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= 0.633 K(o=0.72,f=-3.3!) USER MOD Set 1.2: A 165 TYR OH : rot -30:sc= 0.0824 USER MOD Single : A 150 SER OG : rot -166:sc= 0.417 USER MOD Single : A 152 THR OG1 : rot 180:sc= 0 USER MOD Single : A 154 ASN : amide:sc= 0.927 K(o=0.93,f=-0.15) USER MOD Single : A 161 THR OG1 : rot 170:sc= 0.46 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= 1.49 K(o=1.5,f=-4.9!) USER MOD Single : A 180 SER OG : rot 180:sc= 0 USER MOD Single : A 205 SER OG : rot 180:sc= 0.527 USER MOD Single : A 210 LYS NZ :NH3+ -169:sc= 1.18 (180deg=0.759) 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 -2.730 -13.098 -3.929 1.00 0.00 N ATOM 87 CA ARG A 136 -1.883 -11.986 -4.391 1.00 0.00 C ATOM 88 C ARG A 136 -2.730 -10.961 -5.163 1.00 0.00 C ATOM 89 O ARG A 136 -3.660 -11.318 -5.891 1.00 0.00 O ATOM 90 CB ARG A 136 -0.706 -12.482 -5.253 1.00 0.00 C ATOM 91 CG ARG A 136 0.395 -13.262 -4.509 1.00 0.00 C ATOM 92 CD ARG A 136 -0.055 -14.672 -4.080 1.00 0.00 C ATOM 93 NE ARG A 136 1.029 -15.673 -4.182 1.00 0.00 N ATOM 94 CZ ARG A 136 1.525 -16.440 -3.228 1.00 0.00 C ATOM 95 NH1 ARG A 136 1.268 -16.254 -1.969 1.00 0.00 N ATOM 96 NH2 ARG A 136 2.298 -17.444 -3.538 1.00 0.00 N1+ ATOM 0 HA ARG A 136 -1.457 -11.503 -3.512 1.00 0.00 H new ATOM 0 HB2 ARG A 136 -1.104 -13.119 -6.043 1.00 0.00 H new ATOM 0 HB3 ARG A 136 -0.248 -11.620 -5.738 1.00 0.00 H new ATOM 0 HG2 ARG A 136 1.271 -13.346 -5.152 1.00 0.00 H new ATOM 0 HG3 ARG A 136 0.699 -12.699 -3.627 1.00 0.00 H new ATOM 0 HD2 ARG A 136 -0.416 -14.637 -3.052 1.00 0.00 H new ATOM 0 HD3 ARG A 136 -0.894 -14.986 -4.701 1.00 0.00 H new ATOM 0 HE ARG A 136 1.446 -15.785 -5.106 1.00 0.00 H new ATOM 0 HH11 ARG A 136 0.659 -15.488 -1.681 1.00 0.00 H new ATOM 0 HH12 ARG A 136 1.675 -16.874 -1.268 1.00 0.00 H new ATOM 0 HH21 ARG A 136 2.518 -17.635 -4.515 1.00 0.00 H new ATOM 0 HH22 ARG A 136 2.682 -18.038 -2.803 1.00 0.00 H new ATOM 110 N ILE A 137 -2.382 -9.690 -5.004 1.00 0.00 N ATOM 111 CA ILE A 137 -3.074 -8.461 -5.404 1.00 0.00 C ATOM 112 C ILE A 137 -2.060 -7.599 -6.163 1.00 0.00 C ATOM 113 O ILE A 137 -0.995 -7.313 -5.625 1.00 0.00 O ATOM 114 CB ILE A 137 -3.522 -7.694 -4.134 1.00 0.00 C ATOM 115 CG1 ILE A 137 -4.132 -8.560 -3.012 1.00 0.00 C ATOM 116 CG2 ILE A 137 -4.437 -6.500 -4.454 1.00 0.00 C ATOM 117 CD1 ILE A 137 -5.395 -9.349 -3.375 1.00 0.00 C ATOM 0 H ILE A 137 -1.504 -9.465 -4.536 1.00 0.00 H new ATOM 0 HA ILE A 137 -3.945 -8.687 -6.019 1.00 0.00 H new ATOM 0 HB ILE A 137 -2.581 -7.319 -3.731 1.00 0.00 H new ATOM 0 HG12 ILE A 137 -3.373 -9.265 -2.673 1.00 0.00 H new ATOM 0 HG13 ILE A 137 -4.364 -7.912 -2.167 1.00 0.00 H new ATOM 0 HG21 ILE A 137 -4.720 -6.000 -3.528 1.00 0.00 H new ATOM 0 HG22 ILE A 137 -3.907 -5.798 -5.098 1.00 0.00 H new ATOM 0 HG23 ILE A 137 -5.333 -6.855 -4.963 1.00 0.00 H new ATOM 0 HD11 ILE A 137 -5.730 -9.918 -2.508 1.00 0.00 H new ATOM 0 HD12 ILE A 137 -6.180 -8.658 -3.681 1.00 0.00 H new ATOM 0 HD13 ILE A 137 -5.174 -10.033 -4.195 1.00 0.00 H new ATOM 129 N GLU A 138 -2.352 -7.167 -7.385 1.00 0.00 N ATOM 130 CA GLU A 138 -1.403 -6.384 -8.207 1.00 0.00 C ATOM 131 C GLU A 138 -1.986 -5.108 -8.813 1.00 0.00 C ATOM 132 O GLU A 138 -3.184 -5.040 -9.116 1.00 0.00 O ATOM 133 CB GLU A 138 -0.740 -7.249 -9.288 1.00 0.00 C ATOM 134 CG GLU A 138 -1.700 -7.718 -10.391 1.00 0.00 C ATOM 135 CD GLU A 138 -0.978 -8.614 -11.413 1.00 0.00 C ATOM 136 OE1 GLU A 138 -0.390 -8.083 -12.386 1.00 0.00 O ATOM 137 OE2 GLU A 138 -0.992 -9.860 -11.257 1.00 0.00 O ATOM 0 H GLU A 138 -3.246 -7.343 -7.843 1.00 0.00 H new ATOM 0 HA GLU A 138 -0.640 -6.051 -7.503 1.00 0.00 H new ATOM 0 HB2 GLU A 138 0.072 -6.683 -9.744 1.00 0.00 H new ATOM 0 HB3 GLU A 138 -0.292 -8.123 -8.815 1.00 0.00 H new ATOM 0 HG2 GLU A 138 -2.530 -8.266 -9.945 1.00 0.00 H new ATOM 0 HG3 GLU A 138 -2.125 -6.852 -10.899 1.00 0.00 H new ATOM 144 N PHE A 139 -1.121 -4.101 -8.987 1.00 0.00 N ATOM 145 CA PHE A 139 -1.584 -2.727 -9.312 1.00 0.00 C ATOM 146 C PHE A 139 -0.881 -2.055 -10.493 1.00 0.00 C ATOM 147 O PHE A 139 -1.541 -1.424 -11.320 1.00 0.00 O ATOM 148 CB PHE A 139 -1.493 -1.808 -8.081 1.00 0.00 C ATOM 149 CG PHE A 139 -1.724 -2.539 -6.794 1.00 0.00 C ATOM 150 CD1 PHE A 139 -0.636 -3.169 -6.175 1.00 0.00 C ATOM 151 CD2 PHE A 139 -3.026 -2.683 -6.290 1.00 0.00 C ATOM 152 CE1 PHE A 139 -0.850 -3.969 -5.047 1.00 0.00 C ATOM 153 CE2 PHE A 139 -3.239 -3.493 -5.175 1.00 0.00 C ATOM 154 CZ PHE A 139 -2.152 -4.151 -4.570 1.00 0.00 C ATOM 0 H PHE A 139 -0.109 -4.199 -8.912 1.00 0.00 H new ATOM 0 HA PHE A 139 -2.620 -2.866 -9.620 1.00 0.00 H new ATOM 0 HB2 PHE A 139 -0.510 -1.338 -8.056 1.00 0.00 H new ATOM 0 HB3 PHE A 139 -2.226 -1.007 -8.176 1.00 0.00 H new ATOM 0 HD1 PHE A 139 0.362 -3.038 -6.566 1.00 0.00 H new ATOM 0 HD2 PHE A 139 -3.853 -2.172 -6.760 1.00 0.00 H new ATOM 0 HE1 PHE A 139 -0.017 -4.442 -4.549 1.00 0.00 H new ATOM 0 HE2 PHE A 139 -4.235 -3.615 -4.777 1.00 0.00 H new ATOM 0 HZ PHE A 139 -2.325 -4.804 -3.728 1.00 0.00 H new ATOM 164 N ASP A 140 0.451 -2.143 -10.568 1.00 0.00 N ATOM 165 CA ASP A 140 1.259 -1.385 -11.536 1.00 0.00 C ATOM 166 C ASP A 140 2.527 -2.177 -11.908 1.00 0.00 C ATOM 167 O ASP A 140 2.581 -2.831 -12.952 1.00 0.00 O ATOM 168 CB ASP A 140 1.560 -0.001 -10.920 1.00 0.00 C ATOM 169 CG ASP A 140 2.008 1.051 -11.947 1.00 0.00 C ATOM 170 OD1 ASP A 140 2.771 0.723 -12.889 1.00 0.00 O ATOM 171 OD2 ASP A 140 1.572 2.221 -11.819 1.00 0.00 O ATOM 0 H ASP A 140 1.004 -2.744 -9.957 1.00 0.00 H new ATOM 0 HA ASP A 140 0.721 -1.232 -12.472 1.00 0.00 H new ATOM 0 HB2 ASP A 140 0.668 0.361 -10.409 1.00 0.00 H new ATOM 0 HB3 ASP A 140 2.338 -0.111 -10.164 1.00 0.00 H new ATOM 176 N ASP A 141 3.488 -2.220 -10.981 1.00 0.00 N ATOM 177 CA ASP A 141 4.588 -3.200 -10.923 1.00 0.00 C ATOM 178 C ASP A 141 4.763 -3.785 -9.496 1.00 0.00 C ATOM 179 O ASP A 141 5.670 -4.574 -9.224 1.00 0.00 O ATOM 180 CB ASP A 141 5.873 -2.545 -11.464 1.00 0.00 C ATOM 181 CG ASP A 141 6.906 -3.532 -12.037 1.00 0.00 C ATOM 182 OD1 ASP A 141 6.609 -4.735 -12.235 1.00 0.00 O ATOM 183 OD2 ASP A 141 8.041 -3.084 -12.329 1.00 0.00 O ATOM 0 H ASP A 141 3.527 -1.546 -10.216 1.00 0.00 H new ATOM 0 HA ASP A 141 4.347 -4.054 -11.556 1.00 0.00 H new ATOM 0 HB2 ASP A 141 5.601 -1.832 -12.242 1.00 0.00 H new ATOM 0 HB3 ASP A 141 6.341 -1.976 -10.660 1.00 0.00 H new ATOM 188 N LEU A 142 3.883 -3.378 -8.568 1.00 0.00 N ATOM 189 CA LEU A 142 3.739 -3.852 -7.201 1.00 0.00 C ATOM 190 C LEU A 142 2.778 -5.030 -7.145 1.00 0.00 C ATOM 191 O LEU A 142 1.701 -4.997 -7.748 1.00 0.00 O ATOM 192 CB LEU A 142 3.169 -2.684 -6.377 1.00 0.00 C ATOM 193 CG LEU A 142 2.840 -2.988 -4.902 1.00 0.00 C ATOM 194 CD1 LEU A 142 4.144 -3.059 -4.118 1.00 0.00 C ATOM 195 CD2 LEU A 142 1.903 -1.915 -4.360 1.00 0.00 C ATOM 0 H LEU A 142 3.202 -2.649 -8.782 1.00 0.00 H new ATOM 0 HA LEU A 142 4.701 -4.183 -6.809 1.00 0.00 H new ATOM 0 HB2 LEU A 142 3.885 -1.863 -6.406 1.00 0.00 H new ATOM 0 HB3 LEU A 142 2.260 -2.332 -6.865 1.00 0.00 H new ATOM 0 HG LEU A 142 2.330 -3.946 -4.805 1.00 0.00 H new ATOM 0 HD11 LEU A 142 3.928 -3.274 -3.071 1.00 0.00 H new ATOM 0 HD12 LEU A 142 4.773 -3.849 -4.528 1.00 0.00 H new ATOM 0 HD13 LEU A 142 4.666 -2.105 -4.193 1.00 0.00 H new ATOM 0 HD21 LEU A 142 1.670 -2.129 -3.317 1.00 0.00 H new ATOM 0 HD22 LEU A 142 2.386 -0.940 -4.431 1.00 0.00 H new ATOM 0 HD23 LEU A 142 0.982 -1.907 -4.944 1.00 0.00 H new ATOM 207 N VAL A 143 3.153 -6.014 -6.330 1.00 0.00 N ATOM 208 CA VAL A 143 2.295 -7.141 -5.947 1.00 0.00 C ATOM 209 C VAL A 143 2.310 -7.383 -4.445 1.00 0.00 C ATOM 210 O VAL A 143 3.324 -7.757 -3.865 1.00 0.00 O ATOM 211 CB VAL A 143 2.627 -8.444 -6.681 1.00 0.00 C ATOM 212 CG1 VAL A 143 1.418 -9.393 -6.560 1.00 0.00 C ATOM 213 CG2 VAL A 143 2.978 -8.136 -8.141 1.00 0.00 C ATOM 0 H VAL A 143 4.080 -6.054 -5.907 1.00 0.00 H new ATOM 0 HA VAL A 143 1.292 -6.842 -6.252 1.00 0.00 H new ATOM 0 HB VAL A 143 3.494 -8.934 -6.238 1.00 0.00 H new ATOM 0 HG11 VAL A 143 1.636 -10.327 -7.077 1.00 0.00 H new ATOM 0 HG12 VAL A 143 1.220 -9.598 -5.508 1.00 0.00 H new ATOM 0 HG13 VAL A 143 0.542 -8.925 -7.009 1.00 0.00 H new ATOM 0 HG21 VAL A 143 3.214 -9.064 -8.662 1.00 0.00 H new ATOM 0 HG22 VAL A 143 2.129 -7.654 -8.625 1.00 0.00 H new ATOM 0 HG23 VAL A 143 3.841 -7.471 -8.175 1.00 0.00 H new ATOM 223 N ILE A 144 1.141 -7.234 -3.851 1.00 0.00 N ATOM 224 CA ILE A 144 0.797 -7.437 -2.445 1.00 0.00 C ATOM 225 C ILE A 144 0.258 -8.844 -2.249 1.00 0.00 C ATOM 226 O ILE A 144 -0.384 -9.394 -3.133 1.00 0.00 O ATOM 227 CB ILE A 144 -0.192 -6.332 -2.067 1.00 0.00 C ATOM 228 CG1 ILE A 144 0.622 -5.065 -1.774 1.00 0.00 C ATOM 229 CG2 ILE A 144 -1.114 -6.696 -0.901 1.00 0.00 C ATOM 230 CD1 ILE A 144 -0.219 -3.886 -1.321 1.00 0.00 C ATOM 0 H ILE A 144 0.325 -6.939 -4.388 1.00 0.00 H new ATOM 0 HA ILE A 144 1.661 -7.364 -1.784 1.00 0.00 H new ATOM 0 HB ILE A 144 -0.873 -6.173 -2.903 1.00 0.00 H new ATOM 0 HG12 ILE A 144 1.361 -5.289 -1.004 1.00 0.00 H new ATOM 0 HG13 ILE A 144 1.172 -4.783 -2.671 1.00 0.00 H new ATOM 0 HG21 ILE A 144 -1.785 -5.862 -0.694 1.00 0.00 H new ATOM 0 HG22 ILE A 144 -1.700 -7.577 -1.162 1.00 0.00 H new ATOM 0 HG23 ILE A 144 -0.515 -6.908 -0.016 1.00 0.00 H new ATOM 0 HD11 ILE A 144 0.427 -3.029 -1.133 1.00 0.00 H new ATOM 0 HD12 ILE A 144 -0.940 -3.634 -2.098 1.00 0.00 H new ATOM 0 HD13 ILE A 144 -0.749 -4.148 -0.405 1.00 0.00 H new ATOM 242 N ASP A 145 0.555 -9.460 -1.117 1.00 0.00 N ATOM 243 CA ASP A 145 0.392 -10.897 -0.957 1.00 0.00 C ATOM 244 C ASP A 145 -0.104 -11.226 0.462 1.00 0.00 C ATOM 245 O ASP A 145 0.689 -11.230 1.406 1.00 0.00 O ATOM 246 CB ASP A 145 1.772 -11.505 -1.225 1.00 0.00 C ATOM 247 CG ASP A 145 1.792 -13.033 -1.319 1.00 0.00 C ATOM 248 OD1 ASP A 145 0.748 -13.681 -1.072 1.00 0.00 O ATOM 249 OD2 ASP A 145 2.866 -13.596 -1.625 1.00 0.00 O ATOM 0 H ASP A 145 0.913 -8.984 -0.289 1.00 0.00 H new ATOM 0 HA ASP A 145 -0.352 -11.303 -1.643 1.00 0.00 H new ATOM 0 HB2 ASP A 145 2.161 -11.092 -2.156 1.00 0.00 H new ATOM 0 HB3 ASP A 145 2.451 -11.195 -0.431 1.00 0.00 H new ATOM 254 N ASN A 146 -1.395 -11.533 0.633 1.00 0.00 N ATOM 255 CA ASN A 146 -1.934 -12.044 1.903 1.00 0.00 C ATOM 256 C ASN A 146 -1.709 -13.557 2.060 1.00 0.00 C ATOM 257 O ASN A 146 -1.723 -14.084 3.174 1.00 0.00 O ATOM 258 CB ASN A 146 -3.414 -11.673 2.008 1.00 0.00 C ATOM 259 CG ASN A 146 -4.080 -12.174 3.282 1.00 0.00 C ATOM 260 OD1 ASN A 146 -3.702 -11.845 4.399 1.00 0.00 O ATOM 261 ND2 ASN A 146 -5.088 -13.011 3.160 1.00 0.00 N ATOM 0 H ASN A 146 -2.096 -11.435 -0.102 1.00 0.00 H new ATOM 0 HA ASN A 146 -1.393 -11.576 2.726 1.00 0.00 H new ATOM 0 HB2 ASN A 146 -3.512 -10.589 1.959 1.00 0.00 H new ATOM 0 HB3 ASN A 146 -3.944 -12.080 1.147 1.00 0.00 H new ATOM 0 HD21 ASN A 146 -5.548 -13.380 3.992 1.00 0.00 H new ATOM 0 HD22 ASN A 146 -5.410 -13.290 2.233 1.00 0.00 H new ATOM 268 N GLY A 147 -1.422 -14.236 0.950 1.00 0.00 N ATOM 269 CA GLY A 147 -0.951 -15.624 0.947 1.00 0.00 C ATOM 270 C GLY A 147 0.391 -15.820 1.677 1.00 0.00 C ATOM 271 O GLY A 147 0.688 -16.924 2.134 1.00 0.00 O ATOM 0 H GLY A 147 -1.510 -13.835 0.016 1.00 0.00 H new ATOM 0 HA2 GLY A 147 -1.706 -16.256 1.415 1.00 0.00 H new ATOM 0 HA3 GLY A 147 -0.847 -15.962 -0.084 1.00 0.00 H new ATOM 275 N GLY A 148 1.176 -14.743 1.837 1.00 0.00 N ATOM 276 CA GLY A 148 2.414 -14.699 2.636 1.00 0.00 C ATOM 277 C GLY A 148 2.533 -13.516 3.611 1.00 0.00 C ATOM 278 O GLY A 148 3.549 -13.401 4.303 1.00 0.00 O ATOM 0 H GLY A 148 0.960 -13.847 1.399 1.00 0.00 H new ATOM 0 HA2 GLY A 148 2.491 -15.625 3.205 1.00 0.00 H new ATOM 0 HA3 GLY A 148 3.264 -14.672 1.955 1.00 0.00 H new ATOM 282 N ARG A 149 1.528 -12.624 3.665 1.00 0.00 N ATOM 283 CA ARG A 149 1.500 -11.334 4.390 1.00 0.00 C ATOM 284 C ARG A 149 2.767 -10.497 4.196 1.00 0.00 C ATOM 285 O ARG A 149 3.415 -10.060 5.148 1.00 0.00 O ATOM 286 CB ARG A 149 1.037 -11.533 5.842 1.00 0.00 C ATOM 287 CG ARG A 149 -0.431 -12.000 5.844 1.00 0.00 C ATOM 288 CD ARG A 149 -1.083 -11.973 7.227 1.00 0.00 C ATOM 289 NE ARG A 149 -2.543 -12.138 7.089 1.00 0.00 N ATOM 290 CZ ARG A 149 -3.429 -12.318 8.050 1.00 0.00 C ATOM 291 NH1 ARG A 149 -3.085 -12.406 9.304 1.00 0.00 N1+ ATOM 292 NH2 ARG A 149 -4.693 -12.409 7.757 1.00 0.00 N ATOM 0 H ARG A 149 0.652 -12.794 3.170 1.00 0.00 H new ATOM 0 HA ARG A 149 0.740 -10.701 3.933 1.00 0.00 H new ATOM 0 HB2 ARG A 149 1.667 -12.270 6.340 1.00 0.00 H new ATOM 0 HB3 ARG A 149 1.136 -10.601 6.399 1.00 0.00 H new ATOM 0 HG2 ARG A 149 -1.006 -11.366 5.169 1.00 0.00 H new ATOM 0 HG3 ARG A 149 -0.481 -13.014 5.448 1.00 0.00 H new ATOM 0 HD2 ARG A 149 -0.674 -12.769 7.849 1.00 0.00 H new ATOM 0 HD3 ARG A 149 -0.859 -11.031 7.728 1.00 0.00 H new ATOM 0 HE ARG A 149 -2.911 -12.110 6.138 1.00 0.00 H new ATOM 0 HH11 ARG A 149 -2.103 -12.336 9.570 1.00 0.00 H new ATOM 0 HH12 ARG A 149 -3.798 -12.545 10.020 1.00 0.00 H new ATOM 0 HH21 ARG A 149 -4.998 -12.341 6.786 1.00 0.00 H new ATOM 0 HH22 ARG A 149 -5.380 -12.548 8.498 1.00 0.00 H new ATOM 306 N SER A 150 3.116 -10.311 2.924 1.00 0.00 N ATOM 307 CA SER A 150 4.241 -9.489 2.455 1.00 0.00 C ATOM 308 C SER A 150 3.965 -8.928 1.050 1.00 0.00 C ATOM 309 O SER A 150 2.839 -9.021 0.559 1.00 0.00 O ATOM 310 CB SER A 150 5.534 -10.317 2.482 1.00 0.00 C ATOM 311 OG SER A 150 6.647 -9.442 2.418 1.00 0.00 O ATOM 0 H SER A 150 2.604 -10.745 2.156 1.00 0.00 H new ATOM 0 HA SER A 150 4.360 -8.637 3.125 1.00 0.00 H new ATOM 0 HB2 SER A 150 5.578 -10.916 3.392 1.00 0.00 H new ATOM 0 HB3 SER A 150 5.553 -11.012 1.642 1.00 0.00 H new ATOM 0 HG SER A 150 7.456 -9.956 2.213 1.00 0.00 H new ATOM 317 N VAL A 151 4.957 -8.315 0.390 1.00 0.00 N ATOM 318 CA VAL A 151 4.833 -7.791 -0.988 1.00 0.00 C ATOM 319 C VAL A 151 6.166 -7.869 -1.761 1.00 0.00 C ATOM 320 O VAL A 151 7.261 -7.702 -1.196 1.00 0.00 O ATOM 321 CB VAL A 151 4.196 -6.381 -1.082 1.00 0.00 C ATOM 322 CG1 VAL A 151 3.508 -5.922 0.200 1.00 0.00 C ATOM 323 CG2 VAL A 151 5.068 -5.289 -1.676 1.00 0.00 C ATOM 0 H VAL A 151 5.880 -8.165 0.797 1.00 0.00 H new ATOM 0 HA VAL A 151 4.123 -8.458 -1.477 1.00 0.00 H new ATOM 0 HB VAL A 151 3.416 -6.542 -1.826 1.00 0.00 H new ATOM 0 HG11 VAL A 151 3.089 -4.927 0.052 1.00 0.00 H new ATOM 0 HG12 VAL A 151 2.709 -6.619 0.454 1.00 0.00 H new ATOM 0 HG13 VAL A 151 4.234 -5.892 1.012 1.00 0.00 H new ATOM 0 HG21 VAL A 151 4.516 -4.349 -1.690 1.00 0.00 H new ATOM 0 HG22 VAL A 151 5.967 -5.172 -1.071 1.00 0.00 H new ATOM 0 HG23 VAL A 151 5.348 -5.560 -2.694 1.00 0.00 H new ATOM 333 N THR A 152 6.031 -7.997 -3.082 1.00 0.00 N ATOM 334 CA THR A 152 7.066 -7.855 -4.117 1.00 0.00 C ATOM 335 C THR A 152 6.840 -6.540 -4.860 1.00 0.00 C ATOM 336 O THR A 152 5.703 -6.219 -5.195 1.00 0.00 O ATOM 337 CB THR A 152 6.998 -8.971 -5.185 1.00 0.00 C ATOM 338 OG1 THR A 152 6.526 -10.194 -4.655 1.00 0.00 O ATOM 339 CG2 THR A 152 8.360 -9.261 -5.805 1.00 0.00 C ATOM 0 H THR A 152 5.124 -8.220 -3.492 1.00 0.00 H new ATOM 0 HA THR A 152 8.029 -7.901 -3.608 1.00 0.00 H new ATOM 0 HB THR A 152 6.308 -8.590 -5.938 1.00 0.00 H new ATOM 0 HG1 THR A 152 6.498 -10.869 -5.365 1.00 0.00 H new ATOM 0 HG21 THR A 152 8.260 -10.052 -6.549 1.00 0.00 H new ATOM 0 HG22 THR A 152 8.742 -8.359 -6.283 1.00 0.00 H new ATOM 0 HG23 THR A 152 9.053 -9.580 -5.027 1.00 0.00 H new ATOM 347 N LEU A 153 7.891 -5.805 -5.215 1.00 0.00 N ATOM 348 CA LEU A 153 7.813 -4.789 -6.263 1.00 0.00 C ATOM 349 C LEU A 153 8.837 -5.131 -7.338 1.00 0.00 C ATOM 350 O LEU A 153 9.960 -5.504 -7.004 1.00 0.00 O ATOM 351 CB LEU A 153 8.056 -3.387 -5.682 1.00 0.00 C ATOM 352 CG LEU A 153 8.054 -2.294 -6.759 1.00 0.00 C ATOM 353 CD1 LEU A 153 6.686 -1.709 -6.953 1.00 0.00 C ATOM 354 CD2 LEU A 153 9.032 -1.177 -6.470 1.00 0.00 C ATOM 0 H LEU A 153 8.813 -5.895 -4.789 1.00 0.00 H new ATOM 0 HA LEU A 153 6.816 -4.781 -6.703 1.00 0.00 H new ATOM 0 HB2 LEU A 153 7.286 -3.165 -4.943 1.00 0.00 H new ATOM 0 HB3 LEU A 153 9.012 -3.375 -5.159 1.00 0.00 H new ATOM 0 HG LEU A 153 8.370 -2.793 -7.675 1.00 0.00 H new ATOM 0 HD11 LEU A 153 6.726 -0.939 -7.723 1.00 0.00 H new ATOM 0 HD12 LEU A 153 5.995 -2.494 -7.260 1.00 0.00 H new ATOM 0 HD13 LEU A 153 6.343 -1.269 -6.017 1.00 0.00 H new ATOM 0 HD21 LEU A 153 8.984 -0.436 -7.267 1.00 0.00 H new ATOM 0 HD22 LEU A 153 8.776 -0.706 -5.521 1.00 0.00 H new ATOM 0 HD23 LEU A 153 10.042 -1.583 -6.413 1.00 0.00 H new ATOM 366 N ASN A 154 8.473 -4.938 -8.604 1.00 0.00 N ATOM 367 CA ASN A 154 9.412 -4.915 -9.724 1.00 0.00 C ATOM 368 C ASN A 154 10.167 -6.264 -9.885 1.00 0.00 C ATOM 369 O ASN A 154 11.319 -6.323 -10.317 1.00 0.00 O ATOM 370 CB ASN A 154 10.222 -3.600 -9.639 1.00 0.00 C ATOM 371 CG ASN A 154 11.260 -3.420 -10.736 1.00 0.00 C ATOM 372 OD1 ASN A 154 12.458 -3.348 -10.490 1.00 0.00 O ATOM 373 ND2 ASN A 154 10.837 -3.327 -11.978 1.00 0.00 N ATOM 0 H ASN A 154 7.504 -4.791 -8.885 1.00 0.00 H new ATOM 0 HA ASN A 154 8.916 -4.870 -10.694 1.00 0.00 H new ATOM 0 HB2 ASN A 154 9.529 -2.760 -9.672 1.00 0.00 H new ATOM 0 HB3 ASN A 154 10.724 -3.561 -8.672 1.00 0.00 H new ATOM 0 HD21 ASN A 154 11.506 -3.195 -12.736 1.00 0.00 H new ATOM 0 HD22 ASN A 154 9.840 -3.387 -12.183 1.00 0.00 H new ATOM 380 N GLY A 155 9.511 -7.362 -9.472 1.00 0.00 N ATOM 381 CA GLY A 155 10.075 -8.715 -9.355 1.00 0.00 C ATOM 382 C GLY A 155 11.211 -8.856 -8.330 1.00 0.00 C ATOM 383 O GLY A 155 12.064 -9.733 -8.472 1.00 0.00 O ATOM 0 H GLY A 155 8.529 -7.327 -9.199 1.00 0.00 H new ATOM 0 HA2 GLY A 155 9.275 -9.404 -9.086 1.00 0.00 H new ATOM 0 HA3 GLY A 155 10.446 -9.024 -10.332 1.00 0.00 H new ATOM 387 N GLU A 156 11.267 -7.963 -7.339 1.00 0.00 N ATOM 388 CA GLU A 156 12.477 -7.695 -6.537 1.00 0.00 C ATOM 389 C GLU A 156 12.214 -7.401 -5.045 1.00 0.00 C ATOM 390 O GLU A 156 13.065 -6.849 -4.343 1.00 0.00 O ATOM 391 CB GLU A 156 13.300 -6.576 -7.193 1.00 0.00 C ATOM 392 CG GLU A 156 14.801 -6.837 -6.993 1.00 0.00 C ATOM 393 CD GLU A 156 15.648 -5.636 -7.445 1.00 0.00 C ATOM 394 OE1 GLU A 156 15.884 -4.706 -6.631 1.00 0.00 O ATOM 395 OE2 GLU A 156 16.104 -5.610 -8.618 1.00 0.00 O ATOM 0 H GLU A 156 10.466 -7.395 -7.063 1.00 0.00 H new ATOM 0 HA GLU A 156 13.049 -8.623 -6.533 1.00 0.00 H new ATOM 0 HB2 GLU A 156 13.071 -6.522 -8.257 1.00 0.00 H new ATOM 0 HB3 GLU A 156 13.030 -5.613 -6.759 1.00 0.00 H new ATOM 0 HG2 GLU A 156 14.998 -7.047 -5.942 1.00 0.00 H new ATOM 0 HG3 GLU A 156 15.095 -7.723 -7.555 1.00 0.00 H new ATOM 402 N LEU A 157 11.064 -7.858 -4.542 1.00 0.00 N ATOM 403 CA LEU A 157 10.863 -8.261 -3.142 1.00 0.00 C ATOM 404 C LEU A 157 11.028 -7.087 -2.160 1.00 0.00 C ATOM 405 O LEU A 157 12.078 -6.925 -1.532 1.00 0.00 O ATOM 406 CB LEU A 157 11.804 -9.450 -2.835 1.00 0.00 C ATOM 407 CG LEU A 157 11.619 -10.664 -3.767 1.00 0.00 C ATOM 408 CD1 LEU A 157 12.934 -11.431 -3.886 1.00 0.00 C ATOM 409 CD2 LEU A 157 10.494 -11.565 -3.262 1.00 0.00 C ATOM 0 H LEU A 157 10.223 -7.962 -5.110 1.00 0.00 H new ATOM 0 HA LEU A 157 9.832 -8.585 -3.002 1.00 0.00 H new ATOM 0 HB2 LEU A 157 12.837 -9.108 -2.904 1.00 0.00 H new ATOM 0 HB3 LEU A 157 11.642 -9.769 -1.805 1.00 0.00 H new ATOM 0 HG LEU A 157 11.336 -10.311 -4.759 1.00 0.00 H new ATOM 0 HD11 LEU A 157 12.797 -12.288 -4.546 1.00 0.00 H new ATOM 0 HD12 LEU A 157 13.702 -10.775 -4.297 1.00 0.00 H new ATOM 0 HD13 LEU A 157 13.243 -11.778 -2.900 1.00 0.00 H new ATOM 0 HD21 LEU A 157 10.380 -12.416 -3.934 1.00 0.00 H new ATOM 0 HD22 LEU A 157 10.736 -11.923 -2.261 1.00 0.00 H new ATOM 0 HD23 LEU A 157 9.562 -11.000 -3.230 1.00 0.00 H new ATOM 421 N VAL A 158 9.986 -6.250 -2.022 1.00 0.00 N ATOM 422 CA VAL A 158 10.036 -5.112 -1.083 1.00 0.00 C ATOM 423 C VAL A 158 10.241 -5.616 0.336 1.00 0.00 C ATOM 424 O VAL A 158 11.139 -5.152 1.045 1.00 0.00 O ATOM 425 CB VAL A 158 8.737 -4.284 -1.009 1.00 0.00 C ATOM 426 CG1 VAL A 158 8.790 -3.165 0.046 1.00 0.00 C ATOM 427 CG2 VAL A 158 8.290 -3.724 -2.334 1.00 0.00 C ATOM 0 H VAL A 158 9.111 -6.335 -2.539 1.00 0.00 H new ATOM 0 HA VAL A 158 10.849 -4.492 -1.462 1.00 0.00 H new ATOM 0 HB VAL A 158 7.987 -5.011 -0.696 1.00 0.00 H new ATOM 0 HG11 VAL A 158 7.846 -2.621 0.047 1.00 0.00 H new ATOM 0 HG12 VAL A 158 8.958 -3.601 1.031 1.00 0.00 H new ATOM 0 HG13 VAL A 158 9.604 -2.480 -0.191 1.00 0.00 H new ATOM 0 HG21 VAL A 158 7.370 -3.155 -2.197 1.00 0.00 H new ATOM 0 HG22 VAL A 158 9.065 -3.070 -2.733 1.00 0.00 H new ATOM 0 HG23 VAL A 158 8.110 -4.541 -3.032 1.00 0.00 H new ATOM 437 N ASP A 159 9.336 -6.518 0.740 1.00 0.00 N ATOM 438 CA ASP A 159 9.006 -6.795 2.136 1.00 0.00 C ATOM 439 C ASP A 159 8.684 -5.541 2.982 1.00 0.00 C ATOM 440 O ASP A 159 9.530 -4.988 3.692 1.00 0.00 O ATOM 441 CB ASP A 159 10.097 -7.663 2.761 1.00 0.00 C ATOM 442 CG ASP A 159 10.407 -8.958 1.991 1.00 0.00 C ATOM 443 OD1 ASP A 159 9.523 -9.848 1.920 1.00 0.00 O ATOM 444 OD2 ASP A 159 11.552 -9.121 1.500 1.00 0.00 O ATOM 0 H ASP A 159 8.802 -7.088 0.084 1.00 0.00 H new ATOM 0 HA ASP A 159 8.068 -7.349 2.135 1.00 0.00 H new ATOM 0 HB2 ASP A 159 11.011 -7.074 2.838 1.00 0.00 H new ATOM 0 HB3 ASP A 159 9.799 -7.923 3.777 1.00 0.00 H new ATOM 449 N PHE A 160 7.422 -5.104 2.921 1.00 0.00 N ATOM 450 CA PHE A 160 6.864 -4.066 3.801 1.00 0.00 C ATOM 451 C PHE A 160 6.902 -4.479 5.291 1.00 0.00 C ATOM 452 O PHE A 160 7.002 -5.663 5.632 1.00 0.00 O ATOM 453 CB PHE A 160 5.439 -3.738 3.329 1.00 0.00 C ATOM 454 CG PHE A 160 5.379 -2.694 2.234 1.00 0.00 C ATOM 455 CD1 PHE A 160 5.388 -1.333 2.587 1.00 0.00 C ATOM 456 CD2 PHE A 160 5.363 -3.039 0.867 1.00 0.00 C ATOM 457 CE1 PHE A 160 5.434 -0.358 1.585 1.00 0.00 C ATOM 458 CE2 PHE A 160 5.365 -2.063 -0.123 1.00 0.00 C ATOM 459 CZ PHE A 160 5.416 -0.716 0.236 1.00 0.00 C ATOM 0 H PHE A 160 6.746 -5.466 2.248 1.00 0.00 H new ATOM 0 HA PHE A 160 7.481 -3.170 3.733 1.00 0.00 H new ATOM 0 HB2 PHE A 160 4.966 -4.653 2.971 1.00 0.00 H new ATOM 0 HB3 PHE A 160 4.856 -3.390 4.181 1.00 0.00 H new ATOM 0 HD1 PHE A 160 5.360 -1.042 3.627 1.00 0.00 H new ATOM 0 HD2 PHE A 160 5.349 -4.081 0.584 1.00 0.00 H new ATOM 0 HE1 PHE A 160 5.484 0.686 1.859 1.00 0.00 H new ATOM 0 HE2 PHE A 160 5.327 -2.346 -1.165 1.00 0.00 H new ATOM 0 HZ PHE A 160 5.441 0.047 -0.527 1.00 0.00 H new ATOM 469 N THR A 161 6.805 -3.494 6.194 1.00 0.00 N ATOM 470 CA THR A 161 6.675 -3.717 7.658 1.00 0.00 C ATOM 471 C THR A 161 5.316 -4.348 7.985 1.00 0.00 C ATOM 472 O THR A 161 4.454 -4.395 7.110 1.00 0.00 O ATOM 473 CB THR A 161 6.865 -2.429 8.491 1.00 0.00 C ATOM 474 OG1 THR A 161 5.640 -1.798 8.797 1.00 0.00 O ATOM 475 CG2 THR A 161 7.727 -1.373 7.803 1.00 0.00 C ATOM 0 H THR A 161 6.814 -2.507 5.936 1.00 0.00 H new ATOM 0 HA THR A 161 7.480 -4.398 7.935 1.00 0.00 H new ATOM 0 HB THR A 161 7.363 -2.785 9.393 1.00 0.00 H new ATOM 0 HG1 THR A 161 5.793 -1.087 9.453 1.00 0.00 H new ATOM 0 HG21 THR A 161 7.815 -0.499 8.448 1.00 0.00 H new ATOM 0 HG22 THR A 161 8.718 -1.782 7.609 1.00 0.00 H new ATOM 0 HG23 THR A 161 7.264 -1.083 6.860 1.00 0.00 H new ATOM 483 N SER A 162 5.056 -4.788 9.218 1.00 0.00 N ATOM 484 CA SER A 162 3.725 -5.300 9.599 1.00 0.00 C ATOM 485 C SER A 162 2.611 -4.265 9.372 1.00 0.00 C ATOM 486 O SER A 162 1.697 -4.519 8.585 1.00 0.00 O ATOM 487 CB SER A 162 3.728 -5.820 11.039 1.00 0.00 C ATOM 488 OG SER A 162 4.158 -4.823 11.956 1.00 0.00 O ATOM 0 H SER A 162 5.743 -4.803 9.972 1.00 0.00 H new ATOM 0 HA SER A 162 3.504 -6.139 8.939 1.00 0.00 H new ATOM 0 HB2 SER A 162 2.726 -6.154 11.308 1.00 0.00 H new ATOM 0 HB3 SER A 162 4.383 -6.688 11.111 1.00 0.00 H new ATOM 0 HG SER A 162 4.146 -5.188 12.865 1.00 0.00 H new ATOM 494 N ALA A 163 2.699 -3.072 9.974 1.00 0.00 N ATOM 495 CA ALA A 163 1.697 -2.027 9.766 1.00 0.00 C ATOM 496 C ALA A 163 1.701 -1.462 8.351 1.00 0.00 C ATOM 497 O ALA A 163 0.637 -1.143 7.828 1.00 0.00 O ATOM 498 CB ALA A 163 1.929 -0.833 10.676 1.00 0.00 C ATOM 0 H ALA A 163 3.454 -2.810 10.608 1.00 0.00 H new ATOM 0 HA ALA A 163 0.751 -2.525 9.977 1.00 0.00 H new ATOM 0 HB1 ALA A 163 1.164 -0.080 10.490 1.00 0.00 H new ATOM 0 HB2 ALA A 163 1.878 -1.153 11.717 1.00 0.00 H new ATOM 0 HB3 ALA A 163 2.912 -0.408 10.475 1.00 0.00 H new ATOM 504 N GLU A 164 2.869 -1.286 7.737 1.00 0.00 N ATOM 505 CA GLU A 164 2.923 -0.685 6.407 1.00 0.00 C ATOM 506 C GLU A 164 2.321 -1.651 5.386 1.00 0.00 C ATOM 507 O GLU A 164 1.444 -1.252 4.620 1.00 0.00 O ATOM 508 CB GLU A 164 4.332 -0.188 6.076 1.00 0.00 C ATOM 509 CG GLU A 164 4.751 0.925 7.063 1.00 0.00 C ATOM 510 CD GLU A 164 6.034 1.679 6.665 1.00 0.00 C ATOM 511 OE1 GLU A 164 6.441 1.654 5.479 1.00 0.00 O ATOM 512 OE2 GLU A 164 6.653 2.322 7.546 1.00 0.00 O ATOM 0 H GLU A 164 3.774 -1.545 8.130 1.00 0.00 H new ATOM 0 HA GLU A 164 2.309 0.215 6.374 1.00 0.00 H new ATOM 0 HB2 GLU A 164 5.039 -1.016 6.129 1.00 0.00 H new ATOM 0 HB3 GLU A 164 4.361 0.192 5.055 1.00 0.00 H new ATOM 0 HG2 GLU A 164 3.935 1.642 7.150 1.00 0.00 H new ATOM 0 HG3 GLU A 164 4.895 0.484 8.049 1.00 0.00 H new ATOM 519 N TYR A 165 2.620 -2.950 5.489 1.00 0.00 N ATOM 520 CA TYR A 165 1.855 -3.955 4.758 1.00 0.00 C ATOM 521 C TYR A 165 0.372 -3.938 5.156 1.00 0.00 C ATOM 522 O TYR A 165 -0.452 -3.983 4.252 1.00 0.00 O ATOM 523 CB TYR A 165 2.428 -5.365 4.926 1.00 0.00 C ATOM 524 CG TYR A 165 1.443 -6.437 4.512 1.00 0.00 C ATOM 525 CD1 TYR A 165 0.961 -6.518 3.187 1.00 0.00 C ATOM 526 CD2 TYR A 165 0.865 -7.221 5.529 1.00 0.00 C ATOM 527 CE1 TYR A 165 -0.062 -7.437 2.896 1.00 0.00 C ATOM 528 CE2 TYR A 165 -0.164 -8.134 5.230 1.00 0.00 C ATOM 529 CZ TYR A 165 -0.628 -8.242 3.904 1.00 0.00 C ATOM 530 OH TYR A 165 -1.664 -9.066 3.601 1.00 0.00 O ATOM 0 H TYR A 165 3.376 -3.323 6.064 1.00 0.00 H new ATOM 0 HA TYR A 165 1.937 -3.687 3.705 1.00 0.00 H new ATOM 0 HB2 TYR A 165 3.336 -5.459 4.331 1.00 0.00 H new ATOM 0 HB3 TYR A 165 2.712 -5.518 5.967 1.00 0.00 H new ATOM 0 HD1 TYR A 165 1.370 -5.886 2.413 1.00 0.00 H new ATOM 0 HD2 TYR A 165 1.214 -7.121 6.546 1.00 0.00 H new ATOM 0 HE1 TYR A 165 -0.421 -7.528 1.881 1.00 0.00 H new ATOM 0 HE2 TYR A 165 -0.594 -8.746 6.009 1.00 0.00 H new ATOM 0 HH TYR A 165 -2.189 -8.676 2.871 1.00 0.00 H new ATOM 540 N ASP A 166 -0.006 -3.831 6.439 1.00 0.00 N ATOM 541 CA ASP A 166 -1.419 -3.771 6.805 1.00 0.00 C ATOM 542 C ASP A 166 -2.170 -2.627 6.109 1.00 0.00 C ATOM 543 O ASP A 166 -3.175 -2.856 5.433 1.00 0.00 O ATOM 544 CB ASP A 166 -1.588 -3.633 8.312 1.00 0.00 C ATOM 545 CG ASP A 166 -1.250 -4.872 9.162 1.00 0.00 C ATOM 546 OD1 ASP A 166 -1.362 -6.020 8.667 1.00 0.00 O ATOM 547 OD2 ASP A 166 -0.953 -4.693 10.371 1.00 0.00 O ATOM 0 H ASP A 166 0.641 -3.785 7.226 1.00 0.00 H new ATOM 0 HA ASP A 166 -1.854 -4.712 6.467 1.00 0.00 H new ATOM 0 HB2 ASP A 166 -0.962 -2.807 8.650 1.00 0.00 H new ATOM 0 HB3 ASP A 166 -2.622 -3.353 8.514 1.00 0.00 H new ATOM 552 N LEU A 167 -1.668 -1.398 6.247 1.00 0.00 N ATOM 553 CA LEU A 167 -2.307 -0.201 5.720 1.00 0.00 C ATOM 554 C LEU A 167 -2.292 -0.230 4.185 1.00 0.00 C ATOM 555 O LEU A 167 -3.302 0.070 3.533 1.00 0.00 O ATOM 556 CB LEU A 167 -1.643 1.015 6.404 1.00 0.00 C ATOM 557 CG LEU A 167 -0.332 1.529 5.792 1.00 0.00 C ATOM 558 CD1 LEU A 167 -0.568 2.630 4.769 1.00 0.00 C ATOM 559 CD2 LEU A 167 0.526 2.122 6.903 1.00 0.00 C ATOM 0 H LEU A 167 -0.793 -1.209 6.736 1.00 0.00 H new ATOM 0 HA LEU A 167 -3.369 -0.135 5.956 1.00 0.00 H new ATOM 0 HB2 LEU A 167 -2.360 1.836 6.407 1.00 0.00 H new ATOM 0 HB3 LEU A 167 -1.452 0.755 7.445 1.00 0.00 H new ATOM 0 HG LEU A 167 0.151 0.686 5.299 1.00 0.00 H new ATOM 0 HD11 LEU A 167 0.388 2.961 4.364 1.00 0.00 H new ATOM 0 HD12 LEU A 167 -1.192 2.248 3.961 1.00 0.00 H new ATOM 0 HD13 LEU A 167 -1.070 3.471 5.248 1.00 0.00 H new ATOM 0 HD21 LEU A 167 1.461 2.491 6.483 1.00 0.00 H new ATOM 0 HD22 LEU A 167 -0.009 2.945 7.376 1.00 0.00 H new ATOM 0 HD23 LEU A 167 0.741 1.354 7.646 1.00 0.00 H new ATOM 571 N LEU A 168 -1.186 -0.719 3.615 1.00 0.00 N ATOM 572 CA LEU A 168 -1.064 -0.847 2.167 1.00 0.00 C ATOM 573 C LEU A 168 -2.084 -1.881 1.652 1.00 0.00 C ATOM 574 O LEU A 168 -2.922 -1.512 0.837 1.00 0.00 O ATOM 575 CB LEU A 168 0.393 -1.147 1.791 1.00 0.00 C ATOM 576 CG LEU A 168 0.849 -0.799 0.367 1.00 0.00 C ATOM 577 CD1 LEU A 168 2.003 -1.722 -0.017 1.00 0.00 C ATOM 578 CD2 LEU A 168 -0.234 -0.721 -0.701 1.00 0.00 C ATOM 0 H LEU A 168 -0.367 -1.031 4.136 1.00 0.00 H new ATOM 0 HA LEU A 168 -1.310 0.091 1.669 1.00 0.00 H new ATOM 0 HB2 LEU A 168 1.036 -0.612 2.489 1.00 0.00 H new ATOM 0 HB3 LEU A 168 0.568 -2.211 1.948 1.00 0.00 H new ATOM 0 HG LEU A 168 1.184 0.238 0.400 1.00 0.00 H new ATOM 0 HD11 LEU A 168 2.337 -1.486 -1.027 1.00 0.00 H new ATOM 0 HD12 LEU A 168 2.829 -1.582 0.681 1.00 0.00 H new ATOM 0 HD13 LEU A 168 1.668 -2.759 0.021 1.00 0.00 H new ATOM 0 HD21 LEU A 168 0.218 -0.468 -1.660 1.00 0.00 H new ATOM 0 HD22 LEU A 168 -0.737 -1.685 -0.780 1.00 0.00 H new ATOM 0 HD23 LEU A 168 -0.959 0.046 -0.428 1.00 0.00 H new ATOM 590 N TRP A 169 -2.103 -3.109 2.188 1.00 0.00 N ATOM 591 CA TRP A 169 -3.131 -4.135 1.935 1.00 0.00 C ATOM 592 C TRP A 169 -4.543 -3.584 2.035 1.00 0.00 C ATOM 593 O TRP A 169 -5.317 -3.756 1.102 1.00 0.00 O ATOM 594 CB TRP A 169 -3.022 -5.307 2.921 1.00 0.00 C ATOM 595 CG TRP A 169 -4.209 -6.233 2.964 1.00 0.00 C ATOM 596 CD1 TRP A 169 -5.241 -6.163 3.834 1.00 0.00 C ATOM 597 CD2 TRP A 169 -4.542 -7.327 2.061 1.00 0.00 C ATOM 598 NE1 TRP A 169 -6.223 -7.070 3.478 1.00 0.00 N ATOM 599 CE2 TRP A 169 -5.855 -7.797 2.368 1.00 0.00 C ATOM 600 CE3 TRP A 169 -3.864 -7.970 1.010 1.00 0.00 C ATOM 601 CZ2 TRP A 169 -6.489 -8.797 1.612 1.00 0.00 C ATOM 602 CZ3 TRP A 169 -4.473 -9.000 0.273 1.00 0.00 C ATOM 603 CH2 TRP A 169 -5.791 -9.404 0.555 1.00 0.00 C ATOM 0 H TRP A 169 -1.380 -3.429 2.832 1.00 0.00 H new ATOM 0 HA TRP A 169 -2.944 -4.477 0.917 1.00 0.00 H new ATOM 0 HB2 TRP A 169 -2.137 -5.891 2.667 1.00 0.00 H new ATOM 0 HB3 TRP A 169 -2.862 -4.904 3.921 1.00 0.00 H new ATOM 0 HD1 TRP A 169 -5.292 -5.497 4.683 1.00 0.00 H new ATOM 0 HE1 TRP A 169 -7.107 -7.185 3.974 1.00 0.00 H new ATOM 0 HE3 TRP A 169 -2.857 -7.667 0.765 1.00 0.00 H new ATOM 0 HZ2 TRP A 169 -7.501 -9.096 1.841 1.00 0.00 H new ATOM 0 HZ3 TRP A 169 -3.923 -9.487 -0.519 1.00 0.00 H new ATOM 0 HH2 TRP A 169 -6.262 -10.175 -0.037 1.00 0.00 H new ATOM 614 N LEU A 170 -4.874 -2.896 3.129 1.00 0.00 N ATOM 615 CA LEU A 170 -6.174 -2.255 3.314 1.00 0.00 C ATOM 616 C LEU A 170 -6.522 -1.373 2.105 1.00 0.00 C ATOM 617 O LEU A 170 -7.571 -1.567 1.456 1.00 0.00 O ATOM 618 CB LEU A 170 -6.090 -1.418 4.608 1.00 0.00 C ATOM 619 CG LEU A 170 -6.744 -1.998 5.869 1.00 0.00 C ATOM 620 CD1 LEU A 170 -8.243 -1.719 5.848 1.00 0.00 C ATOM 621 CD2 LEU A 170 -6.507 -3.500 6.063 1.00 0.00 C ATOM 0 H LEU A 170 -4.240 -2.768 3.918 1.00 0.00 H new ATOM 0 HA LEU A 170 -6.964 -3.001 3.397 1.00 0.00 H new ATOM 0 HB2 LEU A 170 -5.037 -1.240 4.826 1.00 0.00 H new ATOM 0 HB3 LEU A 170 -6.543 -0.446 4.410 1.00 0.00 H new ATOM 0 HG LEU A 170 -6.266 -1.500 6.712 1.00 0.00 H new ATOM 0 HD11 LEU A 170 -8.703 -2.133 6.745 1.00 0.00 H new ATOM 0 HD12 LEU A 170 -8.412 -0.643 5.817 1.00 0.00 H new ATOM 0 HD13 LEU A 170 -8.687 -2.182 4.967 1.00 0.00 H new ATOM 0 HD21 LEU A 170 -7.002 -3.831 6.976 1.00 0.00 H new ATOM 0 HD22 LEU A 170 -6.914 -4.045 5.211 1.00 0.00 H new ATOM 0 HD23 LEU A 170 -5.437 -3.693 6.140 1.00 0.00 H new ATOM 633 N LEU A 171 -5.612 -0.463 1.738 1.00 0.00 N ATOM 634 CA LEU A 171 -5.917 0.440 0.640 1.00 0.00 C ATOM 635 C LEU A 171 -6.014 -0.324 -0.690 1.00 0.00 C ATOM 636 O LEU A 171 -6.988 -0.161 -1.418 1.00 0.00 O ATOM 637 CB LEU A 171 -4.859 1.519 0.470 1.00 0.00 C ATOM 638 CG LEU A 171 -4.452 2.465 1.596 1.00 0.00 C ATOM 639 CD1 LEU A 171 -3.088 3.047 1.215 1.00 0.00 C ATOM 640 CD2 LEU A 171 -5.423 3.624 1.692 1.00 0.00 C ATOM 0 H LEU A 171 -4.696 -0.339 2.169 1.00 0.00 H new ATOM 0 HA LEU A 171 -6.871 0.903 0.891 1.00 0.00 H new ATOM 0 HB2 LEU A 171 -3.949 1.013 0.146 1.00 0.00 H new ATOM 0 HB3 LEU A 171 -5.187 2.147 -0.359 1.00 0.00 H new ATOM 0 HG LEU A 171 -4.435 1.926 2.543 1.00 0.00 H new ATOM 0 HD11 LEU A 171 -2.755 3.733 1.994 1.00 0.00 H new ATOM 0 HD12 LEU A 171 -2.364 2.239 1.109 1.00 0.00 H new ATOM 0 HD13 LEU A 171 -3.173 3.584 0.271 1.00 0.00 H new ATOM 0 HD21 LEU A 171 -5.118 4.289 2.500 1.00 0.00 H new ATOM 0 HD22 LEU A 171 -5.427 4.174 0.751 1.00 0.00 H new ATOM 0 HD23 LEU A 171 -6.424 3.244 1.894 1.00 0.00 H new ATOM 652 N ALA A 172 -5.029 -1.180 -0.990 1.00 0.00 N ATOM 653 CA ALA A 172 -4.940 -2.023 -2.178 1.00 0.00 C ATOM 654 C ALA A 172 -6.113 -3.011 -2.348 1.00 0.00 C ATOM 655 O ALA A 172 -6.528 -3.331 -3.460 1.00 0.00 O ATOM 656 CB ALA A 172 -3.636 -2.796 -2.049 1.00 0.00 C ATOM 0 H ALA A 172 -4.229 -1.306 -0.371 1.00 0.00 H new ATOM 0 HA ALA A 172 -4.980 -1.384 -3.060 1.00 0.00 H new ATOM 0 HB1 ALA A 172 -3.513 -3.448 -2.914 1.00 0.00 H new ATOM 0 HB2 ALA A 172 -2.802 -2.096 -2.000 1.00 0.00 H new ATOM 0 HB3 ALA A 172 -3.658 -3.398 -1.141 1.00 0.00 H new ATOM 662 N SER A 173 -6.662 -3.478 -1.237 1.00 0.00 N ATOM 663 CA SER A 173 -7.820 -4.368 -1.159 1.00 0.00 C ATOM 664 C SER A 173 -9.118 -3.576 -1.345 1.00 0.00 C ATOM 665 O SER A 173 -10.078 -4.106 -1.914 1.00 0.00 O ATOM 666 CB SER A 173 -7.804 -5.124 0.175 1.00 0.00 C ATOM 667 OG SER A 173 -8.857 -6.074 0.248 1.00 0.00 O ATOM 0 H SER A 173 -6.296 -3.237 -0.316 1.00 0.00 H new ATOM 0 HA SER A 173 -7.768 -5.101 -1.964 1.00 0.00 H new ATOM 0 HB2 SER A 173 -6.847 -5.631 0.296 1.00 0.00 H new ATOM 0 HB3 SER A 173 -7.895 -4.415 0.997 1.00 0.00 H new ATOM 0 HG SER A 173 -8.818 -6.540 1.109 1.00 0.00 H new ATOM 673 N ASN A 174 -9.136 -2.278 -0.989 1.00 0.00 N ATOM 674 CA ASN A 174 -10.201 -1.385 -1.449 1.00 0.00 C ATOM 675 C ASN A 174 -9.926 -0.726 -2.822 1.00 0.00 C ATOM 676 O ASN A 174 -10.766 0.049 -3.282 1.00 0.00 O ATOM 677 CB ASN A 174 -10.380 -0.328 -0.369 1.00 0.00 C ATOM 678 CG ASN A 174 -11.085 -0.871 0.860 1.00 0.00 C ATOM 679 OD1 ASN A 174 -12.306 -0.826 0.955 1.00 0.00 O ATOM 680 ND2 ASN A 174 -10.376 -1.384 1.838 1.00 0.00 N ATOM 0 H ASN A 174 -8.435 -1.835 -0.394 1.00 0.00 H new ATOM 0 HA ASN A 174 -11.106 -1.972 -1.606 1.00 0.00 H new ATOM 0 HB2 ASN A 174 -9.404 0.063 -0.082 1.00 0.00 H new ATOM 0 HB3 ASN A 174 -10.952 0.507 -0.773 1.00 0.00 H new ATOM 0 HD21 ASN A 174 -10.842 -1.743 2.672 1.00 0.00 H new ATOM 0 HD22 ASN A 174 -9.359 -1.424 1.764 1.00 0.00 H new ATOM 687 N ALA A 175 -8.778 -0.968 -3.467 1.00 0.00 N ATOM 688 CA ALA A 175 -8.234 -0.050 -4.472 1.00 0.00 C ATOM 689 C ALA A 175 -9.204 0.339 -5.608 1.00 0.00 C ATOM 690 O ALA A 175 -9.874 -0.496 -6.225 1.00 0.00 O ATOM 691 CB ALA A 175 -6.877 -0.546 -4.964 1.00 0.00 C ATOM 0 H ALA A 175 -8.206 -1.797 -3.308 1.00 0.00 H new ATOM 0 HA ALA A 175 -8.084 0.903 -3.964 1.00 0.00 H new ATOM 0 HB1 ALA A 175 -6.485 0.146 -5.710 1.00 0.00 H new ATOM 0 HB2 ALA A 175 -6.185 -0.604 -4.124 1.00 0.00 H new ATOM 0 HB3 ALA A 175 -6.991 -1.534 -5.410 1.00 0.00 H new ATOM 697 N GLY A 176 -9.278 1.653 -5.830 1.00 0.00 N ATOM 698 CA GLY A 176 -10.291 2.360 -6.636 1.00 0.00 C ATOM 699 C GLY A 176 -11.417 3.029 -5.814 1.00 0.00 C ATOM 700 O GLY A 176 -12.085 3.936 -6.317 1.00 0.00 O ATOM 0 H GLY A 176 -8.594 2.296 -5.431 1.00 0.00 H new ATOM 0 HA2 GLY A 176 -9.793 3.124 -7.233 1.00 0.00 H new ATOM 0 HA3 GLY A 176 -10.740 1.652 -7.333 1.00 0.00 H new ATOM 704 N ARG A 177 -11.580 2.650 -4.539 1.00 0.00 N ATOM 705 CA ARG A 177 -12.340 3.365 -3.488 1.00 0.00 C ATOM 706 C ARG A 177 -11.377 4.193 -2.637 1.00 0.00 C ATOM 707 O ARG A 177 -10.308 3.684 -2.331 1.00 0.00 O ATOM 708 CB ARG A 177 -13.037 2.322 -2.602 1.00 0.00 C ATOM 709 CG ARG A 177 -13.872 2.940 -1.474 1.00 0.00 C ATOM 710 CD ARG A 177 -14.428 1.868 -0.527 1.00 0.00 C ATOM 711 NE ARG A 177 -15.446 1.030 -1.191 1.00 0.00 N ATOM 712 CZ ARG A 177 -15.599 -0.281 -1.115 1.00 0.00 C ATOM 713 NH1 ARG A 177 -14.823 -1.058 -0.413 1.00 0.00 N ATOM 714 NH2 ARG A 177 -16.569 -0.857 -1.768 1.00 0.00 N1+ ATOM 0 H ARG A 177 -11.164 1.788 -4.187 1.00 0.00 H new ATOM 0 HA ARG A 177 -13.077 4.028 -3.941 1.00 0.00 H new ATOM 0 HB2 ARG A 177 -13.683 1.702 -3.224 1.00 0.00 H new ATOM 0 HB3 ARG A 177 -12.284 1.664 -2.168 1.00 0.00 H new ATOM 0 HG2 ARG A 177 -13.258 3.642 -0.909 1.00 0.00 H new ATOM 0 HG3 ARG A 177 -14.696 3.511 -1.902 1.00 0.00 H new ATOM 0 HD2 ARG A 177 -13.613 1.238 -0.172 1.00 0.00 H new ATOM 0 HD3 ARG A 177 -14.866 2.347 0.349 1.00 0.00 H new ATOM 0 HE ARG A 177 -16.115 1.524 -1.782 1.00 0.00 H new ATOM 0 HH11 ARG A 177 -14.047 -0.660 0.117 1.00 0.00 H new ATOM 0 HH12 ARG A 177 -14.991 -2.064 -0.393 1.00 0.00 H new ATOM 0 HH21 ARG A 177 -17.206 -0.297 -2.334 1.00 0.00 H new ATOM 0 HH22 ARG A 177 -16.691 -1.868 -1.713 1.00 0.00 H new ATOM 728 N ILE A 178 -11.730 5.412 -2.216 1.00 0.00 N ATOM 729 CA ILE A 178 -10.886 6.262 -1.341 1.00 0.00 C ATOM 730 C ILE A 178 -11.064 5.872 0.128 1.00 0.00 C ATOM 731 O ILE A 178 -12.190 5.637 0.573 1.00 0.00 O ATOM 732 CB ILE A 178 -11.202 7.764 -1.491 1.00 0.00 C ATOM 733 CG1 ILE A 178 -11.290 8.237 -2.964 1.00 0.00 C ATOM 734 CG2 ILE A 178 -10.167 8.593 -0.694 1.00 0.00 C ATOM 735 CD1 ILE A 178 -12.524 9.112 -3.201 1.00 0.00 C ATOM 0 H ILE A 178 -12.616 5.849 -2.470 1.00 0.00 H new ATOM 0 HA ILE A 178 -9.856 6.093 -1.657 1.00 0.00 H new ATOM 0 HB ILE A 178 -12.198 7.926 -1.079 1.00 0.00 H new ATOM 0 HG12 ILE A 178 -10.391 8.797 -3.221 1.00 0.00 H new ATOM 0 HG13 ILE A 178 -11.325 7.370 -3.624 1.00 0.00 H new ATOM 0 HG21 ILE A 178 -10.391 9.654 -0.801 1.00 0.00 H new ATOM 0 HG22 ILE A 178 -10.213 8.316 0.359 1.00 0.00 H new ATOM 0 HG23 ILE A 178 -9.167 8.393 -1.078 1.00 0.00 H new ATOM 0 HD11 ILE A 178 -12.553 9.425 -4.245 1.00 0.00 H new ATOM 0 HD12 ILE A 178 -13.424 8.543 -2.968 1.00 0.00 H new ATOM 0 HD13 ILE A 178 -12.475 9.992 -2.559 1.00 0.00 H new ATOM 747 N LEU A 179 -9.972 5.858 0.896 1.00 0.00 N ATOM 748 CA LEU A 179 -9.942 5.449 2.282 1.00 0.00 C ATOM 749 C LEU A 179 -9.421 6.615 3.143 1.00 0.00 C ATOM 750 O LEU A 179 -8.285 7.025 2.972 1.00 0.00 O ATOM 751 CB LEU A 179 -9.103 4.180 2.433 1.00 0.00 C ATOM 752 CG LEU A 179 -9.252 3.015 1.440 1.00 0.00 C ATOM 753 CD1 LEU A 179 -10.697 2.524 1.316 1.00 0.00 C ATOM 754 CD2 LEU A 179 -8.633 3.144 0.063 1.00 0.00 C ATOM 0 H LEU A 179 -9.057 6.143 0.547 1.00 0.00 H new ATOM 0 HA LEU A 179 -10.946 5.206 2.631 1.00 0.00 H new ATOM 0 HB2 LEU A 179 -8.056 4.484 2.415 1.00 0.00 H new ATOM 0 HB3 LEU A 179 -9.302 3.781 3.427 1.00 0.00 H new ATOM 0 HG LEU A 179 -8.626 2.270 1.931 1.00 0.00 H new ATOM 0 HD11 LEU A 179 -10.742 1.702 0.602 1.00 0.00 H new ATOM 0 HD12 LEU A 179 -11.049 2.180 2.289 1.00 0.00 H new ATOM 0 HD13 LEU A 179 -11.330 3.341 0.969 1.00 0.00 H new ATOM 0 HD21 LEU A 179 -8.829 2.238 -0.510 1.00 0.00 H new ATOM 0 HD22 LEU A 179 -9.067 4.001 -0.452 1.00 0.00 H new ATOM 0 HD23 LEU A 179 -7.557 3.286 0.160 1.00 0.00 H new ATOM 766 N SER A 180 -10.205 7.162 4.065 1.00 0.00 N ATOM 767 CA SER A 180 -10.012 8.451 4.781 1.00 0.00 C ATOM 768 C SER A 180 -8.800 8.620 5.757 1.00 0.00 C ATOM 769 O SER A 180 -8.947 9.281 6.783 1.00 0.00 O ATOM 770 CB SER A 180 -11.320 8.802 5.513 1.00 0.00 C ATOM 771 OG SER A 180 -12.451 8.678 4.660 1.00 0.00 O ATOM 0 H SER A 180 -11.060 6.694 4.365 1.00 0.00 H new ATOM 0 HA SER A 180 -9.746 9.140 3.979 1.00 0.00 H new ATOM 0 HB2 SER A 180 -11.441 8.147 6.375 1.00 0.00 H new ATOM 0 HB3 SER A 180 -11.261 9.822 5.893 1.00 0.00 H new ATOM 0 HG SER A 180 -13.263 8.907 5.158 1.00 0.00 H new ATOM 777 N ARG A 181 -7.607 8.055 5.482 1.00 0.00 N ATOM 778 CA ARG A 181 -6.398 7.874 6.367 1.00 0.00 C ATOM 779 C ARG A 181 -6.622 7.156 7.721 1.00 0.00 C ATOM 780 O ARG A 181 -6.071 6.085 8.033 1.00 0.00 O ATOM 781 CB ARG A 181 -5.693 9.217 6.653 1.00 0.00 C ATOM 782 CG ARG A 181 -5.174 9.978 5.432 1.00 0.00 C ATOM 783 CD ARG A 181 -5.637 11.441 5.368 1.00 0.00 C ATOM 784 NE ARG A 181 -4.908 12.149 4.296 1.00 0.00 N ATOM 785 CZ ARG A 181 -3.721 12.715 4.428 1.00 0.00 C ATOM 786 NH1 ARG A 181 -3.133 12.849 5.583 1.00 0.00 N1+ ATOM 787 NH2 ARG A 181 -3.064 13.146 3.398 1.00 0.00 N ATOM 0 H ARG A 181 -7.431 7.673 4.553 1.00 0.00 H new ATOM 0 HA ARG A 181 -5.778 7.207 5.768 1.00 0.00 H new ATOM 0 HB2 ARG A 181 -6.389 9.862 7.189 1.00 0.00 H new ATOM 0 HB3 ARG A 181 -4.853 9.028 7.322 1.00 0.00 H new ATOM 0 HG2 ARG A 181 -4.084 9.952 5.436 1.00 0.00 H new ATOM 0 HG3 ARG A 181 -5.502 9.463 4.529 1.00 0.00 H new ATOM 0 HD2 ARG A 181 -6.710 11.485 5.181 1.00 0.00 H new ATOM 0 HD3 ARG A 181 -5.460 11.931 6.326 1.00 0.00 H new ATOM 0 HE ARG A 181 -5.356 12.206 3.381 1.00 0.00 H new ATOM 0 HH11 ARG A 181 -3.590 12.511 6.430 1.00 0.00 H new ATOM 0 HH12 ARG A 181 -2.216 13.292 5.640 1.00 0.00 H new ATOM 0 HH21 ARG A 181 -3.462 13.051 2.463 1.00 0.00 H new ATOM 0 HH22 ARG A 181 -2.149 13.580 3.522 1.00 0.00 H new ATOM 801 N GLU A 182 -7.461 7.768 8.538 1.00 0.00 N ATOM 802 CA GLU A 182 -7.760 7.294 9.875 1.00 0.00 C ATOM 803 C GLU A 182 -8.569 5.998 9.807 1.00 0.00 C ATOM 804 O GLU A 182 -8.289 5.093 10.572 1.00 0.00 O ATOM 805 CB GLU A 182 -8.474 8.396 10.674 1.00 0.00 C ATOM 806 CG GLU A 182 -9.904 8.670 10.189 1.00 0.00 C ATOM 807 CD GLU A 182 -10.455 9.983 10.777 1.00 0.00 C ATOM 808 OE1 GLU A 182 -10.979 9.969 11.919 1.00 0.00 O ATOM 809 OE2 GLU A 182 -10.372 11.046 10.111 1.00 0.00 O ATOM 0 H GLU A 182 -7.960 8.621 8.286 1.00 0.00 H new ATOM 0 HA GLU A 182 -6.834 7.063 10.401 1.00 0.00 H new ATOM 0 HB2 GLU A 182 -8.503 8.111 11.726 1.00 0.00 H new ATOM 0 HB3 GLU A 182 -7.893 9.316 10.609 1.00 0.00 H new ATOM 0 HG2 GLU A 182 -9.917 8.724 9.100 1.00 0.00 H new ATOM 0 HG3 GLU A 182 -10.552 7.841 10.475 1.00 0.00 H new ATOM 816 N ASP A 183 -9.489 5.851 8.847 1.00 0.00 N ATOM 817 CA ASP A 183 -10.324 4.648 8.673 1.00 0.00 C ATOM 818 C ASP A 183 -9.468 3.375 8.532 1.00 0.00 C ATOM 819 O ASP A 183 -9.673 2.361 9.205 1.00 0.00 O ATOM 820 CB ASP A 183 -11.209 4.833 7.419 1.00 0.00 C ATOM 821 CG ASP A 183 -12.694 4.616 7.743 1.00 0.00 C ATOM 822 OD1 ASP A 183 -13.373 5.580 8.169 1.00 0.00 O ATOM 823 OD2 ASP A 183 -13.189 3.475 7.575 1.00 0.00 O ATOM 0 H ASP A 183 -9.681 6.575 8.155 1.00 0.00 H new ATOM 0 HA ASP A 183 -10.945 4.525 9.560 1.00 0.00 H new ATOM 0 HB2 ASP A 183 -11.066 5.836 7.016 1.00 0.00 H new ATOM 0 HB3 ASP A 183 -10.898 4.131 6.646 1.00 0.00 H new ATOM 828 N ILE A 184 -8.441 3.500 7.690 1.00 0.00 N ATOM 829 CA ILE A 184 -7.376 2.526 7.473 1.00 0.00 C ATOM 830 C ILE A 184 -6.703 2.215 8.808 1.00 0.00 C ATOM 831 O ILE A 184 -6.787 1.088 9.305 1.00 0.00 O ATOM 832 CB ILE A 184 -6.346 3.075 6.456 1.00 0.00 C ATOM 833 CG1 ILE A 184 -6.986 3.478 5.117 1.00 0.00 C ATOM 834 CG2 ILE A 184 -5.215 2.066 6.270 1.00 0.00 C ATOM 835 CD1 ILE A 184 -7.504 4.930 5.148 1.00 0.00 C ATOM 0 H ILE A 184 -8.326 4.331 7.110 1.00 0.00 H new ATOM 0 HA ILE A 184 -7.798 1.609 7.063 1.00 0.00 H new ATOM 0 HB ILE A 184 -5.930 3.995 6.866 1.00 0.00 H new ATOM 0 HG12 ILE A 184 -6.254 3.369 4.316 1.00 0.00 H new ATOM 0 HG13 ILE A 184 -7.810 2.802 4.889 1.00 0.00 H new ATOM 0 HG21 ILE A 184 -4.493 2.457 5.553 1.00 0.00 H new ATOM 0 HG22 ILE A 184 -4.721 1.893 7.226 1.00 0.00 H new ATOM 0 HG23 ILE A 184 -5.623 1.126 5.898 1.00 0.00 H new ATOM 0 HD11 ILE A 184 -7.949 5.178 4.185 1.00 0.00 H new ATOM 0 HD12 ILE A 184 -8.255 5.032 5.932 1.00 0.00 H new ATOM 0 HD13 ILE A 184 -6.675 5.608 5.350 1.00 0.00 H new ATOM 847 N PHE A 185 -6.054 3.220 9.409 1.00 0.00 N ATOM 848 CA PHE A 185 -5.249 2.959 10.609 1.00 0.00 C ATOM 849 C PHE A 185 -6.052 2.421 11.800 1.00 0.00 C ATOM 850 O PHE A 185 -5.599 1.582 12.569 1.00 0.00 O ATOM 851 CB PHE A 185 -4.538 4.240 11.005 1.00 0.00 C ATOM 852 CG PHE A 185 -3.194 4.103 11.693 1.00 0.00 C ATOM 853 CD1 PHE A 185 -2.660 2.850 12.048 1.00 0.00 C ATOM 854 CD2 PHE A 185 -2.467 5.273 11.978 1.00 0.00 C ATOM 855 CE1 PHE A 185 -1.418 2.763 12.695 1.00 0.00 C ATOM 856 CE2 PHE A 185 -1.250 5.195 12.686 1.00 0.00 C ATOM 857 CZ PHE A 185 -0.723 3.938 13.046 1.00 0.00 C ATOM 0 H PHE A 185 -6.068 4.191 9.097 1.00 0.00 H new ATOM 0 HA PHE A 185 -4.541 2.171 10.351 1.00 0.00 H new ATOM 0 HB2 PHE A 185 -4.397 4.840 10.106 1.00 0.00 H new ATOM 0 HB3 PHE A 185 -5.199 4.803 11.664 1.00 0.00 H new ATOM 0 HD1 PHE A 185 -3.210 1.949 11.821 1.00 0.00 H new ATOM 0 HD2 PHE A 185 -2.842 6.233 11.654 1.00 0.00 H new ATOM 0 HE1 PHE A 185 -0.995 1.796 12.924 1.00 0.00 H new ATOM 0 HE2 PHE A 185 -0.722 6.098 12.953 1.00 0.00 H new ATOM 0 HZ PHE A 185 0.209 3.876 13.588 1.00 0.00 H new ATOM 867 N GLU A 186 -7.279 2.889 11.914 1.00 0.00 N ATOM 868 CA GLU A 186 -8.287 2.431 12.874 1.00 0.00 C ATOM 869 C GLU A 186 -8.768 0.991 12.600 1.00 0.00 C ATOM 870 O GLU A 186 -9.082 0.282 13.564 1.00 0.00 O ATOM 871 CB GLU A 186 -9.456 3.425 12.881 1.00 0.00 C ATOM 872 CG GLU A 186 -9.063 4.773 13.510 1.00 0.00 C ATOM 873 CD GLU A 186 -8.997 4.688 15.046 1.00 0.00 C ATOM 874 OE1 GLU A 186 -10.055 4.805 15.715 1.00 0.00 O ATOM 875 OE2 GLU A 186 -7.886 4.510 15.602 1.00 0.00 O ATOM 0 H GLU A 186 -7.626 3.637 11.313 1.00 0.00 H new ATOM 0 HA GLU A 186 -7.827 2.399 13.862 1.00 0.00 H new ATOM 0 HB2 GLU A 186 -9.799 3.588 11.859 1.00 0.00 H new ATOM 0 HB3 GLU A 186 -10.292 2.997 13.434 1.00 0.00 H new ATOM 0 HG2 GLU A 186 -8.094 5.087 13.121 1.00 0.00 H new ATOM 0 HG3 GLU A 186 -9.786 5.535 13.219 1.00 0.00 H new ATOM 882 N ARG A 187 -8.746 0.501 11.344 1.00 0.00 N ATOM 883 CA ARG A 187 -8.793 -0.952 11.066 1.00 0.00 C ATOM 884 C ARG A 187 -7.540 -1.666 11.596 1.00 0.00 C ATOM 885 O ARG A 187 -7.679 -2.599 12.388 1.00 0.00 O ATOM 886 CB ARG A 187 -9.046 -1.254 9.573 1.00 0.00 C ATOM 887 CG ARG A 187 -9.663 -2.648 9.312 1.00 0.00 C ATOM 888 CD ARG A 187 -8.746 -3.842 9.610 1.00 0.00 C ATOM 889 NE ARG A 187 -9.233 -5.077 8.964 1.00 0.00 N ATOM 890 CZ ARG A 187 -8.723 -6.288 9.098 1.00 0.00 C ATOM 891 NH1 ARG A 187 -7.692 -6.528 9.863 1.00 0.00 N1+ ATOM 892 NH2 ARG A 187 -9.245 -7.297 8.462 1.00 0.00 N ATOM 0 H ARG A 187 -8.696 1.085 10.509 1.00 0.00 H new ATOM 0 HA ARG A 187 -9.648 -1.354 11.609 1.00 0.00 H new ATOM 0 HB2 ARG A 187 -9.710 -0.492 9.165 1.00 0.00 H new ATOM 0 HB3 ARG A 187 -8.103 -1.178 9.032 1.00 0.00 H new ATOM 0 HG2 ARG A 187 -10.565 -2.746 9.916 1.00 0.00 H new ATOM 0 HG3 ARG A 187 -9.971 -2.700 8.268 1.00 0.00 H new ATOM 0 HD2 ARG A 187 -7.737 -3.622 9.261 1.00 0.00 H new ATOM 0 HD3 ARG A 187 -8.685 -3.994 10.688 1.00 0.00 H new ATOM 0 HE ARG A 187 -10.045 -4.986 8.353 1.00 0.00 H new ATOM 0 HH11 ARG A 187 -7.254 -5.767 10.382 1.00 0.00 H new ATOM 0 HH12 ARG A 187 -7.325 -7.477 9.942 1.00 0.00 H new ATOM 0 HH21 ARG A 187 -10.053 -7.155 7.856 1.00 0.00 H new ATOM 0 HH22 ARG A 187 -8.846 -8.230 8.570 1.00 0.00 H new ATOM 906 N LEU A 188 -6.329 -1.269 11.181 1.00 0.00 N ATOM 907 CA LEU A 188 -5.131 -2.106 11.449 1.00 0.00 C ATOM 908 C LEU A 188 -4.521 -1.980 12.858 1.00 0.00 C ATOM 909 O LEU A 188 -3.913 -2.942 13.330 1.00 0.00 O ATOM 910 CB LEU A 188 -4.055 -1.933 10.364 1.00 0.00 C ATOM 911 CG LEU A 188 -3.501 -0.501 10.260 1.00 0.00 C ATOM 912 CD1 LEU A 188 -1.989 -0.366 10.408 1.00 0.00 C ATOM 913 CD2 LEU A 188 -3.776 0.054 8.884 1.00 0.00 C ATOM 0 H LEU A 188 -6.146 -0.403 10.674 1.00 0.00 H new ATOM 0 HA LEU A 188 -5.520 -3.124 11.410 1.00 0.00 H new ATOM 0 HB2 LEU A 188 -3.232 -2.617 10.570 1.00 0.00 H new ATOM 0 HB3 LEU A 188 -4.475 -2.221 9.400 1.00 0.00 H new ATOM 0 HG LEU A 188 -3.994 0.020 11.081 1.00 0.00 H new ATOM 0 HD11 LEU A 188 -1.707 0.683 10.318 1.00 0.00 H new ATOM 0 HD12 LEU A 188 -1.684 -0.742 11.385 1.00 0.00 H new ATOM 0 HD13 LEU A 188 -1.494 -0.943 9.627 1.00 0.00 H new ATOM 0 HD21 LEU A 188 -3.382 1.068 8.815 1.00 0.00 H new ATOM 0 HD22 LEU A 188 -3.294 -0.574 8.135 1.00 0.00 H new ATOM 0 HD23 LEU A 188 -4.851 0.070 8.706 1.00 0.00 H new ATOM 1165 N ILE A 204 3.145 6.754 4.234 1.00 0.00 N ATOM 1166 CA ILE A 204 2.764 6.767 2.797 1.00 0.00 C ATOM 1167 C ILE A 204 3.881 7.300 1.904 1.00 0.00 C ATOM 1168 O ILE A 204 4.192 6.654 0.911 1.00 0.00 O ATOM 1169 CB ILE A 204 1.488 7.595 2.549 1.00 0.00 C ATOM 1170 CG1 ILE A 204 0.282 6.994 3.258 1.00 0.00 C ATOM 1171 CG2 ILE A 204 1.169 7.795 1.052 1.00 0.00 C ATOM 1172 CD1 ILE A 204 -0.124 5.556 2.980 1.00 0.00 C ATOM 0 HA ILE A 204 2.574 5.726 2.535 1.00 0.00 H new ATOM 0 HB ILE A 204 1.697 8.579 2.970 1.00 0.00 H new ATOM 0 HG12 ILE A 204 0.461 7.079 4.330 1.00 0.00 H new ATOM 0 HG13 ILE A 204 -0.577 7.624 3.027 1.00 0.00 H new ATOM 0 HG21 ILE A 204 0.259 8.386 0.950 1.00 0.00 H new ATOM 0 HG22 ILE A 204 1.996 8.316 0.570 1.00 0.00 H new ATOM 0 HG23 ILE A 204 1.026 6.824 0.577 1.00 0.00 H new ATOM 0 HD11 ILE A 204 -1.002 5.305 3.574 1.00 0.00 H new ATOM 0 HD12 ILE A 204 -0.357 5.442 1.921 1.00 0.00 H new ATOM 0 HD13 ILE A 204 0.696 4.889 3.245 1.00 0.00 H new ATOM 1184 N SER A 205 4.532 8.416 2.232 1.00 0.00 N ATOM 1185 CA SER A 205 5.732 8.873 1.508 1.00 0.00 C ATOM 1186 C SER A 205 6.971 7.938 1.619 1.00 0.00 C ATOM 1187 O SER A 205 7.960 8.153 0.915 1.00 0.00 O ATOM 1188 CB SER A 205 6.028 10.322 1.899 1.00 0.00 C ATOM 1189 OG SER A 205 6.981 10.905 1.023 1.00 0.00 O ATOM 0 H SER A 205 4.251 9.028 2.998 1.00 0.00 H new ATOM 0 HA SER A 205 5.503 8.826 0.443 1.00 0.00 H new ATOM 0 HB2 SER A 205 5.106 10.903 1.877 1.00 0.00 H new ATOM 0 HB3 SER A 205 6.402 10.356 2.922 1.00 0.00 H new ATOM 0 HG SER A 205 7.151 11.831 1.294 1.00 0.00 H new ATOM 1195 N ARG A 206 6.925 6.854 2.414 1.00 0.00 N ATOM 1196 CA ARG A 206 7.824 5.668 2.318 1.00 0.00 C ATOM 1197 C ARG A 206 7.218 4.462 1.560 1.00 0.00 C ATOM 1198 O ARG A 206 7.946 3.784 0.810 1.00 0.00 O ATOM 1199 CB ARG A 206 8.322 5.251 3.717 1.00 0.00 C ATOM 1200 CG ARG A 206 9.016 6.355 4.537 1.00 0.00 C ATOM 1201 CD ARG A 206 10.183 7.033 3.808 1.00 0.00 C ATOM 1202 NE ARG A 206 10.853 8.018 4.679 1.00 0.00 N ATOM 1203 CZ ARG A 206 11.876 8.789 4.355 1.00 0.00 C ATOM 1204 NH1 ARG A 206 12.431 8.745 3.176 1.00 0.00 N1+ ATOM 1205 NH2 ARG A 206 12.364 9.634 5.220 1.00 0.00 N ATOM 0 H ARG A 206 6.243 6.767 3.168 1.00 0.00 H new ATOM 0 HA ARG A 206 8.671 5.988 1.711 1.00 0.00 H new ATOM 0 HB2 ARG A 206 7.472 4.880 4.289 1.00 0.00 H new ATOM 0 HB3 ARG A 206 9.017 4.419 3.602 1.00 0.00 H new ATOM 0 HG2 ARG A 206 8.279 7.112 4.805 1.00 0.00 H new ATOM 0 HG3 ARG A 206 9.384 5.925 5.469 1.00 0.00 H new ATOM 0 HD2 ARG A 206 10.902 6.279 3.486 1.00 0.00 H new ATOM 0 HD3 ARG A 206 9.816 7.528 2.909 1.00 0.00 H new ATOM 0 HE ARG A 206 10.490 8.113 5.627 1.00 0.00 H new ATOM 0 HH11 ARG A 206 12.077 8.101 2.469 1.00 0.00 H new ATOM 0 HH12 ARG A 206 13.220 9.355 2.960 1.00 0.00 H new ATOM 0 HH21 ARG A 206 11.956 9.702 6.152 1.00 0.00 H new ATOM 0 HH22 ARG A 206 13.154 10.227 4.964 1.00 0.00 H new ATOM 1219 N ILE A 207 5.898 4.218 1.646 1.00 0.00 N ATOM 1220 CA ILE A 207 5.215 3.275 0.742 1.00 0.00 C ATOM 1221 C ILE A 207 5.493 3.715 -0.699 1.00 0.00 C ATOM 1222 O ILE A 207 5.901 2.901 -1.509 1.00 0.00 O ATOM 1223 CB ILE A 207 3.685 3.136 1.022 1.00 0.00 C ATOM 1224 CG1 ILE A 207 3.201 2.363 2.274 1.00 0.00 C ATOM 1225 CG2 ILE A 207 3.023 2.340 -0.103 1.00 0.00 C ATOM 1226 CD1 ILE A 207 3.633 2.969 3.585 1.00 0.00 C ATOM 0 H ILE A 207 5.284 4.660 2.331 1.00 0.00 H new ATOM 0 HA ILE A 207 5.614 2.276 0.918 1.00 0.00 H new ATOM 0 HB ILE A 207 3.421 4.187 1.143 1.00 0.00 H new ATOM 0 HG12 ILE A 207 2.113 2.308 2.254 1.00 0.00 H new ATOM 0 HG13 ILE A 207 3.573 1.340 2.221 1.00 0.00 H new ATOM 0 HG21 ILE A 207 1.956 2.246 0.097 1.00 0.00 H new ATOM 0 HG22 ILE A 207 3.170 2.858 -1.051 1.00 0.00 H new ATOM 0 HG23 ILE A 207 3.471 1.348 -0.159 1.00 0.00 H new ATOM 0 HD11 ILE A 207 3.251 2.365 4.408 1.00 0.00 H new ATOM 0 HD12 ILE A 207 4.722 2.999 3.631 1.00 0.00 H new ATOM 0 HD13 ILE A 207 3.239 3.982 3.665 1.00 0.00 H new ATOM 1238 N ARG A 208 5.390 5.013 -0.972 1.00 0.00 N ATOM 1239 CA ARG A 208 5.742 5.711 -2.226 1.00 0.00 C ATOM 1240 C ARG A 208 6.999 5.128 -2.918 1.00 0.00 C ATOM 1241 O ARG A 208 6.821 4.451 -3.932 1.00 0.00 O ATOM 1242 CB ARG A 208 5.769 7.226 -1.929 1.00 0.00 C ATOM 1243 CG ARG A 208 6.218 8.160 -3.064 1.00 0.00 C ATOM 1244 CD ARG A 208 6.387 9.607 -2.560 1.00 0.00 C ATOM 1245 NE ARG A 208 7.536 9.777 -1.656 1.00 0.00 N ATOM 1246 CZ ARG A 208 8.816 9.747 -1.961 1.00 0.00 C ATOM 1247 NH1 ARG A 208 9.249 9.574 -3.175 1.00 0.00 N1+ ATOM 1248 NH2 ARG A 208 9.696 9.869 -1.012 1.00 0.00 N ATOM 0 H ARG A 208 5.031 5.664 -0.273 1.00 0.00 H new ATOM 0 HA ARG A 208 4.983 5.541 -2.989 1.00 0.00 H new ATOM 0 HB2 ARG A 208 4.768 7.527 -1.621 1.00 0.00 H new ATOM 0 HB3 ARG A 208 6.428 7.391 -1.076 1.00 0.00 H new ATOM 0 HG2 ARG A 208 7.161 7.804 -3.480 1.00 0.00 H new ATOM 0 HG3 ARG A 208 5.485 8.136 -3.870 1.00 0.00 H new ATOM 0 HD2 ARG A 208 6.505 10.271 -3.416 1.00 0.00 H new ATOM 0 HD3 ARG A 208 5.478 9.913 -2.043 1.00 0.00 H new ATOM 0 HE ARG A 208 7.313 9.938 -0.674 1.00 0.00 H new ATOM 0 HH11 ARG A 208 8.586 9.454 -3.941 1.00 0.00 H new ATOM 0 HH12 ARG A 208 10.252 9.558 -3.361 1.00 0.00 H new ATOM 0 HH21 ARG A 208 9.391 9.986 -0.046 1.00 0.00 H new ATOM 0 HH22 ARG A 208 10.691 9.848 -1.234 1.00 0.00 H new ATOM 1262 N PRO A 209 8.241 5.266 -2.406 1.00 0.00 N ATOM 1263 CA PRO A 209 9.407 4.627 -3.015 1.00 0.00 C ATOM 1264 C PRO A 209 9.383 3.093 -2.922 1.00 0.00 C ATOM 1265 O PRO A 209 9.895 2.444 -3.838 1.00 0.00 O ATOM 1266 CB PRO A 209 10.630 5.232 -2.318 1.00 0.00 C ATOM 1267 CG PRO A 209 10.092 5.651 -0.951 1.00 0.00 C ATOM 1268 CD PRO A 209 8.669 6.084 -1.291 1.00 0.00 C ATOM 0 HA PRO A 209 9.424 4.818 -4.088 1.00 0.00 H new ATOM 0 HB2 PRO A 209 11.439 4.507 -2.226 1.00 0.00 H new ATOM 0 HB3 PRO A 209 11.027 6.083 -2.871 1.00 0.00 H new ATOM 0 HG2 PRO A 209 10.109 4.828 -0.236 1.00 0.00 H new ATOM 0 HG3 PRO A 209 10.673 6.464 -0.515 1.00 0.00 H new ATOM 0 HD2 PRO A 209 8.008 5.948 -0.435 1.00 0.00 H new ATOM 0 HD3 PRO A 209 8.638 7.142 -1.553 1.00 0.00 H new ATOM 1276 N LYS A 210 8.758 2.479 -1.898 1.00 0.00 N ATOM 1277 CA LYS A 210 8.604 1.012 -1.852 1.00 0.00 C ATOM 1278 C LYS A 210 7.659 0.424 -2.898 1.00 0.00 C ATOM 1279 O LYS A 210 7.769 -0.764 -3.190 1.00 0.00 O ATOM 1280 CB LYS A 210 8.215 0.574 -0.449 1.00 0.00 C ATOM 1281 CG LYS A 210 9.431 0.593 0.466 1.00 0.00 C ATOM 1282 CD LYS A 210 9.103 0.094 1.866 1.00 0.00 C ATOM 1283 CE LYS A 210 8.075 0.914 2.643 1.00 0.00 C ATOM 1284 NZ LYS A 210 8.644 1.542 3.860 1.00 0.00 N1+ ATOM 0 H LYS A 210 8.356 2.970 -1.100 1.00 0.00 H new ATOM 0 HA LYS A 210 9.581 0.605 -2.114 1.00 0.00 H new ATOM 0 HB2 LYS A 210 7.444 1.236 -0.055 1.00 0.00 H new ATOM 0 HB3 LYS A 210 7.789 -0.429 -0.479 1.00 0.00 H new ATOM 0 HG2 LYS A 210 10.217 -0.027 0.036 1.00 0.00 H new ATOM 0 HG3 LYS A 210 9.823 1.608 0.526 1.00 0.00 H new ATOM 0 HD2 LYS A 210 8.739 -0.931 1.789 1.00 0.00 H new ATOM 0 HD3 LYS A 210 10.026 0.062 2.445 1.00 0.00 H new ATOM 0 HE2 LYS A 210 7.670 1.691 1.994 1.00 0.00 H new ATOM 0 HE3 LYS A 210 7.243 0.270 2.927 1.00 0.00 H new ATOM 0 HZ1 LYS A 210 7.874 1.927 4.444 1.00 0.00 H new ATOM 0 HZ2 LYS A 210 9.170 0.829 4.405 1.00 0.00 H new ATOM 0 HZ3 LYS A 210 9.288 2.311 3.585 1.00 0.00 H new ATOM 1298 N ILE A 211 6.788 1.227 -3.507 1.00 0.00 N ATOM 1299 CA ILE A 211 5.901 0.817 -4.605 1.00 0.00 C ATOM 1300 C ILE A 211 6.288 1.435 -5.951 1.00 0.00 C ATOM 1301 O ILE A 211 5.492 1.496 -6.891 1.00 0.00 O ATOM 1302 CB ILE A 211 4.406 0.897 -4.261 1.00 0.00 C ATOM 1303 CG1 ILE A 211 3.876 2.347 -4.289 1.00 0.00 C ATOM 1304 CG2 ILE A 211 4.184 0.294 -2.864 1.00 0.00 C ATOM 1305 CD1 ILE A 211 2.382 2.492 -3.961 1.00 0.00 C ATOM 0 H ILE A 211 6.673 2.207 -3.247 1.00 0.00 H new ATOM 0 HA ILE A 211 6.071 -0.251 -4.738 1.00 0.00 H new ATOM 0 HB ILE A 211 3.856 0.336 -5.016 1.00 0.00 H new ATOM 0 HG12 ILE A 211 4.449 2.943 -3.578 1.00 0.00 H new ATOM 0 HG13 ILE A 211 4.059 2.767 -5.278 1.00 0.00 H new ATOM 0 HG21 ILE A 211 3.125 0.346 -2.609 1.00 0.00 H new ATOM 0 HG22 ILE A 211 4.507 -0.747 -2.861 1.00 0.00 H new ATOM 0 HG23 ILE A 211 4.762 0.855 -2.129 1.00 0.00 H new ATOM 0 HD11 ILE A 211 2.100 3.544 -4.005 1.00 0.00 H new ATOM 0 HD12 ILE A 211 1.794 1.928 -4.685 1.00 0.00 H new ATOM 0 HD13 ILE A 211 2.190 2.107 -2.960 1.00 0.00 H new ATOM 1317 N GLY A 212 7.540 1.873 -6.052 1.00 0.00 N ATOM 1318 CA GLY A 212 8.144 2.359 -7.298 1.00 0.00 C ATOM 1319 C GLY A 212 7.694 3.773 -7.707 1.00 0.00 C ATOM 1320 O GLY A 212 7.901 4.187 -8.851 1.00 0.00 O ATOM 0 H GLY A 212 8.179 1.902 -5.257 1.00 0.00 H new ATOM 0 HA2 GLY A 212 9.229 2.352 -7.190 1.00 0.00 H new ATOM 0 HA3 GLY A 212 7.899 1.665 -8.102 1.00 0.00 H new ATOM 1324 N ASP A 213 7.024 4.486 -6.802 1.00 0.00 N ATOM 1325 CA ASP A 213 6.256 5.703 -7.076 1.00 0.00 C ATOM 1326 C ASP A 213 7.068 7.027 -7.133 1.00 0.00 C ATOM 1327 O ASP A 213 8.279 7.060 -6.897 1.00 0.00 O ATOM 1328 CB ASP A 213 5.055 5.749 -6.126 1.00 0.00 C ATOM 1329 CG ASP A 213 3.789 6.166 -6.881 1.00 0.00 C ATOM 1330 OD1 ASP A 213 3.858 7.015 -7.799 1.00 0.00 O ATOM 1331 OD2 ASP A 213 2.699 5.707 -6.502 1.00 0.00 O ATOM 0 H ASP A 213 7.000 4.222 -5.817 1.00 0.00 H new ATOM 0 HA ASP A 213 5.905 5.635 -8.106 1.00 0.00 H new ATOM 0 HB2 ASP A 213 4.907 4.770 -5.669 1.00 0.00 H new ATOM 0 HB3 ASP A 213 5.251 6.452 -5.316 1.00 0.00 H new ATOM 1391 N PRO A 218 3.059 9.668 -4.099 1.00 0.00 N ATOM 1392 CA PRO A 218 2.707 8.503 -4.868 1.00 0.00 C ATOM 1393 C PRO A 218 1.479 8.800 -5.738 1.00 0.00 C ATOM 1394 O PRO A 218 0.423 9.199 -5.236 1.00 0.00 O ATOM 1395 CB PRO A 218 2.419 7.420 -3.831 1.00 0.00 C ATOM 1396 CG PRO A 218 1.843 8.219 -2.657 1.00 0.00 C ATOM 1397 CD PRO A 218 2.627 9.521 -2.717 1.00 0.00 C ATOM 0 HA PRO A 218 3.496 8.192 -5.553 1.00 0.00 H new ATOM 0 HB2 PRO A 218 1.710 6.681 -4.204 1.00 0.00 H new ATOM 0 HB3 PRO A 218 3.323 6.880 -3.548 1.00 0.00 H new ATOM 0 HG2 PRO A 218 0.772 8.387 -2.769 1.00 0.00 H new ATOM 0 HG3 PRO A 218 1.987 7.703 -1.708 1.00 0.00 H new ATOM 0 HD2 PRO A 218 2.007 10.364 -2.411 1.00 0.00 H new ATOM 0 HD3 PRO A 218 3.482 9.492 -2.042 1.00 0.00 H new ATOM 1405 N LYS A 219 1.579 8.523 -7.038 1.00 0.00 N ATOM 1406 CA LYS A 219 0.418 8.433 -7.931 1.00 0.00 C ATOM 1407 C LYS A 219 -0.535 7.318 -7.492 1.00 0.00 C ATOM 1408 O LYS A 219 -1.744 7.436 -7.674 1.00 0.00 O ATOM 1409 CB LYS A 219 0.912 8.201 -9.366 1.00 0.00 C ATOM 1410 CG LYS A 219 1.719 9.356 -9.986 1.00 0.00 C ATOM 1411 CD LYS A 219 1.013 10.720 -9.985 1.00 0.00 C ATOM 1412 CE LYS A 219 1.176 11.520 -8.683 1.00 0.00 C ATOM 1413 NZ LYS A 219 2.303 12.481 -8.758 1.00 0.00 N1+ ATOM 0 H LYS A 219 2.470 8.354 -7.506 1.00 0.00 H new ATOM 0 HA LYS A 219 -0.142 9.367 -7.886 1.00 0.00 H new ATOM 0 HB2 LYS A 219 1.529 7.303 -9.378 1.00 0.00 H new ATOM 0 HB3 LYS A 219 0.048 8.003 -10.001 1.00 0.00 H new ATOM 0 HG2 LYS A 219 2.661 9.452 -9.445 1.00 0.00 H new ATOM 0 HG3 LYS A 219 1.967 9.094 -11.014 1.00 0.00 H new ATOM 0 HD2 LYS A 219 1.398 11.315 -10.813 1.00 0.00 H new ATOM 0 HD3 LYS A 219 -0.050 10.565 -10.171 1.00 0.00 H new ATOM 0 HE2 LYS A 219 0.253 12.060 -8.471 1.00 0.00 H new ATOM 0 HE3 LYS A 219 1.341 10.832 -7.853 1.00 0.00 H new ATOM 0 HZ1 LYS A 219 2.378 12.999 -7.860 1.00 0.00 H new ATOM 0 HZ2 LYS A 219 3.188 11.965 -8.934 1.00 0.00 H new ATOM 0 HZ3 LYS A 219 2.135 13.154 -9.533 1.00 0.00 H new ATOM 1427 N ARG A 220 -0.011 6.283 -6.828 1.00 0.00 N ATOM 1428 CA ARG A 220 -0.780 5.186 -6.239 1.00 0.00 C ATOM 1429 C ARG A 220 -1.722 5.603 -5.128 1.00 0.00 C ATOM 1430 O ARG A 220 -2.719 4.913 -5.016 1.00 0.00 O ATOM 1431 CB ARG A 220 0.145 4.070 -5.754 1.00 0.00 C ATOM 1432 CG ARG A 220 0.696 3.285 -6.954 1.00 0.00 C ATOM 1433 CD ARG A 220 -0.355 2.361 -7.604 1.00 0.00 C ATOM 1434 NE ARG A 220 -0.381 2.501 -9.073 1.00 0.00 N ATOM 1435 CZ ARG A 220 -1.313 2.072 -9.907 1.00 0.00 C ATOM 1436 NH1 ARG A 220 -2.409 1.490 -9.522 1.00 0.00 N1+ ATOM 1437 NH2 ARG A 220 -1.155 2.198 -11.188 1.00 0.00 N ATOM 0 H ARG A 220 0.994 6.184 -6.682 1.00 0.00 H new ATOM 0 HA ARG A 220 -1.414 4.819 -7.046 1.00 0.00 H new ATOM 0 HB2 ARG A 220 0.967 4.493 -5.177 1.00 0.00 H new ATOM 0 HB3 ARG A 220 -0.399 3.399 -5.089 1.00 0.00 H new ATOM 0 HG2 ARG A 220 1.066 3.987 -7.701 1.00 0.00 H new ATOM 0 HG3 ARG A 220 1.547 2.686 -6.630 1.00 0.00 H new ATOM 0 HD2 ARG A 220 -0.139 1.325 -7.342 1.00 0.00 H new ATOM 0 HD3 ARG A 220 -1.341 2.593 -7.200 1.00 0.00 H new ATOM 0 HE ARG A 220 0.412 2.985 -9.494 1.00 0.00 H new ATOM 0 HH11 ARG A 220 -2.586 1.343 -8.528 1.00 0.00 H new ATOM 0 HH12 ARG A 220 -3.092 1.180 -10.213 1.00 0.00 H new ATOM 0 HH21 ARG A 220 -0.308 2.630 -11.557 1.00 0.00 H new ATOM 0 HH22 ARG A 220 -1.878 1.865 -11.826 1.00 0.00 H new ATOM 1451 N ILE A 221 -1.428 6.628 -4.314 1.00 0.00 N ATOM 1452 CA ILE A 221 -2.100 6.770 -2.991 1.00 0.00 C ATOM 1453 C ILE A 221 -2.746 8.133 -2.628 1.00 0.00 C ATOM 1454 O ILE A 221 -3.891 8.184 -2.165 1.00 0.00 O ATOM 1455 CB ILE A 221 -1.244 6.208 -1.834 1.00 0.00 C ATOM 1456 CG1 ILE A 221 -0.532 4.898 -2.199 1.00 0.00 C ATOM 1457 CG2 ILE A 221 -2.176 5.952 -0.654 1.00 0.00 C ATOM 1458 CD1 ILE A 221 0.197 4.196 -1.048 1.00 0.00 C ATOM 0 H ILE A 221 -0.750 7.359 -4.530 1.00 0.00 H new ATOM 0 HA ILE A 221 -2.980 6.143 -3.133 1.00 0.00 H new ATOM 0 HB ILE A 221 -0.468 6.936 -1.598 1.00 0.00 H new ATOM 0 HG12 ILE A 221 -1.268 4.209 -2.613 1.00 0.00 H new ATOM 0 HG13 ILE A 221 0.190 5.106 -2.989 1.00 0.00 H new ATOM 0 HG21 ILE A 221 -1.602 5.553 0.183 1.00 0.00 H new ATOM 0 HG22 ILE A 221 -2.651 6.887 -0.356 1.00 0.00 H new ATOM 0 HG23 ILE A 221 -2.942 5.233 -0.944 1.00 0.00 H new ATOM 0 HD11 ILE A 221 0.664 3.283 -1.416 1.00 0.00 H new ATOM 0 HD12 ILE A 221 0.963 4.858 -0.645 1.00 0.00 H new ATOM 0 HD13 ILE A 221 -0.517 3.947 -0.263 1.00 0.00 H new ATOM 1579 N GLY A 228 -8.301 11.269 1.976 1.00 0.00 N ATOM 1580 CA GLY A 228 -7.623 10.128 2.607 1.00 0.00 C ATOM 1581 C GLY A 228 -6.366 9.646 1.911 1.00 0.00 C ATOM 1582 O GLY A 228 -5.371 10.352 1.760 1.00 0.00 O ATOM 0 HA2 GLY A 228 -7.368 10.401 3.631 1.00 0.00 H new ATOM 0 HA3 GLY A 228 -8.326 9.297 2.665 1.00 0.00 H new ATOM 1586 N TYR A 229 -6.448 8.395 1.516 1.00 0.00 N ATOM 1587 CA TYR A 229 -5.561 7.644 0.679 1.00 0.00 C ATOM 1588 C TYR A 229 -6.499 6.845 -0.205 1.00 0.00 C ATOM 1589 O TYR A 229 -7.186 5.946 0.268 1.00 0.00 O ATOM 1590 CB TYR A 229 -4.690 6.775 1.591 1.00 0.00 C ATOM 1591 CG TYR A 229 -3.680 7.485 2.468 1.00 0.00 C ATOM 1592 CD1 TYR A 229 -3.064 8.680 2.057 1.00 0.00 C ATOM 1593 CD2 TYR A 229 -3.392 6.952 3.737 1.00 0.00 C ATOM 1594 CE1 TYR A 229 -2.348 9.459 2.977 1.00 0.00 C ATOM 1595 CE2 TYR A 229 -2.600 7.683 4.636 1.00 0.00 C ATOM 1596 CZ TYR A 229 -2.145 8.974 4.280 1.00 0.00 C ATOM 1597 OH TYR A 229 -1.496 9.755 5.172 1.00 0.00 O ATOM 0 H TYR A 229 -7.235 7.819 1.814 1.00 0.00 H new ATOM 0 HA TYR A 229 -4.875 8.229 0.067 1.00 0.00 H new ATOM 0 HB2 TYR A 229 -5.350 6.197 2.237 1.00 0.00 H new ATOM 0 HB3 TYR A 229 -4.152 6.063 0.965 1.00 0.00 H new ATOM 0 HD1 TYR A 229 -3.143 8.999 1.028 1.00 0.00 H new ATOM 0 HD2 TYR A 229 -3.779 5.984 4.019 1.00 0.00 H new ATOM 0 HE1 TYR A 229 -1.956 10.423 2.687 1.00 0.00 H new ATOM 0 HE2 TYR A 229 -2.339 7.262 5.596 1.00 0.00 H new ATOM 0 HH TYR A 229 -1.432 9.287 6.031 1.00 0.00 H new ATOM 1607 N LEU A 230 -6.599 7.219 -1.476 1.00 0.00 N ATOM 1608 CA LEU A 230 -7.156 6.279 -2.447 1.00 0.00 C ATOM 1609 C LEU A 230 -5.971 5.504 -2.955 1.00 0.00 C ATOM 1610 O LEU A 230 -5.124 6.089 -3.627 1.00 0.00 O ATOM 1611 CB LEU A 230 -7.851 6.983 -3.641 1.00 0.00 C ATOM 1612 CG LEU A 230 -7.956 6.085 -4.905 1.00 0.00 C ATOM 1613 CD1 LEU A 230 -8.867 4.889 -4.706 1.00 0.00 C ATOM 1614 CD2 LEU A 230 -8.402 6.801 -6.162 1.00 0.00 C ATOM 0 H LEU A 230 -6.316 8.125 -1.849 1.00 0.00 H new ATOM 0 HA LEU A 230 -7.921 5.661 -1.976 1.00 0.00 H new ATOM 0 HB2 LEU A 230 -8.852 7.293 -3.339 1.00 0.00 H new ATOM 0 HB3 LEU A 230 -7.299 7.889 -3.892 1.00 0.00 H new ATOM 0 HG LEU A 230 -6.926 5.759 -5.047 1.00 0.00 H new ATOM 0 HD11 LEU A 230 -8.900 4.300 -5.623 1.00 0.00 H new ATOM 0 HD12 LEU A 230 -8.485 4.272 -3.892 1.00 0.00 H new ATOM 0 HD13 LEU A 230 -9.871 5.234 -4.460 1.00 0.00 H new ATOM 0 HD21 LEU A 230 -8.445 6.092 -6.989 1.00 0.00 H new ATOM 0 HD22 LEU A 230 -9.390 7.234 -6.003 1.00 0.00 H new ATOM 0 HD23 LEU A 230 -7.693 7.594 -6.400 1.00 0.00 H new ATOM 1626 N PHE A 231 -5.975 4.191 -2.770 1.00 0.00 N ATOM 1627 CA PHE A 231 -5.091 3.401 -3.592 1.00 0.00 C ATOM 1628 C PHE A 231 -5.719 3.194 -4.962 1.00 0.00 C ATOM 1629 O PHE A 231 -6.743 2.535 -5.099 1.00 0.00 O ATOM 1630 CB PHE A 231 -4.679 2.160 -2.864 1.00 0.00 C ATOM 1631 CG PHE A 231 -3.448 1.529 -3.423 1.00 0.00 C ATOM 1632 CD1 PHE A 231 -3.494 0.935 -4.688 1.00 0.00 C ATOM 1633 CD2 PHE A 231 -2.236 1.634 -2.720 1.00 0.00 C ATOM 1634 CE1 PHE A 231 -2.327 0.438 -5.263 1.00 0.00 C ATOM 1635 CE2 PHE A 231 -1.086 1.039 -3.262 1.00 0.00 C ATOM 1636 CZ PHE A 231 -1.145 0.403 -4.511 1.00 0.00 C ATOM 0 H PHE A 231 -6.547 3.680 -2.097 1.00 0.00 H new ATOM 0 HA PHE A 231 -4.154 3.923 -3.786 1.00 0.00 H new ATOM 0 HB2 PHE A 231 -4.510 2.402 -1.815 1.00 0.00 H new ATOM 0 HB3 PHE A 231 -5.496 1.439 -2.898 1.00 0.00 H new ATOM 0 HD1 PHE A 231 -4.432 0.862 -5.218 1.00 0.00 H new ATOM 0 HD2 PHE A 231 -2.190 2.163 -1.780 1.00 0.00 H new ATOM 0 HE1 PHE A 231 -2.333 0.082 -6.282 1.00 0.00 H new ATOM 0 HE2 PHE A 231 -0.154 1.071 -2.717 1.00 0.00 H new ATOM 0 HZ PHE A 231 -0.278 -0.115 -4.894 1.00 0.00 H new ATOM 1646 N VAL A 232 -5.158 3.829 -5.973 1.00 0.00 N ATOM 1647 CA VAL A 232 -5.670 3.847 -7.350 1.00 0.00 C ATOM 1648 C VAL A 232 -5.539 2.474 -8.039 1.00 0.00 C ATOM 1649 O VAL A 232 -4.721 1.634 -7.653 1.00 0.00 O ATOM 1650 CB VAL A 232 -4.989 4.986 -8.147 1.00 0.00 C ATOM 1651 CG1 VAL A 232 -4.884 6.288 -7.335 1.00 0.00 C ATOM 1652 CG2 VAL A 232 -3.635 4.475 -8.618 1.00 0.00 C ATOM 0 H VAL A 232 -4.300 4.370 -5.865 1.00 0.00 H new ATOM 0 HA VAL A 232 -6.740 4.052 -7.320 1.00 0.00 H new ATOM 0 HB VAL A 232 -5.599 5.251 -9.011 1.00 0.00 H new ATOM 0 HG11 VAL A 232 -4.399 7.055 -7.939 1.00 0.00 H new ATOM 0 HG12 VAL A 232 -5.883 6.624 -7.055 1.00 0.00 H new ATOM 0 HG13 VAL A 232 -4.296 6.109 -6.435 1.00 0.00 H new ATOM 0 HG21 VAL A 232 -3.128 5.256 -9.185 1.00 0.00 H new ATOM 0 HG22 VAL A 232 -3.029 4.202 -7.754 1.00 0.00 H new ATOM 0 HG23 VAL A 232 -3.777 3.600 -9.253 1.00 0.00 H new