USER MOD reduce.3.24.130724 H: found=0, std=0, add=587, rem=0, adj=10 USER MOD reduce.3.24.130724 removed 590 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 146 ASN : amide:sc= 0.15 X(o=0.3,f=0) USER MOD Set 1.2: A 165 TYR OH : rot 15:sc= 0.147 USER MOD Single : A 150 SER OG : rot 180:sc= 0.0836 USER MOD Single : A 152 THR OG1 : rot 180:sc= 0 USER MOD Single : A 154 ASN : amide:sc= -0.209 X(o=-0.21,f=-0.21) USER MOD Single : A 161 THR OG1 : rot 180:sc= 0.502 USER MOD Single : A 162 SER OG : rot 180:sc= 0 USER MOD Single : A 173 SER OG : rot 180:sc= 0 USER MOD Single : A 174 ASN : amide:sc= 1.44 K(o=1.4,f=-4.1!) USER MOD Single : A 180 SER OG : rot 180:sc= 0 USER MOD Single : A 205 SER OG : rot 180:sc= 0.559 USER MOD Single : A 210 LYS NZ :NH3+ -163:sc= 1.19 (180deg=0.574) USER MOD Single : A 219 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 229 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 86 N ARG A 136 -2.754 -13.089 -3.813 1.00 0.00 N ATOM 87 CA ARG A 136 -1.875 -12.057 -4.395 1.00 0.00 C ATOM 88 C ARG A 136 -2.715 -11.029 -5.172 1.00 0.00 C ATOM 89 O ARG A 136 -3.639 -11.385 -5.905 1.00 0.00 O ATOM 90 CB ARG A 136 -0.765 -12.643 -5.284 1.00 0.00 C ATOM 91 CG ARG A 136 0.386 -13.298 -4.505 1.00 0.00 C ATOM 92 CD ARG A 136 0.076 -14.755 -4.126 1.00 0.00 C ATOM 93 NE ARG A 136 1.187 -15.303 -3.338 1.00 0.00 N ATOM 94 CZ ARG A 136 2.197 -16.054 -3.722 1.00 0.00 C ATOM 95 NH1 ARG A 136 2.189 -16.743 -4.829 1.00 0.00 N1+ ATOM 96 NH2 ARG A 136 3.256 -16.095 -2.975 1.00 0.00 N ATOM 0 HA ARG A 136 -1.369 -11.561 -3.566 1.00 0.00 H new ATOM 0 HB2 ARG A 136 -1.204 -13.383 -5.953 1.00 0.00 H new ATOM 0 HB3 ARG A 136 -0.359 -11.849 -5.910 1.00 0.00 H new ATOM 0 HG2 ARG A 136 1.294 -13.266 -5.107 1.00 0.00 H new ATOM 0 HG3 ARG A 136 0.583 -12.723 -3.600 1.00 0.00 H new ATOM 0 HD2 ARG A 136 -0.849 -14.804 -3.552 1.00 0.00 H new ATOM 0 HD3 ARG A 136 -0.075 -15.352 -5.026 1.00 0.00 H new ATOM 0 HE ARG A 136 1.174 -15.067 -2.346 1.00 0.00 H new ATOM 0 HH11 ARG A 136 1.374 -16.714 -5.442 1.00 0.00 H new ATOM 0 HH12 ARG A 136 2.998 -17.310 -5.082 1.00 0.00 H new ATOM 0 HH21 ARG A 136 3.293 -15.553 -2.112 1.00 0.00 H new ATOM 0 HH22 ARG A 136 4.053 -16.670 -3.250 1.00 0.00 H new ATOM 110 N ILE A 137 -2.360 -9.760 -5.014 1.00 0.00 N ATOM 111 CA ILE A 137 -3.057 -8.534 -5.414 1.00 0.00 C ATOM 112 C ILE A 137 -2.052 -7.671 -6.177 1.00 0.00 C ATOM 113 O ILE A 137 -0.989 -7.374 -5.642 1.00 0.00 O ATOM 114 CB ILE A 137 -3.509 -7.765 -4.148 1.00 0.00 C ATOM 115 CG1 ILE A 137 -4.112 -8.633 -3.028 1.00 0.00 C ATOM 116 CG2 ILE A 137 -4.440 -6.586 -4.489 1.00 0.00 C ATOM 117 CD1 ILE A 137 -5.376 -9.427 -3.385 1.00 0.00 C ATOM 0 H ILE A 137 -1.479 -9.535 -4.551 1.00 0.00 H new ATOM 0 HA ILE A 137 -3.928 -8.767 -6.026 1.00 0.00 H new ATOM 0 HB ILE A 137 -2.578 -7.375 -3.736 1.00 0.00 H new ATOM 0 HG12 ILE A 137 -3.350 -9.337 -2.693 1.00 0.00 H new ATOM 0 HG13 ILE A 137 -4.343 -7.986 -2.181 1.00 0.00 H new ATOM 0 HG21 ILE A 137 -4.732 -6.076 -3.571 1.00 0.00 H new ATOM 0 HG22 ILE A 137 -3.918 -5.887 -5.142 1.00 0.00 H new ATOM 0 HG23 ILE A 137 -5.330 -6.960 -4.995 1.00 0.00 H new ATOM 0 HD11 ILE A 137 -5.704 -9.998 -2.516 1.00 0.00 H new ATOM 0 HD12 ILE A 137 -6.165 -8.738 -3.686 1.00 0.00 H new ATOM 0 HD13 ILE A 137 -5.157 -10.110 -4.206 1.00 0.00 H new ATOM 129 N GLU A 138 -2.346 -7.253 -7.405 1.00 0.00 N ATOM 130 CA GLU A 138 -1.403 -6.466 -8.223 1.00 0.00 C ATOM 131 C GLU A 138 -1.991 -5.183 -8.811 1.00 0.00 C ATOM 132 O GLU A 138 -3.183 -5.121 -9.130 1.00 0.00 O ATOM 133 CB GLU A 138 -0.740 -7.318 -9.311 1.00 0.00 C ATOM 134 CG GLU A 138 -1.700 -7.789 -10.413 1.00 0.00 C ATOM 135 CD GLU A 138 -0.972 -8.664 -11.446 1.00 0.00 C ATOM 136 OE1 GLU A 138 -0.401 -8.118 -12.424 1.00 0.00 O ATOM 137 OE2 GLU A 138 -0.967 -9.913 -11.305 1.00 0.00 O ATOM 0 H GLU A 138 -3.235 -7.444 -7.866 1.00 0.00 H new ATOM 0 HA GLU A 138 -0.635 -6.141 -7.521 1.00 0.00 H new ATOM 0 HB2 GLU A 138 0.065 -6.742 -9.768 1.00 0.00 H new ATOM 0 HB3 GLU A 138 -0.283 -8.191 -8.845 1.00 0.00 H new ATOM 0 HG2 GLU A 138 -2.520 -8.353 -9.968 1.00 0.00 H new ATOM 0 HG3 GLU A 138 -2.140 -6.924 -10.910 1.00 0.00 H new ATOM 144 N PHE A 139 -1.130 -4.166 -8.948 1.00 0.00 N ATOM 145 CA PHE A 139 -1.591 -2.800 -9.292 1.00 0.00 C ATOM 146 C PHE A 139 -0.867 -2.163 -10.478 1.00 0.00 C ATOM 147 O PHE A 139 -1.518 -1.562 -11.333 1.00 0.00 O ATOM 148 CB PHE A 139 -1.528 -1.865 -8.067 1.00 0.00 C ATOM 149 CG PHE A 139 -1.760 -2.589 -6.780 1.00 0.00 C ATOM 150 CD1 PHE A 139 -0.666 -3.199 -6.155 1.00 0.00 C ATOM 151 CD2 PHE A 139 -3.063 -2.735 -6.278 1.00 0.00 C ATOM 152 CE1 PHE A 139 -0.878 -4.003 -5.028 1.00 0.00 C ATOM 153 CE2 PHE A 139 -3.277 -3.553 -5.169 1.00 0.00 C ATOM 154 CZ PHE A 139 -2.186 -4.203 -4.561 1.00 0.00 C ATOM 0 H PHE A 139 -0.121 -4.253 -8.829 1.00 0.00 H new ATOM 0 HA PHE A 139 -2.627 -2.927 -9.606 1.00 0.00 H new ATOM 0 HB2 PHE A 139 -0.553 -1.378 -8.035 1.00 0.00 H new ATOM 0 HB3 PHE A 139 -2.274 -1.078 -8.176 1.00 0.00 H new ATOM 0 HD1 PHE A 139 0.333 -3.051 -6.538 1.00 0.00 H new ATOM 0 HD2 PHE A 139 -3.890 -2.220 -6.745 1.00 0.00 H new ATOM 0 HE1 PHE A 139 -0.042 -4.465 -4.523 1.00 0.00 H new ATOM 0 HE2 PHE A 139 -4.275 -3.687 -4.778 1.00 0.00 H new ATOM 0 HZ PHE A 139 -2.358 -4.864 -3.724 1.00 0.00 H new ATOM 164 N ASP A 140 0.470 -2.244 -10.524 1.00 0.00 N ATOM 165 CA ASP A 140 1.275 -1.491 -11.501 1.00 0.00 C ATOM 166 C ASP A 140 2.621 -2.193 -11.783 1.00 0.00 C ATOM 167 O ASP A 140 2.756 -2.941 -12.753 1.00 0.00 O ATOM 168 CB ASP A 140 1.433 -0.055 -10.957 1.00 0.00 C ATOM 169 CG ASP A 140 1.800 0.994 -12.023 1.00 0.00 C ATOM 170 OD1 ASP A 140 2.321 0.639 -13.108 1.00 0.00 O ATOM 171 OD2 ASP A 140 1.505 2.191 -11.783 1.00 0.00 O ATOM 0 H ASP A 140 1.021 -2.826 -9.893 1.00 0.00 H new ATOM 0 HA ASP A 140 0.778 -1.450 -12.470 1.00 0.00 H new ATOM 0 HB2 ASP A 140 0.501 0.243 -10.478 1.00 0.00 H new ATOM 0 HB3 ASP A 140 2.203 -0.055 -10.185 1.00 0.00 H new ATOM 176 N ASP A 141 3.581 -2.039 -10.864 1.00 0.00 N ATOM 177 CA ASP A 141 4.785 -2.873 -10.702 1.00 0.00 C ATOM 178 C ASP A 141 4.752 -3.683 -9.391 1.00 0.00 C ATOM 179 O ASP A 141 5.552 -4.596 -9.179 1.00 0.00 O ATOM 180 CB ASP A 141 6.047 -1.994 -10.744 1.00 0.00 C ATOM 181 CG ASP A 141 6.173 -1.169 -12.035 1.00 0.00 C ATOM 182 OD1 ASP A 141 6.401 -1.764 -13.116 1.00 0.00 O ATOM 183 OD2 ASP A 141 6.095 0.083 -11.972 1.00 0.00 O ATOM 0 H ASP A 141 3.540 -1.289 -10.174 1.00 0.00 H new ATOM 0 HA ASP A 141 4.806 -3.583 -11.529 1.00 0.00 H new ATOM 0 HB2 ASP A 141 6.039 -1.318 -9.889 1.00 0.00 H new ATOM 0 HB3 ASP A 141 6.927 -2.629 -10.640 1.00 0.00 H new ATOM 188 N LEU A 142 3.838 -3.317 -8.489 1.00 0.00 N ATOM 189 CA LEU A 142 3.672 -3.838 -7.146 1.00 0.00 C ATOM 190 C LEU A 142 2.731 -5.033 -7.120 1.00 0.00 C ATOM 191 O LEU A 142 1.650 -5.007 -7.722 1.00 0.00 O ATOM 192 CB LEU A 142 3.113 -2.683 -6.300 1.00 0.00 C ATOM 193 CG LEU A 142 2.797 -3.003 -4.828 1.00 0.00 C ATOM 194 CD1 LEU A 142 4.102 -3.049 -4.040 1.00 0.00 C ATOM 195 CD2 LEU A 142 1.845 -1.933 -4.296 1.00 0.00 C ATOM 0 H LEU A 142 3.149 -2.596 -8.702 1.00 0.00 H new ATOM 0 HA LEU A 142 4.624 -4.195 -6.753 1.00 0.00 H new ATOM 0 HB2 LEU A 142 3.831 -1.863 -6.325 1.00 0.00 H new ATOM 0 HB3 LEU A 142 2.200 -2.322 -6.775 1.00 0.00 H new ATOM 0 HG LEU A 142 2.313 -3.974 -4.727 1.00 0.00 H new ATOM 0 HD11 LEU A 142 3.888 -3.275 -2.995 1.00 0.00 H new ATOM 0 HD12 LEU A 142 4.750 -3.822 -4.454 1.00 0.00 H new ATOM 0 HD13 LEU A 142 4.602 -2.083 -4.107 1.00 0.00 H new ATOM 0 HD21 LEU A 142 1.609 -2.142 -3.253 1.00 0.00 H new ATOM 0 HD22 LEU A 142 2.319 -0.954 -4.371 1.00 0.00 H new ATOM 0 HD23 LEU A 142 0.927 -1.938 -4.884 1.00 0.00 H new ATOM 207 N VAL A 143 3.126 -6.026 -6.330 1.00 0.00 N ATOM 208 CA VAL A 143 2.289 -7.169 -5.953 1.00 0.00 C ATOM 209 C VAL A 143 2.309 -7.414 -4.454 1.00 0.00 C ATOM 210 O VAL A 143 3.328 -7.777 -3.870 1.00 0.00 O ATOM 211 CB VAL A 143 2.639 -8.468 -6.693 1.00 0.00 C ATOM 212 CG1 VAL A 143 1.444 -9.434 -6.580 1.00 0.00 C ATOM 213 CG2 VAL A 143 3.000 -8.150 -8.148 1.00 0.00 C ATOM 0 H VAL A 143 4.060 -6.063 -5.922 1.00 0.00 H new ATOM 0 HA VAL A 143 1.282 -6.887 -6.260 1.00 0.00 H new ATOM 0 HB VAL A 143 3.508 -8.951 -6.247 1.00 0.00 H new ATOM 0 HG11 VAL A 143 1.676 -10.363 -7.101 1.00 0.00 H new ATOM 0 HG12 VAL A 143 1.246 -9.647 -5.529 1.00 0.00 H new ATOM 0 HG13 VAL A 143 0.563 -8.977 -7.030 1.00 0.00 H new ATOM 0 HG21 VAL A 143 3.248 -9.073 -8.671 1.00 0.00 H new ATOM 0 HG22 VAL A 143 2.151 -7.672 -8.637 1.00 0.00 H new ATOM 0 HG23 VAL A 143 3.858 -7.478 -8.171 1.00 0.00 H new ATOM 223 N ILE A 144 1.140 -7.271 -3.857 1.00 0.00 N ATOM 224 CA ILE A 144 0.805 -7.482 -2.455 1.00 0.00 C ATOM 225 C ILE A 144 0.297 -8.902 -2.264 1.00 0.00 C ATOM 226 O ILE A 144 -0.344 -9.455 -3.148 1.00 0.00 O ATOM 227 CB ILE A 144 -0.199 -6.393 -2.065 1.00 0.00 C ATOM 228 CG1 ILE A 144 0.606 -5.125 -1.755 1.00 0.00 C ATOM 229 CG2 ILE A 144 -1.117 -6.777 -0.901 1.00 0.00 C ATOM 230 CD1 ILE A 144 -0.236 -3.958 -1.276 1.00 0.00 C ATOM 0 H ILE A 144 0.322 -6.976 -4.390 1.00 0.00 H new ATOM 0 HA ILE A 144 1.667 -7.393 -1.794 1.00 0.00 H new ATOM 0 HB ILE A 144 -0.883 -6.234 -2.898 1.00 0.00 H new ATOM 0 HG12 ILE A 144 1.351 -5.358 -0.994 1.00 0.00 H new ATOM 0 HG13 ILE A 144 1.149 -4.824 -2.651 1.00 0.00 H new ATOM 0 HG21 ILE A 144 -1.797 -5.953 -0.687 1.00 0.00 H new ATOM 0 HG22 ILE A 144 -1.693 -7.663 -1.169 1.00 0.00 H new ATOM 0 HG23 ILE A 144 -0.515 -6.989 -0.017 1.00 0.00 H new ATOM 0 HD11 ILE A 144 0.408 -3.101 -1.079 1.00 0.00 H new ATOM 0 HD12 ILE A 144 -0.964 -3.695 -2.043 1.00 0.00 H new ATOM 0 HD13 ILE A 144 -0.758 -4.237 -0.361 1.00 0.00 H new ATOM 242 N ASP A 145 0.619 -9.526 -1.139 1.00 0.00 N ATOM 243 CA ASP A 145 0.511 -10.971 -0.990 1.00 0.00 C ATOM 244 C ASP A 145 0.024 -11.337 0.421 1.00 0.00 C ATOM 245 O ASP A 145 0.811 -11.401 1.366 1.00 0.00 O ATOM 246 CB ASP A 145 1.907 -11.538 -1.265 1.00 0.00 C ATOM 247 CG ASP A 145 1.982 -13.067 -1.301 1.00 0.00 C ATOM 248 OD1 ASP A 145 0.951 -13.733 -1.058 1.00 0.00 O ATOM 249 OD2 ASP A 145 3.071 -13.631 -1.561 1.00 0.00 O ATOM 0 H ASP A 145 0.961 -9.047 -0.306 1.00 0.00 H new ATOM 0 HA ASP A 145 -0.218 -11.389 -1.684 1.00 0.00 H new ATOM 0 HB2 ASP A 145 2.261 -11.148 -2.219 1.00 0.00 H new ATOM 0 HB3 ASP A 145 2.590 -11.172 -0.498 1.00 0.00 H new ATOM 254 N ASN A 146 -1.269 -11.616 0.578 1.00 0.00 N ATOM 255 CA ASN A 146 -1.833 -12.154 1.821 1.00 0.00 C ATOM 256 C ASN A 146 -1.599 -13.667 1.951 1.00 0.00 C ATOM 257 O ASN A 146 -1.649 -14.217 3.051 1.00 0.00 O ATOM 258 CB ASN A 146 -3.318 -11.784 1.859 1.00 0.00 C ATOM 259 CG ASN A 146 -4.013 -12.210 3.135 1.00 0.00 C ATOM 260 OD1 ASN A 146 -4.833 -13.121 3.143 1.00 0.00 O ATOM 261 ND2 ASN A 146 -3.690 -11.590 4.249 1.00 0.00 N ATOM 0 H ASN A 146 -1.962 -11.475 -0.157 1.00 0.00 H new ATOM 0 HA ASN A 146 -1.328 -11.715 2.681 1.00 0.00 H new ATOM 0 HB2 ASN A 146 -3.419 -10.705 1.742 1.00 0.00 H new ATOM 0 HB3 ASN A 146 -3.821 -12.245 1.009 1.00 0.00 H new ATOM 0 HD21 ASN A 146 -4.123 -11.866 5.130 1.00 0.00 H new ATOM 0 HD22 ASN A 146 -3.006 -10.833 4.232 1.00 0.00 H new ATOM 268 N GLY A 147 -1.260 -14.320 0.835 1.00 0.00 N ATOM 269 CA GLY A 147 -0.766 -15.699 0.821 1.00 0.00 C ATOM 270 C GLY A 147 0.561 -15.876 1.583 1.00 0.00 C ATOM 271 O GLY A 147 0.848 -16.972 2.073 1.00 0.00 O ATOM 0 H GLY A 147 -1.322 -13.901 -0.093 1.00 0.00 H new ATOM 0 HA2 GLY A 147 -1.520 -16.353 1.260 1.00 0.00 H new ATOM 0 HA3 GLY A 147 -0.630 -16.019 -0.212 1.00 0.00 H new ATOM 275 N GLY A 148 1.339 -14.796 1.737 1.00 0.00 N ATOM 276 CA GLY A 148 2.611 -14.751 2.481 1.00 0.00 C ATOM 277 C GLY A 148 2.750 -13.592 3.482 1.00 0.00 C ATOM 278 O GLY A 148 3.821 -13.426 4.072 1.00 0.00 O ATOM 0 H GLY A 148 1.092 -13.893 1.332 1.00 0.00 H new ATOM 0 HA2 GLY A 148 2.730 -15.691 3.020 1.00 0.00 H new ATOM 0 HA3 GLY A 148 3.430 -14.689 1.764 1.00 0.00 H new ATOM 282 N ARG A 149 1.696 -12.780 3.666 1.00 0.00 N ATOM 283 CA ARG A 149 1.649 -11.533 4.463 1.00 0.00 C ATOM 284 C ARG A 149 2.826 -10.576 4.184 1.00 0.00 C ATOM 285 O ARG A 149 3.461 -10.065 5.108 1.00 0.00 O ATOM 286 CB ARG A 149 1.441 -11.855 5.954 1.00 0.00 C ATOM 287 CG ARG A 149 0.130 -12.619 6.209 1.00 0.00 C ATOM 288 CD ARG A 149 -0.118 -12.865 7.705 1.00 0.00 C ATOM 289 NE ARG A 149 0.876 -13.792 8.286 1.00 0.00 N ATOM 290 CZ ARG A 149 0.983 -14.129 9.559 1.00 0.00 C ATOM 291 NH1 ARG A 149 0.175 -13.665 10.471 1.00 0.00 N1+ ATOM 292 NH2 ARG A 149 1.916 -14.949 9.948 1.00 0.00 N ATOM 0 H ARG A 149 0.794 -12.986 3.237 1.00 0.00 H new ATOM 0 HA ARG A 149 0.779 -10.965 4.134 1.00 0.00 H new ATOM 0 HB2 ARG A 149 2.281 -12.448 6.316 1.00 0.00 H new ATOM 0 HB3 ARG A 149 1.436 -10.927 6.526 1.00 0.00 H new ATOM 0 HG2 ARG A 149 -0.704 -12.054 5.792 1.00 0.00 H new ATOM 0 HG3 ARG A 149 0.161 -13.575 5.686 1.00 0.00 H new ATOM 0 HD2 ARG A 149 -0.084 -11.915 8.239 1.00 0.00 H new ATOM 0 HD3 ARG A 149 -1.119 -13.273 7.844 1.00 0.00 H new ATOM 0 HE ARG A 149 1.545 -14.213 7.641 1.00 0.00 H new ATOM 0 HH11 ARG A 149 -0.570 -13.019 10.211 1.00 0.00 H new ATOM 0 HH12 ARG A 149 0.288 -13.948 11.444 1.00 0.00 H new ATOM 0 HH21 ARG A 149 2.571 -15.336 9.268 1.00 0.00 H new ATOM 0 HH22 ARG A 149 1.992 -15.205 10.933 1.00 0.00 H new ATOM 306 N SER A 150 3.154 -10.385 2.903 1.00 0.00 N ATOM 307 CA SER A 150 4.278 -9.553 2.433 1.00 0.00 C ATOM 308 C SER A 150 3.987 -8.969 1.043 1.00 0.00 C ATOM 309 O SER A 150 2.858 -9.055 0.564 1.00 0.00 O ATOM 310 CB SER A 150 5.566 -10.391 2.427 1.00 0.00 C ATOM 311 OG SER A 150 6.690 -9.531 2.355 1.00 0.00 O ATOM 0 H SER A 150 2.633 -10.815 2.138 1.00 0.00 H new ATOM 0 HA SER A 150 4.409 -8.712 3.114 1.00 0.00 H new ATOM 0 HB2 SER A 150 5.619 -11.002 3.328 1.00 0.00 H new ATOM 0 HB3 SER A 150 5.563 -11.075 1.578 1.00 0.00 H new ATOM 0 HG SER A 150 7.511 -10.066 2.353 1.00 0.00 H new ATOM 317 N VAL A 151 4.970 -8.337 0.390 1.00 0.00 N ATOM 318 CA VAL A 151 4.843 -7.800 -0.982 1.00 0.00 C ATOM 319 C VAL A 151 6.173 -7.856 -1.757 1.00 0.00 C ATOM 320 O VAL A 151 7.268 -7.673 -1.199 1.00 0.00 O ATOM 321 CB VAL A 151 4.195 -6.393 -1.069 1.00 0.00 C ATOM 322 CG1 VAL A 151 3.493 -5.956 0.214 1.00 0.00 C ATOM 323 CG2 VAL A 151 5.066 -5.286 -1.627 1.00 0.00 C ATOM 0 H VAL A 151 5.891 -8.179 0.800 1.00 0.00 H new ATOM 0 HA VAL A 151 4.138 -8.473 -1.471 1.00 0.00 H new ATOM 0 HB VAL A 151 3.429 -6.551 -1.828 1.00 0.00 H new ATOM 0 HG11 VAL A 151 3.065 -4.963 0.075 1.00 0.00 H new ATOM 0 HG12 VAL A 151 2.698 -6.663 0.453 1.00 0.00 H new ATOM 0 HG13 VAL A 151 4.213 -5.930 1.032 1.00 0.00 H new ATOM 0 HG21 VAL A 151 4.504 -4.352 -1.638 1.00 0.00 H new ATOM 0 HG22 VAL A 151 5.951 -5.170 -1.002 1.00 0.00 H new ATOM 0 HG23 VAL A 151 5.370 -5.539 -2.643 1.00 0.00 H new ATOM 333 N THR A 152 6.029 -7.985 -3.076 1.00 0.00 N ATOM 334 CA THR A 152 7.061 -7.824 -4.111 1.00 0.00 C ATOM 335 C THR A 152 6.812 -6.513 -4.856 1.00 0.00 C ATOM 336 O THR A 152 5.670 -6.204 -5.178 1.00 0.00 O ATOM 337 CB THR A 152 7.012 -8.940 -5.179 1.00 0.00 C ATOM 338 OG1 THR A 152 6.605 -10.184 -4.646 1.00 0.00 O ATOM 339 CG2 THR A 152 8.369 -9.181 -5.826 1.00 0.00 C ATOM 0 H THR A 152 5.124 -8.222 -3.483 1.00 0.00 H new ATOM 0 HA THR A 152 8.024 -7.852 -3.601 1.00 0.00 H new ATOM 0 HB THR A 152 6.289 -8.580 -5.911 1.00 0.00 H new ATOM 0 HG1 THR A 152 6.588 -10.856 -5.359 1.00 0.00 H new ATOM 0 HG21 THR A 152 8.282 -9.974 -6.569 1.00 0.00 H new ATOM 0 HG22 THR A 152 8.709 -8.266 -6.310 1.00 0.00 H new ATOM 0 HG23 THR A 152 9.089 -9.476 -5.063 1.00 0.00 H new ATOM 347 N LEU A 153 7.852 -5.770 -5.223 1.00 0.00 N ATOM 348 CA LEU A 153 7.757 -4.739 -6.263 1.00 0.00 C ATOM 349 C LEU A 153 8.768 -5.063 -7.355 1.00 0.00 C ATOM 350 O LEU A 153 9.906 -5.407 -7.043 1.00 0.00 O ATOM 351 CB LEU A 153 8.011 -3.346 -5.670 1.00 0.00 C ATOM 352 CG LEU A 153 7.997 -2.247 -6.740 1.00 0.00 C ATOM 353 CD1 LEU A 153 6.623 -1.666 -6.911 1.00 0.00 C ATOM 354 CD2 LEU A 153 8.984 -1.136 -6.467 1.00 0.00 C ATOM 0 H LEU A 153 8.782 -5.861 -4.813 1.00 0.00 H new ATOM 0 HA LEU A 153 6.753 -4.730 -6.687 1.00 0.00 H new ATOM 0 HB2 LEU A 153 7.251 -3.129 -4.919 1.00 0.00 H new ATOM 0 HB3 LEU A 153 8.974 -3.341 -5.159 1.00 0.00 H new ATOM 0 HG LEU A 153 8.303 -2.738 -7.664 1.00 0.00 H new ATOM 0 HD11 LEU A 153 6.649 -0.890 -7.676 1.00 0.00 H new ATOM 0 HD12 LEU A 153 5.931 -2.452 -7.214 1.00 0.00 H new ATOM 0 HD13 LEU A 153 6.291 -1.234 -5.967 1.00 0.00 H new ATOM 0 HD21 LEU A 153 8.923 -0.392 -7.261 1.00 0.00 H new ATOM 0 HD22 LEU A 153 8.749 -0.667 -5.512 1.00 0.00 H new ATOM 0 HD23 LEU A 153 9.993 -1.546 -6.431 1.00 0.00 H new ATOM 366 N ASN A 154 8.385 -4.877 -8.620 1.00 0.00 N ATOM 367 CA ASN A 154 9.309 -4.848 -9.753 1.00 0.00 C ATOM 368 C ASN A 154 10.093 -6.184 -9.895 1.00 0.00 C ATOM 369 O ASN A 154 11.253 -6.226 -10.312 1.00 0.00 O ATOM 370 CB ASN A 154 10.104 -3.526 -9.696 1.00 0.00 C ATOM 371 CG ASN A 154 11.120 -3.362 -10.820 1.00 0.00 C ATOM 372 OD1 ASN A 154 10.790 -3.414 -12.000 1.00 0.00 O ATOM 373 ND2 ASN A 154 12.377 -3.142 -10.499 1.00 0.00 N ATOM 0 H ASN A 154 7.411 -4.741 -8.889 1.00 0.00 H new ATOM 0 HA ASN A 154 8.793 -4.818 -10.713 1.00 0.00 H new ATOM 0 HB2 ASN A 154 9.404 -2.692 -9.729 1.00 0.00 H new ATOM 0 HB3 ASN A 154 10.624 -3.468 -8.740 1.00 0.00 H new ATOM 0 HD21 ASN A 154 13.076 -3.015 -11.231 1.00 0.00 H new ATOM 0 HD22 ASN A 154 12.653 -3.099 -9.518 1.00 0.00 H new ATOM 380 N GLY A 155 9.453 -7.289 -9.480 1.00 0.00 N ATOM 381 CA GLY A 155 10.045 -8.629 -9.360 1.00 0.00 C ATOM 382 C GLY A 155 11.186 -8.743 -8.338 1.00 0.00 C ATOM 383 O GLY A 155 12.053 -9.607 -8.483 1.00 0.00 O ATOM 0 H GLY A 155 8.470 -7.271 -9.208 1.00 0.00 H new ATOM 0 HA2 GLY A 155 9.260 -9.334 -9.086 1.00 0.00 H new ATOM 0 HA3 GLY A 155 10.420 -8.933 -10.337 1.00 0.00 H new ATOM 387 N GLU A 156 11.235 -7.849 -7.347 1.00 0.00 N ATOM 388 CA GLU A 156 12.435 -7.566 -6.537 1.00 0.00 C ATOM 389 C GLU A 156 12.160 -7.277 -5.044 1.00 0.00 C ATOM 390 O GLU A 156 12.980 -6.684 -4.344 1.00 0.00 O ATOM 391 CB GLU A 156 13.256 -6.442 -7.190 1.00 0.00 C ATOM 392 CG GLU A 156 14.758 -6.691 -6.973 1.00 0.00 C ATOM 393 CD GLU A 156 15.596 -5.468 -7.395 1.00 0.00 C ATOM 394 OE1 GLU A 156 15.807 -4.547 -6.565 1.00 0.00 O ATOM 395 OE2 GLU A 156 16.067 -5.416 -8.560 1.00 0.00 O ATOM 0 H GLU A 156 10.428 -7.287 -7.075 1.00 0.00 H new ATOM 0 HA GLU A 156 13.016 -8.488 -6.527 1.00 0.00 H new ATOM 0 HB2 GLU A 156 13.038 -6.394 -8.257 1.00 0.00 H new ATOM 0 HB3 GLU A 156 12.973 -5.480 -6.763 1.00 0.00 H new ATOM 0 HG2 GLU A 156 14.943 -6.916 -5.923 1.00 0.00 H new ATOM 0 HG3 GLU A 156 15.071 -7.564 -7.546 1.00 0.00 H new ATOM 402 N LEU A 157 11.027 -7.778 -4.541 1.00 0.00 N ATOM 403 CA LEU A 157 10.856 -8.213 -3.146 1.00 0.00 C ATOM 404 C LEU A 157 11.007 -7.068 -2.130 1.00 0.00 C ATOM 405 O LEU A 157 12.038 -6.951 -1.457 1.00 0.00 O ATOM 406 CB LEU A 157 11.815 -9.395 -2.880 1.00 0.00 C ATOM 407 CG LEU A 157 11.640 -10.594 -3.834 1.00 0.00 C ATOM 408 CD1 LEU A 157 12.957 -11.359 -3.950 1.00 0.00 C ATOM 409 CD2 LEU A 157 10.515 -11.513 -3.361 1.00 0.00 C ATOM 0 H LEU A 157 10.184 -7.896 -5.102 1.00 0.00 H new ATOM 0 HA LEU A 157 9.830 -8.551 -3.004 1.00 0.00 H new ATOM 0 HB2 LEU A 157 12.842 -9.036 -2.954 1.00 0.00 H new ATOM 0 HB3 LEU A 157 11.671 -9.739 -1.856 1.00 0.00 H new ATOM 0 HG LEU A 157 11.363 -10.218 -4.819 1.00 0.00 H new ATOM 0 HD11 LEU A 157 12.828 -12.205 -4.625 1.00 0.00 H new ATOM 0 HD12 LEU A 157 13.729 -10.697 -4.342 1.00 0.00 H new ATOM 0 HD13 LEU A 157 13.255 -11.722 -2.966 1.00 0.00 H new ATOM 0 HD21 LEU A 157 10.414 -12.350 -4.052 1.00 0.00 H new ATOM 0 HD22 LEU A 157 10.748 -11.891 -2.366 1.00 0.00 H new ATOM 0 HD23 LEU A 157 9.579 -10.955 -3.327 1.00 0.00 H new ATOM 421 N VAL A 158 9.982 -6.206 -2.021 1.00 0.00 N ATOM 422 CA VAL A 158 10.027 -5.065 -1.082 1.00 0.00 C ATOM 423 C VAL A 158 10.234 -5.561 0.342 1.00 0.00 C ATOM 424 O VAL A 158 11.123 -5.086 1.051 1.00 0.00 O ATOM 425 CB VAL A 158 8.722 -4.245 -1.000 1.00 0.00 C ATOM 426 CG1 VAL A 158 8.769 -3.125 0.062 1.00 0.00 C ATOM 427 CG2 VAL A 158 8.251 -3.691 -2.316 1.00 0.00 C ATOM 0 H VAL A 158 9.121 -6.273 -2.563 1.00 0.00 H new ATOM 0 HA VAL A 158 10.836 -4.446 -1.469 1.00 0.00 H new ATOM 0 HB VAL A 158 7.984 -4.983 -0.684 1.00 0.00 H new ATOM 0 HG11 VAL A 158 7.820 -2.588 0.067 1.00 0.00 H new ATOM 0 HG12 VAL A 158 8.943 -3.563 1.045 1.00 0.00 H new ATOM 0 HG13 VAL A 158 9.577 -2.432 -0.175 1.00 0.00 H new ATOM 0 HG21 VAL A 158 7.329 -3.129 -2.165 1.00 0.00 H new ATOM 0 HG22 VAL A 158 9.015 -3.031 -2.727 1.00 0.00 H new ATOM 0 HG23 VAL A 158 8.067 -4.510 -3.011 1.00 0.00 H new ATOM 437 N ASP A 159 9.336 -6.465 0.749 1.00 0.00 N ATOM 438 CA ASP A 159 9.020 -6.767 2.140 1.00 0.00 C ATOM 439 C ASP A 159 8.690 -5.527 3.004 1.00 0.00 C ATOM 440 O ASP A 159 9.533 -4.977 3.722 1.00 0.00 O ATOM 441 CB ASP A 159 10.139 -7.620 2.741 1.00 0.00 C ATOM 442 CG ASP A 159 10.511 -8.910 1.980 1.00 0.00 C ATOM 443 OD1 ASP A 159 9.675 -9.481 1.240 1.00 0.00 O ATOM 444 OD2 ASP A 159 11.654 -9.400 2.169 1.00 0.00 O ATOM 0 H ASP A 159 8.792 -7.024 0.091 1.00 0.00 H new ATOM 0 HA ASP A 159 8.091 -7.337 2.143 1.00 0.00 H new ATOM 0 HB2 ASP A 159 11.033 -7.002 2.820 1.00 0.00 H new ATOM 0 HB3 ASP A 159 9.850 -7.895 3.756 1.00 0.00 H new ATOM 449 N PHE A 160 7.423 -5.097 2.952 1.00 0.00 N ATOM 450 CA PHE A 160 6.860 -4.083 3.853 1.00 0.00 C ATOM 451 C PHE A 160 6.889 -4.528 5.335 1.00 0.00 C ATOM 452 O PHE A 160 6.996 -5.720 5.647 1.00 0.00 O ATOM 453 CB PHE A 160 5.436 -3.739 3.382 1.00 0.00 C ATOM 454 CG PHE A 160 5.382 -2.691 2.287 1.00 0.00 C ATOM 455 CD1 PHE A 160 5.400 -1.330 2.636 1.00 0.00 C ATOM 456 CD2 PHE A 160 5.351 -3.036 0.920 1.00 0.00 C ATOM 457 CE1 PHE A 160 5.436 -0.360 1.631 1.00 0.00 C ATOM 458 CE2 PHE A 160 5.340 -2.060 -0.074 1.00 0.00 C ATOM 459 CZ PHE A 160 5.396 -0.714 0.282 1.00 0.00 C ATOM 0 H PHE A 160 6.749 -5.449 2.272 1.00 0.00 H new ATOM 0 HA PHE A 160 7.481 -3.188 3.808 1.00 0.00 H new ATOM 0 HB2 PHE A 160 4.954 -4.648 3.024 1.00 0.00 H new ATOM 0 HB3 PHE A 160 4.858 -3.387 4.236 1.00 0.00 H new ATOM 0 HD1 PHE A 160 5.386 -1.035 3.675 1.00 0.00 H new ATOM 0 HD2 PHE A 160 5.335 -4.078 0.638 1.00 0.00 H new ATOM 0 HE1 PHE A 160 5.496 0.683 1.903 1.00 0.00 H new ATOM 0 HE2 PHE A 160 5.288 -2.345 -1.114 1.00 0.00 H new ATOM 0 HZ PHE A 160 5.408 0.050 -0.481 1.00 0.00 H new ATOM 469 N THR A 161 6.781 -3.567 6.260 1.00 0.00 N ATOM 470 CA THR A 161 6.651 -3.817 7.718 1.00 0.00 C ATOM 471 C THR A 161 5.306 -4.485 8.033 1.00 0.00 C ATOM 472 O THR A 161 4.443 -4.531 7.159 1.00 0.00 O ATOM 473 CB THR A 161 6.814 -2.536 8.568 1.00 0.00 C ATOM 474 OG1 THR A 161 5.577 -1.933 8.878 1.00 0.00 O ATOM 475 CG2 THR A 161 7.658 -1.459 7.891 1.00 0.00 C ATOM 0 H THR A 161 6.780 -2.575 6.023 1.00 0.00 H new ATOM 0 HA THR A 161 7.467 -4.487 7.989 1.00 0.00 H new ATOM 0 HB THR A 161 7.314 -2.891 9.469 1.00 0.00 H new ATOM 0 HG1 THR A 161 5.731 -1.129 9.417 1.00 0.00 H new ATOM 0 HG21 THR A 161 7.730 -0.589 8.544 1.00 0.00 H new ATOM 0 HG22 THR A 161 8.657 -1.849 7.695 1.00 0.00 H new ATOM 0 HG23 THR A 161 7.191 -1.168 6.950 1.00 0.00 H new ATOM 483 N SER A 162 5.058 -4.957 9.261 1.00 0.00 N ATOM 484 CA SER A 162 3.737 -5.502 9.628 1.00 0.00 C ATOM 485 C SER A 162 2.599 -4.492 9.409 1.00 0.00 C ATOM 486 O SER A 162 1.690 -4.756 8.617 1.00 0.00 O ATOM 487 CB SER A 162 3.748 -6.028 11.067 1.00 0.00 C ATOM 488 OG SER A 162 4.177 -5.033 11.987 1.00 0.00 O ATOM 0 H SER A 162 5.746 -4.975 10.014 1.00 0.00 H new ATOM 0 HA SER A 162 3.538 -6.338 8.957 1.00 0.00 H new ATOM 0 HB2 SER A 162 2.748 -6.367 11.338 1.00 0.00 H new ATOM 0 HB3 SER A 162 4.407 -6.893 11.133 1.00 0.00 H new ATOM 0 HG SER A 162 4.170 -5.402 12.895 1.00 0.00 H new ATOM 494 N ALA A 163 2.669 -3.301 10.018 1.00 0.00 N ATOM 495 CA ALA A 163 1.652 -2.268 9.819 1.00 0.00 C ATOM 496 C ALA A 163 1.655 -1.678 8.414 1.00 0.00 C ATOM 497 O ALA A 163 0.590 -1.369 7.889 1.00 0.00 O ATOM 498 CB ALA A 163 1.854 -1.095 10.760 1.00 0.00 C ATOM 0 H ALA A 163 3.421 -3.032 10.652 1.00 0.00 H new ATOM 0 HA ALA A 163 0.710 -2.783 10.007 1.00 0.00 H new ATOM 0 HB1 ALA A 163 1.080 -0.349 10.582 1.00 0.00 H new ATOM 0 HB2 ALA A 163 1.794 -1.442 11.792 1.00 0.00 H new ATOM 0 HB3 ALA A 163 2.834 -0.651 10.583 1.00 0.00 H new ATOM 504 N GLU A 164 2.823 -1.467 7.810 1.00 0.00 N ATOM 505 CA GLU A 164 2.860 -0.854 6.486 1.00 0.00 C ATOM 506 C GLU A 164 2.265 -1.818 5.457 1.00 0.00 C ATOM 507 O GLU A 164 1.389 -1.420 4.688 1.00 0.00 O ATOM 508 CB GLU A 164 4.252 -0.315 6.144 1.00 0.00 C ATOM 509 CG GLU A 164 4.648 0.799 7.137 1.00 0.00 C ATOM 510 CD GLU A 164 5.872 1.635 6.708 1.00 0.00 C ATOM 511 OE1 GLU A 164 6.393 1.469 5.579 1.00 0.00 O ATOM 512 OE2 GLU A 164 6.330 2.476 7.516 1.00 0.00 O ATOM 0 H GLU A 164 3.733 -1.704 8.204 1.00 0.00 H new ATOM 0 HA GLU A 164 2.230 0.035 6.471 1.00 0.00 H new ATOM 0 HB2 GLU A 164 4.983 -1.123 6.181 1.00 0.00 H new ATOM 0 HB3 GLU A 164 4.260 0.075 5.126 1.00 0.00 H new ATOM 0 HG2 GLU A 164 3.797 1.467 7.272 1.00 0.00 H new ATOM 0 HG3 GLU A 164 4.855 0.347 8.107 1.00 0.00 H new ATOM 519 N TYR A 165 2.575 -3.113 5.553 1.00 0.00 N ATOM 520 CA TYR A 165 1.816 -4.119 4.819 1.00 0.00 C ATOM 521 C TYR A 165 0.333 -4.135 5.221 1.00 0.00 C ATOM 522 O TYR A 165 -0.491 -4.179 4.315 1.00 0.00 O ATOM 523 CB TYR A 165 2.426 -5.514 4.960 1.00 0.00 C ATOM 524 CG TYR A 165 1.464 -6.597 4.529 1.00 0.00 C ATOM 525 CD1 TYR A 165 0.959 -6.643 3.210 1.00 0.00 C ATOM 526 CD2 TYR A 165 0.931 -7.431 5.530 1.00 0.00 C ATOM 527 CE1 TYR A 165 -0.047 -7.576 2.908 1.00 0.00 C ATOM 528 CE2 TYR A 165 -0.067 -8.368 5.212 1.00 0.00 C ATOM 529 CZ TYR A 165 -0.562 -8.442 3.896 1.00 0.00 C ATOM 530 OH TYR A 165 -1.566 -9.311 3.601 1.00 0.00 O ATOM 0 H TYR A 165 3.335 -3.483 6.124 1.00 0.00 H new ATOM 0 HA TYR A 165 1.872 -3.834 3.769 1.00 0.00 H new ATOM 0 HB2 TYR A 165 3.334 -5.575 4.360 1.00 0.00 H new ATOM 0 HB3 TYR A 165 2.718 -5.679 5.997 1.00 0.00 H new ATOM 0 HD1 TYR A 165 1.338 -5.975 2.450 1.00 0.00 H new ATOM 0 HD2 TYR A 165 1.290 -7.351 6.545 1.00 0.00 H new ATOM 0 HE1 TYR A 165 -0.433 -7.631 1.901 1.00 0.00 H new ATOM 0 HE2 TYR A 165 -0.453 -9.029 5.974 1.00 0.00 H new ATOM 0 HH TYR A 165 -1.658 -9.386 2.628 1.00 0.00 H new ATOM 540 N ASP A 166 -0.056 -4.048 6.504 1.00 0.00 N ATOM 541 CA ASP A 166 -1.475 -3.977 6.863 1.00 0.00 C ATOM 542 C ASP A 166 -2.228 -2.837 6.161 1.00 0.00 C ATOM 543 O ASP A 166 -3.235 -3.063 5.478 1.00 0.00 O ATOM 544 CB ASP A 166 -1.646 -3.819 8.369 1.00 0.00 C ATOM 545 CG ASP A 166 -1.293 -5.034 9.243 1.00 0.00 C ATOM 546 OD1 ASP A 166 -1.428 -6.194 8.786 1.00 0.00 O ATOM 547 OD2 ASP A 166 -0.963 -4.822 10.438 1.00 0.00 O ATOM 0 H ASP A 166 0.585 -4.026 7.297 1.00 0.00 H new ATOM 0 HA ASP A 166 -1.907 -4.919 6.525 1.00 0.00 H new ATOM 0 HB2 ASP A 166 -1.032 -2.979 8.693 1.00 0.00 H new ATOM 0 HB3 ASP A 166 -2.684 -3.550 8.566 1.00 0.00 H new ATOM 552 N LEU A 167 -1.721 -1.611 6.303 1.00 0.00 N ATOM 553 CA LEU A 167 -2.351 -0.406 5.781 1.00 0.00 C ATOM 554 C LEU A 167 -2.332 -0.419 4.248 1.00 0.00 C ATOM 555 O LEU A 167 -3.336 -0.092 3.604 1.00 0.00 O ATOM 556 CB LEU A 167 -1.685 0.801 6.481 1.00 0.00 C ATOM 557 CG LEU A 167 -0.390 1.349 5.873 1.00 0.00 C ATOM 558 CD1 LEU A 167 -0.657 2.469 4.875 1.00 0.00 C ATOM 559 CD2 LEU A 167 0.472 1.919 6.990 1.00 0.00 C ATOM 0 H LEU A 167 -0.845 -1.429 6.793 1.00 0.00 H new ATOM 0 HA LEU A 167 -3.415 -0.339 6.010 1.00 0.00 H new ATOM 0 HB2 LEU A 167 -2.411 1.613 6.513 1.00 0.00 H new ATOM 0 HB3 LEU A 167 -1.478 0.518 7.513 1.00 0.00 H new ATOM 0 HG LEU A 167 0.105 0.529 5.354 1.00 0.00 H new ATOM 0 HD11 LEU A 167 0.289 2.828 4.469 1.00 0.00 H new ATOM 0 HD12 LEU A 167 -1.281 2.093 4.064 1.00 0.00 H new ATOM 0 HD13 LEU A 167 -1.170 3.289 5.377 1.00 0.00 H new ATOM 0 HD21 LEU A 167 1.398 2.313 6.570 1.00 0.00 H new ATOM 0 HD22 LEU A 167 -0.068 2.721 7.493 1.00 0.00 H new ATOM 0 HD23 LEU A 167 0.705 1.132 7.708 1.00 0.00 H new ATOM 571 N LEU A 168 -1.234 -0.920 3.673 1.00 0.00 N ATOM 572 CA LEU A 168 -1.108 -1.027 2.223 1.00 0.00 C ATOM 573 C LEU A 168 -2.083 -2.088 1.683 1.00 0.00 C ATOM 574 O LEU A 168 -2.882 -1.766 0.816 1.00 0.00 O ATOM 575 CB LEU A 168 0.357 -1.279 1.848 1.00 0.00 C ATOM 576 CG LEU A 168 0.821 -0.881 0.437 1.00 0.00 C ATOM 577 CD1 LEU A 168 1.986 -1.788 0.053 1.00 0.00 C ATOM 578 CD2 LEU A 168 -0.244 -0.772 -0.644 1.00 0.00 C ATOM 0 H LEU A 168 -0.423 -1.256 4.192 1.00 0.00 H new ATOM 0 HA LEU A 168 -1.391 -0.089 1.745 1.00 0.00 H new ATOM 0 HB2 LEU A 168 0.981 -0.748 2.567 1.00 0.00 H new ATOM 0 HB3 LEU A 168 0.556 -2.343 1.977 1.00 0.00 H new ATOM 0 HG LEU A 168 1.138 0.160 0.496 1.00 0.00 H new ATOM 0 HD11 LEU A 168 2.336 -1.527 -0.946 1.00 0.00 H new ATOM 0 HD12 LEU A 168 2.799 -1.659 0.768 1.00 0.00 H new ATOM 0 HD13 LEU A 168 1.657 -2.827 0.062 1.00 0.00 H new ATOM 0 HD21 LEU A 168 0.222 -0.485 -1.586 1.00 0.00 H new ATOM 0 HD22 LEU A 168 -0.741 -1.735 -0.764 1.00 0.00 H new ATOM 0 HD23 LEU A 168 -0.978 -0.018 -0.357 1.00 0.00 H new ATOM 590 N TRP A 169 -2.124 -3.302 2.241 1.00 0.00 N ATOM 591 CA TRP A 169 -3.164 -4.310 1.966 1.00 0.00 C ATOM 592 C TRP A 169 -4.575 -3.745 2.054 1.00 0.00 C ATOM 593 O TRP A 169 -5.328 -3.884 1.100 1.00 0.00 O ATOM 594 CB TRP A 169 -3.067 -5.496 2.926 1.00 0.00 C ATOM 595 CG TRP A 169 -4.259 -6.413 2.953 1.00 0.00 C ATOM 596 CD1 TRP A 169 -5.273 -6.363 3.845 1.00 0.00 C ATOM 597 CD2 TRP A 169 -4.612 -7.481 2.027 1.00 0.00 C ATOM 598 NE1 TRP A 169 -6.272 -7.245 3.472 1.00 0.00 N ATOM 599 CE2 TRP A 169 -5.927 -7.946 2.337 1.00 0.00 C ATOM 600 CE3 TRP A 169 -3.955 -8.107 0.953 1.00 0.00 C ATOM 601 CZ2 TRP A 169 -6.584 -8.916 1.562 1.00 0.00 C ATOM 602 CZ3 TRP A 169 -4.579 -9.127 0.217 1.00 0.00 C ATOM 603 CH2 TRP A 169 -5.899 -9.517 0.496 1.00 0.00 C ATOM 0 H TRP A 169 -1.424 -3.622 2.910 1.00 0.00 H new ATOM 0 HA TRP A 169 -2.979 -4.637 0.943 1.00 0.00 H new ATOM 0 HB2 TRP A 169 -2.187 -6.082 2.662 1.00 0.00 H new ATOM 0 HB3 TRP A 169 -2.904 -5.112 3.933 1.00 0.00 H new ATOM 0 HD1 TRP A 169 -5.300 -5.729 4.719 1.00 0.00 H new ATOM 0 HE1 TRP A 169 -7.152 -7.361 3.974 1.00 0.00 H new ATOM 0 HE3 TRP A 169 -2.954 -7.798 0.690 1.00 0.00 H new ATOM 0 HZ2 TRP A 169 -7.603 -9.195 1.784 1.00 0.00 H new ATOM 0 HZ3 TRP A 169 -4.035 -9.619 -0.576 1.00 0.00 H new ATOM 0 HH2 TRP A 169 -6.382 -10.273 -0.105 1.00 0.00 H new ATOM 614 N LEU A 170 -4.928 -3.079 3.154 1.00 0.00 N ATOM 615 CA LEU A 170 -6.238 -2.437 3.308 1.00 0.00 C ATOM 616 C LEU A 170 -6.557 -1.503 2.123 1.00 0.00 C ATOM 617 O LEU A 170 -7.603 -1.622 1.459 1.00 0.00 O ATOM 618 CB LEU A 170 -6.213 -1.666 4.647 1.00 0.00 C ATOM 619 CG LEU A 170 -6.956 -2.328 5.818 1.00 0.00 C ATOM 620 CD1 LEU A 170 -8.467 -2.135 5.666 1.00 0.00 C ATOM 621 CD2 LEU A 170 -6.643 -3.815 5.981 1.00 0.00 C ATOM 0 H LEU A 170 -4.317 -2.968 3.963 1.00 0.00 H new ATOM 0 HA LEU A 170 -7.028 -3.188 3.316 1.00 0.00 H new ATOM 0 HB2 LEU A 170 -5.173 -1.518 4.939 1.00 0.00 H new ATOM 0 HB3 LEU A 170 -6.642 -0.677 4.483 1.00 0.00 H new ATOM 0 HG LEU A 170 -6.599 -1.831 6.720 1.00 0.00 H new ATOM 0 HD11 LEU A 170 -8.980 -2.609 6.503 1.00 0.00 H new ATOM 0 HD12 LEU A 170 -8.698 -1.070 5.655 1.00 0.00 H new ATOM 0 HD13 LEU A 170 -8.800 -2.588 4.732 1.00 0.00 H new ATOM 0 HD21 LEU A 170 -7.203 -4.214 6.827 1.00 0.00 H new ATOM 0 HD22 LEU A 170 -6.927 -4.348 5.074 1.00 0.00 H new ATOM 0 HD23 LEU A 170 -5.576 -3.945 6.159 1.00 0.00 H new ATOM 633 N LEU A 171 -5.601 -0.625 1.813 1.00 0.00 N ATOM 634 CA LEU A 171 -5.713 0.360 0.747 1.00 0.00 C ATOM 635 C LEU A 171 -5.910 -0.341 -0.609 1.00 0.00 C ATOM 636 O LEU A 171 -6.904 -0.117 -1.294 1.00 0.00 O ATOM 637 CB LEU A 171 -4.394 1.157 0.755 1.00 0.00 C ATOM 638 CG LEU A 171 -4.261 2.395 1.644 1.00 0.00 C ATOM 639 CD1 LEU A 171 -2.971 3.097 1.222 1.00 0.00 C ATOM 640 CD2 LEU A 171 -5.394 3.397 1.518 1.00 0.00 C ATOM 0 H LEU A 171 -4.711 -0.582 2.309 1.00 0.00 H new ATOM 0 HA LEU A 171 -6.571 1.015 0.900 1.00 0.00 H new ATOM 0 HB2 LEU A 171 -3.599 0.467 1.037 1.00 0.00 H new ATOM 0 HB3 LEU A 171 -4.196 1.470 -0.270 1.00 0.00 H new ATOM 0 HG LEU A 171 -4.273 2.053 2.679 1.00 0.00 H new ATOM 0 HD11 LEU A 171 -2.828 3.991 1.829 1.00 0.00 H new ATOM 0 HD12 LEU A 171 -2.126 2.423 1.365 1.00 0.00 H new ATOM 0 HD13 LEU A 171 -3.037 3.378 0.171 1.00 0.00 H new ATOM 0 HD21 LEU A 171 -5.211 4.239 2.186 1.00 0.00 H new ATOM 0 HD22 LEU A 171 -5.451 3.755 0.490 1.00 0.00 H new ATOM 0 HD23 LEU A 171 -6.335 2.918 1.788 1.00 0.00 H new ATOM 652 N ALA A 172 -4.992 -1.242 -0.953 1.00 0.00 N ATOM 653 CA ALA A 172 -4.957 -2.074 -2.149 1.00 0.00 C ATOM 654 C ALA A 172 -6.163 -3.021 -2.316 1.00 0.00 C ATOM 655 O ALA A 172 -6.601 -3.309 -3.428 1.00 0.00 O ATOM 656 CB ALA A 172 -3.685 -2.903 -2.042 1.00 0.00 C ATOM 0 H ALA A 172 -4.188 -1.422 -0.351 1.00 0.00 H new ATOM 0 HA ALA A 172 -4.990 -1.420 -3.020 1.00 0.00 H new ATOM 0 HB1 ALA A 172 -3.599 -3.552 -2.914 1.00 0.00 H new ATOM 0 HB2 ALA A 172 -2.821 -2.240 -1.997 1.00 0.00 H new ATOM 0 HB3 ALA A 172 -3.722 -3.512 -1.139 1.00 0.00 H new ATOM 662 N SER A 173 -6.708 -3.504 -1.208 1.00 0.00 N ATOM 663 CA SER A 173 -7.877 -4.386 -1.151 1.00 0.00 C ATOM 664 C SER A 173 -9.162 -3.581 -1.364 1.00 0.00 C ATOM 665 O SER A 173 -10.110 -4.083 -1.974 1.00 0.00 O ATOM 666 CB SER A 173 -7.898 -5.133 0.189 1.00 0.00 C ATOM 667 OG SER A 173 -8.975 -6.056 0.249 1.00 0.00 O ATOM 0 H SER A 173 -6.336 -3.286 -0.284 1.00 0.00 H new ATOM 0 HA SER A 173 -7.813 -5.123 -1.951 1.00 0.00 H new ATOM 0 HB2 SER A 173 -6.955 -5.662 0.328 1.00 0.00 H new ATOM 0 HB3 SER A 173 -7.985 -4.416 1.006 1.00 0.00 H new ATOM 0 HG SER A 173 -8.962 -6.518 1.113 1.00 0.00 H new ATOM 673 N ASN A 174 -9.169 -2.295 -0.974 1.00 0.00 N ATOM 674 CA ASN A 174 -10.225 -1.369 -1.397 1.00 0.00 C ATOM 675 C ASN A 174 -9.938 -0.663 -2.739 1.00 0.00 C ATOM 676 O ASN A 174 -10.741 0.181 -3.148 1.00 0.00 O ATOM 677 CB ASN A 174 -10.377 -0.343 -0.283 1.00 0.00 C ATOM 678 CG ASN A 174 -11.090 -0.909 0.936 1.00 0.00 C ATOM 679 OD1 ASN A 174 -12.304 -0.804 1.058 1.00 0.00 O ATOM 680 ND2 ASN A 174 -10.392 -1.502 1.872 1.00 0.00 N ATOM 0 H ASN A 174 -8.460 -1.879 -0.371 1.00 0.00 H new ATOM 0 HA ASN A 174 -11.140 -1.937 -1.568 1.00 0.00 H new ATOM 0 HB2 ASN A 174 -9.391 0.018 0.011 1.00 0.00 H new ATOM 0 HB3 ASN A 174 -10.932 0.517 -0.658 1.00 0.00 H new ATOM 0 HD21 ASN A 174 -10.860 -1.874 2.698 1.00 0.00 H new ATOM 0 HD22 ASN A 174 -9.381 -1.592 1.775 1.00 0.00 H new ATOM 687 N ALA A 175 -8.809 -0.940 -3.401 1.00 0.00 N ATOM 688 CA ALA A 175 -8.258 -0.056 -4.423 1.00 0.00 C ATOM 689 C ALA A 175 -9.255 0.343 -5.532 1.00 0.00 C ATOM 690 O ALA A 175 -9.913 -0.493 -6.160 1.00 0.00 O ATOM 691 CB ALA A 175 -6.928 -0.598 -4.935 1.00 0.00 C ATOM 0 H ALA A 175 -8.256 -1.782 -3.241 1.00 0.00 H new ATOM 0 HA ALA A 175 -8.052 0.900 -3.942 1.00 0.00 H new ATOM 0 HB1 ALA A 175 -6.531 0.073 -5.697 1.00 0.00 H new ATOM 0 HB2 ALA A 175 -6.221 -0.668 -4.108 1.00 0.00 H new ATOM 0 HB3 ALA A 175 -7.080 -1.587 -5.367 1.00 0.00 H new ATOM 697 N GLY A 176 -9.372 1.658 -5.718 1.00 0.00 N ATOM 698 CA GLY A 176 -10.407 2.356 -6.499 1.00 0.00 C ATOM 699 C GLY A 176 -11.448 3.137 -5.664 1.00 0.00 C ATOM 700 O GLY A 176 -12.114 4.026 -6.201 1.00 0.00 O ATOM 0 H GLY A 176 -8.707 2.310 -5.303 1.00 0.00 H new ATOM 0 HA2 GLY A 176 -9.917 3.051 -7.182 1.00 0.00 H new ATOM 0 HA3 GLY A 176 -10.932 1.624 -7.112 1.00 0.00 H new ATOM 704 N ARG A 177 -11.546 2.876 -4.349 1.00 0.00 N ATOM 705 CA ARG A 177 -12.269 3.684 -3.332 1.00 0.00 C ATOM 706 C ARG A 177 -11.290 4.595 -2.582 1.00 0.00 C ATOM 707 O ARG A 177 -10.222 4.100 -2.253 1.00 0.00 O ATOM 708 CB ARG A 177 -12.928 2.696 -2.351 1.00 0.00 C ATOM 709 CG ARG A 177 -13.660 3.374 -1.188 1.00 0.00 C ATOM 710 CD ARG A 177 -14.237 2.339 -0.210 1.00 0.00 C ATOM 711 NE ARG A 177 -15.394 1.627 -0.794 1.00 0.00 N ATOM 712 CZ ARG A 177 -15.680 0.336 -0.729 1.00 0.00 C ATOM 713 NH1 ARG A 177 -14.929 -0.537 -0.121 1.00 0.00 N1+ ATOM 714 NH2 ARG A 177 -16.769 -0.116 -1.285 1.00 0.00 N ATOM 0 H ARG A 177 -11.102 2.055 -3.938 1.00 0.00 H new ATOM 0 HA ARG A 177 -13.018 4.318 -3.807 1.00 0.00 H new ATOM 0 HB2 ARG A 177 -13.635 2.072 -2.898 1.00 0.00 H new ATOM 0 HB3 ARG A 177 -12.162 2.033 -1.949 1.00 0.00 H new ATOM 0 HG2 ARG A 177 -12.973 4.034 -0.658 1.00 0.00 H new ATOM 0 HG3 ARG A 177 -14.465 3.998 -1.577 1.00 0.00 H new ATOM 0 HD2 ARG A 177 -13.463 1.620 0.058 1.00 0.00 H new ATOM 0 HD3 ARG A 177 -14.542 2.837 0.710 1.00 0.00 H new ATOM 0 HE ARG A 177 -16.056 2.204 -1.313 1.00 0.00 H new ATOM 0 HH11 ARG A 177 -14.069 -0.238 0.338 1.00 0.00 H new ATOM 0 HH12 ARG A 177 -15.201 -1.520 -0.104 1.00 0.00 H new ATOM 0 HH21 ARG A 177 -17.398 0.525 -1.769 1.00 0.00 H new ATOM 0 HH22 ARG A 177 -16.992 -1.110 -1.236 1.00 0.00 H new ATOM 728 N ILE A 178 -11.596 5.859 -2.242 1.00 0.00 N ATOM 729 CA ILE A 178 -10.704 6.649 -1.349 1.00 0.00 C ATOM 730 C ILE A 178 -10.876 6.188 0.100 1.00 0.00 C ATOM 731 O ILE A 178 -12.003 6.133 0.602 1.00 0.00 O ATOM 732 CB ILE A 178 -10.911 8.186 -1.394 1.00 0.00 C ATOM 733 CG1 ILE A 178 -10.931 8.784 -2.818 1.00 0.00 C ATOM 734 CG2 ILE A 178 -9.848 8.918 -0.524 1.00 0.00 C ATOM 735 CD1 ILE A 178 -11.939 9.931 -2.917 1.00 0.00 C ATOM 0 H ILE A 178 -12.430 6.353 -2.558 1.00 0.00 H new ATOM 0 HA ILE A 178 -9.699 6.460 -1.727 1.00 0.00 H new ATOM 0 HB ILE A 178 -11.906 8.351 -0.980 1.00 0.00 H new ATOM 0 HG12 ILE A 178 -9.936 9.146 -3.078 1.00 0.00 H new ATOM 0 HG13 ILE A 178 -11.186 8.007 -3.539 1.00 0.00 H new ATOM 0 HG21 ILE A 178 -10.016 9.994 -0.573 1.00 0.00 H new ATOM 0 HG22 ILE A 178 -9.932 8.584 0.510 1.00 0.00 H new ATOM 0 HG23 ILE A 178 -8.851 8.689 -0.899 1.00 0.00 H new ATOM 0 HD11 ILE A 178 -11.933 10.334 -3.930 1.00 0.00 H new ATOM 0 HD12 ILE A 178 -12.936 9.560 -2.680 1.00 0.00 H new ATOM 0 HD13 ILE A 178 -11.667 10.717 -2.212 1.00 0.00 H new ATOM 747 N LEU A 179 -9.765 5.927 0.790 1.00 0.00 N ATOM 748 CA LEU A 179 -9.732 5.530 2.182 1.00 0.00 C ATOM 749 C LEU A 179 -9.214 6.711 3.030 1.00 0.00 C ATOM 750 O LEU A 179 -8.109 7.175 2.807 1.00 0.00 O ATOM 751 CB LEU A 179 -8.858 4.284 2.351 1.00 0.00 C ATOM 752 CG LEU A 179 -9.067 3.045 1.464 1.00 0.00 C ATOM 753 CD1 LEU A 179 -10.508 2.564 1.505 1.00 0.00 C ATOM 754 CD2 LEU A 179 -8.574 3.043 0.028 1.00 0.00 C ATOM 0 H LEU A 179 -8.836 5.991 0.373 1.00 0.00 H new ATOM 0 HA LEU A 179 -10.735 5.274 2.524 1.00 0.00 H new ATOM 0 HB2 LEU A 179 -7.823 4.600 2.220 1.00 0.00 H new ATOM 0 HB3 LEU A 179 -8.963 3.958 3.386 1.00 0.00 H new ATOM 0 HG LEU A 179 -8.377 2.354 1.948 1.00 0.00 H new ATOM 0 HD11 LEU A 179 -10.617 1.687 0.866 1.00 0.00 H new ATOM 0 HD12 LEU A 179 -10.775 2.303 2.529 1.00 0.00 H new ATOM 0 HD13 LEU A 179 -11.166 3.356 1.149 1.00 0.00 H new ATOM 0 HD21 LEU A 179 -8.811 2.086 -0.437 1.00 0.00 H new ATOM 0 HD22 LEU A 179 -9.061 3.846 -0.525 1.00 0.00 H new ATOM 0 HD23 LEU A 179 -7.495 3.196 0.014 1.00 0.00 H new ATOM 766 N SER A 180 -9.962 7.217 4.002 1.00 0.00 N ATOM 767 CA SER A 180 -9.782 8.530 4.668 1.00 0.00 C ATOM 768 C SER A 180 -8.606 8.706 5.677 1.00 0.00 C ATOM 769 O SER A 180 -8.801 9.306 6.734 1.00 0.00 O ATOM 770 CB SER A 180 -11.118 8.960 5.300 1.00 0.00 C ATOM 771 OG SER A 180 -12.188 8.815 4.376 1.00 0.00 O ATOM 0 H SER A 180 -10.759 6.704 4.378 1.00 0.00 H new ATOM 0 HA SER A 180 -9.468 9.187 3.857 1.00 0.00 H new ATOM 0 HB2 SER A 180 -11.315 8.358 6.187 1.00 0.00 H new ATOM 0 HB3 SER A 180 -11.053 9.998 5.626 1.00 0.00 H new ATOM 0 HG SER A 180 -13.027 9.093 4.800 1.00 0.00 H new ATOM 777 N ARG A 181 -7.392 8.200 5.386 1.00 0.00 N ATOM 778 CA ARG A 181 -6.176 8.034 6.271 1.00 0.00 C ATOM 779 C ARG A 181 -6.373 7.305 7.634 1.00 0.00 C ATOM 780 O ARG A 181 -5.845 6.214 7.937 1.00 0.00 O ATOM 781 CB ARG A 181 -5.473 9.392 6.526 1.00 0.00 C ATOM 782 CG ARG A 181 -5.346 10.318 5.308 1.00 0.00 C ATOM 783 CD ARG A 181 -4.494 11.561 5.603 1.00 0.00 C ATOM 784 NE ARG A 181 -5.171 12.472 6.545 1.00 0.00 N ATOM 785 CZ ARG A 181 -4.637 13.515 7.157 1.00 0.00 C ATOM 786 NH1 ARG A 181 -3.405 13.887 6.973 1.00 0.00 N1+ ATOM 787 NH2 ARG A 181 -5.350 14.219 7.988 1.00 0.00 N ATOM 0 H ARG A 181 -7.198 7.860 4.444 1.00 0.00 H new ATOM 0 HA ARG A 181 -5.556 7.360 5.680 1.00 0.00 H new ATOM 0 HB2 ARG A 181 -6.020 9.922 7.306 1.00 0.00 H new ATOM 0 HB3 ARG A 181 -4.474 9.195 6.915 1.00 0.00 H new ATOM 0 HG2 ARG A 181 -4.903 9.765 4.480 1.00 0.00 H new ATOM 0 HG3 ARG A 181 -6.340 10.630 4.987 1.00 0.00 H new ATOM 0 HD2 ARG A 181 -3.534 11.255 6.019 1.00 0.00 H new ATOM 0 HD3 ARG A 181 -4.285 12.089 4.672 1.00 0.00 H new ATOM 0 HE ARG A 181 -6.152 12.277 6.745 1.00 0.00 H new ATOM 0 HH11 ARG A 181 -2.805 13.366 6.333 1.00 0.00 H new ATOM 0 HH12 ARG A 181 -3.038 14.699 7.469 1.00 0.00 H new ATOM 0 HH21 ARG A 181 -6.322 13.966 8.167 1.00 0.00 H new ATOM 0 HH22 ARG A 181 -4.937 15.024 8.460 1.00 0.00 H new ATOM 801 N GLU A 182 -7.181 7.929 8.477 1.00 0.00 N ATOM 802 CA GLU A 182 -7.490 7.446 9.814 1.00 0.00 C ATOM 803 C GLU A 182 -8.342 6.183 9.728 1.00 0.00 C ATOM 804 O GLU A 182 -8.088 5.255 10.473 1.00 0.00 O ATOM 805 CB GLU A 182 -8.159 8.560 10.637 1.00 0.00 C ATOM 806 CG GLU A 182 -9.585 8.878 10.166 1.00 0.00 C ATOM 807 CD GLU A 182 -10.074 10.225 10.732 1.00 0.00 C ATOM 808 OE1 GLU A 182 -9.855 11.282 10.089 1.00 0.00 O ATOM 809 OE2 GLU A 182 -10.687 10.242 11.829 1.00 0.00 O ATOM 0 H GLU A 182 -7.650 8.804 8.246 1.00 0.00 H new ATOM 0 HA GLU A 182 -6.570 7.177 10.333 1.00 0.00 H new ATOM 0 HB2 GLU A 182 -8.186 8.264 11.686 1.00 0.00 H new ATOM 0 HB3 GLU A 182 -7.552 9.463 10.577 1.00 0.00 H new ATOM 0 HG2 GLU A 182 -9.612 8.907 9.077 1.00 0.00 H new ATOM 0 HG3 GLU A 182 -10.260 8.082 10.481 1.00 0.00 H new ATOM 816 N ASP A 183 -9.271 6.089 8.770 1.00 0.00 N ATOM 817 CA ASP A 183 -10.139 4.917 8.557 1.00 0.00 C ATOM 818 C ASP A 183 -9.321 3.625 8.391 1.00 0.00 C ATOM 819 O ASP A 183 -9.596 2.590 9.007 1.00 0.00 O ATOM 820 CB ASP A 183 -10.987 5.159 7.292 1.00 0.00 C ATOM 821 CG ASP A 183 -12.492 5.128 7.608 1.00 0.00 C ATOM 822 OD1 ASP A 183 -13.052 6.179 7.999 1.00 0.00 O ATOM 823 OD2 ASP A 183 -13.120 4.051 7.471 1.00 0.00 O ATOM 0 H ASP A 183 -9.447 6.841 8.104 1.00 0.00 H new ATOM 0 HA ASP A 183 -10.776 4.792 9.432 1.00 0.00 H new ATOM 0 HB2 ASP A 183 -10.725 6.123 6.856 1.00 0.00 H new ATOM 0 HB3 ASP A 183 -10.755 4.399 6.546 1.00 0.00 H new ATOM 828 N ILE A 184 -8.251 3.736 7.599 1.00 0.00 N ATOM 829 CA ILE A 184 -7.241 2.708 7.372 1.00 0.00 C ATOM 830 C ILE A 184 -6.603 2.348 8.712 1.00 0.00 C ATOM 831 O ILE A 184 -6.724 1.213 9.188 1.00 0.00 O ATOM 832 CB ILE A 184 -6.160 3.209 6.383 1.00 0.00 C ATOM 833 CG1 ILE A 184 -6.691 3.664 5.017 1.00 0.00 C ATOM 834 CG2 ILE A 184 -5.086 2.137 6.223 1.00 0.00 C ATOM 835 CD1 ILE A 184 -7.349 5.051 5.073 1.00 0.00 C ATOM 0 H ILE A 184 -8.059 4.589 7.074 1.00 0.00 H new ATOM 0 HA ILE A 184 -7.712 1.828 6.934 1.00 0.00 H new ATOM 0 HB ILE A 184 -5.739 4.112 6.824 1.00 0.00 H new ATOM 0 HG12 ILE A 184 -5.870 3.684 4.300 1.00 0.00 H new ATOM 0 HG13 ILE A 184 -7.416 2.936 4.652 1.00 0.00 H new ATOM 0 HG21 ILE A 184 -4.323 2.487 5.527 1.00 0.00 H new ATOM 0 HG22 ILE A 184 -4.628 1.933 7.191 1.00 0.00 H new ATOM 0 HG23 ILE A 184 -5.538 1.224 5.836 1.00 0.00 H new ATOM 0 HD11 ILE A 184 -7.707 5.324 4.080 1.00 0.00 H new ATOM 0 HD12 ILE A 184 -8.188 5.028 5.768 1.00 0.00 H new ATOM 0 HD13 ILE A 184 -6.619 5.787 5.411 1.00 0.00 H new ATOM 847 N PHE A 185 -5.930 3.320 9.340 1.00 0.00 N ATOM 848 CA PHE A 185 -5.175 2.988 10.555 1.00 0.00 C ATOM 849 C PHE A 185 -6.039 2.469 11.708 1.00 0.00 C ATOM 850 O PHE A 185 -5.651 1.599 12.472 1.00 0.00 O ATOM 851 CB PHE A 185 -4.410 4.212 11.011 1.00 0.00 C ATOM 852 CG PHE A 185 -3.109 3.964 11.755 1.00 0.00 C ATOM 853 CD1 PHE A 185 -2.668 2.670 12.101 1.00 0.00 C ATOM 854 CD2 PHE A 185 -2.310 5.072 12.077 1.00 0.00 C ATOM 855 CE1 PHE A 185 -1.454 2.488 12.778 1.00 0.00 C ATOM 856 CE2 PHE A 185 -1.104 4.895 12.780 1.00 0.00 C ATOM 857 CZ PHE A 185 -0.678 3.602 13.140 1.00 0.00 C ATOM 0 H PHE A 185 -5.891 4.296 9.047 1.00 0.00 H new ATOM 0 HA PHE A 185 -4.503 2.172 10.289 1.00 0.00 H new ATOM 0 HB2 PHE A 185 -4.190 4.822 10.135 1.00 0.00 H new ATOM 0 HB3 PHE A 185 -5.063 4.802 11.654 1.00 0.00 H new ATOM 0 HD1 PHE A 185 -3.271 1.812 11.842 1.00 0.00 H new ATOM 0 HD2 PHE A 185 -2.622 6.064 11.784 1.00 0.00 H new ATOM 0 HE1 PHE A 185 -1.115 1.492 13.021 1.00 0.00 H new ATOM 0 HE2 PHE A 185 -0.504 5.753 13.044 1.00 0.00 H new ATOM 0 HZ PHE A 185 0.241 3.467 13.692 1.00 0.00 H new ATOM 867 N GLU A 186 -7.244 2.989 11.797 1.00 0.00 N ATOM 868 CA GLU A 186 -8.301 2.552 12.714 1.00 0.00 C ATOM 869 C GLU A 186 -8.875 1.162 12.369 1.00 0.00 C ATOM 870 O GLU A 186 -9.329 0.465 13.283 1.00 0.00 O ATOM 871 CB GLU A 186 -9.396 3.624 12.755 1.00 0.00 C ATOM 872 CG GLU A 186 -8.914 4.912 13.452 1.00 0.00 C ATOM 873 CD GLU A 186 -8.635 4.691 14.949 1.00 0.00 C ATOM 874 OE1 GLU A 186 -9.596 4.564 15.747 1.00 0.00 O ATOM 875 OE2 GLU A 186 -7.440 4.670 15.335 1.00 0.00 O ATOM 0 H GLU A 186 -7.538 3.767 11.207 1.00 0.00 H new ATOM 0 HA GLU A 186 -7.861 2.436 13.704 1.00 0.00 H new ATOM 0 HB2 GLU A 186 -9.713 3.858 11.739 1.00 0.00 H new ATOM 0 HB3 GLU A 186 -10.268 3.232 13.279 1.00 0.00 H new ATOM 0 HG2 GLU A 186 -8.008 5.270 12.964 1.00 0.00 H new ATOM 0 HG3 GLU A 186 -9.668 5.691 13.335 1.00 0.00 H new ATOM 882 N ARG A 187 -8.786 0.692 11.111 1.00 0.00 N ATOM 883 CA ARG A 187 -8.883 -0.749 10.797 1.00 0.00 C ATOM 884 C ARG A 187 -7.716 -1.533 11.413 1.00 0.00 C ATOM 885 O ARG A 187 -7.966 -2.466 12.175 1.00 0.00 O ATOM 886 CB ARG A 187 -9.024 -1.011 9.282 1.00 0.00 C ATOM 887 CG ARG A 187 -9.726 -2.347 8.961 1.00 0.00 C ATOM 888 CD ARG A 187 -8.945 -3.620 9.313 1.00 0.00 C ATOM 889 NE ARG A 187 -9.509 -4.796 8.623 1.00 0.00 N ATOM 890 CZ ARG A 187 -9.045 -6.033 8.655 1.00 0.00 C ATOM 891 NH1 ARG A 187 -7.986 -6.358 9.344 1.00 0.00 N1+ ATOM 892 NH2 ARG A 187 -9.638 -6.977 7.986 1.00 0.00 N ATOM 0 H ARG A 187 -8.647 1.287 10.295 1.00 0.00 H new ATOM 0 HA ARG A 187 -9.801 -1.117 11.256 1.00 0.00 H new ATOM 0 HB2 ARG A 187 -9.586 -0.194 8.829 1.00 0.00 H new ATOM 0 HB3 ARG A 187 -8.034 -1.009 8.825 1.00 0.00 H new ATOM 0 HG2 ARG A 187 -10.678 -2.371 9.491 1.00 0.00 H new ATOM 0 HG3 ARG A 187 -9.954 -2.368 7.895 1.00 0.00 H new ATOM 0 HD2 ARG A 187 -7.899 -3.498 9.034 1.00 0.00 H new ATOM 0 HD3 ARG A 187 -8.970 -3.780 10.391 1.00 0.00 H new ATOM 0 HE ARG A 187 -10.346 -4.637 8.062 1.00 0.00 H new ATOM 0 HH11 ARG A 187 -7.489 -5.647 9.880 1.00 0.00 H new ATOM 0 HH12 ARG A 187 -7.655 -7.323 9.346 1.00 0.00 H new ATOM 0 HH21 ARG A 187 -10.467 -6.765 7.431 1.00 0.00 H new ATOM 0 HH22 ARG A 187 -9.274 -7.929 8.016 1.00 0.00 H new ATOM 906 N LEU A 188 -6.456 -1.187 11.104 1.00 0.00 N ATOM 907 CA LEU A 188 -5.326 -2.088 11.461 1.00 0.00 C ATOM 908 C LEU A 188 -4.794 -1.981 12.908 1.00 0.00 C ATOM 909 O LEU A 188 -4.334 -2.988 13.451 1.00 0.00 O ATOM 910 CB LEU A 188 -4.176 -2.016 10.439 1.00 0.00 C ATOM 911 CG LEU A 188 -3.574 -0.610 10.297 1.00 0.00 C ATOM 912 CD1 LEU A 188 -2.059 -0.512 10.441 1.00 0.00 C ATOM 913 CD2 LEU A 188 -3.844 -0.089 8.908 1.00 0.00 C ATOM 0 H LEU A 188 -6.190 -0.326 10.626 1.00 0.00 H new ATOM 0 HA LEU A 188 -5.781 -3.077 11.416 1.00 0.00 H new ATOM 0 HB2 LEU A 188 -3.391 -2.711 10.737 1.00 0.00 H new ATOM 0 HB3 LEU A 188 -4.542 -2.346 9.467 1.00 0.00 H new ATOM 0 HG LEU A 188 -4.041 -0.051 11.108 1.00 0.00 H new ATOM 0 HD11 LEU A 188 -1.749 0.526 10.322 1.00 0.00 H new ATOM 0 HD12 LEU A 188 -1.764 -0.868 11.428 1.00 0.00 H new ATOM 0 HD13 LEU A 188 -1.580 -1.124 9.676 1.00 0.00 H new ATOM 0 HD21 LEU A 188 -3.418 0.909 8.804 1.00 0.00 H new ATOM 0 HD22 LEU A 188 -3.390 -0.755 8.175 1.00 0.00 H new ATOM 0 HD23 LEU A 188 -4.920 -0.043 8.739 1.00 0.00 H new ATOM 1165 N ILE A 204 3.080 6.779 4.289 1.00 0.00 N ATOM 1166 CA ILE A 204 2.683 6.740 2.859 1.00 0.00 C ATOM 1167 C ILE A 204 3.766 7.296 1.941 1.00 0.00 C ATOM 1168 O ILE A 204 4.086 6.652 0.954 1.00 0.00 O ATOM 1169 CB ILE A 204 1.380 7.520 2.612 1.00 0.00 C ATOM 1170 CG1 ILE A 204 0.196 6.870 3.329 1.00 0.00 C ATOM 1171 CG2 ILE A 204 1.036 7.708 1.116 1.00 0.00 C ATOM 1172 CD1 ILE A 204 -0.168 5.429 2.991 1.00 0.00 C ATOM 0 HA ILE A 204 2.530 5.687 2.624 1.00 0.00 H new ATOM 0 HB ILE A 204 1.563 8.512 3.026 1.00 0.00 H new ATOM 0 HG12 ILE A 204 0.393 6.918 4.400 1.00 0.00 H new ATOM 0 HG13 ILE A 204 -0.683 7.486 3.138 1.00 0.00 H new ATOM 0 HG21 ILE A 204 0.105 8.267 1.024 1.00 0.00 H new ATOM 0 HG22 ILE A 204 1.839 8.258 0.624 1.00 0.00 H new ATOM 0 HG23 ILE A 204 0.922 6.732 0.643 1.00 0.00 H new ATOM 0 HD11 ILE A 204 -1.028 5.122 3.586 1.00 0.00 H new ATOM 0 HD12 ILE A 204 -0.414 5.355 1.932 1.00 0.00 H new ATOM 0 HD13 ILE A 204 0.678 4.778 3.213 1.00 0.00 H new ATOM 1184 N SER A 205 4.381 8.434 2.256 1.00 0.00 N ATOM 1185 CA SER A 205 5.560 8.925 1.518 1.00 0.00 C ATOM 1186 C SER A 205 6.823 8.020 1.612 1.00 0.00 C ATOM 1187 O SER A 205 7.797 8.255 0.893 1.00 0.00 O ATOM 1188 CB SER A 205 5.817 10.383 1.895 1.00 0.00 C ATOM 1189 OG SER A 205 6.732 10.998 1.002 1.00 0.00 O ATOM 0 H SER A 205 4.086 9.042 3.020 1.00 0.00 H new ATOM 0 HA SER A 205 5.323 8.872 0.455 1.00 0.00 H new ATOM 0 HB2 SER A 205 4.876 10.933 1.889 1.00 0.00 H new ATOM 0 HB3 SER A 205 6.209 10.433 2.911 1.00 0.00 H new ATOM 0 HG SER A 205 6.874 11.930 1.270 1.00 0.00 H new ATOM 1195 N ARG A 206 6.806 6.937 2.410 1.00 0.00 N ATOM 1196 CA ARG A 206 7.741 5.778 2.340 1.00 0.00 C ATOM 1197 C ARG A 206 7.169 4.537 1.605 1.00 0.00 C ATOM 1198 O ARG A 206 7.902 3.864 0.860 1.00 0.00 O ATOM 1199 CB ARG A 206 8.242 5.425 3.753 1.00 0.00 C ATOM 1200 CG ARG A 206 8.986 6.589 4.433 1.00 0.00 C ATOM 1201 CD ARG A 206 9.319 6.256 5.890 1.00 0.00 C ATOM 1202 NE ARG A 206 9.946 7.410 6.563 1.00 0.00 N ATOM 1203 CZ ARG A 206 10.181 7.541 7.858 1.00 0.00 C ATOM 1204 NH1 ARG A 206 9.882 6.606 8.718 1.00 0.00 N ATOM 1205 NH2 ARG A 206 10.728 8.628 8.320 1.00 0.00 N1+ ATOM 0 H ARG A 206 6.116 6.832 3.154 1.00 0.00 H new ATOM 0 HA ARG A 206 8.583 6.094 1.724 1.00 0.00 H new ATOM 0 HB2 ARG A 206 7.393 5.132 4.371 1.00 0.00 H new ATOM 0 HB3 ARG A 206 8.905 4.562 3.693 1.00 0.00 H new ATOM 0 HG2 ARG A 206 9.904 6.805 3.887 1.00 0.00 H new ATOM 0 HG3 ARG A 206 8.372 7.489 4.394 1.00 0.00 H new ATOM 0 HD2 ARG A 206 8.410 5.971 6.419 1.00 0.00 H new ATOM 0 HD3 ARG A 206 9.991 5.399 5.927 1.00 0.00 H new ATOM 0 HE ARG A 206 10.228 8.188 5.967 1.00 0.00 H new ATOM 0 HH11 ARG A 206 9.452 5.738 8.399 1.00 0.00 H new ATOM 0 HH12 ARG A 206 10.078 6.743 9.709 1.00 0.00 H new ATOM 0 HH21 ARG A 206 10.978 9.384 7.682 1.00 0.00 H new ATOM 0 HH22 ARG A 206 10.907 8.724 9.320 1.00 0.00 H new ATOM 1219 N ILE A 207 5.855 4.267 1.709 1.00 0.00 N ATOM 1220 CA ILE A 207 5.180 3.298 0.821 1.00 0.00 C ATOM 1221 C ILE A 207 5.427 3.727 -0.630 1.00 0.00 C ATOM 1222 O ILE A 207 5.843 2.913 -1.436 1.00 0.00 O ATOM 1223 CB ILE A 207 3.654 3.127 1.116 1.00 0.00 C ATOM 1224 CG1 ILE A 207 3.214 2.365 2.388 1.00 0.00 C ATOM 1225 CG2 ILE A 207 2.978 2.312 0.006 1.00 0.00 C ATOM 1226 CD1 ILE A 207 3.672 2.992 3.685 1.00 0.00 C ATOM 0 H ILE A 207 5.240 4.703 2.396 1.00 0.00 H new ATOM 0 HA ILE A 207 5.607 2.313 1.008 1.00 0.00 H new ATOM 0 HB ILE A 207 3.367 4.174 1.219 1.00 0.00 H new ATOM 0 HG12 ILE A 207 2.126 2.296 2.397 1.00 0.00 H new ATOM 0 HG13 ILE A 207 3.597 1.346 2.337 1.00 0.00 H new ATOM 0 HG21 ILE A 207 1.917 2.204 0.229 1.00 0.00 H new ATOM 0 HG22 ILE A 207 3.098 2.826 -0.947 1.00 0.00 H new ATOM 0 HG23 ILE A 207 3.439 1.326 -0.053 1.00 0.00 H new ATOM 0 HD11 ILE A 207 3.319 2.392 4.524 1.00 0.00 H new ATOM 0 HD12 ILE A 207 4.761 3.036 3.703 1.00 0.00 H new ATOM 0 HD13 ILE A 207 3.267 4.001 3.764 1.00 0.00 H new ATOM 1238 N ARG A 208 5.293 5.020 -0.918 1.00 0.00 N ATOM 1239 CA ARG A 208 5.609 5.715 -2.182 1.00 0.00 C ATOM 1240 C ARG A 208 6.873 5.153 -2.878 1.00 0.00 C ATOM 1241 O ARG A 208 6.703 4.452 -3.876 1.00 0.00 O ATOM 1242 CB ARG A 208 5.597 7.232 -1.888 1.00 0.00 C ATOM 1243 CG ARG A 208 5.998 8.188 -3.021 1.00 0.00 C ATOM 1244 CD ARG A 208 6.126 9.634 -2.494 1.00 0.00 C ATOM 1245 NE ARG A 208 7.306 9.835 -1.639 1.00 0.00 N ATOM 1246 CZ ARG A 208 8.576 9.817 -1.988 1.00 0.00 C ATOM 1247 NH1 ARG A 208 8.963 9.680 -3.224 1.00 0.00 N1+ ATOM 1248 NH2 ARG A 208 9.492 9.913 -1.068 1.00 0.00 N ATOM 0 H ARG A 208 4.931 5.670 -0.220 1.00 0.00 H new ATOM 0 HA ARG A 208 4.851 5.526 -2.943 1.00 0.00 H new ATOM 0 HB2 ARG A 208 4.592 7.502 -1.563 1.00 0.00 H new ATOM 0 HB3 ARG A 208 6.264 7.414 -1.045 1.00 0.00 H new ATOM 0 HG2 ARG A 208 6.945 7.868 -3.455 1.00 0.00 H new ATOM 0 HG3 ARG A 208 5.254 8.150 -3.816 1.00 0.00 H new ATOM 0 HD2 ARG A 208 6.177 10.319 -3.340 1.00 0.00 H new ATOM 0 HD3 ARG A 208 5.229 9.890 -1.930 1.00 0.00 H new ATOM 0 HE ARG A 208 7.117 10.010 -0.652 1.00 0.00 H new ATOM 0 HH11 ARG A 208 8.271 9.581 -3.967 1.00 0.00 H new ATOM 0 HH12 ARG A 208 9.958 9.672 -3.449 1.00 0.00 H new ATOM 0 HH21 ARG A 208 9.223 10.001 -0.088 1.00 0.00 H new ATOM 0 HH22 ARG A 208 10.478 9.900 -1.327 1.00 0.00 H new ATOM 1262 N PRO A 209 8.117 5.323 -2.379 1.00 0.00 N ATOM 1263 CA PRO A 209 9.297 4.700 -2.987 1.00 0.00 C ATOM 1264 C PRO A 209 9.314 3.165 -2.876 1.00 0.00 C ATOM 1265 O PRO A 209 9.840 2.519 -3.787 1.00 0.00 O ATOM 1266 CB PRO A 209 10.508 5.336 -2.298 1.00 0.00 C ATOM 1267 CG PRO A 209 9.966 5.761 -0.938 1.00 0.00 C ATOM 1268 CD PRO A 209 8.530 6.161 -1.271 1.00 0.00 C ATOM 0 HA PRO A 209 9.300 4.880 -4.062 1.00 0.00 H new ATOM 0 HB2 PRO A 209 11.330 4.627 -2.198 1.00 0.00 H new ATOM 0 HB3 PRO A 209 10.888 6.188 -2.862 1.00 0.00 H new ATOM 0 HG2 PRO A 209 10.004 4.948 -0.213 1.00 0.00 H new ATOM 0 HG3 PRO A 209 10.532 6.591 -0.516 1.00 0.00 H new ATOM 0 HD2 PRO A 209 7.877 6.016 -0.410 1.00 0.00 H new ATOM 0 HD3 PRO A 209 8.473 7.216 -1.540 1.00 0.00 H new ATOM 1276 N LYS A 210 8.704 2.544 -1.848 1.00 0.00 N ATOM 1277 CA LYS A 210 8.573 1.072 -1.794 1.00 0.00 C ATOM 1278 C LYS A 210 7.636 0.467 -2.840 1.00 0.00 C ATOM 1279 O LYS A 210 7.775 -0.716 -3.141 1.00 0.00 O ATOM 1280 CB LYS A 210 8.195 0.617 -0.389 1.00 0.00 C ATOM 1281 CG LYS A 210 9.416 0.644 0.521 1.00 0.00 C ATOM 1282 CD LYS A 210 9.121 0.157 1.936 1.00 0.00 C ATOM 1283 CE LYS A 210 8.059 0.932 2.710 1.00 0.00 C ATOM 1284 NZ LYS A 210 8.592 1.559 3.943 1.00 0.00 N1+ ATOM 0 H LYS A 210 8.297 3.032 -1.050 1.00 0.00 H new ATOM 0 HA LYS A 210 9.560 0.687 -2.051 1.00 0.00 H new ATOM 0 HB2 LYS A 210 7.418 1.266 0.014 1.00 0.00 H new ATOM 0 HB3 LYS A 210 7.782 -0.391 -0.425 1.00 0.00 H new ATOM 0 HG2 LYS A 210 10.199 0.023 0.086 1.00 0.00 H new ATOM 0 HG3 LYS A 210 9.804 1.661 0.567 1.00 0.00 H new ATOM 0 HD2 LYS A 210 8.811 -0.886 1.881 1.00 0.00 H new ATOM 0 HD3 LYS A 210 10.049 0.184 2.508 1.00 0.00 H new ATOM 0 HE2 LYS A 210 7.639 1.705 2.067 1.00 0.00 H new ATOM 0 HE3 LYS A 210 7.244 0.258 2.973 1.00 0.00 H new ATOM 0 HZ1 LYS A 210 7.803 1.819 4.569 1.00 0.00 H new ATOM 0 HZ2 LYS A 210 9.215 0.886 4.433 1.00 0.00 H new ATOM 0 HZ3 LYS A 210 9.132 2.412 3.693 1.00 0.00 H new ATOM 1298 N ILE A 211 6.745 1.253 -3.443 1.00 0.00 N ATOM 1299 CA ILE A 211 5.864 0.831 -4.543 1.00 0.00 C ATOM 1300 C ILE A 211 6.240 1.466 -5.885 1.00 0.00 C ATOM 1301 O ILE A 211 5.442 1.521 -6.826 1.00 0.00 O ATOM 1302 CB ILE A 211 4.372 0.900 -4.201 1.00 0.00 C ATOM 1303 CG1 ILE A 211 3.837 2.349 -4.234 1.00 0.00 C ATOM 1304 CG2 ILE A 211 4.155 0.306 -2.799 1.00 0.00 C ATOM 1305 CD1 ILE A 211 2.350 2.485 -3.888 1.00 0.00 C ATOM 0 H ILE A 211 6.609 2.228 -3.176 1.00 0.00 H new ATOM 0 HA ILE A 211 6.049 -0.235 -4.678 1.00 0.00 H new ATOM 0 HB ILE A 211 3.825 0.330 -4.952 1.00 0.00 H new ATOM 0 HG12 ILE A 211 4.416 2.953 -3.536 1.00 0.00 H new ATOM 0 HG13 ILE A 211 4.005 2.762 -5.228 1.00 0.00 H new ATOM 0 HG21 ILE A 211 3.096 0.350 -2.545 1.00 0.00 H new ATOM 0 HG22 ILE A 211 4.488 -0.732 -2.788 1.00 0.00 H new ATOM 0 HG23 ILE A 211 4.727 0.878 -2.069 1.00 0.00 H new ATOM 0 HD11 ILE A 211 2.060 3.535 -3.936 1.00 0.00 H new ATOM 0 HD12 ILE A 211 1.757 1.912 -4.601 1.00 0.00 H new ATOM 0 HD13 ILE A 211 2.174 2.105 -2.881 1.00 0.00 H new ATOM 1317 N GLY A 212 7.492 1.906 -5.982 1.00 0.00 N ATOM 1318 CA GLY A 212 8.091 2.396 -7.227 1.00 0.00 C ATOM 1319 C GLY A 212 7.655 3.813 -7.630 1.00 0.00 C ATOM 1320 O GLY A 212 7.887 4.237 -8.764 1.00 0.00 O ATOM 0 H GLY A 212 8.131 1.934 -5.188 1.00 0.00 H new ATOM 0 HA2 GLY A 212 9.176 2.379 -7.124 1.00 0.00 H new ATOM 0 HA3 GLY A 212 7.836 1.708 -8.033 1.00 0.00 H new ATOM 1324 N ASP A 213 6.972 4.520 -6.729 1.00 0.00 N ATOM 1325 CA ASP A 213 6.211 5.739 -6.999 1.00 0.00 C ATOM 1326 C ASP A 213 7.029 7.058 -6.996 1.00 0.00 C ATOM 1327 O ASP A 213 8.215 7.091 -6.650 1.00 0.00 O ATOM 1328 CB ASP A 213 4.982 5.774 -6.083 1.00 0.00 C ATOM 1329 CG ASP A 213 3.748 6.203 -6.876 1.00 0.00 C ATOM 1330 OD1 ASP A 213 3.830 7.107 -7.739 1.00 0.00 O ATOM 1331 OD2 ASP A 213 2.657 5.691 -6.581 1.00 0.00 O ATOM 0 H ASP A 213 6.933 4.246 -5.747 1.00 0.00 H new ATOM 0 HA ASP A 213 5.885 5.687 -8.038 1.00 0.00 H new ATOM 0 HB2 ASP A 213 4.818 4.790 -5.644 1.00 0.00 H new ATOM 0 HB3 ASP A 213 5.153 6.466 -5.259 1.00 0.00 H new ATOM 1391 N PRO A 218 2.818 9.732 -4.189 1.00 0.00 N ATOM 1392 CA PRO A 218 2.533 8.533 -4.933 1.00 0.00 C ATOM 1393 C PRO A 218 1.297 8.744 -5.817 1.00 0.00 C ATOM 1394 O PRO A 218 0.213 9.090 -5.328 1.00 0.00 O ATOM 1395 CB PRO A 218 2.287 7.464 -3.878 1.00 0.00 C ATOM 1396 CG PRO A 218 1.653 8.262 -2.730 1.00 0.00 C ATOM 1397 CD PRO A 218 2.354 9.608 -2.813 1.00 0.00 C ATOM 0 HA PRO A 218 3.345 8.250 -5.602 1.00 0.00 H new ATOM 0 HB2 PRO A 218 1.622 6.681 -4.242 1.00 0.00 H new ATOM 0 HB3 PRO A 218 3.213 6.978 -3.570 1.00 0.00 H new ATOM 0 HG2 PRO A 218 0.575 8.361 -2.856 1.00 0.00 H new ATOM 0 HG3 PRO A 218 1.818 7.781 -1.766 1.00 0.00 H new ATOM 0 HD2 PRO A 218 1.673 10.420 -2.556 1.00 0.00 H new ATOM 0 HD3 PRO A 218 3.188 9.658 -2.113 1.00 0.00 H new ATOM 1405 N LYS A 219 1.415 8.452 -7.110 1.00 0.00 N ATOM 1406 CA LYS A 219 0.264 8.305 -8.011 1.00 0.00 C ATOM 1407 C LYS A 219 -0.625 7.135 -7.586 1.00 0.00 C ATOM 1408 O LYS A 219 -1.836 7.206 -7.775 1.00 0.00 O ATOM 1409 CB LYS A 219 0.767 8.137 -9.450 1.00 0.00 C ATOM 1410 CG LYS A 219 1.504 9.362 -10.020 1.00 0.00 C ATOM 1411 CD LYS A 219 0.700 10.667 -10.016 1.00 0.00 C ATOM 1412 CE LYS A 219 0.792 11.452 -8.699 1.00 0.00 C ATOM 1413 NZ LYS A 219 1.938 12.398 -8.697 1.00 0.00 N1+ ATOM 0 H LYS A 219 2.315 8.309 -7.569 1.00 0.00 H new ATOM 0 HA LYS A 219 -0.351 9.203 -7.956 1.00 0.00 H new ATOM 0 HB2 LYS A 219 1.436 7.277 -9.489 1.00 0.00 H new ATOM 0 HB3 LYS A 219 -0.083 7.909 -10.093 1.00 0.00 H new ATOM 0 HG2 LYS A 219 2.418 9.515 -9.447 1.00 0.00 H new ATOM 0 HG3 LYS A 219 1.804 9.142 -11.045 1.00 0.00 H new ATOM 0 HD2 LYS A 219 1.051 11.301 -10.830 1.00 0.00 H new ATOM 0 HD3 LYS A 219 -0.346 10.438 -10.219 1.00 0.00 H new ATOM 0 HE2 LYS A 219 -0.134 12.004 -8.540 1.00 0.00 H new ATOM 0 HE3 LYS A 219 0.895 10.755 -7.867 1.00 0.00 H new ATOM 0 HZ1 LYS A 219 1.965 12.908 -7.791 1.00 0.00 H new ATOM 0 HZ2 LYS A 219 2.825 11.869 -8.824 1.00 0.00 H new ATOM 0 HZ3 LYS A 219 1.827 13.079 -9.475 1.00 0.00 H new ATOM 1427 N ARG A 220 -0.062 6.124 -6.916 1.00 0.00 N ATOM 1428 CA ARG A 220 -0.791 5.014 -6.299 1.00 0.00 C ATOM 1429 C ARG A 220 -1.723 5.428 -5.182 1.00 0.00 C ATOM 1430 O ARG A 220 -2.722 4.745 -5.054 1.00 0.00 O ATOM 1431 CB ARG A 220 0.166 3.936 -5.794 1.00 0.00 C ATOM 1432 CG ARG A 220 0.717 3.111 -6.966 1.00 0.00 C ATOM 1433 CD ARG A 220 -0.338 2.197 -7.618 1.00 0.00 C ATOM 1434 NE ARG A 220 -0.432 2.413 -9.073 1.00 0.00 N ATOM 1435 CZ ARG A 220 -1.381 1.982 -9.885 1.00 0.00 C ATOM 1436 NH1 ARG A 220 -2.445 1.359 -9.476 1.00 0.00 N ATOM 1437 NH2 ARG A 220 -1.266 2.153 -11.167 1.00 0.00 N1+ ATOM 0 H ARG A 220 0.947 6.055 -6.785 1.00 0.00 H new ATOM 0 HA ARG A 220 -1.417 4.613 -7.096 1.00 0.00 H new ATOM 0 HB2 ARG A 220 0.989 4.399 -5.249 1.00 0.00 H new ATOM 0 HB3 ARG A 220 -0.352 3.281 -5.093 1.00 0.00 H new ATOM 0 HG2 ARG A 220 1.117 3.788 -7.721 1.00 0.00 H new ATOM 0 HG3 ARG A 220 1.548 2.500 -6.612 1.00 0.00 H new ATOM 0 HD2 ARG A 220 -0.086 1.155 -7.422 1.00 0.00 H new ATOM 0 HD3 ARG A 220 -1.310 2.381 -7.161 1.00 0.00 H new ATOM 0 HE ARG A 220 0.319 2.955 -9.500 1.00 0.00 H new ATOM 0 HH11 ARG A 220 -2.580 1.180 -8.481 1.00 0.00 H new ATOM 0 HH12 ARG A 220 -3.145 1.049 -10.150 1.00 0.00 H new ATOM 0 HH21 ARG A 220 -0.443 2.620 -11.547 1.00 0.00 H new ATOM 0 HH22 ARG A 220 -1.999 1.820 -11.794 1.00 0.00 H new ATOM 1451 N ILE A 221 -1.414 6.452 -4.377 1.00 0.00 N ATOM 1452 CA ILE A 221 -2.106 6.665 -3.071 1.00 0.00 C ATOM 1453 C ILE A 221 -2.825 8.033 -2.890 1.00 0.00 C ATOM 1454 O ILE A 221 -3.854 8.125 -2.214 1.00 0.00 O ATOM 1455 CB ILE A 221 -1.261 6.160 -1.875 1.00 0.00 C ATOM 1456 CG1 ILE A 221 -0.546 4.834 -2.194 1.00 0.00 C ATOM 1457 CG2 ILE A 221 -2.197 5.934 -0.696 1.00 0.00 C ATOM 1458 CD1 ILE A 221 0.191 4.164 -1.030 1.00 0.00 C ATOM 0 H ILE A 221 -0.699 7.147 -4.591 1.00 0.00 H new ATOM 0 HA ILE A 221 -2.978 6.011 -3.093 1.00 0.00 H new ATOM 0 HB ILE A 221 -0.500 6.907 -1.651 1.00 0.00 H new ATOM 0 HG12 ILE A 221 -1.284 4.132 -2.581 1.00 0.00 H new ATOM 0 HG13 ILE A 221 0.172 5.016 -2.994 1.00 0.00 H new ATOM 0 HG21 ILE A 221 -1.624 5.577 0.160 1.00 0.00 H new ATOM 0 HG22 ILE A 221 -2.690 6.871 -0.438 1.00 0.00 H new ATOM 0 HG23 ILE A 221 -2.948 5.191 -0.965 1.00 0.00 H new ATOM 0 HD11 ILE A 221 0.654 3.240 -1.376 1.00 0.00 H new ATOM 0 HD12 ILE A 221 0.961 4.836 -0.652 1.00 0.00 H new ATOM 0 HD13 ILE A 221 -0.517 3.938 -0.233 1.00 0.00 H new ATOM 1579 N GLY A 228 -8.024 11.429 1.951 1.00 0.00 N ATOM 1580 CA GLY A 228 -7.334 10.167 2.150 1.00 0.00 C ATOM 1581 C GLY A 228 -6.605 9.543 0.962 1.00 0.00 C ATOM 1582 O GLY A 228 -6.380 10.055 -0.139 1.00 0.00 O ATOM 0 HA2 GLY A 228 -6.606 10.309 2.949 1.00 0.00 H new ATOM 0 HA3 GLY A 228 -8.065 9.442 2.509 1.00 0.00 H new ATOM 1586 N TYR A 229 -6.212 8.334 1.275 1.00 0.00 N ATOM 1587 CA TYR A 229 -5.406 7.446 0.510 1.00 0.00 C ATOM 1588 C TYR A 229 -6.381 6.681 -0.357 1.00 0.00 C ATOM 1589 O TYR A 229 -6.999 5.724 0.095 1.00 0.00 O ATOM 1590 CB TYR A 229 -4.652 6.620 1.537 1.00 0.00 C ATOM 1591 CG TYR A 229 -3.722 7.383 2.456 1.00 0.00 C ATOM 1592 CD1 TYR A 229 -3.205 8.657 2.122 1.00 0.00 C ATOM 1593 CD2 TYR A 229 -3.427 6.807 3.703 1.00 0.00 C ATOM 1594 CE1 TYR A 229 -2.533 9.411 3.093 1.00 0.00 C ATOM 1595 CE2 TYR A 229 -2.689 7.530 4.653 1.00 0.00 C ATOM 1596 CZ TYR A 229 -2.305 8.859 4.368 1.00 0.00 C ATOM 1597 OH TYR A 229 -1.664 9.605 5.291 1.00 0.00 O ATOM 0 H TYR A 229 -6.482 7.915 2.165 1.00 0.00 H new ATOM 0 HA TYR A 229 -4.664 7.888 -0.155 1.00 0.00 H new ATOM 0 HB2 TYR A 229 -5.380 6.089 2.150 1.00 0.00 H new ATOM 0 HB3 TYR A 229 -4.069 5.866 1.009 1.00 0.00 H new ATOM 0 HD1 TYR A 229 -3.328 9.047 1.122 1.00 0.00 H new ATOM 0 HD2 TYR A 229 -3.768 5.808 3.931 1.00 0.00 H new ATOM 0 HE1 TYR A 229 -2.192 10.410 2.865 1.00 0.00 H new ATOM 0 HE2 TYR A 229 -2.417 7.074 5.594 1.00 0.00 H new ATOM 0 HH TYR A 229 -1.579 9.094 6.123 1.00 0.00 H new ATOM 1607 N LEU A 230 -6.582 7.134 -1.593 1.00 0.00 N ATOM 1608 CA LEU A 230 -7.166 6.225 -2.562 1.00 0.00 C ATOM 1609 C LEU A 230 -5.977 5.454 -3.050 1.00 0.00 C ATOM 1610 O LEU A 230 -5.122 6.021 -3.730 1.00 0.00 O ATOM 1611 CB LEU A 230 -7.835 6.953 -3.762 1.00 0.00 C ATOM 1612 CG LEU A 230 -7.926 6.054 -5.019 1.00 0.00 C ATOM 1613 CD1 LEU A 230 -8.829 4.860 -4.806 1.00 0.00 C ATOM 1614 CD2 LEU A 230 -8.385 6.738 -6.289 1.00 0.00 C ATOM 0 H LEU A 230 -6.362 8.071 -1.930 1.00 0.00 H new ATOM 0 HA LEU A 230 -7.959 5.624 -2.117 1.00 0.00 H new ATOM 0 HB2 LEU A 230 -8.836 7.276 -3.476 1.00 0.00 H new ATOM 0 HB3 LEU A 230 -7.267 7.852 -4.001 1.00 0.00 H new ATOM 0 HG LEU A 230 -6.887 5.754 -5.160 1.00 0.00 H new ATOM 0 HD11 LEU A 230 -8.860 4.260 -5.716 1.00 0.00 H new ATOM 0 HD12 LEU A 230 -8.444 4.255 -3.985 1.00 0.00 H new ATOM 0 HD13 LEU A 230 -9.835 5.203 -4.563 1.00 0.00 H new ATOM 0 HD21 LEU A 230 -8.411 6.014 -7.103 1.00 0.00 H new ATOM 0 HD22 LEU A 230 -9.382 7.152 -6.139 1.00 0.00 H new ATOM 0 HD23 LEU A 230 -7.693 7.541 -6.540 1.00 0.00 H new ATOM 1626 N PHE A 231 -5.986 4.157 -2.806 1.00 0.00 N ATOM 1627 CA PHE A 231 -5.105 3.339 -3.588 1.00 0.00 C ATOM 1628 C PHE A 231 -5.732 3.113 -4.960 1.00 0.00 C ATOM 1629 O PHE A 231 -6.765 2.466 -5.089 1.00 0.00 O ATOM 1630 CB PHE A 231 -4.752 2.112 -2.811 1.00 0.00 C ATOM 1631 CG PHE A 231 -3.515 1.441 -3.342 1.00 0.00 C ATOM 1632 CD1 PHE A 231 -3.581 0.826 -4.597 1.00 0.00 C ATOM 1633 CD2 PHE A 231 -2.280 1.553 -2.676 1.00 0.00 C ATOM 1634 CE1 PHE A 231 -2.430 0.326 -5.200 1.00 0.00 C ATOM 1635 CE2 PHE A 231 -1.143 0.944 -3.237 1.00 0.00 C ATOM 1636 CZ PHE A 231 -1.229 0.300 -4.482 1.00 0.00 C ATOM 0 H PHE A 231 -6.560 3.677 -2.113 1.00 0.00 H new ATOM 0 HA PHE A 231 -4.149 3.822 -3.789 1.00 0.00 H new ATOM 0 HB2 PHE A 231 -4.599 2.378 -1.765 1.00 0.00 H new ATOM 0 HB3 PHE A 231 -5.586 1.411 -2.843 1.00 0.00 H new ATOM 0 HD1 PHE A 231 -4.532 0.738 -5.102 1.00 0.00 H new ATOM 0 HD2 PHE A 231 -2.206 2.099 -1.747 1.00 0.00 H new ATOM 0 HE1 PHE A 231 -2.464 -0.040 -6.216 1.00 0.00 H new ATOM 0 HE2 PHE A 231 -0.201 0.972 -2.709 1.00 0.00 H new ATOM 0 HZ PHE A 231 -0.369 -0.215 -4.885 1.00 0.00 H new ATOM 1646 N VAL A 232 -5.170 3.732 -5.983 1.00 0.00 N ATOM 1647 CA VAL A 232 -5.688 3.738 -7.356 1.00 0.00 C ATOM 1648 C VAL A 232 -5.603 2.355 -8.026 1.00 0.00 C ATOM 1649 O VAL A 232 -4.820 1.490 -7.617 1.00 0.00 O ATOM 1650 CB VAL A 232 -4.997 4.850 -8.171 1.00 0.00 C ATOM 1651 CG1 VAL A 232 -4.872 6.161 -7.379 1.00 0.00 C ATOM 1652 CG2 VAL A 232 -3.654 4.319 -8.642 1.00 0.00 C ATOM 0 H VAL A 232 -4.307 4.267 -5.885 1.00 0.00 H new ATOM 0 HA VAL A 232 -6.754 3.964 -7.321 1.00 0.00 H new ATOM 0 HB VAL A 232 -5.607 5.107 -9.037 1.00 0.00 H new ATOM 0 HG11 VAL A 232 -4.379 6.913 -7.995 1.00 0.00 H new ATOM 0 HG12 VAL A 232 -5.865 6.514 -7.101 1.00 0.00 H new ATOM 0 HG13 VAL A 232 -4.283 5.987 -6.478 1.00 0.00 H new ATOM 0 HG21 VAL A 232 -3.142 5.087 -9.222 1.00 0.00 H new ATOM 0 HG22 VAL A 232 -3.045 4.051 -7.778 1.00 0.00 H new ATOM 0 HG23 VAL A 232 -3.809 3.437 -9.264 1.00 0.00 H new