASN A 143 15.022 15.225 5.496 1.00 0.00 H new ATOM 0 HB2 ASN A 143 14.328 12.295 5.416 1.00 0.00 H new ATOM 0 HB3 ASN A 143 15.989 12.845 5.322 1.00 0.00 H new ATOM 0 HD21 ASN A 143 14.395 12.369 8.933 1.00 0.00 H new ATOM 0 HD22 ASN A 143 13.766 11.656 7.443 1.00 0.00 H new ATOM 343 N ASP A 144 15.687 15.278 3.039 1.00 0.00 N ATOM 344 CA ASP A 144 16.169 15.278 1.657 1.00 0.00 C ATOM 345 C ASP A 144 16.952 13.999 1.337 1.00 0.00 C ATOM 346 O ASP A 144 16.891 13.528 0.196 1.00 0.00 O ATOM 347 CB ASP A 144 17.033 16.519 1.379 1.00 0.00 C ATOM 348 CG ASP A 144 16.201 17.673 0.817 1.00 0.00 C ATOM 349 OD1 ASP A 144 15.398 18.287 1.564 1.00 0.00 O ATOM 350 OD2 ASP A 144 16.318 17.953 -0.394 1.00 0.00 O ATOM 0 H ASP A 144 16.011 16.073 3.590 1.00 0.00 H new ATOM 0 HA ASP A 144 15.296 15.310 1.005 1.00 0.00 H new ATOM 0 HB2 ASP A 144 17.521 16.837 2.301 1.00 0.00 H new ATOM 0 HB3 ASP A 144 17.823 16.262 0.673 1.00 0.00 H new ATOM 355 N TRP A 145 17.664 13.429 2.321 1.00 0.00 N ATOM 356 CA TRP A 145 18.410 12.184 2.149 1.00 0.00 C ATOM 357 C TRP A 145 17.459 11.005 1.950 1.00 0.00 C ATOM 358 O TRP A 145 17.745 10.138 1.125 1.00 0.00 O ATOM 359 CB TRP A 145 19.382 11.920 3.318 1.00 0.00 C ATOM 360 CG TRP A 145 18.815 11.395 4.612 1.00 0.00 C ATOM 361 CD1 TRP A 145 18.588 12.128 5.724 1.00 0.00 C ATOM 362 CD2 TRP A 145 18.415 10.027 4.955 1.00 0.00 C ATOM 363 NE1 TRP A 145 18.046 11.326 6.709 1.00 0.00 N ATOM 364 CE2 TRP A 145 17.904 10.024 6.286 1.00 0.00 C ATOM 365 CE3 TRP A 145 18.397 8.792 4.269 1.00 0.00 C ATOM 366 CZ2 TRP A 145 17.364 8.873 6.883 1.00 0.00 C ATOM 367 CZ3 TRP A 145 17.867 7.628 4.858 1.00 0.00 C ATOM 368 CH2 TRP A 145 17.327 7.670 6.156 1.00 0.00 C ATOM 0 H TRP A 145 17.736 13.824 3.259 1.00 0.00 H new ATOM 0 HA TRP A 145 19.017 12.294 1.250 1.00 0.00 H new ATOM 0 HB2 TRP A 145 20.134 11.211 2.972 1.00 0.00 H new ATOM 0 HB3 TRP A 145 19.901 12.853 3.536 1.00 0.00 H new ATOM 0 HD1 TRP A 145 18.799 13.182 5.827 1.00 0.00 H new ATOM 0 HE1 TRP A 145 17.783 11.658 7.637 1.00 0.00 H new ATOM 0 HE3 TRP A 145 18.800 8.739 3.268 1.00 0.00 H new ATOM 0 HZ2 TRP A 145 16.980 8.912 7.892 1.00 0.00 H new ATOM 0 HZ3 TRP A 145 17.875 6.697 4.310 1.00 0.00 H new ATOM 0 HH2 TRP A 145 16.887 6.785 6.591 1.00 0.00 H new ATOM 379 N GLU A 146 16.348 10.961 2.699 1.00 0.00 N ATOM 380 CA GLU A 146 15.349 9.910 2.557 1.00 0.00 C ATOM 381 C GLU A 146 14.781 10.041 1.161 1.00 0.00 C ATOM 382 O GLU A 146 14.829 9.082 0.396 1.00 0.00 O ATOM 383 CB GLU A 146 14.227 9.983 3.617 1.00 0.00 C ATOM 384 CG GLU A 146 14.774 9.608 4.993 1.00 0.00 C ATOM 385 CD GLU A 146 13.737 9.494 6.116 1.00 0.00 C ATOM 386 OE1 GLU A 146 12.972 10.448 6.384 1.00 0.00 O ATOM 387 OE2 GLU A 146 13.737 8.457 6.814 1.00 0.00 O ATOM 0 H GLU A 146 16.124 11.652 3.415 1.00 0.00 H new ATOM 0 HA GLU A 146 15.821 8.940 2.715 1.00 0.00 H new ATOM 0 HB2 GLU A 146 13.809 10.989 3.646 1.00 0.00 H new ATOM 0 HB3 GLU A 146 13.415 9.309 3.344 1.00 0.00 H new ATOM 0 HG2 GLU A 146 15.296 8.655 4.908 1.00 0.00 H new ATOM 0 HG3 GLU A 146 15.515 10.352 5.283 1.00 0.00 H new ATOM 394 N ASP A 147 14.304 11.238 0.821 1.00 0.00 N ATOM 395 CA ASP A 147 13.506 11.490 -0.370 1.00 0.00 C ATOM 396 C ASP A 147 14.221 10.941 -1.614 1.00 0.00 C ATOM 397 O ASP A 147 13.657 10.154 -2.378 1.00 0.00 O ATOM 398 CB ASP A 147 13.260 12.999 -0.485 1.00 0.00 C ATOM 399 CG ASP A 147 11.996 13.291 -1.285 1.00 0.00 C ATOM 400 OD1 ASP A 147 10.895 13.011 -0.752 1.00 0.00 O ATOM 401 OD2 ASP A 147 12.110 13.872 -2.386 1.00 0.00 O ATOM 0 H ASP A 147 14.467 12.075 1.381 1.00 0.00 H new ATOM 0 HA ASP A 147 12.546 10.979 -0.295 1.00 0.00 H new ATOM 0 HB2 ASP A 147 13.172 13.433 0.511 1.00 0.00 H new ATOM 0 HB3 ASP A 147 14.115 13.474 -0.965 1.00 0.00 H new ATOM 406 N ARG A 148 15.508 11.292 -1.766 1.00 0.00 N ATOM 407 CA ARG A 148 16.391 10.798 -2.821 1.00 0.00 C ATOM 408 C ARG A 148 16.596 9.287 -2.717 1.00 0.00 C ATOM 409 O ARG A 148 16.506 8.627 -3.746 1.00 0.00 O ATOM 410 CB ARG A 148 17.733 11.555 -2.751 1.00 0.00 C ATOM 411 CG ARG A 148 18.889 10.814 -3.439 1.00 0.00 C ATOM 412 CD ARG A 148 20.203 11.592 -3.418 1.00 0.00 C ATOM 413 NE ARG A 148 21.302 10.695 -3.802 1.00 0.00 N ATOM 414 CZ ARG A 148 22.342 10.947 -4.598 1.00 0.00 C ATOM 415 NH1 ARG A 148 22.554 12.176 -5.062 1.00 0.00 N ATOM 416 NH2 ARG A 148 23.160 9.947 -4.911 1.00 0.00 N ATOM 0 H ARG A 148 15.971 11.947 -1.136 1.00 0.00 H new ATOM 0 HA ARG A 148 15.927 10.983 -3.790 1.00 0.00 H new ATOM 0 HB2 ARG A 148 17.613 12.535 -3.213 1.00 0.00 H new ATOM 0 HB3 ARG A 148 17.991 11.725 -1.706 1.00 0.00 H new ATOM 0 HG2 ARG A 148 19.037 9.851 -2.949 1.00 0.00 H new ATOM 0 HG3 ARG A 148 18.614 10.607 -4.473 1.00 0.00 H new ATOM 0 HD2 ARG A 148 20.150 12.437 -4.105 1.00 0.00 H new ATOM 0 HD3 ARG A 148 20.382 12.001 -2.423 1.00 0.00 H new ATOM 0 HE ARG A 148 21.264 9.755 -3.407 1.00 0.00 H new ATOM 0 HH11 ARG A 148 21.919 12.933 -4.809 1.00 0.00 H new ATOM 0 HH12 ARG A 148 23.352 12.361 -5.670 1.00 0.00 H new ATOM 0 HH21 ARG A 148 22.985 9.011 -4.544 1.00 0.00 H new ATOM 0 HH22 ARG A 148 23.962 10.115 -5.518 1.00 0.00 H new ATOM 430 N TYR A 149 16.918 8.726 -1.543 1.00 0.00 N ATOM 431 CA TYR A 149 17.120 7.280 -1.389 1.00 0.00 C ATOM 432 C TYR A 149 15.931 6.535 -1.993 1.00 0.00 C ATOM 433 O TYR A 149 16.125 5.632 -2.817 1.00 0.00 O ATOM 434 CB TYR A 149 17.378 6.909 0.092 1.00 0.00 C ATOM 435 CG TYR A 149 16.844 5.573 0.617 1.00 0.00 C ATOM 436 CD1 TYR A 149 16.928 4.384 -0.138 1.00 0.00 C ATOM 437 CD2 TYR A 149 16.232 5.528 1.886 1.00 0.00 C ATOM 438 CE1 TYR A 149 16.427 3.170 0.367 1.00 0.00 C ATOM 439 CE2 TYR A 149 15.741 4.317 2.405 1.00 0.00 C ATOM 440 CZ TYR A 149 15.854 3.132 1.654 1.00 0.00 C ATOM 441 OH TYR A 149 15.519 1.950 2.226 1.00 0.00 O ATOM 0 H TYR A 149 17.045 9.257 -0.681 1.00 0.00 H new ATOM 0 HA TYR A 149 18.013 6.973 -1.933 1.00 0.00 H new ATOM 0 HB2 TYR A 149 18.456 6.921 0.253 1.00 0.00 H new ATOM 0 HB3 TYR A 149 16.954 7.701 0.710 1.00 0.00 H new ATOM 0 HD1 TYR A 149 17.383 4.406 -1.117 1.00 0.00 H new ATOM 0 HD2 TYR A 149 16.139 6.434 2.466 1.00 0.00 H new ATOM 0 HE1 TYR A 149 16.481 2.271 -0.229 1.00 0.00 H new ATOM 0 HE2 TYR A 149 15.277 4.296 3.380 1.00 0.00 H new ATOM 0 HH TYR A 149 15.292 1.301 1.527 1.00 0.00 H new ATOM 451 N TYR A 150 14.721 6.929 -1.593 1.00 0.00 N ATOM 452 CA TYR A 150 13.486 6.398 -2.132 1.00 0.00 C ATOM 453 C TYR A 150 13.462 6.594 -3.643 1.00 0.00 C ATOM 454 O TYR A 150 13.395 5.604 -4.360 1.00 0.00 O ATOM 455 CB TYR A 150 12.289 7.045 -1.429 1.00 0.00 C ATOM 456 CG TYR A 150 10.969 6.911 -2.160 1.00 0.00 C ATOM 457 CD1 TYR A 150 10.357 5.652 -2.280 1.00 0.00 C ATOM 458 CD2 TYR A 150 10.356 8.045 -2.728 1.00 0.00 C ATOM 459 CE1 TYR A 150 9.164 5.515 -3.011 1.00 0.00 C ATOM 460 CE2 TYR A 150 9.137 7.924 -3.417 1.00 0.00 C ATOM 461 CZ TYR A 150 8.545 6.650 -3.578 1.00 0.00 C ATOM 462 OH TYR A 150 7.391 6.508 -4.282 1.00 0.00 O ATOM 0 H TYR A 150 14.579 7.638 -0.873 1.00 0.00 H new ATOM 0 HA TYR A 150 13.421 5.326 -1.945 1.00 0.00 H new ATOM 0 HB2 TYR A 150 12.185 6.602 -0.439 1.00 0.00 H new ATOM 0 HB3 TYR A 150 12.501 8.104 -1.284 1.00 0.00 H new ATOM 0 HD1 TYR A 150 10.804 4.788 -1.810 1.00 0.00 H new ATOM 0 HD2 TYR A 150 10.825 9.013 -2.633 1.00 0.00 H new ATOM 0 HE1 TYR A 150 8.720 4.539 -3.139 1.00 0.00 H new ATOM 0 HE2 TYR A 150 8.654 8.801 -3.822 1.00 0.00 H new ATOM 0 HH TYR A 150 7.006 7.391 -4.460 1.00 0.00 H new ATOM 472 N ARG A 151 13.577 7.826 -4.143 1.00 0.00 N ATOM 473 CA ARG A 151 13.578 8.140 -5.575 1.00 0.00 C ATOM 474 C ARG A 151 14.500 7.241 -6.387 1.00 0.00 C ATOM 475 O ARG A 151 14.085 6.726 -7.423 1.00 0.00 O ATOM 476 CB ARG A 151 13.953 9.613 -5.756 1.00 0.00 C ATOM 477 CG ARG A 151 12.708 10.496 -5.730 1.00 0.00 C ATOM 478 CD ARG A 151 12.907 11.866 -5.073 1.00 0.00 C ATOM 479 NE ARG A 151 13.958 12.657 -5.725 1.00 0.00 N ATOM 480 CZ ARG A 151 14.210 13.952 -5.525 1.00 0.00 C ATOM 481 NH1 ARG A 151 13.557 14.644 -4.600 1.00 0.00 N ATOM 482 NH2 ARG A 151 15.125 14.543 -6.276 1.00 0.00 N ATOM 0 H ARG A 151 13.674 8.651 -3.552 1.00 0.00 H new ATOM 0 HA ARG A 151 12.575 7.954 -5.959 1.00 0.00 H new ATOM 0 HB2 ARG A 151 14.638 9.919 -4.965 1.00 0.00 H new ATOM 0 HB3 ARG A 151 14.479 9.746 -6.702 1.00 0.00 H new ATOM 0 HG2 ARG A 151 12.364 10.646 -6.753 1.00 0.00 H new ATOM 0 HG3 ARG A 151 11.915 9.967 -5.202 1.00 0.00 H new ATOM 0 HD2 ARG A 151 11.969 12.420 -5.104 1.00 0.00 H new ATOM 0 HD3 ARG A 151 13.161 11.728 -4.022 1.00 0.00 H new ATOM 0 HE ARG A 151 14.553 12.170 -6.395 1.00 0.00 H new ATOM 0 HH11 ARG A 151 12.848 14.187 -4.027 1.00 0.00 H new ATOM 0 HH12 ARG A 151 13.764 15.633 -4.462 1.00 0.00 H new ATOM 0 HH21 ARG A 151 15.621 14.010 -6.990 1.00 0.00 H new ATOM 0 HH22 ARG A 151 15.334 15.532 -6.141 1.00 0.00 H new ATOM 496 N GLU A 152 15.738 7.049 -5.950 1.00 0.00 N ATOM 497 CA GLU A 152 16.702 6.212 -6.649 1.00 0.00 C ATOM 498 C GLU A 152 16.264 4.739 -6.714 1.00 0.00 C ATOM 499 O GLU A 152 16.692 4.024 -7.622 1.00 0.00 O ATOM 500 CB GLU A 152 18.085 6.286 -5.985 1.00 0.00 C ATOM 501 CG GLU A 152 18.819 7.638 -6.117 1.00 0.00 C ATOM 502 CD GLU A 152 20.355 7.480 -6.149 1.00 0.00 C ATOM 503 OE1 GLU A 152 20.886 6.395 -5.799 1.00 0.00 O ATOM 504 OE2 GLU A 152 21.048 8.449 -6.530 1.00 0.00 O ATOM 0 H GLU A 152 16.102 7.472 -5.096 1.00 0.00 H new ATOM 0 HA GLU A 152 16.756 6.602 -7.665 1.00 0.00 H new ATOM 0 HB2 GLU A 152 17.972 6.057 -4.925 1.00 0.00 H new ATOM 0 HB3 GLU A 152 18.716 5.507 -6.414 1.00 0.00 H new ATOM 0 HG2 GLU A 152 18.490 8.138 -7.028 1.00 0.00 H new ATOM 0 HG3 GLU A 152 18.541 8.281 -5.282 1.00 0.00 H new ATOM 511 N ASN A 153 15.438 4.259 -5.777 1.00 0.00 N ATOM 512 CA ASN A 153 15.185 2.831 -5.555 1.00 0.00 C ATOM 513 C ASN A 153 13.706 2.456 -5.636 1.00 0.00 C ATOM 514 O ASN A 153 13.400 1.273 -5.507 1.00 0.00 O ATOM 515 CB ASN A 153 15.754 2.392 -4.192 1.00 0.00 C ATOM 516 CG ASN A 153 17.272 2.349 -4.200 1.00 0.00 C ATOM 517 OD1 ASN A 153 17.870 1.350 -4.603 1.00 0.00 O ATOM 518 ND2 ASN A 153 17.909 3.433 -3.789 1.00 0.00 N ATOM 0 H ASN A 153 14.918 4.863 -5.141 1.00 0.00 H new ATOM 0 HA ASN A 153 15.692 2.304 -6.364 1.00 0.00 H new ATOM 0 HB2 ASN A 153 15.414 3.080 -3.418 1.00 0.00 H new ATOM 0 HB3 ASN A 153 15.364 1.407 -3.936 1.00 0.00 H new ATOM 0 HD21 ASN A 153 18.929 3.460 -3.799 1.00 0.00 H new ATOM 0 HD22 ASN A 153 17.381 4.242 -3.462 1.00 0.00 H new ATOM 525 N MET A 154 12.802 3.417 -5.859 1.00 0.00 N ATOM 526 CA MET A 154 11.365 3.360 -5.562 1.00 0.00 C ATOM 527 C MET A 154 10.664 2.110 -6.106 1.00 0.00 C ATOM 528 O MET A 154 9.769 1.566 -5.465 1.00 0.00 O ATOM 529 CB MET A 154 10.687 4.680 -6.001 1.00 0.00 C ATOM 530 CG MET A 154 10.791 5.020 -7.499 1.00 0.00 C ATOM 531 SD MET A 154 10.783 6.786 -7.990 1.00 0.00 S ATOM 532 CE MET A 154 9.855 7.645 -6.683 1.00 0.00 C ATOM 0 H MET A 154 13.069 4.308 -6.276 1.00 0.00 H new ATOM 0 HA MET A 154 11.258 3.262 -4.482 1.00 0.00 H new ATOM 0 HB2 MET A 154 9.632 4.632 -5.731 1.00 0.00 H new ATOM 0 HB3 MET A 154 11.125 5.499 -5.430 1.00 0.00 H new ATOM 0 HG2 MET A 154 11.710 4.573 -7.879 1.00 0.00 H new ATOM 0 HG3 MET A 154 9.963 4.529 -8.010 1.00 0.00 H new ATOM 0 HE1 MET A 154 9.655 8.671 -6.993 1.00 0.00 H new ATOM 0 HE2 MET A 154 8.911 7.128 -6.507 1.00 0.00 H new ATOM 0 HE3 MET A 154 10.442 7.651 -5.764 1.00 0.00 H new ATOM 542 N TYR A 155 11.142 1.586 -7.229 1.00 0.00 N ATOM 543 CA TYR A 155 10.680 0.369 -7.889 1.00 0.00 C ATOM 544 C TYR A 155 10.847 -0.905 -7.053 1.00 0.00 C ATOM 545 O TYR A 155 10.320 -1.955 -7.428 1.00 0.00 O ATOM 546 CB TYR A 155 11.445 0.199 -9.208 1.00 0.00 C ATOM 547 CG TYR A 155 12.030 1.480 -9.772 1.00 0.00 C ATOM 548 CD1 TYR A 155 11.170 2.434 -10.331 1.00 0.00 C ATOM 549 CD2 TYR A 155 13.396 1.780 -9.602 1.00 0.00 C ATOM 550 CE1 TYR A 155 11.663 3.679 -10.738 1.00 0.00 C ATOM 551 CE2 TYR A 155 13.902 3.029 -10.001 1.00 0.00 C ATOM 552 CZ TYR A 155 13.031 3.980 -10.576 1.00 0.00 C ATOM 553 OH TYR A 155 13.523 5.172 -11.007 1.00 0.00 O ATOM 0 H TYR A 155 11.910 2.027 -7.735 1.00 0.00 H new ATOM 0 HA TYR A 155 9.609 0.494 -8.049 1.00 0.00 H new ATOM 0 HB2 TYR A 155 12.253 -0.516 -9.054 1.00 0.00 H new ATOM 0 HB3 TYR A 155 10.773 -0.234 -9.949 1.00 0.00 H new ATOM 0 HD1 TYR A 155 10.121 2.208 -10.449 1.00 0.00 H new ATOM 0 HD2 TYR A 155 14.057 1.047 -9.163 1.00 0.00 H new ATOM 0 HE1 TYR A 155 10.997 4.408 -11.175 1.00 0.00 H new ATOM 0 HE2 TYR A 155 14.949 3.260 -9.869 1.00 0.00 H new ATOM 0 HH TYR A 155 14.483 5.217 -10.817 1.00 0.00 H new ATOM 563 N ARG A 156 11.596 -0.857 -5.945 1.00 0.00 N ATOM 564 CA ARG A 156 11.633 -1.941 -4.969 1.00 0.00 C ATOM 565 C ARG A 156 10.233 -2.214 -4.437 1.00 0.00 C ATOM 566 O ARG A 156 9.900 -3.374 -4.195 1.00 0.00 O ATOM 567 CB ARG A 156 12.579 -1.608 -3.799 1.00 0.00 C ATOM 568 CG ARG A 156 13.927 -2.329 -3.896 1.00 0.00 C ATOM 569 CD ARG A 156 14.710 -1.988 -5.163 1.00 0.00 C ATOM 570 NE ARG A 156 15.982 -2.726 -5.200 1.00 0.00 N ATOM 571 CZ ARG A 156 17.009 -2.454 -6.006 1.00 0.00 C ATOM 572 NH1 ARG A 156 16.905 -1.508 -6.934 1.00 0.00 N ATOM 573 NH2 ARG A 156 18.131 -3.148 -5.889 1.00 0.00 N ATOM 0 H ARG A 156 12.191 -0.064 -5.704 1.00 0.00 H new ATOM 0 HA ARG A 156 12.011 -2.831 -5.471 1.00 0.00 H new ATOM 0 HB2 ARG A 156 12.750 -0.532 -3.772 1.00 0.00 H new ATOM 0 HB3 ARG A 156 12.096 -1.878 -2.860 1.00 0.00 H new ATOM 0 HG2 ARG A 156 14.531 -2.073 -3.025 1.00 0.00 H new ATOM 0 HG3 ARG A 156 13.758 -3.405 -3.861 1.00 0.00 H new ATOM 0 HD2 ARG A 156 14.115 -2.234 -6.042 1.00 0.00 H new ATOM 0 HD3 ARG A 156 14.904 -0.916 -5.200 1.00 0.00 H new ATOM 0 HE ARG A 156 16.087 -3.510 -4.556 1.00 0.00 H new ATOM 0 HH11 ARG A 156 16.035 -0.984 -7.033 1.00 0.00 H new ATOM 0 HH12 ARG A 156 17.695 -1.306 -7.547 1.00 0.00 H new ATOM 0 HH21 ARG A 156 18.205 -3.884 -5.187 1.00 0.00 H new ATOM 0 HH22 ARG A 156 18.921 -2.947 -6.501 1.00 0.00 H new ATOM 587 N TYR A 157 9.446 -1.161 -4.250 1.00 0.00 N ATOM 588 CA TYR A 157 8.139 -1.220 -3.636 1.00 0.00 C ATOM 589 C TYR A 157 7.091 -1.339 -4.752 1.00 0.00 C ATOM 590 O TYR A 157 7.328 -0.857 -5.866 1.00 0.00 O ATOM 591 CB TYR A 157 7.962 0.028 -2.762 1.00 0.00 C ATOM 592 CG TYR A 157 9.213 0.406 -1.977 1.00 0.00 C ATOM 593 CD1 TYR A 157 9.734 -0.450 -0.986 1.00 0.00 C ATOM 594 CD2 TYR A 157 9.917 1.575 -2.316 1.00 0.00 C ATOM 595 CE1 TYR A 157 10.936 -0.130 -0.323 1.00 0.00 C ATOM 596 CE2 TYR A 157 11.127 1.889 -1.678 1.00 0.00 C ATOM 597 CZ TYR A 157 11.650 1.039 -0.683 1.00 0.00 C ATOM 598 OH TYR A 157 12.817 1.410 -0.091 1.00 0.00 O ATOM 0 H TYR A 157 9.714 -0.218 -4.532 1.00 0.00 H new ATOM 0 HA TYR A 157 8.020 -2.087 -2.987 1.00 0.00 H new ATOM 0 HB2 TYR A 157 7.673 0.867 -3.395 1.00 0.00 H new ATOM 0 HB3 TYR A 157 7.142 -0.141 -2.064 1.00 0.00 H new ATOM 0 HD1 TYR A 157 9.208 -1.359 -0.733 1.00 0.00 H new ATOM 0 HD2 TYR A 157 9.523 2.237 -3.073 1.00 0.00 H new ATOM 0 HE1 TYR A 157 11.312 -0.775 0.458 1.00 0.00 H new ATOM 0 HE2 TYR A 157 11.661 2.787 -1.951 1.00 0.00 H new ATOM 0 HH TYR A 157 13.233 0.629 0.329 1.00 0.00 H new ATOM 608 N PRO A 158 5.937 -1.975 -4.493 1.00 0.00 N ATOM 609 CA PRO A 158 5.016 -2.368 -5.553 1.00 0.00 C ATOM 610 C PRO A 158 4.323 -1.191 -6.252 1.00 0.00 C ATOM 611 O PRO A 158 4.355 -0.042 -5.798 1.00 0.00 O ATOM 612 CB PRO A 158 4.008 -3.309 -4.889 1.00 0.00 C ATOM 613 CG PRO A 158 4.088 -2.984 -3.401 1.00 0.00 C ATOM 614 CD PRO A 158 5.550 -2.590 -3.233 1.00 0.00 C ATOM 0 HA PRO A 158 5.565 -2.851 -6.361 1.00 0.00 H new ATOM 0 HB2 PRO A 158 3.002 -3.146 -5.275 1.00 0.00 H new ATOM 0 HB3 PRO A 158 4.257 -4.353 -5.079 1.00 0.00 H new ATOM 0 HG2 PRO A 158 3.414 -2.173 -3.125 1.00 0.00 H new ATOM 0 HG3 PRO A 158 3.824 -3.842 -2.783 1.00 0.00 H new ATOM 0 HD2 PRO A 158 5.676 -1.895 -2.403 1.00 0.00 H new ATOM 0 HD3 PRO A 158 6.168 -3.461 -3.016 1.00 0.00 H new ATOM 622 N ASN A 159 3.640 -1.500 -7.358 1.00 0.00 N ATOM 623 CA ASN A 159 2.765 -0.574 -8.070 1.00 0.00 C ATOM 624 C ASN A 159 1.300 -0.800 -7.713 1.00 0.00 C ATOM 625 O ASN A 159 0.503 0.107 -7.946 1.00 0.00 O ATOM 626 CB ASN A 159 2.906 -0.735 -9.592 1.00 0.00 C ATOM 627 CG ASN A 159 4.070 0.056 -10.157 1.00 0.00 C ATOM 628 OD1 ASN A 159 5.207 -0.394 -10.158 1.00 0.00 O ATOM 629 ND2 ASN A 159 3.812 1.230 -10.705 1.00 0.00 N ATOM 0 H ASN A 159 3.683 -2.423 -7.790 1.00 0.00 H new ATOM 0 HA ASN A 159 3.069 0.428 -7.767 1.00 0.00 H new ATOM 0 HB2 ASN A 159 3.038 -1.790 -9.831 1.00 0.00 H new ATOM 0 HB3 ASN A 159 1.984 -0.412 -10.075 1.00 0.00 H new ATOM 0 HD21 ASN A 159 4.564 1.769 -11.134 1.00 0.00 H new ATOM 0 HD22 ASN A 159 2.860 1.597 -10.699 1.00 0.00 H new ATOM 636 N GLN A 160 0.925 -1.981 -7.209 1.00 0.00 N ATOM 637 CA GLN A 160 -0.452 -2.321 -6.853 1.00 0.00 C ATOM 638 C GLN A 160 -0.535 -2.673 -5.357 1.00 0.00 C ATOM 639 O GLN A 160 0.495 -2.756 -4.683 1.00 0.00 O ATOM 640 CB GLN A 160 -0.983 -3.494 -7.697 1.00 0.00 C ATOM 641 CG GLN A 160 -0.618 -3.590 -9.184 1.00 0.00 C ATOM 642 CD GLN A 160 -1.069 -4.918 -9.796 1.00 0.00 C ATOM 643 OE1 GLN A 160 -0.269 -5.831 -9.971 1.00 0.00 O ATOM 644 NE2 GLN A 160 -2.346 -5.077 -10.102 1.00 0.00 N ATOM 0 H GLN A 160 1.584 -2.740 -7.035 1.00 0.00 H new ATOM 0 HA GLN A 160 -1.075 -1.451 -7.060 1.00 0.00 H new ATOM 0 HB2 GLN A 160 -0.649 -4.415 -7.220 1.00 0.00 H new ATOM 0 HB3 GLN A 160 -2.071 -3.477 -7.630 1.00 0.00 H new ATOM 0 HG2 GLN A 160 -1.080 -2.765 -9.726 1.00 0.00 H new ATOM 0 HG3 GLN A 160 0.460 -3.484 -9.301 1.00 0.00 H new ATOM 0 HE21 GLN A 160 -3.005 -4.313 -9.953 1.00 0.00 H new ATOM 0 HE22 GLN A 160 -2.672 -5.964 -10.486 1.00 0.00 H new ATOM 653 N VAL A 161 -1.742 -2.929 -4.846 1.00 0.00 N ATOM 654 CA VAL A 161 -2.060 -3.065 -3.423 1.00 0.00 C ATOM 655 C VAL A 161 -3.302 -3.947 -3.253 1.00 0.00 C ATOM 656 O VAL A 161 -4.191 -3.918 -4.108 1.00 0.00 O ATOM 657 CB VAL A 161 -2.324 -1.657 -2.830 1.00 0.00 C ATOM 658 CG1 VAL A 161 -1.039 -1.006 -2.311 1.00 0.00 C ATOM 659 CG2 VAL A 161 -3.024 -0.697 -3.815 1.00 0.00 C ATOM 0 H VAL A 161 -2.561 -3.053 -5.441 1.00 0.00 H new ATOM 0 HA VAL A 161 -1.225 -3.531 -2.900 1.00 0.00 H new ATOM 0 HB VAL A 161 -3.004 -1.827 -1.996 1.00 0.00 H new ATOM 0 HG11 VAL A 161 -1.269 -0.021 -1.904 1.00 0.00 H new ATOM 0 HG12 VAL A 161 -0.605 -1.630 -1.529 1.00 0.00 H new ATOM 0 HG13 VAL A 161 -0.327 -0.903 -3.130 1.00 0.00 H new ATOM 0 HG21 VAL A 161 -3.178 0.269 -3.334 1.00 0.00 H new ATOM 0 HG22 VAL A 161 -2.402 -0.567 -4.700 1.00 0.00 H new ATOM 0 HG23 VAL A 161 -3.988 -1.114 -4.107 1.00 0.00 H new ATOM 669 N TYR A 162 -3.351 -4.720 -2.161 1.00 0.00 N ATOM 670 CA TYR A 162 -4.459 -5.569 -1.739 1.00 0.00 C ATOM 671 C TYR A 162 -5.322 -4.809 -0.732 1.00 0.00 C ATOM 672 O TYR A 162 -4.890 -4.552 0.399 1.00 0.00 O ATOM 673 CB TYR A 162 -3.946 -6.857 -1.076 1.00 0.00 C ATOM 674 CG TYR A 162 -3.321 -7.874 -2.010 1.00 0.00 C ATOM 675 CD1 TYR A 162 -4.102 -8.645 -2.888 1.00 0.00 C ATOM 676 CD2 TYR A 162 -1.933 -8.041 -2.010 1.00 0.00 C ATOM 677 CE1 TYR A 162 -3.489 -9.504 -3.822 1.00 0.00 C ATOM 678 CE2 TYR A 162 -1.308 -8.945 -2.883 1.00 0.00 C ATOM 679 CZ TYR A 162 -2.082 -9.651 -3.836 1.00 0.00 C ATOM 680 OH TYR A 162 -1.477 -10.385 -4.817 1.00 0.00 O ATOM 0 H TYR A 162 -2.566 -4.768 -1.512 1.00 0.00 H new ATOM 0 HA TYR A 162 -5.042 -5.835 -2.621 1.00 0.00 H new ATOM 0 HB2 TYR A 162 -3.210 -6.586 -0.319 1.00 0.00 H new ATOM 0 HB3 TYR A 162 -4.778 -7.332 -0.556 1.00 0.00 H new ATOM 0 HD1 TYR A 162 -5.179 -8.579 -2.847 1.00 0.00 H new ATOM 0 HD2 TYR A 162 -1.330 -7.463 -1.325 1.00 0.00 H new ATOM 0 HE1 TYR A 162 -4.095 -10.051 -4.529 1.00 0.00 H new ATOM 0 HE2 TYR A 162 -0.241 -9.102 -2.828 1.00 0.00 H new ATOM 0 HH TYR A 162 -0.507 -10.382 -4.677 1.00 0.00 H new ATOM 690 N TYR A 163 -6.551 -4.501 -1.125 1.00 0.00 N ATOM 691 CA TYR A 163 -7.613 -3.989 -0.274 1.00 0.00 C ATOM 692 C TYR A 163 -8.682 -5.072 -0.087 1.00 0.00 C ATOM 693 O TYR A 163 -8.643 -6.129 -0.718 1.00 0.00 O ATOM 694 CB TYR A 163 -8.153 -2.655 -0.829 1.00 0.00 C ATOM 695 CG TYR A 163 -8.790 -2.605 -2.210 1.00 0.00 C ATOM 696 CD1 TYR A 163 -8.019 -2.820 -3.371 1.00 0.00 C ATOM 697 CD2 TYR A 163 -10.123 -2.167 -2.343 1.00 0.00 C ATOM 698 CE1 TYR A 163 -8.588 -2.642 -4.643 1.00 0.00 C ATOM 699 CE2 TYR A 163 -10.696 -1.983 -3.612 1.00 0.00 C ATOM 700 CZ TYR A 163 -9.931 -2.241 -4.768 1.00 0.00 C ATOM 701 OH TYR A 163 -10.479 -2.132 -6.005 1.00 0.00 O ATOM 0 H TYR A 163 -6.847 -4.608 -2.095 1.00 0.00 H new ATOM 0 HA TYR A 163 -7.230 -3.755 0.720 1.00 0.00 H new ATOM 0 HB2 TYR A 163 -8.892 -2.284 -0.118 1.00 0.00 H new ATOM 0 HB3 TYR A 163 -7.326 -1.946 -0.828 1.00 0.00 H new ATOM 0 HD1 TYR A 163 -6.986 -3.123 -3.282 1.00 0.00 H new ATOM 0 HD2 TYR A 163 -10.711 -1.971 -1.459 1.00 0.00 H new ATOM 0 HE1 TYR A 163 -7.993 -2.813 -5.528 1.00 0.00 H new ATOM 0 HE2 TYR A 163 -11.718 -1.645 -3.702 1.00 0.00 H new ATOM 0 HH TYR A 163 -11.038 -2.916 -6.185 1.00 0.00 H new ATOM 711 N ARG A 164 -9.652 -4.841 0.793 1.00 0.00 N ATOM 712 CA ARG A 164 -10.918 -5.579 0.810 1.00 0.00 C ATOM 713 C ARG A 164 -11.992 -4.639 0.251 1.00 0.00 C ATOM 714 O ARG A 164 -11.744 -3.434 0.201 1.00 0.00 O ATOM 715 CB ARG A 164 -11.176 -6.056 2.252 1.00 0.00 C ATOM 716 CG ARG A 164 -10.220 -7.207 2.630 1.00 0.00 C ATOM 717 CD ARG A 164 -9.500 -6.988 3.965 1.00 0.00 C ATOM 718 NE ARG A 164 -10.342 -7.313 5.135 1.00 0.00 N ATOM 719 CZ ARG A 164 -10.012 -8.152 6.129 1.00 0.00 C ATOM 720 NH1 ARG A 164 -8.787 -8.652 6.223 1.00 0.00 N ATOM 721 NH2 ARG A 164 -10.909 -8.496 7.046 1.00 0.00 N ATOM 0 H ARG A 164 -9.584 -4.131 1.522 1.00 0.00 H new ATOM 0 HA ARG A 164 -10.913 -6.475 0.189 1.00 0.00 H new ATOM 0 HB2 ARG A 164 -11.042 -5.224 2.944 1.00 0.00 H new ATOM 0 HB3 ARG A 164 -12.209 -6.389 2.350 1.00 0.00 H new ATOM 0 HG2 ARG A 164 -10.786 -8.138 2.679 1.00 0.00 H new ATOM 0 HG3 ARG A 164 -9.478 -7.327 1.841 1.00 0.00 H new ATOM 0 HD2 ARG A 164 -8.599 -7.602 3.991 1.00 0.00 H new ATOM 0 HD3 ARG A 164 -9.180 -5.948 4.032 1.00 0.00 H new ATOM 0 HE ARG A 164 -11.254 -6.860 5.192 1.00 0.00 H new ATOM 0 HH11 ARG A 164 -8.079 -8.400 5.533 1.00 0.00 H new ATOM 0 HH12 ARG A 164 -8.553 -9.288 6.985 1.00 0.00 H new ATOM 0 HH21 ARG A 164 -11.857 -8.122 6.998 1.00 0.00 H new ATOM 0 HH22 ARG A 164 -10.650 -9.134 7.798 1.00 0.00 H new ATOM 735 N PRO A 165 -13.159 -5.129 -0.200 1.00 0.00 N ATOM 736 CA PRO A 165 -14.195 -4.248 -0.727 1.00 0.00 C ATOM 737 C PRO A 165 -14.653 -3.277 0.362 1.00 0.00 C ATOM 738 O PRO A 165 -14.653 -3.628 1.537 1.00 0.00 O ATOM 739 CB PRO A 165 -15.317 -5.166 -1.214 1.00 0.00 C ATOM 740 CG PRO A 165 -15.117 -6.428 -0.380 1.00 0.00 C ATOM 741 CD PRO A 165 -13.602 -6.512 -0.214 1.00 0.00 C ATOM 0 HA PRO A 165 -13.843 -3.627 -1.551 1.00 0.00 H new ATOM 0 HB2 PRO A 165 -16.300 -4.725 -1.048 1.00 0.00 H new ATOM 0 HB3 PRO A 165 -15.236 -5.371 -2.281 1.00 0.00 H new ATOM 0 HG2 PRO A 165 -15.623 -6.356 0.583 1.00 0.00 H new ATOM 0 HG3 PRO A 165 -15.515 -7.309 -0.884 1.00 0.00 H new ATOM 0 HD2 PRO A 165 -13.332 -7.024 0.709 1.00 0.00 H new ATOM 0 HD3 PRO A 165 -13.143 -7.067 -1.032 1.00 0.00 H new ATOM 749 N VAL A 166 -15.024 -2.062 -0.039 1.00 0.00 N ATOM 750 CA VAL A 166 -15.255 -0.936 0.861 1.00 0.00 C ATOM 751 C VAL A 166 -16.374 -1.239 1.864 1.00 0.00 C ATOM 752 O VAL A 166 -16.160 -1.038 3.060 1.00 0.00 O ATOM 753 CB VAL A 166 -15.472 0.326 0.001 1.00 0.00 C ATOM 754 CG1 VAL A 166 -15.988 1.558 0.750 1.00 0.00 C ATOM 755 CG2 VAL A 166 -14.133 0.696 -0.663 1.00 0.00 C ATOM 0 H VAL A 166 -15.175 -1.829 -1.020 1.00 0.00 H new ATOM 0 HA VAL A 166 -14.387 -0.752 1.494 1.00 0.00 H new ATOM 0 HB VAL A 166 -16.253 0.063 -0.713 1.00 0.00 H new ATOM 0 HG11 VAL A 166 -16.105 2.386 0.051 1.00 0.00 H new ATOM 0 HG12 VAL A 166 -16.951 1.330 1.206 1.00 0.00 H new ATOM 0 HG13 VAL A 166 -15.276 1.836 1.527 1.00 0.00 H new ATOM 0 HG21 VAL A 166 -14.265 1.587 -1.277 1.00 0.00 H new ATOM 0 HG22 VAL A 166 -13.387 0.893 0.107 1.00 0.00 H new ATOM 0 HG23 VAL A 166 -13.797 -0.130 -1.290 1.00 0.00 H new ATOM 840 N GLN A 172 -11.142 3.842 8.178 1.00 0.00 N ATOM 841 CA GLN A 172 -10.126 3.416 7.242 1.00 0.00 C ATOM 842 C GLN A 172 -8.831 3.032 7.939 1.00 0.00 C ATOM 843 O GLN A 172 -8.082 2.230 7.410 1.00 0.00 O ATOM 844 CB GLN A 172 -9.903 4.529 6.211 1.00 0.00 C ATOM 845 CG GLN A 172 -8.701 5.466 6.429 1.00 0.00 C ATOM 846 CD GLN A 172 -8.512 6.432 5.263 1.00 0.00 C ATOM 847 OE1 GLN A 172 -7.272 6.763 4.949 1.00 0.00 O flip ATOM 848 NE2 GLN A 172 -9.440 6.796 4.543 1.00 0.00 N flip ATOM 0 HA GLN A 172 -10.471 2.516 6.734 1.00 0.00 H new ATOM 0 HB2 GLN A 172 -9.794 4.064 5.231 1.00 0.00 H new ATOM 0 HB3 GLN A 172 -10.805 5.140 6.175 1.00 0.00 H new ATOM 0 HG2 GLN A 172 -8.845 6.032 7.349 1.00 0.00 H new ATOM 0 HG3 GLN A 172 -7.796 4.872 6.558 1.00 0.00 H new ATOM 0 HE21 GLN A 172 -10.399 6.543 4.781 1.00 0.00 H new ATOM 0 HE22 GLN A 172 -9.251 7.351 3.708 1.00 0.00 H new ATOM 857 N ASN A 173 -8.539 3.600 9.105 1.00 0.00 N ATOM 858 CA ASN A 173 -7.292 3.404 9.815 1.00 0.00 C ATOM 859 C ASN A 173 -6.920 1.928 9.935 1.00 0.00 C ATOM 860 O ASN A 173 -5.806 1.523 9.590 1.00 0.00 O ATOM 861 CB ASN A 173 -7.402 4.025 11.204 1.00 0.00 C ATOM 862 CG ASN A 173 -6.023 3.986 11.818 1.00 0.00 C ATOM 863 OD1 ASN A 173 -5.695 3.120 12.618 1.00 0.00 O ATOM 864 ND2 ASN A 173 -5.155 4.875 11.384 1.00 0.00 N ATOM 0 H ASN A 173 -9.184 4.224 9.590 1.00 0.00 H new ATOM 0 HA ASN A 173 -6.502 3.890 9.243 1.00 0.00 H new ATOM 0 HB2 ASN A 173 -7.766 5.050 11.140 1.00 0.00 H new ATOM 0 HB3 ASN A 173 -8.113 3.472 11.818 1.00 0.00 H new ATOM 0 HD21 ASN A 173 -4.190 4.849 11.714 1.00 0.00 H new ATOM 0 HD22 ASN A 173 -5.447 5.589 10.717 1.00 0.00 H new ATOM 871 N ASN A 174 -7.872 1.118 10.401 1.00 0.00 N ATOM 872 CA ASN A 174 -7.630 -0.307 10.577 1.00 0.00 C ATOM 873 C ASN A 174 -7.526 -1.042 9.239 1.00 0.00 C ATOM 874 O ASN A 174 -6.768 -2.004 9.121 1.00 0.00 O ATOM 875 CB ASN A 174 -8.728 -0.962 11.419 1.00 0.00 C ATOM 876 CG ASN A 174 -8.316 -2.378 11.795 1.00 0.00 C ATOM 877 OD1 ASN A 174 -7.406 -2.550 12.598 1.00 0.00 O ATOM 878 ND2 ASN A 174 -8.931 -3.410 11.245 1.00 0.00 N ATOM 0 H ASN A 174 -8.809 1.425 10.660 1.00 0.00 H new ATOM 0 HA ASN A 174 -6.676 -0.389 11.098 1.00 0.00 H new ATOM 0 HB2 ASN A 174 -8.907 -0.375 12.320 1.00 0.00 H new ATOM 0 HB3 ASN A 174 -9.664 -0.982 10.860 1.00 0.00 H new ATOM 0 HD21 ASN A 174 -8.650 -4.360 11.488 1.00 0.00 H new ATOM 0 HD22 ASN A 174 -9.687 -3.257 10.578 1.00 0.00 H new ATOM 885 N PHE A 175 -8.308 -0.601 8.250 1.00 0.00 N ATOM 886 CA PHE A 175 -8.361 -1.128 6.891 1.00 0.00 C ATOM 887 C PHE A 175 -7.003 -0.910 6.213 1.00 0.00 C ATOM 888 O PHE A 175 -6.439 -1.846 5.654 1.00 0.00 O ATOM 889 CB PHE A 175 -9.533 -0.432 6.167 1.00 0.00 C ATOM 890 CG PHE A 175 -9.814 -0.809 4.726 1.00 0.00 C ATOM 891 CD1 PHE A 175 -8.908 -0.453 3.710 1.00 0.00 C ATOM 892 CD2 PHE A 175 -11.034 -1.421 4.381 1.00 0.00 C ATOM 893 CE1 PHE A 175 -9.224 -0.684 2.364 1.00 0.00 C ATOM 894 CE2 PHE A 175 -11.357 -1.645 3.030 1.00 0.00 C ATOM 895 CZ PHE A 175 -10.456 -1.261 2.024 1.00 0.00 C ATOM 0 H PHE A 175 -8.955 0.176 8.387 1.00 0.00 H new ATOM 0 HA PHE A 175 -8.544 -2.202 6.868 1.00 0.00 H new ATOM 0 HB2 PHE A 175 -10.439 -0.622 6.743 1.00 0.00 H new ATOM 0 HB3 PHE A 175 -9.353 0.643 6.200 1.00 0.00 H new ATOM 0 HD1 PHE A 175 -7.963 0.001 3.969 1.00 0.00 H new ATOM 0 HD2 PHE A 175 -11.724 -1.720 5.156 1.00 0.00 H new ATOM 0 HE1 PHE A 175 -8.520 -0.418 1.590 1.00 0.00 H new ATOM 0 HE2 PHE A 175 -12.295 -2.111 2.768 1.00 0.00 H new ATOM 0 HZ PHE A 175 -10.712 -1.410 0.986 1.00 0.00 H new ATOM 905 N VAL A 176 -6.449 0.300 6.312 1.00 0.00 N ATOM 906 CA VAL A 176 -5.129 0.689 5.832 1.00 0.00 C ATOM 907 C VAL A 176 -4.082 -0.199 6.487 1.00 0.00 C ATOM 908 O VAL A 176 -3.220 -0.721 5.789 1.00 0.00 O ATOM 909 CB VAL A 176 -4.877 2.176 6.161 1.00 0.00 C ATOM 910 CG1 VAL A 176 -3.423 2.605 5.938 1.00 0.00 C ATOM 911 CG2 VAL A 176 -5.754 3.085 5.299 1.00 0.00 C ATOM 0 H VAL A 176 -6.941 1.076 6.755 1.00 0.00 H new ATOM 0 HA VAL A 176 -5.069 0.564 4.751 1.00 0.00 H new ATOM 0 HB VAL A 176 -5.120 2.278 7.219 1.00 0.00 H new ATOM 0 HG11 VAL A 176 -3.313 3.660 6.187 1.00 0.00 H new ATOM 0 HG12 VAL A 176 -2.767 2.011 6.574 1.00 0.00 H new ATOM 0 HG13 VAL A 176 -3.154 2.449 4.893 1.00 0.00 H new ATOM 0 HG21 VAL A 176 -5.556 4.127 5.551 1.00 0.00 H new ATOM 0 HG22 VAL A 176 -5.527 2.917 4.246 1.00 0.00 H new ATOM 0 HG23 VAL A 176 -6.804 2.860 5.484 1.00 0.00 H new ATOM 921 N HIS A 177 -4.147 -0.386 7.807 1.00 0.00 N ATOM 922 CA HIS A 177 -3.195 -1.246 8.485 1.00 0.00 C ATOM 923 C HIS A 177 -3.261 -2.655 7.883 1.00 0.00 C ATOM 924 O HIS A 177 -2.218 -3.261 7.653 1.00 0.00 O ATOM 925 CB HIS A 177 -3.465 -1.216 9.993 1.00 0.00 C ATOM 926 CG HIS A 177 -2.419 -1.916 10.827 1.00 0.00 C ATOM 927 ND1 HIS A 177 -2.035 -3.227 10.736 1.00 0.00 N flip ATOM 928 CD2 HIS A 177 -1.782 -1.375 11.921 1.00 0.00 C flip ATOM 929 CE1 HIS A 177 -1.149 -3.482 11.785 1.00 0.00 C flip ATOM 930 NE2 HIS A 177 -1.004 -2.327 12.461 1.00 0.00 N flip ATOM 0 H HIS A 177 -4.843 0.044 8.416 1.00 0.00 H new ATOM 0 HA HIS A 177 -2.175 -0.889 8.340 1.00 0.00 H new ATOM 0 HB2 HIS A 177 -3.535 -0.178 10.317 1.00 0.00 H new ATOM 0 HB3 HIS A 177 -4.434 -1.676 10.186 1.00 0.00 H new ATOM 0 HD2 HIS A 177 -1.889 -0.363 12.282 1.00 0.00 H new ATOM 0 HE1 HIS A 177 -0.672 -4.424 12.010 1.00 0.00 H new ATOM 0 HE2 HIS A 177 -0.392 -2.194 13.266 1.00 0.00 H new ATOM 938 N ASP A 178 -4.461 -3.175 7.604 1.00 0.00 N ATOM 939 CA ASP A 178 -4.635 -4.497 7.003 1.00 0.00 C ATOM 940 C ASP A 178 -4.055 -4.529 5.587 1.00 0.00 C ATOM 941 O ASP A 178 -3.394 -5.495 5.225 1.00 0.00 O ATOM 942 CB ASP A 178 -6.116 -4.909 6.995 1.00 0.00 C ATOM 943 CG ASP A 178 -6.285 -6.428 7.062 1.00 0.00 C ATOM 944 OD1 ASP A 178 -6.313 -6.954 8.201 1.00 0.00 O ATOM 945 OD2 ASP A 178 -6.500 -7.087 6.021 1.00 0.00 O ATOM 0 H ASP A 178 -5.338 -2.689 7.790 1.00 0.00 H new ATOM 0 HA ASP A 178 -4.089 -5.218 7.612 1.00 0.00 H new ATOM 0 HB2 ASP A 178 -6.625 -4.449 7.842 1.00 0.00 H new ATOM 0 HB3 ASP A 178 -6.594 -4.530 6.092 1.00 0.00 H new ATOM 950 N CYS A 179 -4.251 -3.469 4.795 1.00 0.00 N ATOM 951 CA CYS A 179 -3.630 -3.298 3.485 1.00 0.00 C ATOM 952 C CYS A 179 -2.107 -3.419 3.585 1.00 0.00 C ATOM 953 O CYS A 179 -1.528 -4.282 2.919 1.00 0.00 O ATOM 954 CB CYS A 179 -3.981 -1.940 2.875 1.00 0.00 C ATOM 955 SG CYS A 179 -5.662 -1.588 2.329 1.00 0.00 S ATOM 0 H CYS A 179 -4.859 -2.693 5.056 1.00 0.00 H new ATOM 0 HA CYS A 179 -4.018 -4.088 2.841 1.00 0.00 H new ATOM 0 HB2 CYS A 179 -3.716 -1.179 3.609 1.00 0.00 H new ATOM 0 HB3 CYS A 179 -3.327 -1.795 2.015 1.00 0.00 H new ATOM 960 N VAL A 180 -1.476 -2.577 4.415 1.00 0.00 N ATOM 961 CA VAL A 180 -0.038 -2.563 4.662 1.00 0.00 C ATOM 962 C VAL A 180 0.392 -3.982 5.016 1.00 0.00 C ATOM 963 O VAL A 180 1.117 -4.609 4.248 1.00 0.00 O ATOM 964 CB VAL A 180 0.315 -1.513 5.751 1.00 0.00 C ATOM 965 CG1 VAL A 180 1.784 -1.574 6.182 1.00 0.00 C ATOM 966 CG2 VAL A 180 0.063 -0.069 5.292 1.00 0.00 C ATOM 0 H VAL A 180 -1.975 -1.865 4.948 1.00 0.00 H new ATOM 0 HA VAL A 180 0.515 -2.256 3.774 1.00 0.00 H new ATOM 0 HB VAL A 180 -0.341 -1.772 6.582 1.00 0.00 H new ATOM 0 HG11 VAL A 180 1.971 -0.818 6.944 1.00 0.00 H new ATOM 0 HG12 VAL A 180 2.003 -2.561 6.589 1.00 0.00 H new ATOM 0 HG13 VAL A 180 2.424 -1.387 5.320 1.00 0.00 H new ATOM 0 HG21 VAL A 180 0.328 0.619 6.095 1.00 0.00 H new ATOM 0 HG22 VAL A 180 0.673 0.145 4.414 1.00 0.00 H new ATOM 0 HG23 VAL A 180 -0.991 0.054 5.041 1.00 0.00 H new ATOM 976 N ASN A 181 -0.102 -4.499 6.139 1.00 0.00 N ATOM 977 CA ASN A 181 0.246 -5.776 6.747 1.00 0.00 C ATOM 978 C ASN A 181 0.218 -6.955 5.779 1.00 0.00 C ATOM 979 O ASN A 181 0.913 -7.940 6.014 1.00 0.00 O ATOM 980 CB ASN A 181 -0.740 -6.057 7.886 1.00 0.00 C ATOM 981 CG ASN A 181 -0.231 -7.111 8.843 1.00 0.00 C ATOM 982 OD1 ASN A 181 0.892 -7.029 9.329 1.00 0.00 O ATOM 983 ND2 ASN A 181 -1.053 -8.069 9.212 1.00 0.00 N ATOM 0 H ASN A 181 -0.805 -4.000 6.684 1.00 0.00 H new ATOM 0 HA ASN A 181 1.274 -5.685 7.099 1.00 0.00 H new ATOM 0 HB2 ASN A 181 -0.930 -5.134 8.434 1.00 0.00 H new ATOM 0 HB3 ASN A 181 -1.693 -6.381 7.467 1.00 0.00 H new ATOM 0 HD21 ASN A 181 -0.759 -8.753 9.909 1.00 0.00 H new ATOM 0 HD22 ASN A 181 -1.985 -8.128 8.801 1.00 0.00 H new ATOM 990 N ILE A 182 -0.583 -6.882 4.716 1.00 0.00 N ATOM 991 CA ILE A 182 -0.777 -7.938 3.739 1.00 0.00 C ATOM 992 C ILE A 182 0.070 -7.669 2.496 1.00 0.00 C ATOM 993 O ILE A 182 0.788 -8.573 2.077 1.00 0.00 O ATOM 994 CB ILE A 182 -2.291 -8.052 3.462 1.00 0.00 C ATOM 995 CG1 ILE A 182 -3.043 -8.565 4.706 1.00 0.00 C ATOM 996 CG2 ILE A 182 -2.632 -8.913 2.240 1.00 0.00 C ATOM 997 CD1 ILE A 182 -2.667 -9.959 5.220 1.00 0.00 C ATOM 0 H ILE A 182 -1.134 -6.049 4.509 1.00 0.00 H new ATOM 0 HA ILE A 182 -0.436 -8.904 4.111 1.00 0.00 H new ATOM 0 HB ILE A 182 -2.625 -7.041 3.228 1.00 0.00 H new ATOM 0 HG12 ILE A 182 -2.886 -7.852 5.515 1.00 0.00 H new ATOM 0 HG13 ILE A 182 -4.110 -8.563 4.482 1.00 0.00 H new ATOM 0 HG21 ILE A 182 -3.714 -8.946 2.109 1.00 0.00 H new ATOM 0 HG22 ILE A 182 -2.172 -8.482 1.351 1.00 0.00 H new ATOM 0 HG23 ILE A 182 -2.253 -9.924 2.390 1.00 0.00 H new ATOM 0 HD11 ILE A 182 -3.269 -10.198 6.097 1.00 0.00 H new ATOM 0 HD12 ILE A 182 -2.854 -10.697 4.440 1.00 0.00 H new ATOM 0 HD13 ILE A 182 -1.611 -9.975 5.489 1.00 0.00 H new ATOM 1009 N THR A 183 0.023 -6.495 1.871 1.00 0.00 N ATOM 1010 CA THR A 183 0.854 -6.177 0.713 1.00 0.00 C ATOM 1011 C THR A 183 2.334 -6.293 1.061 1.00 0.00 C ATOM 1012 O THR A 183 3.089 -6.953 0.347 1.00 0.00 O ATOM 1013 CB THR A 183 0.470 -4.770 0.248 1.00 0.00 C ATOM 1014 OG1 THR A 183 -0.759 -4.914 -0.414 1.00 0.00 O ATOM 1015 CG2 THR A 183 1.455 -4.124 -0.724 1.00 0.00 C ATOM 0 H THR A 183 -0.595 -5.735 2.155 1.00 0.00 H new ATOM 0 HA THR A 183 0.683 -6.884 -0.099 1.00 0.00 H new ATOM 0 HB THR A 183 0.448 -4.119 1.122 1.00 0.00 H new ATOM 0 HG1 THR A 183 -1.470 -4.505 0.123 1.00 0.00 H new ATOM 0 HG21 THR A 183 1.099 -3.131 -0.997 1.00 0.00 H new ATOM 0 HG22 THR A 183 2.433 -4.041 -0.250 1.00 0.00 H new ATOM 0 HG23 THR A 183 1.538 -4.739 -1.620 1.00 0.00 H new ATOM 1023 N ILE A 184 2.737 -5.686 2.174 1.00 0.00 N ATOM 1024 CA ILE A 184 4.090 -5.796 2.714 1.00 0.00 C ATOM 1025 C ILE A 184 4.423 -7.265 2.911 1.00 0.00 C ATOM 1026 O ILE A 184 5.476 -7.703 2.452 1.00 0.00 O ATOM 1027 CB ILE A 184 4.221 -4.951 4.002 1.00 0.00 C ATOM 1028 CG1 ILE A 184 4.109 -3.466 3.570 1.00 0.00 C ATOM 1029 CG2 ILE A 184 5.471 -5.269 4.841 1.00 0.00 C ATOM 1030 CD1 ILE A 184 4.819 -2.464 4.469 1.00 0.00 C ATOM 0 H ILE A 184 2.124 -5.095 2.735 1.00 0.00 H new ATOM 0 HA ILE A 184 4.822 -5.390 2.016 1.00 0.00 H new ATOM 0 HB ILE A 184 3.418 -5.201 4.696 1.00 0.00 H new ATOM 0 HG12 ILE A 184 4.509 -3.369 2.561 1.00 0.00 H new ATOM 0 HG13 ILE A 184 3.053 -3.199 3.521 1.00 0.00 H new ATOM 0 HG21 ILE A 184 5.487 -4.633 5.726 1.00 0.00 H new ATOM 0 HG22 ILE A 184 5.448 -6.315 5.146 1.00 0.00 H new ATOM 0 HG23 ILE A 184 6.365 -5.085 4.246 1.00 0.00 H new ATOM 0 HD11 ILE A 184 4.677 -1.458 4.076 1.00 0.00 H new ATOM 0 HD12 ILE A 184 4.406 -2.522 5.476 1.00 0.00 H new ATOM 0 HD13 ILE A 184 5.884 -2.694 4.500 1.00 0.00 H new ATOM 1042 N LYS A 185 3.520 -8.030 3.535 1.00 0.00 N ATOM 1043 CA LYS A 185 3.692 -9.465 3.713 1.00 0.00 C ATOM 1044 C LYS A 185 3.994 -10.141 2.384 1.00 0.00 C ATOM 1045 O LYS A 185 5.046 -10.761 2.294 1.00 0.00 O ATOM 1046 CB LYS A 185 2.507 -10.069 4.477 1.00 0.00 C ATOM 1047 CG LYS A 185 2.450 -11.597 4.412 1.00 0.00 C ATOM 1048 CD LYS A 185 1.689 -12.162 5.610 1.00 0.00 C ATOM 1049 CE LYS A 185 1.623 -13.685 5.543 1.00 0.00 C ATOM 1050 NZ LYS A 185 1.036 -14.224 6.779 1.00 0.00 N ATOM 0 H LYS A 185 2.652 -7.666 3.928 1.00 0.00 H new ATOM 0 HA LYS A 185 4.564 -9.651 4.340 1.00 0.00 H new ATOM 0 HB2 LYS A 185 2.563 -9.760 5.521 1.00 0.00 H new ATOM 0 HB3 LYS A 185 1.580 -9.662 4.073 1.00 0.00 H new ATOM 0 HG2 LYS A 185 1.965 -11.908 3.487 1.00 0.00 H new ATOM 0 HG3 LYS A 185 3.461 -12.003 4.393 1.00 0.00 H new ATOM 0 HD2 LYS A 185 2.178 -11.855 6.534 1.00 0.00 H new ATOM 0 HD3 LYS A 185 0.680 -11.751 5.632 1.00 0.00 H new ATOM 0 HE2 LYS A 185 1.026 -13.993 4.684 1.00 0.00 H new ATOM 0 HE3 LYS A 185 2.623 -14.093 5.399 1.00 0.00 H new ATOM 0 HZ1 LYS A 185 0.997 -15.262 6.721 1.00 0.00 H new ATOM 0 HZ2 LYS A 185 1.621 -13.945 7.592 1.00 0.00 H new ATOM 0 HZ3 LYS A 185 0.074 -13.847 6.900 1.00 0.00 H new ATOM 1064 N GLN A 186 3.147 -10.034 1.354 1.00 0.00 N ATOM 1065 CA GLN A 186 3.452 -10.673 0.074 1.00 0.00 C ATOM 1066 C GLN A 186 4.802 -10.190 -0.444 1.00 0.00 C ATOM 1067 O GLN A 186 5.638 -11.028 -0.764 1.00 0.00 O ATOM 1068 CB GLN A 186 2.374 -10.441 -1.005 1.00 0.00 C ATOM 1069 CG GLN A 186 1.293 -11.530 -1.074 1.00 0.00 C ATOM 1070 CD GLN A 186 1.838 -12.900 -1.447 1.00 0.00 C ATOM 1071 OE1 GLN A 186 2.366 -13.117 -2.536 1.00 0.00 O ATOM 1072 NE2 GLN A 186 1.744 -13.850 -0.533 1.00 0.00 N ATOM 0 H GLN A 186 2.265 -9.523 1.381 1.00 0.00 H new ATOM 0 HA GLN A 186 3.478 -11.745 0.269 1.00 0.00 H new ATOM 0 HB2 GLN A 186 1.893 -9.481 -0.818 1.00 0.00 H new ATOM 0 HB3 GLN A 186 2.861 -10.369 -1.977 1.00 0.00 H new ATOM 0 HG2 GLN A 186 0.793 -11.597 -0.108 1.00 0.00 H new ATOM 0 HG3 GLN A 186 0.538 -11.237 -1.804 1.00 0.00 H new ATOM 0 HE21 GLN A 186 1.303 -13.652 0.365 1.00 0.00 H new ATOM 0 HE22 GLN A 186 2.113 -14.781 -0.726 1.00 0.00 H new ATOM 1081 N HIS A 187 5.067 -8.883 -0.494 1.00 0.00 N ATOM 1082 CA HIS A 187 6.332 -8.399 -1.036 1.00 0.00 C ATOM 1083 C HIS A 187 7.551 -8.808 -0.198 1.00 0.00 C ATOM 1084 O HIS A 187 8.655 -8.744 -0.723 1.00 0.00 O ATOM 1085 CB HIS A 187 6.296 -6.884 -1.289 1.00 0.00 C ATOM 1086 CG HIS A 187 6.540 -6.561 -2.744 1.00 0.00 C ATOM 1087 ND1 HIS A 187 7.751 -6.243 -3.327 1.00 0.00 N ATOM 1088 CD2 HIS A 187 5.610 -6.656 -3.745 1.00 0.00 C ATOM 1089 CE1 HIS A 187 7.540 -6.110 -4.649 1.00 0.00 C ATOM 1090 NE2 HIS A 187 6.256 -6.369 -4.954 1.00 0.00 N ATOM 0 H HIS A 187 4.432 -8.153 -0.171 1.00 0.00 H new ATOM 0 HA HIS A 187 6.455 -8.895 -1.999 1.00 0.00 H new ATOM 0 HB2 HIS A 187 5.328 -6.486 -0.984 1.00 0.00 H new ATOM 0 HB3 HIS A 187 7.051 -6.393 -0.675 1.00 0.00 H new ATOM 0 HD2 HIS A 187 4.567 -6.907 -3.624 1.00 0.00 H new ATOM 0 HE1 HIS A 187 8.298 -5.833 -5.367 1.00 0.00 H new ATOM 0 HE2 HIS A 187 5.835 -6.358 -5.883 1.00 0.00 H new ATOM 1098 N THR A 188 7.367 -9.289 1.035 1.00 0.00 N ATOM 1099 CA THR A 188 8.373 -9.802 1.968 1.00 0.00 C ATOM 1100 C THR A 188 8.296 -11.340 2.088 1.00 0.00 C ATOM 1101 O THR A 188 8.998 -11.955 2.889 1.00 0.00 O ATOM 1102 CB THR A 188 8.131 -9.087 3.311 1.00 0.00 C ATOM 1103 OG1 THR A 188 8.340 -7.695 3.144 1.00 0.00 O ATOM 1104 CG2 THR A 188 9.014 -9.523 4.486 1.00 0.00 C ATOM 0 H THR A 188 6.432 -9.333 1.439 1.00 0.00 H new ATOM 0 HA THR A 188 9.384 -9.597 1.615 1.00 0.00 H new ATOM 0 HB THR A 188 7.108 -9.358 3.570 1.00 0.00 H new ATOM 0 HG1 THR A 188 7.504 -7.271 2.857 1.00 0.00 H new ATOM 0 HG21 THR A 188 8.749 -8.948 5.373 1.00 0.00 H new ATOM 0 HG22 THR A 188 8.861 -10.584 4.682 1.00 0.00 H new ATOM 0 HG23 THR A 188 10.061 -9.347 4.239 1.00 0.00 H new ATOM 1112 N VAL A 189 7.441 -12.014 1.319 1.00 0.00 N ATOM 1113 CA VAL A 189 7.269 -13.467 1.371 1.00 0.00 C ATOM 1114 C VAL A 189 7.448 -14.068 -0.018 1.00 0.00 C ATOM 1115 O VAL A 189 8.240 -14.992 -0.164 1.00 0.00 O ATOM 1116 CB VAL A 189 5.920 -13.838 2.018 1.00 0.00 C ATOM 1117 CG1 VAL A 189 5.578 -15.328 1.889 1.00 0.00 C ATOM 1118 CG2 VAL A 189 5.942 -13.519 3.519 1.00 0.00 C ATOM 0 H VAL A 189 6.839 -11.560 0.632 1.00 0.00 H new ATOM 0 HA VAL A 189 8.042 -13.898 2.007 1.00 0.00 H new ATOM 0 HB VAL A 189 5.172 -13.251 1.486 1.00 0.00 H new ATOM 0 HG11 VAL A 189 4.617 -15.523 2.365 1.00 0.00 H new ATOM 0 HG12 VAL A 189 5.523 -15.599 0.835 1.00 0.00 H new ATOM 0 HG13 VAL A 189 6.351 -15.922 2.376 1.00 0.00 H new ATOM 0 HG21 VAL A 189 4.983 -13.786 3.962 1.00 0.00 H new ATOM 0 HG22 VAL A 189 6.736 -14.090 4.001 1.00 0.00 H new ATOM 0 HG23 VAL A 189 6.123 -12.454 3.662 1.00 0.00 H new ATOM 1128 N THR A 190 6.782 -13.531 -1.036 1.00 0.00 N ATOM 1129 CA THR A 190 6.702 -13.966 -2.435 1.00 0.00 C ATOM 1130 C THR A 190 8.028 -13.731 -3.199 1.00 0.00 C ATOM 1131 O THR A 190 8.107 -13.782 -4.429 1.00 0.00 O ATOM 1132 CB THR A 190 5.441 -13.266 -3.006 1.00 0.00 C ATOM 1133 OG1 THR A 190 4.621 -14.166 -3.720 1.00 0.00 O ATOM 1134 CG2 THR A 190 5.655 -11.987 -3.820 1.00 0.00 C ATOM 0 H THR A 190 6.224 -12.690 -0.889 1.00 0.00 H new ATOM 0 HA THR A 190 6.585 -15.044 -2.545 1.00 0.00 H new ATOM 0 HB THR A 190 4.939 -12.923 -2.101 1.00 0.00 H new ATOM 0 HG1 THR A 190 3.683 -14.015 -3.480 1.00 0.00 H new ATOM 0 HG21 THR A 190 4.691 -11.605 -4.157 1.00 0.00 H new ATOM 0 HG22 THR A 190 6.145 -11.238 -3.198 1.00 0.00 H new ATOM 0 HG23 THR A 190 6.281 -12.207 -4.685 1.00 0.00 H new ATOM 1142 N THR A 191 9.080 -13.460 -2.437 1.00 0.00 N ATOM 1143 CA THR A 191 10.341 -12.832 -2.766 1.00 0.00 C ATOM 1144 C THR A 191 11.377 -13.433 -1.833 1.00 0.00 C ATOM 1145 O THR A 191 12.366 -14.001 -2.272 1.00 0.00 O ATOM 1146 CB THR A 191 10.187 -11.330 -2.483 1.00 0.00 C ATOM 1147 OG1 THR A 191 9.426 -11.151 -1.297 1.00 0.00 O ATOM 1148 CG2 THR A 191 9.492 -10.693 -3.667 1.00 0.00 C ATOM 0 H THR A 191 9.059 -13.710 -1.448 1.00 0.00 H new ATOM 0 HA THR A 191 10.634 -12.982 -3.805 1.00 0.00 H new ATOM 0 HB THR A 191 11.161 -10.861 -2.340 1.00 0.00 H new ATOM 0 HG1 THR A 191 9.495 -10.219 -1.002 1.00 0.00 H new ATOM 0 HG21 THR A 191 9.372 -9.625 -3.487 1.00 0.00 H new ATOM 0 HG22 THR A 191 10.091 -10.845 -4.565 1.00 0.00 H new ATOM 0 HG23 THR A 191 8.512 -11.150 -3.803 1.00 0.00 H new ATOM 1156 N THR A 192 11.132 -13.386 -0.527 1.00 0.00 N ATOM 1157 CA THR A 192 11.941 -14.059 0.470 1.00 0.00 C ATOM 1158 C THR A 192 11.909 -15.576 0.254 1.00 0.00 C ATOM 1159 O THR A 192 12.941 -16.222 0.414 1.00 0.00 O ATOM 1160 CB THR A 192 11.466 -13.543 1.828 1.00 0.00 C ATOM 1161 OG1 THR A 192 11.759 -12.159 1.868 1.00 0.00 O ATOM 1162 CG2 THR A 192 12.096 -14.214 3.037 1.00 0.00 C ATOM 0 H THR A 192 10.349 -12.867 -0.130 1.00 0.00 H new ATOM 0 HA THR A 192 13.005 -13.834 0.398 1.00 0.00 H new ATOM 0 HB THR A 192 10.402 -13.770 1.902 1.00 0.00 H new ATOM 0 HG1 THR A 192 12.704 -12.018 1.650 1.00 0.00 H new ATOM 0 HG21 THR A 192 11.691 -13.775 3.949 1.00 0.00 H new ATOM 0 HG22 THR A 192 11.874 -15.281 3.018 1.00 0.00 H new ATOM 0 HG23 THR A 192 13.176 -14.068 3.013 1.00 0.00 H new ATOM 1170 N THR A 193 10.812 -16.125 -0.273 1.00 0.00 N ATOM 1171 CA THR A 193 10.716 -17.499 -0.754 1.00 0.00 C ATOM 1172 C THR A 193 11.480 -17.730 -2.076 1.00 0.00 C ATOM 1173 O THR A 193 11.378 -18.814 -2.647 1.00 0.00 O ATOM 1174 CB THR A 193 9.216 -17.853 -0.874 1.00 0.00 C ATOM 1175 OG1 THR A 193 8.969 -19.239 -0.740 1.00 0.00 O ATOM 1176 CG2 THR A 193 8.571 -17.333 -2.171 1.00 0.00 C ATOM 0 H THR A 193 9.940 -15.606 -0.379 1.00 0.00 H new ATOM 0 HA THR A 193 11.200 -18.165 -0.040 1.00 0.00 H new ATOM 0 HB THR A 193 8.746 -17.337 -0.037 1.00 0.00 H new ATOM 0 HG1 THR A 193 8.007 -19.409 -0.822 1.00 0.00 H new ATOM 0 HG21 THR A 193 7.518 -17.615 -2.192 1.00 0.00 H new ATOM 0 HG22 THR A 193 8.656 -16.247 -2.210 1.00 0.00 H new ATOM 0 HG23 THR A 193 9.081 -17.768 -3.031 1.00 0.00 H new ATOM 1184 N LYS A 194 12.152 -16.701 -2.600 1.00 0.00 N ATOM 1185 CA LYS A 194 12.920 -16.665 -3.841 1.00 0.00 C ATOM 1186 C LYS A 194 14.337 -16.113 -3.610 1.00 0.00 C ATOM 1187 O LYS A 194 15.084 -15.958 -4.575 1.00 0.00 O ATOM 1188 CB LYS A 194 12.213 -15.815 -4.918 1.00 0.00 C ATOM 1189 CG LYS A 194 10.692 -15.989 -5.053 1.00 0.00 C ATOM 1190 CD LYS A 194 10.207 -15.331 -6.349 1.00 0.00 C ATOM 1191 CE LYS A 194 8.866 -15.904 -6.812 1.00 0.00 C ATOM 1192 NZ LYS A 194 8.549 -15.501 -8.203 1.00 0.00 N ATOM 0 H LYS A 194 12.172 -15.799 -2.125 1.00 0.00 H new ATOM 0 HA LYS A 194 12.993 -17.694 -4.193 1.00 0.00 H new ATOM 0 HB2 LYS A 194 12.417 -14.765 -4.709 1.00 0.00 H new ATOM 0 HB3 LYS A 194 12.667 -16.043 -5.882 1.00 0.00 H new ATOM 0 HG2 LYS A 194 10.437 -17.049 -5.055 1.00 0.00 H new ATOM 0 HG3 LYS A 194 10.188 -15.541 -4.196 1.00 0.00 H new ATOM 0 HD2 LYS A 194 10.109 -14.256 -6.196 1.00 0.00 H new ATOM 0 HD3 LYS A 194 10.953 -15.475 -7.131 1.00 0.00 H new ATOM 0 HE2 LYS A 194 8.892 -16.992 -6.745 1.00 0.00 H new ATOM 0 HE3 LYS A 194 8.074 -15.563 -6.145 1.00 0.00 H new ATOM 0 HZ1 LYS A 194 7.633 -15.908 -8.482 1.00 0.00 H new ATOM 0 HZ2 LYS A 194 8.499 -14.464 -8.261 1.00 0.00 H new ATOM 0 HZ3 LYS A 194 9.292 -15.848 -8.843 1.00 0.00 H new ATOM 1206 N GLY A 195 14.703 -15.770 -2.370 1.00 0.00 N ATOM 1207 CA GLY A 195 16.030 -15.322 -1.994 1.00 0.00 C ATOM 1208 C GLY A 195 16.080 -13.805 -1.911 1.00 0.00 C ATOM 1209 O GLY A 195 16.993 -13.199 -2.473 1.00 0.00 O ATOM 0 H GLY A 195 14.056 -15.801 -1.582 1.00 0.00 H new ATOM 0 HA2 GLY A 195 16.306 -15.753 -1.032 1.00 0.00 H new ATOM 0 HA3 GLY A 195 16.759 -15.676 -2.723 1.00 0.00 H new ATOM 1213 N GLU A 196 15.126 -13.182 -1.211 1.00 0.00 N ATOM 1214 CA GLU A 196 15.017 -11.731 -1.068 1.00 0.00 C ATOM 1215 C GLU A 196 14.907 -11.339 0.413 1.00 0.00 C ATOM 1216 O GLU A 196 14.505 -12.160 1.248 1.00 0.00 O ATOM 1217 CB GLU A 196 13.818 -11.220 -1.882 1.00 0.00 C ATOM 1218 CG GLU A 196 13.830 -9.716 -2.164 1.00 0.00 C ATOM 1219 CD GLU A 196 13.459 -9.435 -3.618 1.00 0.00 C ATOM 1220 OE1 GLU A 196 14.343 -9.481 -4.500 1.00 0.00 O ATOM 1221 OE2 GLU A 196 12.267 -9.176 -3.894 1.00 0.00 O ATOM 0 H GLU A 196 14.391 -13.688 -0.717 1.00 0.00 H new ATOM 0 HA GLU A 196 15.920 -11.261 -1.459 1.00 0.00 H new ATOM 0 HB2 GLU A 196 13.787 -11.754 -2.832 1.00 0.00 H new ATOM 0 HB3 GLU A 196 12.901 -11.468 -1.347 1.00 0.00 H new ATOM 0 HG2 GLU A 196 13.128 -9.211 -1.501 1.00 0.00 H new ATOM 0 HG3 GLU A 196 14.819 -9.309 -1.951 1.00 0.00 H new ATOM 1228 N ASN A 197 15.214 -10.083 0.747 1.00 0.00 N ATOM 1229 CA ASN A 197 15.176 -9.551 2.110 1.00 0.00 C ATOM 1230 C ASN A 197 14.732 -8.090 2.125 1.00 0.00 C ATOM 1231 O ASN A 197 14.808 -7.427 1.092 1.00 0.00 O ATOM 1232 CB ASN A 197 16.564 -9.685 2.759 1.00 0.00 C ATOM 1233 CG ASN A 197 16.585 -9.111 4.168 1.00 0.00 C ATOM 1234 OD1 ASN A 197 17.254 -8.131 4.462 1.00 0.00 O ATOM 1235 ND2 ASN A 197 15.779 -9.674 5.050 1.00 0.00 N ATOM 0 H ASN A 197 15.504 -9.390 0.057 1.00 0.00 H new ATOM 0 HA ASN A 197 14.448 -10.129 2.680 1.00 0.00 H new ATOM 0 HB2 ASN A 197 16.851 -10.736 2.790 1.00 0.00 H new ATOM 0 HB3 ASN A 197 17.304 -9.171 2.146 1.00 0.00 H new ATOM 0 HD21 ASN A 197 15.708 -9.291 5.993 1.00 0.00 H new ATOM 0 HD22 ASN A 197 15.228 -10.491 4.788 1.00 0.00 H new ATOM 1242 N PHE A 198 14.284 -7.596 3.283 1.00 0.00 N ATOM 1243 CA PHE A 198 13.777 -6.253 3.503 1.00 0.00 C ATOM 1244 C PHE A 198 14.266 -5.765 4.865 1.00 0.00 C ATOM 1245 O PHE A 198 13.752 -6.185 5.907 1.00 0.00 O ATOM 1246 CB PHE A 198 12.248 -6.270 3.406 1.00 0.00 C ATOM 1247 CG PHE A 198 11.783 -6.471 1.983 1.00 0.00 C ATOM 1248 CD1 PHE A 198 11.626 -5.352 1.151 1.00 0.00 C ATOM 1249 CD2 PHE A 198 11.617 -7.764 1.457 1.00 0.00 C ATOM 1250 CE1 PHE A 198 11.291 -5.520 -0.204 1.00 0.00 C ATOM 1251 CE2 PHE A 198 11.320 -7.933 0.099 1.00 0.00 C ATOM 1252 CZ PHE A 198 11.150 -6.814 -0.733 1.00 0.00 C ATOM 0 H PHE A 198 14.268 -8.159 4.133 1.00 0.00 H new ATOM 0 HA PHE A 198 14.145 -5.562 2.744 1.00 0.00 H new ATOM 0 HB2 PHE A 198 11.852 -7.067 4.035 1.00 0.00 H new ATOM 0 HB3 PHE A 198 11.848 -5.332 3.791 1.00 0.00 H new ATOM 0 HD1 PHE A 198 11.763 -4.359 1.553 1.00 0.00 H new ATOM 0 HD2 PHE A 198 11.718 -8.626 2.100 1.00 0.00 H new ATOM 0 HE1 PHE A 198 11.142 -4.657 -0.836 1.00 0.00 H new ATOM 0 HE2 PHE A 198 11.221 -8.928 -0.310 1.00 0.00 H new ATOM 0 HZ PHE A 198 10.911 -6.948 -1.778 1.00 0.00 H new ATOM 1262 N THR A 199 15.292 -4.919 4.859 1.00 0.00 N ATOM 1263 CA THR A 199 15.763 -4.231 6.053 1.00 0.00 C ATOM 1264 C THR A 199 14.676 -3.298 6.560 1.00 0.00 C ATOM 1265 O THR A 199 13.951 -2.720 5.755 1.00 0.00 O ATOM 1266 CB THR A 199 17.050 -3.446 5.746 1.00 0.00 C ATOM 1267 OG1 THR A 199 17.015 -2.669 4.559 1.00 0.00 O ATOM 1268 CG2 THR A 199 18.203 -4.441 5.646 1.00 0.00 C ATOM 0 H THR A 199 15.823 -4.691 4.018 1.00 0.00 H new ATOM 0 HA THR A 199 15.991 -4.965 6.826 1.00 0.00 H new ATOM 0 HB THR A 199 17.173 -2.733 6.561 1.00 0.00 H new ATOM 0 HG1 THR A 199 17.871 -2.206 4.446 1.00 0.00 H new ATOM 0 HG21 THR A 199 19.127 -3.906 5.428 1.00 0.00 H new ATOM 0 HG22 THR A 199 18.306 -4.974 6.591 1.00 0.00 H new ATOM 0 HG23 THR A 199 18.000 -5.154 4.847 1.00 0.00 H new ATOM 1276 N GLU A 200 14.582 -3.108 7.875 1.00 0.00 N ATOM 1277 CA GLU A 200 13.585 -2.252 8.515 1.00 0.00 C ATOM 1278 C GLU A 200 13.534 -0.837 7.909 1.00 0.00 C ATOM 1279 O GLU A 200 12.438 -0.316 7.734 1.00 0.00 O ATOM 1280 CB GLU A 200 13.780 -2.274 10.035 1.00 0.00 C ATOM 1281 CG GLU A 200 15.182 -1.820 10.421 1.00 0.00 C ATOM 1282 CD GLU A 200 15.423 -1.802 11.935 1.00 0.00 C ATOM 1283 OE1 GLU A 200 14.679 -1.134 12.690 1.00 0.00 O ATOM 1284 OE2 GLU A 200 16.403 -2.432 12.392 1.00 0.00 O ATOM 0 H GLU A 200 15.212 -3.556 8.541 1.00 0.00 H new ATOM 0 HA GLU A 200 12.595 -2.659 8.310 1.00 0.00 H new ATOM 0 HB2 GLU A 200 13.043 -1.625 10.508 1.00 0.00 H new ATOM 0 HB3 GLU A 200 13.606 -3.282 10.411 1.00 0.00 H new ATOM 0 HG2 GLU A 200 15.911 -2.481 9.953 1.00 0.00 H new ATOM 0 HG3 GLU A 200 15.355 -0.821 10.022 1.00 0.00 H new ATOM 1291 N THR A 201 14.661 -0.235 7.503 1.00 0.00 N ATOM 1292 CA THR A 201 14.636 1.057 6.806 1.00 0.00 C ATOM 1293 C THR A 201 13.990 0.949 5.412 1.00 0.00 C ATOM 1294 O THR A 201 13.295 1.875 4.996 1.00 0.00 O ATOM 1295 CB THR A 201 16.049 1.662 6.754 1.00 0.00 C ATOM 1296 OG1 THR A 201 16.445 2.020 8.064 1.00 0.00 O ATOM 1297 CG2 THR A 201 16.130 2.936 5.905 1.00 0.00 C ATOM 0 H THR A 201 15.595 -0.620 7.644 1.00 0.00 H new ATOM 0 HA THR A 201 14.004 1.739 7.375 1.00 0.00 H new ATOM 0 HB THR A 201 16.692 0.904 6.308 1.00 0.00 H new ATOM 0 HG1 THR A 201 17.346 2.405 8.040 1.00 0.00 H new ATOM 0 HG21 THR A 201 17.153 3.312 5.910 1.00 0.00 H new ATOM 0 HG22 THR A 201 15.831 2.711 4.881 1.00 0.00 H new ATOM 0 HG23 THR A 201 15.464 3.692 6.319 1.00 0.00 H new ATOM 1305 N ASP A 202 14.152 -0.159 4.680 1.00 0.00 N ATOM 1306 CA ASP A 202 13.397 -0.332 3.431 1.00 0.00 C ATOM 1307 C ASP A 202 11.910 -0.478 3.757 1.00 0.00 C ATOM 1308 O ASP A 202 11.070 0.100 3.065 1.00 0.00 O ATOM 1309 CB ASP A 202 13.886 -1.532 2.592 1.00 0.00 C ATOM 1310 CG ASP A 202 14.909 -1.141 1.525 1.00 0.00 C ATOM 1311 OD1 ASP A 202 14.724 -0.094 0.860 1.00 0.00 O ATOM 1312 OD2 ASP A 202 15.904 -1.877 1.349 1.00 0.00 O ATOM 0 H ASP A 202 14.778 -0.928 4.919 1.00 0.00 H new ATOM 0 HA ASP A 202 13.564 0.555 2.820 1.00 0.00 H new ATOM 0 HB2 ASP A 202 14.328 -2.275 3.255 1.00 0.00 H new ATOM 0 HB3 ASP A 202 13.030 -2.004 2.110 1.00 0.00 H new ATOM 1317 N VAL A 203 11.567 -1.198 4.832 1.00 0.00 N ATOM 1318 CA VAL A 203 10.180 -1.337 5.275 1.00 0.00 C ATOM 1319 C VAL A 203 9.603 0.030 5.653 1.00 0.00 C ATOM 1320 O VAL A 203 8.465 0.325 5.293 1.00 0.00 O ATOM 1321 CB VAL A 203 10.030 -2.355 6.427 1.00 0.00 C ATOM 1322 CG1 VAL A 203 8.568 -2.808 6.561 1.00 0.00 C ATOM 1323 CG2 VAL A 203 10.897 -3.602 6.204 1.00 0.00 C ATOM 0 H VAL A 203 12.240 -1.696 5.414 1.00 0.00 H new ATOM 0 HA VAL A 203 9.605 -1.735 4.439 1.00 0.00 H new ATOM 0 HB VAL A 203 10.357 -1.849 7.335 1.00 0.00 H new ATOM 0 HG11 VAL A 203 8.483 -3.525 7.378 1.00 0.00 H new ATOM 0 HG12 VAL A 203 7.937 -1.944 6.769 1.00 0.00 H new ATOM 0 HG13 VAL A 203 8.246 -3.277 5.631 1.00 0.00 H new ATOM 0 HG21 VAL A 203 10.762 -4.292 7.037 1.00 0.00 H new ATOM 0 HG22 VAL A 203 10.600 -4.090 5.276 1.00 0.00 H new ATOM 0 HG23 VAL A 203 11.945 -3.310 6.141 1.00 0.00 H new ATOM 1333 N LYS A 204 10.379 0.901 6.306 1.00 0.00 N ATOM 1334 CA LYS A 204 9.959 2.258 6.637 1.00 0.00 C ATOM 1335 C LYS A 204 9.514 3.019 5.400 1.00 0.00 C ATOM 1336 O LYS A 204 8.584 3.818 5.509 1.00 0.00 O ATOM 1337 CB LYS A 204 11.090 3.035 7.321 1.00 0.00 C ATOM 1338 CG LYS A 204 11.311 2.637 8.788 1.00 0.00 C ATOM 1339 CD LYS A 204 11.136 3.849 9.712 1.00 0.00 C ATOM 1340 CE LYS A 204 11.656 3.558 11.117 1.00 0.00 C ATOM 1341 NZ LYS A 204 11.560 4.746 11.985 1.00 0.00 N ATOM 0 H LYS A 204 11.323 0.678 6.620 1.00 0.00 H new ATOM 0 HA LYS A 204 9.116 2.169 7.322 1.00 0.00 H new ATOM 0 HB2 LYS A 204 12.015 2.876 6.767 1.00 0.00 H new ATOM 0 HB3 LYS A 204 10.868 4.101 7.272 1.00 0.00 H new ATOM 0 HG2 LYS A 204 10.605 1.855 9.068 1.00 0.00 H new ATOM 0 HG3 LYS A 204 12.311 2.222 8.910 1.00 0.00 H new ATOM 0 HD2 LYS A 204 11.667 4.705 9.296 1.00 0.00 H new ATOM 0 HD3 LYS A 204 10.082 4.121 9.762 1.00 0.00 H new ATOM 0 HE2 LYS A 204 11.086 2.739 11.555 1.00 0.00 H new ATOM 0 HE3 LYS A 204 12.694 3.230 11.061 1.00 0.00 H new ATOM 0 HZ1 LYS A 204 11.921 4.514 12.932 1.00 0.00 H new ATOM 0 HZ2 LYS A 204 12.124 5.519 11.579 1.00 0.00 H new ATOM 0 HZ3 LYS A 204 10.566 5.044 12.057 1.00 0.00 H new ATOM 1355 N MET A 205 10.161 2.823 4.250 1.00 0.00 N ATOM 1356 CA MET A 205 9.740 3.510 3.037 1.00 0.00 C ATOM 1357 C MET A 205 8.548 2.789 2.425 1.00 0.00 C ATOM 1358 O MET A 205 7.592 3.434 1.985 1.00 0.00 O ATOM 1359 CB MET A 205 10.894 3.650 2.028 1.00 0.00 C ATOM 1360 CG MET A 205 12.100 4.330 2.676 1.00 0.00 C ATOM 1361 SD MET A 205 11.648 5.945 3.350 1.00 0.00 S ATOM 1362 CE MET A 205 13.091 6.318 4.339 1.00 0.00 C ATOM 0 H MET A 205 10.964 2.205 4.137 1.00 0.00 H new ATOM 0 HA MET A 205 9.437 4.523 3.303 1.00 0.00 H new ATOM 0 HB2 MET A 205 11.181 2.666 1.658 1.00 0.00 H new ATOM 0 HB3 MET A 205 10.562 4.230 1.167 1.00 0.00 H new ATOM 0 HG2 MET A 205 12.495 3.698 3.471 1.00 0.00 H new ATOM 0 HG3 MET A 205 12.894 4.449 1.939 1.00 0.00 H new ATOM 0 HE1 MET A 205 12.777 6.684 5.317 1.00 0.00 H new ATOM 0 HE2 MET A 205 13.689 5.416 4.464 1.00 0.00 H new ATOM 0 HE3 MET A 205 13.687 7.082 3.840 1.00 0.00 H new ATOM 1372 N MET A 206 8.595 1.455 2.391 1.00 0.00 N ATOM 1373 CA MET A 206 7.544 0.604 1.858 1.00 0.00 C ATOM 1374 C MET A 206 6.206 0.941 2.521 1.00 0.00 C ATOM 1375 O MET A 206 5.221 1.139 1.819 1.00 0.00 O ATOM 1376 CB MET A 206 7.935 -0.867 2.059 1.00 0.00 C ATOM 1377 CG MET A 206 6.998 -1.833 1.325 1.00 0.00 C ATOM 1378 SD MET A 206 7.146 -3.588 1.789 1.00 0.00 S ATOM 1379 CE MET A 206 8.937 -3.820 1.898 1.00 0.00 C ATOM 0 H MET A 206 9.392 0.927 2.746 1.00 0.00 H new ATOM 0 HA MET A 206 7.425 0.779 0.789 1.00 0.00 H new ATOM 0 HB2 MET A 206 8.955 -1.019 1.707 1.00 0.00 H new ATOM 0 HB3 MET A 206 7.927 -1.099 3.124 1.00 0.00 H new ATOM 0 HG2 MET A 206 5.970 -1.516 1.501 1.00 0.00 H new ATOM 0 HG3 MET A 206 7.181 -1.743 0.254 1.00 0.00 H new ATOM 0 HE1 MET A 206 9.155 -4.856 2.157 1.00 0.00 H new ATOM 0 HE2 MET A 206 9.394 -3.582 0.937 1.00 0.00 H new ATOM 0 HE3 MET A 206 9.343 -3.161 2.666 1.00 0.00 H new ATOM 1389 N GLU A 207 6.160 1.060 3.848 1.00 0.00 N ATOM 1390 CA GLU A 207 4.938 1.323 4.598 1.00 0.00 C ATOM 1391 C GLU A 207 4.253 2.609 4.174 1.00 0.00 C ATOM 1392 O GLU A 207 3.033 2.605 4.018 1.00 0.00 O ATOM 1393 CB GLU A 207 5.225 1.405 6.094 1.00 0.00 C ATOM 1394 CG GLU A 207 5.365 0.040 6.760 1.00 0.00 C ATOM 1395 CD GLU A 207 5.420 0.143 8.280 1.00 0.00 C ATOM 1396 OE1 GLU A 207 5.904 1.162 8.817 1.00 0.00 O ATOM 1397 OE2 GLU A 207 4.936 -0.804 8.949 1.00 0.00 O ATOM 0 H GLU A 207 6.987 0.974 4.439 1.00 0.00 H new ATOM 0 HA GLU A 207 4.272 0.488 4.382 1.00 0.00 H new ATOM 0 HB2 GLU A 207 6.142 1.973 6.250 1.00 0.00 H new ATOM 0 HB3 GLU A 207 4.421 1.958 6.581 1.00 0.00 H new ATOM 0 HG2 GLU A 207 4.525 -0.591 6.471 1.00 0.00 H new ATOM 0 HG3 GLU A 207 6.270 -0.448 6.398 1.00 0.00 H new ATOM 1404 N ARG A 208 4.991 3.709 4.004 1.00 0.00 N ATOM 1405 CA ARG A 208 4.352 4.962 3.616 1.00 0.00 C ATOM 1406 C ARG A 208 3.795 4.820 2.206 1.00 0.00 C ATOM 1407 O ARG A 208 2.695 5.296 1.947 1.00 0.00 O ATOM 1408 CB ARG A 208 5.305 6.155 3.714 1.00 0.00 C ATOM 1409 CG ARG A 208 5.403 6.822 5.074 1.00 0.00 C ATOM 1410 CD ARG A 208 6.063 5.914 6.075 1.00 0.00 C ATOM 1411 NE ARG A 208 5.122 5.216 6.978 1.00 0.00 N ATOM 1412 CZ ARG A 208 5.410 4.284 7.901 1.00 0.00 C ATOM 1413 NH1 ARG A 208 6.655 3.959 8.218 1.00 0.00 N ATOM 1414 NH2 ARG A 208 4.429 3.633 8.504 1.00 0.00 N ATOM 0 H ARG A 208 6.003 3.756 4.125 1.00 0.00 H new ATOM 0 HA ARG A 208 3.539 5.164 4.313 1.00 0.00 H new ATOM 0 HB2 ARG A 208 6.301 5.823 3.422 1.00 0.00 H new ATOM 0 HB3 ARG A 208 4.993 6.904 2.986 1.00 0.00 H new ATOM 0 HG2 ARG A 208 5.971 7.748 4.988 1.00 0.00 H new ATOM 0 HG3 ARG A 208 4.406 7.091 5.424 1.00 0.00 H new ATOM 0 HD2 ARG A 208 6.653 5.170 5.539 1.00 0.00 H new ATOM 0 HD3 ARG A 208 6.758 6.500 6.676 1.00 0.00 H new ATOM 0 HE ARG A 208 4.139 5.473 6.889 1.00 0.00 H new ATOM 0 HH11 ARG A 208 7.437 4.423 7.755 1.00 0.00 H new ATOM 0 HH12 ARG A 208 6.832 3.245 8.925 1.00 0.00 H new ATOM 0 HH21 ARG A 208 3.459 3.840 8.267 1.00 0.00 H new ATOM 0 HH22 ARG A 208 4.643 2.924 9.206 1.00 0.00 H new ATOM 1428 N VAL A 209 4.520 4.189 1.282 1.00 0.00 N ATOM 1429 CA VAL A 209 4.074 4.078 -0.103 1.00 0.00 C ATOM 1430 C VAL A 209 2.865 3.136 -0.207 1.00 0.00 C ATOM 1431 O VAL A 209 1.899 3.458 -0.897 1.00 0.00 O ATOM 1432 CB VAL A 209 5.290 3.736 -0.996 1.00 0.00 C ATOM 1433 CG1 VAL A 209 5.335 2.325 -1.574 1.00 0.00 C ATOM 1434 CG2 VAL A 209 5.412 4.689 -2.185 1.00 0.00 C ATOM 0 H VAL A 209 5.420 3.747 1.470 1.00 0.00 H new ATOM 0 HA VAL A 209 3.693 5.026 -0.483 1.00 0.00 H new ATOM 0 HB VAL A 209 6.115 3.834 -0.290 1.00 0.00 H new ATOM 0 HG11 VAL A 209 6.233 2.209 -2.181 1.00 0.00 H new ATOM 0 HG12 VAL A 209 5.350 1.599 -0.761 1.00 0.00 H new ATOM 0 HG13 VAL A 209 4.454 2.158 -2.194 1.00 0.00 H new ATOM 0 HG21 VAL A 209 6.279 4.413 -2.785 1.00 0.00 H new ATOM 0 HG22 VAL A 209 4.512 4.625 -2.796 1.00 0.00 H new ATOM 0 HG23 VAL A 209 5.532 5.710 -1.822 1.00 0.00 H new ATOM 1444 N VAL A 210 2.894 1.994 0.485 1.00 0.00 N ATOM 1445 CA VAL A 210 1.814 1.019 0.497 1.00 0.00 C ATOM 1446 C VAL A 210 0.597 1.629 1.198 1.00 0.00 C ATOM 1447 O VAL A 210 -0.512 1.476 0.681 1.00 0.00 O ATOM 1448 CB VAL A 210 2.315 -0.304 1.122 1.00 0.00 C ATOM 1449 CG1 VAL A 210 1.195 -1.321 1.359 1.00 0.00 C ATOM 1450 CG2 VAL A 210 3.345 -0.980 0.197 1.00 0.00 C ATOM 0 H VAL A 210 3.689 1.721 1.063 1.00 0.00 H new ATOM 0 HA VAL A 210 1.493 0.767 -0.514 1.00 0.00 H new ATOM 0 HB VAL A 210 2.751 -0.025 2.081 1.00 0.00 H new ATOM 0 HG11 VAL A 210 1.613 -2.227 1.799 1.00 0.00 H new ATOM 0 HG12 VAL A 210 0.455 -0.896 2.037 1.00 0.00 H new ATOM 0 HG13 VAL A 210 0.719 -1.565 0.410 1.00 0.00 H new ATOM 0 HG21 VAL A 210 3.687 -1.910 0.652 1.00 0.00 H new ATOM 0 HG22 VAL A 210 2.883 -1.196 -0.766 1.00 0.00 H new ATOM 0 HG23 VAL A 210 4.195 -0.313 0.050 1.00 0.00 H new ATOM 1460 N GLU A 211 0.779 2.348 2.318 1.00 0.00 N ATOM 1461 CA GLU A 211 -0.290 3.092 2.976 1.00 0.00 C ATOM 1462 C GLU A 211 -0.923 4.015 1.947 1.00 0.00 C ATOM 1463 O GLU A 211 -2.086 3.834 1.612 1.00 0.00 O ATOM 1464 CB GLU A 211 0.178 3.843 4.240 1.00 0.00 C ATOM 1465 CG GLU A 211 -0.926 4.814 4.710 1.00 0.00 C ATOM 1466 CD GLU A 211 -0.917 5.229 6.185 1.00 0.00 C ATOM 1467 OE1 GLU A 211 -0.087 4.735 6.983 1.00 0.00 O ATOM 1468 OE2 GLU A 211 -1.766 6.090 6.532 1.00 0.00 O ATOM 0 H GLU A 211 1.680 2.425 2.789 1.00 0.00 H new ATOM 0 HA GLU A 211 -1.036 2.389 3.347 1.00 0.00 H new ATOM 0 HB2 GLU A 211 0.410 3.131 5.032 1.00 0.00 H new ATOM 0 HB3 GLU A 211 1.094 4.394 4.028 1.00 0.00 H new ATOM 0 HG2 GLU A 211 -0.860 5.718 4.105 1.00 0.00 H new ATOM 0 HG3 GLU A 211 -1.892 4.356 4.494 1.00 0.00 H new ATOM 1475 N GLN A 212 -0.165 4.971 1.418 1.00 0.00 N ATOM 1476 CA GLN A 212 -0.663 6.013 0.531 1.00 0.00 C ATOM 1477 C GLN A 212 -1.400 5.432 -0.683 1.00 0.00 C ATOM 1478 O GLN A 212 -2.433 5.971 -1.093 1.00 0.00 O ATOM 1479 CB GLN A 212 0.536 6.861 0.101 1.00 0.00 C ATOM 1480 CG GLN A 212 1.069 7.772 1.227 1.00 0.00 C ATOM 1481 CD GLN A 212 0.148 8.936 1.538 1.00 0.00 C ATOM 1482 OE1 GLN A 212 -0.272 9.655 0.632 1.00 0.00 O ATOM 1483 NE2 GLN A 212 -0.181 9.136 2.798 1.00 0.00 N ATOM 0 H GLN A 212 0.836 5.043 1.600 1.00 0.00 H new ATOM 0 HA GLN A 212 -1.395 6.626 1.057 1.00 0.00 H new ATOM 0 HB2 GLN A 212 1.337 6.203 -0.235 1.00 0.00 H new ATOM 0 HB3 GLN A 212 0.251 7.477 -0.752 1.00 0.00 H new ATOM 0 HG2 GLN A 212 1.211 7.178 2.130 1.00 0.00 H new ATOM 0 HG3 GLN A 212 2.048 8.157 0.941 1.00 0.00 H new ATOM 0 HE21 GLN A 212 0.185 8.521 3.525 1.00 0.00 H new ATOM 0 HE22 GLN A 212 -0.802 9.906 3.047 1.00 0.00 H new ATOM 1492 N MET A 213 -0.910 4.317 -1.236 1.00 0.00 N ATOM 1493 CA MET A 213 -1.616 3.600 -2.285 1.00 0.00 C ATOM 1494 C MET A 213 -2.980 3.118 -1.796 1.00 0.00 C ATOM 1495 O MET A 213 -3.988 3.535 -2.364 1.00 0.00 O ATOM 1496 CB MET A 213 -0.782 2.446 -2.842 1.00 0.00 C ATOM 1497 CG MET A 213 0.166 2.945 -3.931 1.00 0.00 C ATOM 1498 SD MET A 213 0.846 1.616 -4.953 1.00 0.00 S ATOM 1499 CE MET A 213 2.108 1.018 -3.813 1.00 0.00 C ATOM 0 H MET A 213 -0.021 3.895 -0.967 1.00 0.00 H new ATOM 0 HA MET A 213 -1.783 4.298 -3.105 1.00 0.00 H new ATOM 0 HB2 MET A 213 -0.210 1.983 -2.038 1.00 0.00 H new ATOM 0 HB3 MET A 213 -1.440 1.678 -3.249 1.00 0.00 H new ATOM 0 HG2 MET A 213 -0.365 3.650 -4.570 1.00 0.00 H new ATOM 0 HG3 MET A 213 0.986 3.492 -3.466 1.00 0.00 H new ATOM 0 HE1 MET A 213 2.131 -0.072 -3.835 1.00 0.00 H new ATOM 0 HE2 MET A 213 3.081 1.407 -4.111 1.00 0.00 H new ATOM 0 HE3 MET A 213 1.876 1.356 -2.803 1.00 0.00 H new ATOM 1509 N CYS A 214 -3.044 2.251 -0.778 1.00 0.00 N ATOM 1510 CA CYS A 214 -4.328 1.692 -0.352 1.00 0.00 C ATOM 1511 C CYS A 214 -5.260 2.778 0.197 1.00 0.00 C ATOM 1512 O CYS A 214 -6.477 2.668 0.058 1.00 0.00 O ATOM 1513 CB CYS A 214 -4.161 0.568 0.673 1.00 0.00 C ATOM 1514 SG CYS A 214 -5.357 -0.781 0.475 1.00 0.00 S ATOM 0 H CYS A 214 -2.237 1.928 -0.244 1.00 0.00 H new ATOM 0 HA CYS A 214 -4.785 1.262 -1.243 1.00 0.00 H new ATOM 0 HB2 CYS A 214 -3.152 0.162 0.593 1.00 0.00 H new ATOM 0 HB3 CYS A 214 -4.259 0.985 1.675 1.00 0.00 H new ATOM 1519 N VAL A 215 -4.717 3.841 0.793 1.00 0.00 N ATOM 1520 CA VAL A 215 -5.452 5.017 1.228 1.00 0.00 C ATOM 1521 C VAL A 215 -6.205 5.582 0.042 1.00 0.00 C ATOM 1522 O VAL A 215 -7.424 5.716 0.115 1.00 0.00 O ATOM 1523 CB VAL A 215 -4.498 6.046 1.861 1.00 0.00 C ATOM 1524 CG1 VAL A 215 -5.108 7.446 2.000 1.00 0.00 C ATOM 1525 CG2 VAL A 215 -4.108 5.586 3.270 1.00 0.00 C ATOM 0 H VAL A 215 -3.718 3.903 0.990 1.00 0.00 H new ATOM 0 HA VAL A 215 -6.174 4.750 2.000 1.00 0.00 H new ATOM 0 HB VAL A 215 -3.642 6.108 1.189 1.00 0.00 H new ATOM 0 HG11 VAL A 215 -4.379 8.117 2.453 1.00 0.00 H new ATOM 0 HG12 VAL A 215 -5.384 7.822 1.015 1.00 0.00 H new ATOM 0 HG13 VAL A 215 -5.996 7.395 2.631 1.00 0.00 H new ATOM 0 HG21 VAL A 215 -3.433 6.315 3.717 1.00 0.00 H new ATOM 0 HG22 VAL A 215 -5.004 5.497 3.885 1.00 0.00 H new ATOM 0 HG23 VAL A 215 -3.610 4.618 3.212 1.00 0.00 H new ATOM 1535 N THR A 216 -5.498 5.889 -1.046 1.00 0.00 N ATOM 1536 CA THR A 216 -6.136 6.374 -2.253 1.00 0.00 C ATOM 1537 C THR A 216 -7.168 5.339 -2.736 1.00 0.00 C ATOM 1538 O THR A 216 -8.284 5.706 -3.102 1.00 0.00 O ATOM 1539 CB THR A 216 -5.084 6.599 -3.347 1.00 0.00 C ATOM 1540 OG1 THR A 216 -3.917 7.301 -2.947 1.00 0.00 O ATOM 1541 CG2 THR A 216 -5.716 7.388 -4.500 1.00 0.00 C ATOM 0 H THR A 216 -4.483 5.808 -1.108 1.00 0.00 H new ATOM 0 HA THR A 216 -6.636 7.319 -2.040 1.00 0.00 H new ATOM 0 HB THR A 216 -4.764 5.596 -3.629 1.00 0.00 H new ATOM 0 HG1 THR A 216 -3.365 6.722 -2.380 1.00 0.00 H new ATOM 0 HG21 THR A 216 -4.972 7.551 -5.280 1.00 0.00 H new ATOM 0 HG22 THR A 216 -6.555 6.825 -4.910 1.00 0.00 H new ATOM 0 HG23 THR A 216 -6.071 8.350 -4.131 1.00 0.00 H new ATOM 1549 N GLN A 217 -6.801 4.052 -2.732 1.00 0.00 N ATOM 1550 CA GLN A 217 -7.619 2.961 -3.241 1.00 0.00 C ATOM 1551 C GLN A 217 -8.977 2.910 -2.536 1.00 0.00 C ATOM 1552 O GLN A 217 -9.997 2.675 -3.178 1.00 0.00 O ATOM 1553 CB GLN A 217 -6.854 1.630 -3.082 1.00 0.00 C ATOM 1554 CG GLN A 217 -7.238 0.543 -4.093 1.00 0.00 C ATOM 1555 CD GLN A 217 -6.613 0.813 -5.456 1.00 0.00 C ATOM 1556 OE1 GLN A 217 -5.632 0.195 -5.858 1.00 0.00 O ATOM 1557 NE2 GLN A 217 -7.131 1.763 -6.208 1.00 0.00 N ATOM 0 H GLN A 217 -5.903 3.740 -2.364 1.00 0.00 H new ATOM 0 HA GLN A 217 -7.817 3.130 -4.299 1.00 0.00 H new ATOM 0 HB2 GLN A 217 -5.786 1.828 -3.171 1.00 0.00 H new ATOM 0 HB3 GLN A 217 -7.024 1.247 -2.076 1.00 0.00 H new ATOM 0 HG2 GLN A 217 -6.911 -0.430 -3.726 1.00 0.00 H new ATOM 0 HG3 GLN A 217 -8.323 0.499 -4.190 1.00 0.00 H new ATOM 0 HE21 GLN A 217 -7.946 2.283 -5.883 1.00 0.00 H new ATOM 0 HE22 GLN A 217 -6.717 1.979 -7.115 1.00 0.00 H new ATOM 1566 N TYR A 218 -8.990 3.154 -1.223 1.00 0.00 N ATOM 1567 CA TYR A 218 -10.199 3.203 -0.427 1.00 0.00 C ATOM 1568 C TYR A 218 -10.869 4.523 -0.719 1.00 0.00 C ATOM 1569 O TYR A 218 -12.015 4.497 -1.121 1.00 0.00 O ATOM 1570 CB TYR A 218 -9.858 3.083 1.061 1.00 0.00 C ATOM 1571 CG TYR A 218 -11.040 3.168 2.019 1.00 0.00 C ATOM 1572 CD1 TYR A 218 -11.873 2.047 2.177 1.00 0.00 C ATOM 1573 CD2 TYR A 218 -11.286 4.330 2.785 1.00 0.00 C ATOM 1574 CE1 TYR A 218 -12.965 2.082 3.060 1.00 0.00 C ATOM 1575 CE2 TYR A 218 -12.357 4.360 3.703 1.00 0.00 C ATOM 1576 CZ TYR A 218 -13.219 3.246 3.817 1.00 0.00 C ATOM 1577 OH TYR A 218 -14.303 3.314 4.635 1.00 0.00 O ATOM 0 H TYR A 218 -8.142 3.325 -0.683 1.00 0.00 H new ATOM 0 HA TYR A 218 -10.864 2.376 -0.675 1.00 0.00 H new ATOM 0 HB2 TYR A 218 -9.350 2.132 1.223 1.00 0.00 H new ATOM 0 HB3 TYR A 218 -9.149 3.870 1.317 1.00 0.00 H new ATOM 0 HD1 TYR A 218 -11.671 1.148 1.613 1.00 0.00 H new ATOM 0 HD2 TYR A 218 -10.653 5.197 2.667 1.00 0.00 H new ATOM 0 HE1 TYR A 218 -13.609 1.220 3.159 1.00 0.00 H new ATOM 0 HE2 TYR A 218 -12.518 5.233 4.318 1.00 0.00 H new ATOM 0 HH TYR A 218 -14.323 4.187 5.080 1.00 0.00 H new ATOM 1587 N GLN A 219 -10.187 5.660 -0.559 1.00 0.00 N ATOM 1588 CA GLN A 219 -10.736 6.999 -0.749 1.00 0.00 C ATOM 1589 C GLN A 219 -11.548 7.118 -2.044 1.00 0.00 C ATOM 1590 O GLN A 219 -12.695 7.559 -1.985 1.00 0.00 O ATOM 1591 CB GLN A 219 -9.601 8.033 -0.673 1.00 0.00 C ATOM 1592 CG GLN A 219 -9.259 8.389 0.785 1.00 0.00 C ATOM 1593 CD GLN A 219 -8.554 9.739 0.926 1.00 0.00 C ATOM 1594 OE1 GLN A 219 -7.257 9.747 1.184 1.00 0.00 O flip ATOM 1595 NE2 GLN A 219 -9.183 10.791 0.836 1.00 0.00 N flip ATOM 0 H GLN A 219 -9.205 5.671 -0.284 1.00 0.00 H new ATOM 0 HA GLN A 219 -11.443 7.201 0.055 1.00 0.00 H new ATOM 0 HB2 GLN A 219 -8.715 7.639 -1.170 1.00 0.00 H new ATOM 0 HB3 GLN A 219 -9.893 8.935 -1.210 1.00 0.00 H new ATOM 0 HG2 GLN A 219 -10.176 8.402 1.374 1.00 0.00 H new ATOM 0 HG3 GLN A 219 -8.623 7.609 1.203 1.00 0.00 H new ATOM 0 HE21 GLN A 219 -10.183 10.772 0.637 1.00 0.00 H new ATOM 0 HE22 GLN A 219 -8.705 11.683 0.961 1.00 0.00 H new ATOM 1604 N LYS A 220 -11.001 6.658 -3.175 1.00 0.00 N ATOM 1605 CA LYS A 220 -11.668 6.643 -4.478 1.00 0.00 C ATOM 1606 C LYS A 220 -13.062 6.022 -4.395 1.00 0.00 C ATOM 1607 O LYS A 220 -14.031 6.607 -4.891 1.00 0.00 O ATOM 1608 CB LYS A 220 -10.804 5.867 -5.486 1.00 0.00 C ATOM 1609 CG LYS A 220 -9.647 6.710 -6.035 1.00 0.00 C ATOM 1610 CD LYS A 220 -8.535 5.848 -6.653 1.00 0.00 C ATOM 1611 CE LYS A 220 -8.086 6.341 -8.034 1.00 0.00 C ATOM 1612 NZ LYS A 220 -8.846 5.705 -9.134 1.00 0.00 N ATOM 0 H LYS A 220 -10.056 6.276 -3.208 1.00 0.00 H new ATOM 0 HA LYS A 220 -11.789 7.675 -4.809 1.00 0.00 H new ATOM 0 HB2 LYS A 220 -10.403 4.974 -5.006 1.00 0.00 H new ATOM 0 HB3 LYS A 220 -11.429 5.531 -6.313 1.00 0.00 H new ATOM 0 HG2 LYS A 220 -10.029 7.400 -6.788 1.00 0.00 H new ATOM 0 HG3 LYS A 220 -9.229 7.316 -5.231 1.00 0.00 H new ATOM 0 HD2 LYS A 220 -7.677 5.837 -5.981 1.00 0.00 H new ATOM 0 HD3 LYS A 220 -8.886 4.820 -6.738 1.00 0.00 H new ATOM 0 HE2 LYS A 220 -8.209 7.423 -8.089 1.00 0.00 H new ATOM 0 HE3 LYS A 220 -7.024 6.134 -8.163 1.00 0.00 H new ATOM 0 HZ1 LYS A 220 -8.507 6.070 -10.047 1.00 0.00 H new ATOM 0 HZ2 LYS A 220 -8.709 4.675 -9.100 1.00 0.00 H new ATOM 0 HZ3 LYS A 220 -9.857 5.923 -9.028 1.00 0.00 H new ATOM 1626 N GLU A 221 -13.159 4.820 -3.828 1.00 0.00 N ATOM 1627 CA GLU A 221 -14.388 4.041 -3.781 1.00 0.00 C ATOM 1628 C GLU A 221 -15.269 4.393 -2.578 1.00 0.00 C ATOM 1629 O GLU A 221 -16.490 4.322 -2.661 1.00 0.00 O ATOM 1630 CB GLU A 221 -14.040 2.558 -3.691 1.00 0.00 C ATOM 1631 CG GLU A 221 -13.930 1.849 -5.040 1.00 0.00 C ATOM 1632 CD GLU A 221 -12.614 2.029 -5.798 1.00 0.00 C ATOM 1633 OE1 GLU A 221 -12.383 3.103 -6.401 1.00 0.00 O ATOM 1634 OE2 GLU A 221 -11.882 1.021 -5.926 1.00 0.00 O ATOM 0 H GLU A 221 -12.369 4.355 -3.381 1.00 0.00 H new ATOM 0 HA GLU A 221 -14.944 4.273 -4.689 1.00 0.00 H new ATOM 0 HB2 GLU A 221 -13.094 2.452 -3.161 1.00 0.00 H new ATOM 0 HB3 GLU A 221 -14.799 2.055 -3.092 1.00 0.00 H new ATOM 0 HG2 GLU A 221 -14.088 0.783 -4.879 1.00 0.00 H new ATOM 0 HG3 GLU A 221 -14.742 2.199 -5.677 1.00 0.00 H new ATOM 1641 N SER A 222 -14.653 4.751 -1.458 1.00 0.00 N ATOM 1642 CA SER A 222 -15.246 5.234 -0.229 1.00 0.00 C ATOM 1643 C SER A 222 -16.079 6.432 -0.600 1.00 0.00 C ATOM 1644 O SER A 222 -17.298 6.380 -0.461 1.00 0.00 O ATOM 1645 CB SER A 222 -14.126 5.542 0.769 1.00 0.00 C ATOM 1646 OG SER A 222 -14.537 6.200 1.938 1.00 0.00 O ATOM 0 H SER A 222 -13.637 4.704 -1.386 1.00 0.00 H new ATOM 0 HA SER A 222 -15.892 4.505 0.259 1.00 0.00 H new ATOM 0 HB2 SER A 222 -13.641 4.606 1.048 1.00 0.00 H new ATOM 0 HB3 SER A 222 -13.374 6.154 0.271 1.00 0.00 H new ATOM 0 HG SER A 222 -14.025 5.861 2.702 1.00 0.00 H new