USER MOD reduce.3.24.130724 H: found=0, std=0, add=541, rem=0, adj=13 USER MOD reduce.3.24.130724 removed 539 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 224 ASN : amide:sc= -0.616 X(o=-1,f=-1.5) USER MOD Set 1.2: A 226 LYS NZ :NH3+ 171:sc= -0.0125 (180deg=-0.0833) USER MOD Set 1.3: A 232 THR OG1 : rot 140:sc= -0.422 USER MOD Set 2.1: A 194 HIS : no HD1:sc= -3.15! C(o=-2.3!,f=-1.8!) USER MOD Set 2.2: A 197 TYR OH : rot 62:sc= 0.867 USER MOD Set 3.1: A 182 HIS : no HD1:sc= 0 X(o=0,f=-0.07) USER MOD Set 3.2: A 186 MET CE :methyl -145:sc= 0 (180deg=0) USER MOD Single : A 180 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 181 GLN : amide:sc= -3.69! C(o=-3.7!,f=-2.9!) USER MOD Single : A 189 SER OG : rot -59:sc= 0.981 USER MOD Single : A 193 LYS NZ :NH3+ -158:sc= -0.0613 (180deg=-0.536) USER MOD Single : A 195 GLN : amide:sc= -0.173 X(o=-0.17,f=-0.12) USER MOD Single : A 196 TYR OH : rot 180:sc= 0 USER MOD Single : A 198 ASN : amide:sc= -2.44! C(o=-2.4!,f=-15!) USER MOD Single : A 200 LYS NZ :NH3+ -159:sc= -0.0703 (180deg=-0.462) USER MOD Single : A 206 THR OG1 : rot -48:sc= 0.765 USER MOD Single : A 207 LYS NZ :NH3+ 161:sc= -0.0457 (180deg=-0.508) USER MOD Single : A 208 GLN : amide:sc= -6.77! C(o=-6.8!,f=-14!) USER MOD Single : A 212 TYR OH : rot 154:sc= -0.564 USER MOD Single : A 214 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 218 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 223 GLN : amide:sc= -15.1! C(o=-15!,f=-2.1!) USER MOD Single : A 229 HIS : no HD1:sc= -0.195 X(o=-0.2,f=-0.2) USER MOD Single : A 230 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 231 ASN : amide:sc= -0.0765 X(o=-0.076,f=-0.076) USER MOD Single : A 236 LYS NZ :NH3+ -138:sc= -2.89 (180deg=-5.72!) USER MOD Single : A 239 TYR OH : rot -9:sc= -0.567! USER MOD ----------------------------------------------------------------- ATOM 69 N ASP A 179 5.788 -6.388 -7.684 1.00 0.00 N ATOM 70 CA ASP A 179 5.124 -5.081 -7.844 1.00 0.00 C ATOM 71 C ASP A 179 4.249 -4.824 -6.618 1.00 0.00 C ATOM 72 O ASP A 179 4.432 -3.871 -5.897 1.00 0.00 O ATOM 73 CB ASP A 179 4.246 -5.138 -9.095 1.00 0.00 C ATOM 74 CG ASP A 179 5.128 -5.053 -10.341 1.00 0.00 C ATOM 75 OD1 ASP A 179 5.652 -3.983 -10.600 1.00 0.00 O ATOM 76 OD2 ASP A 179 5.269 -6.061 -11.012 1.00 0.00 O ATOM 0 HA ASP A 179 5.860 -4.283 -7.942 1.00 0.00 H new ATOM 0 HB2 ASP A 179 3.670 -6.063 -9.106 1.00 0.00 H new ATOM 0 HB3 ASP A 179 3.529 -4.317 -9.087 1.00 0.00 H new ATOM 81 N LYS A 180 3.311 -5.688 -6.368 1.00 0.00 N ATOM 82 CA LYS A 180 2.421 -5.514 -5.182 1.00 0.00 C ATOM 83 C LYS A 180 3.232 -5.490 -3.893 1.00 0.00 C ATOM 84 O LYS A 180 3.126 -4.586 -3.093 1.00 0.00 O ATOM 85 CB LYS A 180 1.455 -6.700 -5.118 1.00 0.00 C ATOM 86 CG LYS A 180 0.607 -6.629 -3.841 1.00 0.00 C ATOM 87 CD LYS A 180 -0.605 -7.557 -3.987 1.00 0.00 C ATOM 88 CE LYS A 180 -1.396 -7.605 -2.675 1.00 0.00 C ATOM 89 NZ LYS A 180 -2.643 -8.397 -2.881 1.00 0.00 N ATOM 0 H LYS A 180 3.118 -6.514 -6.935 1.00 0.00 H new ATOM 0 HA LYS A 180 1.885 -4.570 -5.283 1.00 0.00 H new ATOM 0 HB2 LYS A 180 0.806 -6.697 -5.994 1.00 0.00 H new ATOM 0 HB3 LYS A 180 2.015 -7.635 -5.139 1.00 0.00 H new ATOM 0 HG2 LYS A 180 1.203 -6.924 -2.977 1.00 0.00 H new ATOM 0 HG3 LYS A 180 0.277 -5.605 -3.666 1.00 0.00 H new ATOM 0 HD2 LYS A 180 -1.247 -7.205 -4.794 1.00 0.00 H new ATOM 0 HD3 LYS A 180 -0.274 -8.560 -4.257 1.00 0.00 H new ATOM 0 HE2 LYS A 180 -0.791 -8.056 -1.888 1.00 0.00 H new ATOM 0 HE3 LYS A 180 -1.643 -6.595 -2.348 1.00 0.00 H new ATOM 0 HZ1 LYS A 180 -3.183 -8.432 -1.993 1.00 0.00 H new ATOM 0 HZ2 LYS A 180 -3.221 -7.948 -3.620 1.00 0.00 H new ATOM 0 HZ3 LYS A 180 -2.396 -9.364 -3.174 1.00 0.00 H new ATOM 103 N GLN A 181 4.008 -6.505 -3.673 1.00 0.00 N ATOM 104 CA GLN A 181 4.801 -6.592 -2.424 1.00 0.00 C ATOM 105 C GLN A 181 5.751 -5.396 -2.310 1.00 0.00 C ATOM 106 O GLN A 181 5.850 -4.768 -1.274 1.00 0.00 O ATOM 107 CB GLN A 181 5.595 -7.902 -2.452 1.00 0.00 C ATOM 108 CG GLN A 181 6.202 -8.185 -1.076 1.00 0.00 C ATOM 109 CD GLN A 181 7.475 -7.359 -0.898 1.00 0.00 C ATOM 110 OE1 GLN A 181 8.512 -7.697 -1.432 1.00 0.00 O ATOM 111 NE2 GLN A 181 7.438 -6.275 -0.173 1.00 0.00 N ATOM 0 H GLN A 181 4.129 -7.289 -4.314 1.00 0.00 H new ATOM 0 HA GLN A 181 4.138 -6.575 -1.559 1.00 0.00 H new ATOM 0 HB2 GLN A 181 4.942 -8.724 -2.745 1.00 0.00 H new ATOM 0 HB3 GLN A 181 6.385 -7.840 -3.200 1.00 0.00 H new ATOM 0 HG2 GLN A 181 5.484 -7.939 -0.293 1.00 0.00 H new ATOM 0 HG3 GLN A 181 6.429 -9.247 -0.979 1.00 0.00 H new ATOM 0 HE21 GLN A 181 6.567 -5.991 0.276 1.00 0.00 H new ATOM 0 HE22 GLN A 181 8.280 -5.712 -0.055 1.00 0.00 H new ATOM 120 N HIS A 182 6.431 -5.062 -3.374 1.00 0.00 N ATOM 121 CA HIS A 182 7.360 -3.901 -3.343 1.00 0.00 C ATOM 122 C HIS A 182 6.541 -2.626 -3.204 1.00 0.00 C ATOM 123 O HIS A 182 6.970 -1.656 -2.614 1.00 0.00 O ATOM 124 CB HIS A 182 8.140 -3.850 -4.650 1.00 0.00 C ATOM 125 CG HIS A 182 9.153 -2.748 -4.605 1.00 0.00 C ATOM 126 ND1 HIS A 182 10.100 -2.633 -3.599 1.00 0.00 N ATOM 127 CD2 HIS A 182 9.384 -1.710 -5.460 1.00 0.00 C ATOM 128 CE1 HIS A 182 10.854 -1.554 -3.878 1.00 0.00 C ATOM 129 NE2 HIS A 182 10.459 -0.954 -5.005 1.00 0.00 N ATOM 0 H HIS A 182 6.381 -5.549 -4.269 1.00 0.00 H new ATOM 0 HA HIS A 182 8.051 -3.997 -2.506 1.00 0.00 H new ATOM 0 HB2 HIS A 182 8.638 -4.804 -4.823 1.00 0.00 H new ATOM 0 HB3 HIS A 182 7.456 -3.692 -5.484 1.00 0.00 H new ATOM 0 HD2 HIS A 182 8.817 -1.506 -6.356 1.00 0.00 H new ATOM 0 HE1 HIS A 182 11.677 -1.215 -3.267 1.00 0.00 H new ATOM 0 HE2 HIS A 182 10.859 -0.122 -5.438 1.00 0.00 H new ATOM 137 N VAL A 183 5.363 -2.621 -3.763 1.00 0.00 N ATOM 138 CA VAL A 183 4.505 -1.416 -3.680 1.00 0.00 C ATOM 139 C VAL A 183 4.042 -1.231 -2.239 1.00 0.00 C ATOM 140 O VAL A 183 3.963 -0.125 -1.751 1.00 0.00 O ATOM 141 CB VAL A 183 3.306 -1.592 -4.631 1.00 0.00 C ATOM 142 CG1 VAL A 183 2.187 -0.592 -4.287 1.00 0.00 C ATOM 143 CG2 VAL A 183 3.767 -1.360 -6.090 1.00 0.00 C ATOM 0 H VAL A 183 4.960 -3.405 -4.275 1.00 0.00 H new ATOM 0 HA VAL A 183 5.060 -0.527 -3.980 1.00 0.00 H new ATOM 0 HB VAL A 183 2.919 -2.605 -4.518 1.00 0.00 H new ATOM 0 HG11 VAL A 183 1.350 -0.733 -4.971 1.00 0.00 H new ATOM 0 HG12 VAL A 183 1.852 -0.759 -3.263 1.00 0.00 H new ATOM 0 HG13 VAL A 183 2.566 0.425 -4.383 1.00 0.00 H new ATOM 0 HG21 VAL A 183 2.919 -1.484 -6.764 1.00 0.00 H new ATOM 0 HG22 VAL A 183 4.165 -0.350 -6.190 1.00 0.00 H new ATOM 0 HG23 VAL A 183 4.542 -2.082 -6.346 1.00 0.00 H new ATOM 153 N LEU A 184 3.743 -2.300 -1.544 1.00 0.00 N ATOM 154 CA LEU A 184 3.297 -2.143 -0.138 1.00 0.00 C ATOM 155 C LEU A 184 4.403 -1.432 0.631 1.00 0.00 C ATOM 156 O LEU A 184 4.148 -0.552 1.426 1.00 0.00 O ATOM 157 CB LEU A 184 3.019 -3.518 0.480 1.00 0.00 C ATOM 158 CG LEU A 184 1.740 -4.126 -0.119 1.00 0.00 C ATOM 159 CD1 LEU A 184 1.555 -5.542 0.436 1.00 0.00 C ATOM 160 CD2 LEU A 184 0.513 -3.267 0.249 1.00 0.00 C ATOM 0 H LEU A 184 3.789 -3.259 -1.888 1.00 0.00 H new ATOM 0 HA LEU A 184 2.377 -1.560 -0.095 1.00 0.00 H new ATOM 0 HB2 LEU A 184 3.864 -4.182 0.300 1.00 0.00 H new ATOM 0 HB3 LEU A 184 2.913 -3.423 1.561 1.00 0.00 H new ATOM 0 HG LEU A 184 1.833 -4.157 -1.205 1.00 0.00 H new ATOM 0 HD11 LEU A 184 0.650 -5.982 0.017 1.00 0.00 H new ATOM 0 HD12 LEU A 184 2.415 -6.154 0.165 1.00 0.00 H new ATOM 0 HD13 LEU A 184 1.468 -5.499 1.522 1.00 0.00 H new ATOM 0 HD21 LEU A 184 -0.384 -3.711 -0.182 1.00 0.00 H new ATOM 0 HD22 LEU A 184 0.411 -3.224 1.333 1.00 0.00 H new ATOM 0 HD23 LEU A 184 0.644 -2.259 -0.144 1.00 0.00 H new ATOM 172 N ASP A 185 5.631 -1.784 0.375 1.00 0.00 N ATOM 173 CA ASP A 185 6.751 -1.105 1.076 1.00 0.00 C ATOM 174 C ASP A 185 6.631 0.404 0.848 1.00 0.00 C ATOM 175 O ASP A 185 6.787 1.190 1.759 1.00 0.00 O ATOM 176 CB ASP A 185 8.093 -1.594 0.521 1.00 0.00 C ATOM 177 CG ASP A 185 8.364 -3.026 0.987 1.00 0.00 C ATOM 178 OD1 ASP A 185 7.984 -3.351 2.100 1.00 0.00 O ATOM 179 OD2 ASP A 185 8.962 -3.770 0.227 1.00 0.00 O ATOM 0 H ASP A 185 5.906 -2.510 -0.287 1.00 0.00 H new ATOM 0 HA ASP A 185 6.704 -1.332 2.141 1.00 0.00 H new ATOM 0 HB2 ASP A 185 8.081 -1.554 -0.568 1.00 0.00 H new ATOM 0 HB3 ASP A 185 8.895 -0.936 0.856 1.00 0.00 H new ATOM 184 N MET A 186 6.348 0.810 -0.362 1.00 0.00 N ATOM 185 CA MET A 186 6.213 2.270 -0.648 1.00 0.00 C ATOM 186 C MET A 186 5.066 2.850 0.178 1.00 0.00 C ATOM 187 O MET A 186 5.135 3.967 0.650 1.00 0.00 O ATOM 188 CB MET A 186 5.908 2.481 -2.136 1.00 0.00 C ATOM 189 CG MET A 186 7.083 2.000 -2.987 1.00 0.00 C ATOM 190 SD MET A 186 8.527 3.042 -2.674 1.00 0.00 S ATOM 191 CE MET A 186 9.560 2.359 -3.992 1.00 0.00 C ATOM 0 H MET A 186 6.205 0.196 -1.163 1.00 0.00 H new ATOM 0 HA MET A 186 7.146 2.770 -0.389 1.00 0.00 H new ATOM 0 HB2 MET A 186 5.004 1.938 -2.410 1.00 0.00 H new ATOM 0 HB3 MET A 186 5.717 3.536 -2.330 1.00 0.00 H new ATOM 0 HG2 MET A 186 7.314 0.961 -2.752 1.00 0.00 H new ATOM 0 HG3 MET A 186 6.818 2.036 -4.044 1.00 0.00 H new ATOM 0 HE1 MET A 186 10.600 2.342 -3.667 1.00 0.00 H new ATOM 0 HE2 MET A 186 9.234 1.344 -4.221 1.00 0.00 H new ATOM 0 HE3 MET A 186 9.469 2.979 -4.884 1.00 0.00 H new ATOM 201 N LEU A 187 4.002 2.111 0.346 1.00 0.00 N ATOM 202 CA LEU A 187 2.853 2.646 1.135 1.00 0.00 C ATOM 203 C LEU A 187 3.300 2.892 2.572 1.00 0.00 C ATOM 204 O LEU A 187 2.988 3.908 3.161 1.00 0.00 O ATOM 205 CB LEU A 187 1.704 1.637 1.154 1.00 0.00 C ATOM 206 CG LEU A 187 1.281 1.257 -0.265 1.00 0.00 C ATOM 207 CD1 LEU A 187 0.036 0.376 -0.184 1.00 0.00 C ATOM 208 CD2 LEU A 187 0.970 2.515 -1.085 1.00 0.00 C ATOM 0 H LEU A 187 3.878 1.169 -0.025 1.00 0.00 H new ATOM 0 HA LEU A 187 2.516 3.574 0.673 1.00 0.00 H new ATOM 0 HB2 LEU A 187 2.010 0.743 1.697 1.00 0.00 H new ATOM 0 HB3 LEU A 187 0.854 2.060 1.689 1.00 0.00 H new ATOM 0 HG LEU A 187 2.093 0.718 -0.754 1.00 0.00 H new ATOM 0 HD11 LEU A 187 -0.278 0.097 -1.190 1.00 0.00 H new ATOM 0 HD12 LEU A 187 0.263 -0.523 0.388 1.00 0.00 H new ATOM 0 HD13 LEU A 187 -0.767 0.925 0.307 1.00 0.00 H new ATOM 0 HD21 LEU A 187 0.670 2.228 -2.093 1.00 0.00 H new ATOM 0 HD22 LEU A 187 0.160 3.068 -0.610 1.00 0.00 H new ATOM 0 HD23 LEU A 187 1.858 3.145 -1.136 1.00 0.00 H new ATOM 220 N PHE A 188 4.027 1.974 3.146 1.00 0.00 N ATOM 221 CA PHE A 188 4.479 2.175 4.546 1.00 0.00 C ATOM 222 C PHE A 188 5.278 3.471 4.627 1.00 0.00 C ATOM 223 O PHE A 188 5.101 4.264 5.523 1.00 0.00 O ATOM 224 CB PHE A 188 5.351 0.993 4.997 1.00 0.00 C ATOM 225 CG PHE A 188 4.474 -0.192 5.343 1.00 0.00 C ATOM 226 CD1 PHE A 188 3.797 -0.221 6.567 1.00 0.00 C ATOM 227 CD2 PHE A 188 4.335 -1.260 4.446 1.00 0.00 C ATOM 228 CE1 PHE A 188 2.983 -1.310 6.895 1.00 0.00 C ATOM 229 CE2 PHE A 188 3.522 -2.349 4.773 1.00 0.00 C ATOM 230 CZ PHE A 188 2.847 -2.377 5.998 1.00 0.00 C ATOM 0 H PHE A 188 4.324 1.102 2.709 1.00 0.00 H new ATOM 0 HA PHE A 188 3.611 2.235 5.203 1.00 0.00 H new ATOM 0 HB2 PHE A 188 6.048 0.721 4.205 1.00 0.00 H new ATOM 0 HB3 PHE A 188 5.948 1.280 5.863 1.00 0.00 H new ATOM 0 HD1 PHE A 188 3.903 0.600 7.261 1.00 0.00 H new ATOM 0 HD2 PHE A 188 4.857 -1.241 3.501 1.00 0.00 H new ATOM 0 HE1 PHE A 188 2.460 -1.328 7.840 1.00 0.00 H new ATOM 0 HE2 PHE A 188 3.415 -3.170 4.079 1.00 0.00 H new ATOM 0 HZ PHE A 188 2.222 -3.220 6.252 1.00 0.00 H new ATOM 240 N SER A 189 6.143 3.710 3.688 1.00 0.00 N ATOM 241 CA SER A 189 6.926 4.973 3.728 1.00 0.00 C ATOM 242 C SER A 189 5.954 6.143 3.591 1.00 0.00 C ATOM 243 O SER A 189 6.049 7.140 4.284 1.00 0.00 O ATOM 244 CB SER A 189 7.917 4.985 2.569 1.00 0.00 C ATOM 245 OG SER A 189 7.209 5.169 1.352 1.00 0.00 O ATOM 0 H SER A 189 6.342 3.093 2.901 1.00 0.00 H new ATOM 0 HA SER A 189 7.475 5.054 4.666 1.00 0.00 H new ATOM 0 HB2 SER A 189 8.645 5.785 2.705 1.00 0.00 H new ATOM 0 HB3 SER A 189 8.474 4.049 2.542 1.00 0.00 H new ATOM 0 HG SER A 189 6.565 4.440 1.235 1.00 0.00 H new ATOM 251 N ALA A 190 5.006 6.009 2.706 1.00 0.00 N ATOM 252 CA ALA A 190 4.001 7.085 2.513 1.00 0.00 C ATOM 253 C ALA A 190 3.176 7.235 3.786 1.00 0.00 C ATOM 254 O ALA A 190 3.024 8.319 4.315 1.00 0.00 O ATOM 255 CB ALA A 190 3.071 6.706 1.358 1.00 0.00 C ATOM 0 H ALA A 190 4.886 5.194 2.105 1.00 0.00 H new ATOM 0 HA ALA A 190 4.508 8.023 2.287 1.00 0.00 H new ATOM 0 HB1 ALA A 190 2.331 7.493 1.213 1.00 0.00 H new ATOM 0 HB2 ALA A 190 3.655 6.584 0.446 1.00 0.00 H new ATOM 0 HB3 ALA A 190 2.563 5.770 1.592 1.00 0.00 H new ATOM 261 N PHE A 191 2.637 6.151 4.277 1.00 0.00 N ATOM 262 CA PHE A 191 1.807 6.230 5.512 1.00 0.00 C ATOM 263 C PHE A 191 2.676 6.563 6.717 1.00 0.00 C ATOM 264 O PHE A 191 2.196 7.067 7.712 1.00 0.00 O ATOM 265 CB PHE A 191 1.064 4.909 5.745 1.00 0.00 C ATOM 266 CG PHE A 191 -0.140 4.869 4.839 1.00 0.00 C ATOM 267 CD1 PHE A 191 -1.240 5.675 5.134 1.00 0.00 C ATOM 268 CD2 PHE A 191 -0.147 4.057 3.704 1.00 0.00 C ATOM 269 CE1 PHE A 191 -2.357 5.668 4.299 1.00 0.00 C ATOM 270 CE2 PHE A 191 -1.263 4.046 2.859 1.00 0.00 C ATOM 271 CZ PHE A 191 -2.370 4.855 3.157 1.00 0.00 C ATOM 0 H PHE A 191 2.736 5.218 3.877 1.00 0.00 H new ATOM 0 HA PHE A 191 1.072 7.025 5.381 1.00 0.00 H new ATOM 0 HB2 PHE A 191 1.721 4.064 5.539 1.00 0.00 H new ATOM 0 HB3 PHE A 191 0.756 4.827 6.787 1.00 0.00 H new ATOM 0 HD1 PHE A 191 -1.226 6.306 6.011 1.00 0.00 H new ATOM 0 HD2 PHE A 191 0.708 3.437 3.478 1.00 0.00 H new ATOM 0 HE1 PHE A 191 -3.210 6.288 4.532 1.00 0.00 H new ATOM 0 HE2 PHE A 191 -1.272 3.417 1.981 1.00 0.00 H new ATOM 0 HZ PHE A 191 -3.232 4.851 2.507 1.00 0.00 H new ATOM 281 N GLU A 192 3.946 6.303 6.651 1.00 0.00 N ATOM 282 CA GLU A 192 4.804 6.636 7.813 1.00 0.00 C ATOM 283 C GLU A 192 4.866 8.160 7.944 1.00 0.00 C ATOM 284 O GLU A 192 5.046 8.689 9.024 1.00 0.00 O ATOM 285 CB GLU A 192 6.213 6.059 7.603 1.00 0.00 C ATOM 286 CG GLU A 192 6.254 4.587 8.051 1.00 0.00 C ATOM 287 CD GLU A 192 6.398 4.510 9.571 1.00 0.00 C ATOM 288 OE1 GLU A 192 6.292 5.542 10.209 1.00 0.00 O ATOM 289 OE2 GLU A 192 6.605 3.415 10.071 1.00 0.00 O ATOM 0 H GLU A 192 4.422 5.880 5.854 1.00 0.00 H new ATOM 0 HA GLU A 192 4.391 6.204 8.725 1.00 0.00 H new ATOM 0 HB2 GLU A 192 6.493 6.135 6.552 1.00 0.00 H new ATOM 0 HB3 GLU A 192 6.941 6.640 8.170 1.00 0.00 H new ATOM 0 HG2 GLU A 192 5.344 4.077 7.737 1.00 0.00 H new ATOM 0 HG3 GLU A 192 7.088 4.075 7.571 1.00 0.00 H new ATOM 296 N LYS A 193 4.709 8.879 6.858 1.00 0.00 N ATOM 297 CA LYS A 193 4.757 10.371 6.949 1.00 0.00 C ATOM 298 C LYS A 193 3.371 10.922 7.316 1.00 0.00 C ATOM 299 O LYS A 193 3.258 11.964 7.931 1.00 0.00 O ATOM 300 CB LYS A 193 5.202 10.955 5.606 1.00 0.00 C ATOM 301 CG LYS A 193 6.664 10.578 5.364 1.00 0.00 C ATOM 302 CD LYS A 193 7.129 11.128 4.013 1.00 0.00 C ATOM 303 CE LYS A 193 8.620 10.831 3.829 1.00 0.00 C ATOM 304 NZ LYS A 193 9.418 11.599 4.831 1.00 0.00 N ATOM 0 H LYS A 193 4.552 8.502 5.923 1.00 0.00 H new ATOM 0 HA LYS A 193 5.470 10.656 7.723 1.00 0.00 H new ATOM 0 HB2 LYS A 193 4.575 10.571 4.801 1.00 0.00 H new ATOM 0 HB3 LYS A 193 5.087 12.039 5.609 1.00 0.00 H new ATOM 0 HG2 LYS A 193 7.288 10.978 6.163 1.00 0.00 H new ATOM 0 HG3 LYS A 193 6.777 9.494 5.383 1.00 0.00 H new ATOM 0 HD2 LYS A 193 6.554 10.674 3.206 1.00 0.00 H new ATOM 0 HD3 LYS A 193 6.952 12.203 3.965 1.00 0.00 H new ATOM 0 HE2 LYS A 193 8.804 9.763 3.946 1.00 0.00 H new ATOM 0 HE3 LYS A 193 8.932 11.100 2.820 1.00 0.00 H new ATOM 0 HZ1 LYS A 193 10.396 11.701 4.491 1.00 0.00 H new ATOM 0 HZ2 LYS A 193 8.997 12.541 4.962 1.00 0.00 H new ATOM 0 HZ3 LYS A 193 9.418 11.090 5.738 1.00 0.00 H new ATOM 318 N HIS A 194 2.316 10.229 6.968 1.00 0.00 N ATOM 319 CA HIS A 194 0.949 10.723 7.326 1.00 0.00 C ATOM 320 C HIS A 194 -0.031 9.549 7.396 1.00 0.00 C ATOM 321 O HIS A 194 0.081 8.588 6.677 1.00 0.00 O ATOM 322 CB HIS A 194 0.470 11.740 6.287 1.00 0.00 C ATOM 323 CG HIS A 194 1.309 12.978 6.390 1.00 0.00 C ATOM 324 ND1 HIS A 194 2.190 13.371 5.395 1.00 0.00 N ATOM 325 CD2 HIS A 194 1.421 13.910 7.381 1.00 0.00 C ATOM 326 CE1 HIS A 194 2.792 14.500 5.813 1.00 0.00 C ATOM 327 NE2 HIS A 194 2.357 14.872 7.019 1.00 0.00 N ATOM 0 H HIS A 194 2.340 9.348 6.455 1.00 0.00 H new ATOM 0 HA HIS A 194 0.994 11.207 8.302 1.00 0.00 H new ATOM 0 HB2 HIS A 194 0.544 11.317 5.285 1.00 0.00 H new ATOM 0 HB3 HIS A 194 -0.580 11.982 6.454 1.00 0.00 H new ATOM 0 HD2 HIS A 194 0.866 13.901 8.307 1.00 0.00 H new ATOM 0 HE1 HIS A 194 3.535 15.038 5.243 1.00 0.00 H new ATOM 0 HE2 HIS A 194 2.649 15.687 7.559 1.00 0.00 H new ATOM 335 N GLN A 195 -0.987 9.616 8.273 1.00 0.00 N ATOM 336 CA GLN A 195 -1.967 8.501 8.398 1.00 0.00 C ATOM 337 C GLN A 195 -2.865 8.401 7.157 1.00 0.00 C ATOM 338 O GLN A 195 -3.357 7.337 6.832 1.00 0.00 O ATOM 339 CB GLN A 195 -2.851 8.750 9.626 1.00 0.00 C ATOM 340 CG GLN A 195 -3.756 7.537 9.880 1.00 0.00 C ATOM 341 CD GLN A 195 -2.910 6.332 10.296 1.00 0.00 C ATOM 342 OE1 GLN A 195 -2.515 6.215 11.438 1.00 0.00 O ATOM 343 NE2 GLN A 195 -2.614 5.422 9.407 1.00 0.00 N ATOM 0 H GLN A 195 -1.135 10.397 8.913 1.00 0.00 H new ATOM 0 HA GLN A 195 -1.412 7.569 8.499 1.00 0.00 H new ATOM 0 HB2 GLN A 195 -2.228 8.938 10.500 1.00 0.00 H new ATOM 0 HB3 GLN A 195 -3.459 9.641 9.471 1.00 0.00 H new ATOM 0 HG2 GLN A 195 -4.480 7.770 10.660 1.00 0.00 H new ATOM 0 HG3 GLN A 195 -4.323 7.301 8.979 1.00 0.00 H new ATOM 0 HE21 GLN A 195 -2.946 5.520 8.447 1.00 0.00 H new ATOM 0 HE22 GLN A 195 -2.051 4.614 9.672 1.00 0.00 H new ATOM 352 N TYR A 196 -3.146 9.503 6.501 1.00 0.00 N ATOM 353 CA TYR A 196 -4.090 9.468 5.328 1.00 0.00 C ATOM 354 C TYR A 196 -3.415 9.782 3.982 1.00 0.00 C ATOM 355 O TYR A 196 -2.516 10.595 3.884 1.00 0.00 O ATOM 356 CB TYR A 196 -5.169 10.512 5.585 1.00 0.00 C ATOM 357 CG TYR A 196 -5.942 10.116 6.816 1.00 0.00 C ATOM 358 CD1 TYR A 196 -7.023 9.230 6.719 1.00 0.00 C ATOM 359 CD2 TYR A 196 -5.575 10.644 8.058 1.00 0.00 C ATOM 360 CE1 TYR A 196 -7.739 8.875 7.869 1.00 0.00 C ATOM 361 CE2 TYR A 196 -6.291 10.291 9.206 1.00 0.00 C ATOM 362 CZ TYR A 196 -7.374 9.408 9.110 1.00 0.00 C ATOM 363 OH TYR A 196 -8.084 9.066 10.243 1.00 0.00 O ATOM 0 H TYR A 196 -2.766 10.423 6.723 1.00 0.00 H new ATOM 0 HA TYR A 196 -4.486 8.456 5.248 1.00 0.00 H new ATOM 0 HB2 TYR A 196 -4.718 11.495 5.722 1.00 0.00 H new ATOM 0 HB3 TYR A 196 -5.837 10.584 4.727 1.00 0.00 H new ATOM 0 HD1 TYR A 196 -7.304 8.822 5.759 1.00 0.00 H new ATOM 0 HD2 TYR A 196 -4.739 11.324 8.130 1.00 0.00 H new ATOM 0 HE1 TYR A 196 -8.572 8.191 7.798 1.00 0.00 H new ATOM 0 HE2 TYR A 196 -6.009 10.699 10.166 1.00 0.00 H new ATOM 0 HH TYR A 196 -7.699 9.522 11.020 1.00 0.00 H new ATOM 373 N TYR A 197 -3.902 9.146 2.942 1.00 0.00 N ATOM 374 CA TYR A 197 -3.388 9.374 1.552 1.00 0.00 C ATOM 375 C TYR A 197 -4.524 9.148 0.554 1.00 0.00 C ATOM 376 O TYR A 197 -5.238 8.168 0.632 1.00 0.00 O ATOM 377 CB TYR A 197 -2.222 8.416 1.236 1.00 0.00 C ATOM 378 CG TYR A 197 -0.935 8.993 1.766 1.00 0.00 C ATOM 379 CD1 TYR A 197 -0.566 8.785 3.093 1.00 0.00 C ATOM 380 CD2 TYR A 197 -0.115 9.750 0.918 1.00 0.00 C ATOM 381 CE1 TYR A 197 0.622 9.336 3.577 1.00 0.00 C ATOM 382 CE2 TYR A 197 1.075 10.299 1.402 1.00 0.00 C ATOM 383 CZ TYR A 197 1.445 10.091 2.734 1.00 0.00 C ATOM 384 OH TYR A 197 2.616 10.635 3.219 1.00 0.00 O ATOM 0 H TYR A 197 -4.655 8.460 3.001 1.00 0.00 H new ATOM 0 HA TYR A 197 -3.022 10.398 1.475 1.00 0.00 H new ATOM 0 HB2 TYR A 197 -2.407 7.441 1.686 1.00 0.00 H new ATOM 0 HB3 TYR A 197 -2.147 8.261 0.160 1.00 0.00 H new ATOM 0 HD1 TYR A 197 -1.197 8.199 3.745 1.00 0.00 H new ATOM 0 HD2 TYR A 197 -0.403 9.909 -0.111 1.00 0.00 H new ATOM 0 HE1 TYR A 197 0.907 9.179 4.607 1.00 0.00 H new ATOM 0 HE2 TYR A 197 1.707 10.882 0.749 1.00 0.00 H new ATOM 0 HH TYR A 197 3.215 9.916 3.509 1.00 0.00 H new ATOM 394 N ASN A 198 -4.696 10.041 -0.391 1.00 0.00 N ATOM 395 CA ASN A 198 -5.786 9.859 -1.399 1.00 0.00 C ATOM 396 C ASN A 198 -5.227 9.137 -2.629 1.00 0.00 C ATOM 397 O ASN A 198 -4.037 8.924 -2.752 1.00 0.00 O ATOM 398 CB ASN A 198 -6.375 11.220 -1.805 1.00 0.00 C ATOM 399 CG ASN A 198 -5.376 12.016 -2.641 1.00 0.00 C ATOM 400 OD1 ASN A 198 -4.186 11.798 -2.563 1.00 0.00 O ATOM 401 ND2 ASN A 198 -5.821 12.941 -3.453 1.00 0.00 N ATOM 0 H ASN A 198 -4.132 10.883 -0.507 1.00 0.00 H new ATOM 0 HA ASN A 198 -6.582 9.259 -0.959 1.00 0.00 H new ATOM 0 HB2 ASN A 198 -7.293 11.069 -2.373 1.00 0.00 H new ATOM 0 HB3 ASN A 198 -6.642 11.786 -0.913 1.00 0.00 H new ATOM 0 HD21 ASN A 198 -5.166 13.479 -4.021 1.00 0.00 H new ATOM 0 HD22 ASN A 198 -6.822 13.124 -3.518 1.00 0.00 H new ATOM 408 N LEU A 199 -6.083 8.753 -3.531 1.00 0.00 N ATOM 409 CA LEU A 199 -5.626 8.034 -4.757 1.00 0.00 C ATOM 410 C LEU A 199 -4.604 8.882 -5.535 1.00 0.00 C ATOM 411 O LEU A 199 -3.616 8.373 -6.026 1.00 0.00 O ATOM 412 CB LEU A 199 -6.836 7.785 -5.656 1.00 0.00 C ATOM 413 CG LEU A 199 -7.830 6.836 -4.970 1.00 0.00 C ATOM 414 CD1 LEU A 199 -9.081 6.723 -5.848 1.00 0.00 C ATOM 415 CD2 LEU A 199 -7.206 5.438 -4.786 1.00 0.00 C ATOM 0 H LEU A 199 -7.090 8.906 -3.474 1.00 0.00 H new ATOM 0 HA LEU A 199 -5.157 7.095 -4.463 1.00 0.00 H new ATOM 0 HB2 LEU A 199 -7.327 8.731 -5.886 1.00 0.00 H new ATOM 0 HB3 LEU A 199 -6.510 7.357 -6.604 1.00 0.00 H new ATOM 0 HG LEU A 199 -8.087 7.232 -3.987 1.00 0.00 H new ATOM 0 HD11 LEU A 199 -9.798 6.052 -5.375 1.00 0.00 H new ATOM 0 HD12 LEU A 199 -9.531 7.708 -5.969 1.00 0.00 H new ATOM 0 HD13 LEU A 199 -8.805 6.328 -6.826 1.00 0.00 H new ATOM 0 HD21 LEU A 199 -7.925 4.780 -4.298 1.00 0.00 H new ATOM 0 HD22 LEU A 199 -6.940 5.027 -5.760 1.00 0.00 H new ATOM 0 HD23 LEU A 199 -6.311 5.517 -4.169 1.00 0.00 H new ATOM 427 N LYS A 200 -4.854 10.160 -5.680 1.00 0.00 N ATOM 428 CA LYS A 200 -3.919 11.039 -6.458 1.00 0.00 C ATOM 429 C LYS A 200 -2.527 11.051 -5.829 1.00 0.00 C ATOM 430 O LYS A 200 -1.521 11.018 -6.510 1.00 0.00 O ATOM 431 CB LYS A 200 -4.462 12.476 -6.493 1.00 0.00 C ATOM 432 CG LYS A 200 -3.618 13.354 -7.439 1.00 0.00 C ATOM 433 CD LYS A 200 -4.078 13.156 -8.887 1.00 0.00 C ATOM 434 CE LYS A 200 -3.290 14.086 -9.808 1.00 0.00 C ATOM 435 NZ LYS A 200 -3.628 15.505 -9.506 1.00 0.00 N ATOM 0 H LYS A 200 -5.668 10.636 -5.292 1.00 0.00 H new ATOM 0 HA LYS A 200 -3.846 10.641 -7.470 1.00 0.00 H new ATOM 0 HB2 LYS A 200 -5.500 12.470 -6.824 1.00 0.00 H new ATOM 0 HB3 LYS A 200 -4.450 12.899 -5.489 1.00 0.00 H new ATOM 0 HG2 LYS A 200 -3.715 14.403 -7.158 1.00 0.00 H new ATOM 0 HG3 LYS A 200 -2.563 13.095 -7.345 1.00 0.00 H new ATOM 0 HD2 LYS A 200 -3.929 12.119 -9.188 1.00 0.00 H new ATOM 0 HD3 LYS A 200 -5.145 13.363 -8.972 1.00 0.00 H new ATOM 0 HE2 LYS A 200 -2.221 13.922 -9.676 1.00 0.00 H new ATOM 0 HE3 LYS A 200 -3.521 13.862 -10.849 1.00 0.00 H new ATOM 0 HZ1 LYS A 200 -3.390 16.100 -10.325 1.00 0.00 H new ATOM 0 HZ2 LYS A 200 -4.645 15.584 -9.304 1.00 0.00 H new ATOM 0 HZ3 LYS A 200 -3.085 15.823 -8.678 1.00 0.00 H new ATOM 449 N ASP A 201 -2.449 11.144 -4.541 1.00 0.00 N ATOM 450 CA ASP A 201 -1.108 11.190 -3.904 1.00 0.00 C ATOM 451 C ASP A 201 -0.421 9.833 -4.055 1.00 0.00 C ATOM 452 O ASP A 201 0.769 9.751 -4.277 1.00 0.00 O ATOM 453 CB ASP A 201 -1.259 11.527 -2.419 1.00 0.00 C ATOM 454 CG ASP A 201 -1.710 12.981 -2.258 1.00 0.00 C ATOM 455 OD1 ASP A 201 -1.390 13.782 -3.119 1.00 0.00 O ATOM 456 OD2 ASP A 201 -2.369 13.270 -1.271 1.00 0.00 O ATOM 0 H ASP A 201 -3.244 11.190 -3.903 1.00 0.00 H new ATOM 0 HA ASP A 201 -0.503 11.956 -4.389 1.00 0.00 H new ATOM 0 HB2 ASP A 201 -1.986 10.858 -1.958 1.00 0.00 H new ATOM 0 HB3 ASP A 201 -0.311 11.372 -1.904 1.00 0.00 H new ATOM 461 N LEU A 202 -1.163 8.768 -3.920 1.00 0.00 N ATOM 462 CA LEU A 202 -0.562 7.410 -4.036 1.00 0.00 C ATOM 463 C LEU A 202 0.020 7.185 -5.438 1.00 0.00 C ATOM 464 O LEU A 202 1.061 6.576 -5.587 1.00 0.00 O ATOM 465 CB LEU A 202 -1.636 6.351 -3.753 1.00 0.00 C ATOM 466 CG LEU A 202 -2.077 6.428 -2.282 1.00 0.00 C ATOM 467 CD1 LEU A 202 -3.295 5.519 -2.073 1.00 0.00 C ATOM 468 CD2 LEU A 202 -0.925 5.985 -1.350 1.00 0.00 C ATOM 0 H LEU A 202 -2.166 8.781 -3.733 1.00 0.00 H new ATOM 0 HA LEU A 202 0.246 7.326 -3.309 1.00 0.00 H new ATOM 0 HB2 LEU A 202 -2.494 6.508 -4.407 1.00 0.00 H new ATOM 0 HB3 LEU A 202 -1.245 5.357 -3.972 1.00 0.00 H new ATOM 0 HG LEU A 202 -2.340 7.458 -2.041 1.00 0.00 H new ATOM 0 HD11 LEU A 202 -3.612 5.570 -1.031 1.00 0.00 H new ATOM 0 HD12 LEU A 202 -4.110 5.849 -2.717 1.00 0.00 H new ATOM 0 HD13 LEU A 202 -3.029 4.492 -2.322 1.00 0.00 H new ATOM 0 HD21 LEU A 202 -1.253 6.045 -0.312 1.00 0.00 H new ATOM 0 HD22 LEU A 202 -0.643 4.958 -1.583 1.00 0.00 H new ATOM 0 HD23 LEU A 202 -0.066 6.639 -1.497 1.00 0.00 H new ATOM 480 N VAL A 203 -0.628 7.654 -6.473 1.00 0.00 N ATOM 481 CA VAL A 203 -0.069 7.428 -7.836 1.00 0.00 C ATOM 482 C VAL A 203 1.257 8.177 -7.971 1.00 0.00 C ATOM 483 O VAL A 203 2.188 7.696 -8.588 1.00 0.00 O ATOM 484 CB VAL A 203 -1.054 7.878 -8.917 1.00 0.00 C ATOM 485 CG1 VAL A 203 -2.227 6.896 -8.980 1.00 0.00 C ATOM 486 CG2 VAL A 203 -1.581 9.259 -8.575 1.00 0.00 C ATOM 0 H VAL A 203 -1.504 8.174 -6.435 1.00 0.00 H new ATOM 0 HA VAL A 203 0.104 6.360 -7.973 1.00 0.00 H new ATOM 0 HB VAL A 203 -0.546 7.905 -9.881 1.00 0.00 H new ATOM 0 HG11 VAL A 203 -2.929 7.216 -9.750 1.00 0.00 H new ATOM 0 HG12 VAL A 203 -1.855 5.900 -9.220 1.00 0.00 H new ATOM 0 HG13 VAL A 203 -2.733 6.872 -8.015 1.00 0.00 H new ATOM 0 HG21 VAL A 203 -2.283 9.581 -9.344 1.00 0.00 H new ATOM 0 HG22 VAL A 203 -2.089 9.226 -7.611 1.00 0.00 H new ATOM 0 HG23 VAL A 203 -0.750 9.963 -8.524 1.00 0.00 H new ATOM 496 N ASP A 204 1.370 9.340 -7.383 1.00 0.00 N ATOM 497 CA ASP A 204 2.659 10.084 -7.485 1.00 0.00 C ATOM 498 C ASP A 204 3.758 9.217 -6.874 1.00 0.00 C ATOM 499 O ASP A 204 4.832 9.082 -7.423 1.00 0.00 O ATOM 500 CB ASP A 204 2.569 11.411 -6.715 1.00 0.00 C ATOM 501 CG ASP A 204 3.813 12.254 -7.013 1.00 0.00 C ATOM 502 OD1 ASP A 204 4.713 11.738 -7.657 1.00 0.00 O ATOM 503 OD2 ASP A 204 3.847 13.398 -6.591 1.00 0.00 O ATOM 0 H ASP A 204 0.637 9.801 -6.844 1.00 0.00 H new ATOM 0 HA ASP A 204 2.878 10.303 -8.530 1.00 0.00 H new ATOM 0 HB2 ASP A 204 1.670 11.954 -7.006 1.00 0.00 H new ATOM 0 HB3 ASP A 204 2.493 11.219 -5.645 1.00 0.00 H new ATOM 508 N ILE A 205 3.489 8.617 -5.751 1.00 0.00 N ATOM 509 CA ILE A 205 4.502 7.736 -5.107 1.00 0.00 C ATOM 510 C ILE A 205 4.672 6.468 -5.956 1.00 0.00 C ATOM 511 O ILE A 205 5.694 5.814 -5.918 1.00 0.00 O ATOM 512 CB ILE A 205 4.018 7.361 -3.705 1.00 0.00 C ATOM 513 CG1 ILE A 205 3.678 8.640 -2.932 1.00 0.00 C ATOM 514 CG2 ILE A 205 5.119 6.594 -2.963 1.00 0.00 C ATOM 515 CD1 ILE A 205 3.155 8.284 -1.536 1.00 0.00 C ATOM 0 H ILE A 205 2.606 8.699 -5.247 1.00 0.00 H new ATOM 0 HA ILE A 205 5.458 8.253 -5.032 1.00 0.00 H new ATOM 0 HB ILE A 205 3.133 6.730 -3.783 1.00 0.00 H new ATOM 0 HG12 ILE A 205 4.563 9.270 -2.848 1.00 0.00 H new ATOM 0 HG13 ILE A 205 2.928 9.215 -3.475 1.00 0.00 H new ATOM 0 HG21 ILE A 205 4.769 6.329 -1.965 1.00 0.00 H new ATOM 0 HG22 ILE A 205 5.365 5.686 -3.514 1.00 0.00 H new ATOM 0 HG23 ILE A 205 6.007 7.220 -2.882 1.00 0.00 H new ATOM 0 HD11 ILE A 205 2.916 9.198 -0.993 1.00 0.00 H new ATOM 0 HD12 ILE A 205 2.258 7.672 -1.629 1.00 0.00 H new ATOM 0 HD13 ILE A 205 3.919 7.728 -0.992 1.00 0.00 H new ATOM 527 N THR A 206 3.659 6.108 -6.713 1.00 0.00 N ATOM 528 CA THR A 206 3.733 4.875 -7.558 1.00 0.00 C ATOM 529 C THR A 206 2.984 5.106 -8.877 1.00 0.00 C ATOM 530 O THR A 206 1.784 5.227 -8.908 1.00 0.00 O ATOM 531 CB THR A 206 3.071 3.722 -6.808 1.00 0.00 C ATOM 532 OG1 THR A 206 1.771 4.119 -6.382 1.00 0.00 O ATOM 533 CG2 THR A 206 3.926 3.348 -5.600 1.00 0.00 C ATOM 0 H THR A 206 2.780 6.621 -6.780 1.00 0.00 H new ATOM 0 HA THR A 206 4.776 4.640 -7.769 1.00 0.00 H new ATOM 0 HB THR A 206 2.982 2.857 -7.465 1.00 0.00 H new ATOM 0 HG1 THR A 206 1.822 4.998 -5.952 1.00 0.00 H new ATOM 0 HG21 THR A 206 3.456 2.525 -5.062 1.00 0.00 H new ATOM 0 HG22 THR A 206 4.917 3.043 -5.936 1.00 0.00 H new ATOM 0 HG23 THR A 206 4.017 4.209 -4.938 1.00 0.00 H new ATOM 541 N LYS A 207 3.686 5.163 -9.966 1.00 0.00 N ATOM 542 CA LYS A 207 3.019 5.397 -11.281 1.00 0.00 C ATOM 543 C LYS A 207 2.392 4.104 -11.808 1.00 0.00 C ATOM 544 O LYS A 207 2.192 3.941 -12.994 1.00 0.00 O ATOM 545 CB LYS A 207 4.061 5.913 -12.273 1.00 0.00 C ATOM 546 CG LYS A 207 4.603 7.275 -11.793 1.00 0.00 C ATOM 547 CD LYS A 207 3.703 8.413 -12.298 1.00 0.00 C ATOM 548 CE LYS A 207 4.253 9.755 -11.810 1.00 0.00 C ATOM 549 NZ LYS A 207 5.593 9.993 -12.415 1.00 0.00 N ATOM 0 H LYS A 207 4.700 5.058 -10.009 1.00 0.00 H new ATOM 0 HA LYS A 207 2.223 6.132 -11.156 1.00 0.00 H new ATOM 0 HB2 LYS A 207 4.878 5.197 -12.363 1.00 0.00 H new ATOM 0 HB3 LYS A 207 3.616 6.016 -13.263 1.00 0.00 H new ATOM 0 HG2 LYS A 207 4.648 7.293 -10.704 1.00 0.00 H new ATOM 0 HG3 LYS A 207 5.621 7.418 -12.156 1.00 0.00 H new ATOM 0 HD2 LYS A 207 3.660 8.400 -13.387 1.00 0.00 H new ATOM 0 HD3 LYS A 207 2.684 8.273 -11.937 1.00 0.00 H new ATOM 0 HE2 LYS A 207 3.571 10.560 -12.083 1.00 0.00 H new ATOM 0 HE3 LYS A 207 4.328 9.755 -10.723 1.00 0.00 H new ATOM 0 HZ1 LYS A 207 5.825 11.005 -12.357 1.00 0.00 H new ATOM 0 HZ2 LYS A 207 6.309 9.443 -11.899 1.00 0.00 H new ATOM 0 HZ3 LYS A 207 5.581 9.697 -13.412 1.00 0.00 H new ATOM 563 N GLN A 208 2.073 3.183 -10.943 1.00 0.00 N ATOM 564 CA GLN A 208 1.455 1.911 -11.402 1.00 0.00 C ATOM 565 C GLN A 208 -0.069 2.107 -11.540 1.00 0.00 C ATOM 566 O GLN A 208 -0.650 2.911 -10.838 1.00 0.00 O ATOM 567 CB GLN A 208 1.747 0.819 -10.366 1.00 0.00 C ATOM 568 CG GLN A 208 3.257 0.508 -10.341 1.00 0.00 C ATOM 569 CD GLN A 208 3.994 1.535 -9.474 1.00 0.00 C ATOM 570 OE1 GLN A 208 4.175 2.667 -9.872 1.00 0.00 O ATOM 571 NE2 GLN A 208 4.437 1.181 -8.297 1.00 0.00 N ATOM 0 H GLN A 208 2.214 3.258 -9.936 1.00 0.00 H new ATOM 0 HA GLN A 208 1.867 1.619 -12.368 1.00 0.00 H new ATOM 0 HB2 GLN A 208 1.418 1.145 -9.379 1.00 0.00 H new ATOM 0 HB3 GLN A 208 1.185 -0.083 -10.608 1.00 0.00 H new ATOM 0 HG2 GLN A 208 3.423 -0.496 -9.949 1.00 0.00 H new ATOM 0 HG3 GLN A 208 3.656 0.524 -11.355 1.00 0.00 H new ATOM 0 HE21 GLN A 208 4.286 0.230 -7.960 1.00 0.00 H new ATOM 0 HE22 GLN A 208 4.934 1.856 -7.715 1.00 0.00 H new ATOM 580 N PRO A 209 -0.721 1.388 -12.433 1.00 0.00 N ATOM 581 CA PRO A 209 -2.199 1.509 -12.635 1.00 0.00 C ATOM 582 C PRO A 209 -2.974 1.606 -11.312 1.00 0.00 C ATOM 583 O PRO A 209 -2.779 0.815 -10.413 1.00 0.00 O ATOM 584 CB PRO A 209 -2.562 0.209 -13.361 1.00 0.00 C ATOM 585 CG PRO A 209 -1.335 -0.170 -14.128 1.00 0.00 C ATOM 586 CD PRO A 209 -0.133 0.386 -13.345 1.00 0.00 C ATOM 0 HA PRO A 209 -2.457 2.416 -13.182 1.00 0.00 H new ATOM 0 HB2 PRO A 209 -2.841 -0.572 -12.654 1.00 0.00 H new ATOM 0 HB3 PRO A 209 -3.413 0.354 -14.027 1.00 0.00 H new ATOM 0 HG2 PRO A 209 -1.262 -1.253 -14.231 1.00 0.00 H new ATOM 0 HG3 PRO A 209 -1.365 0.245 -15.136 1.00 0.00 H new ATOM 0 HD2 PRO A 209 0.380 -0.401 -12.793 1.00 0.00 H new ATOM 0 HD3 PRO A 209 0.601 0.838 -14.012 1.00 0.00 H new ATOM 594 N VAL A 210 -3.869 2.547 -11.196 1.00 0.00 N ATOM 595 CA VAL A 210 -4.664 2.665 -9.946 1.00 0.00 C ATOM 596 C VAL A 210 -5.429 1.364 -9.724 1.00 0.00 C ATOM 597 O VAL A 210 -5.501 0.847 -8.626 1.00 0.00 O ATOM 598 CB VAL A 210 -5.646 3.827 -10.074 1.00 0.00 C ATOM 599 CG1 VAL A 210 -4.869 5.121 -10.330 1.00 0.00 C ATOM 600 CG2 VAL A 210 -6.609 3.568 -11.237 1.00 0.00 C ATOM 0 H VAL A 210 -4.083 3.239 -11.914 1.00 0.00 H new ATOM 0 HA VAL A 210 -4.002 2.851 -9.100 1.00 0.00 H new ATOM 0 HB VAL A 210 -6.218 3.920 -9.151 1.00 0.00 H new ATOM 0 HG11 VAL A 210 -5.568 5.953 -10.422 1.00 0.00 H new ATOM 0 HG12 VAL A 210 -4.190 5.308 -9.498 1.00 0.00 H new ATOM 0 HG13 VAL A 210 -4.296 5.025 -11.252 1.00 0.00 H new ATOM 0 HG21 VAL A 210 -7.307 4.400 -11.323 1.00 0.00 H new ATOM 0 HG22 VAL A 210 -6.043 3.471 -12.163 1.00 0.00 H new ATOM 0 HG23 VAL A 210 -7.163 2.647 -11.053 1.00 0.00 H new ATOM 610 N VAL A 211 -6.004 0.831 -10.768 1.00 0.00 N ATOM 611 CA VAL A 211 -6.774 -0.436 -10.634 1.00 0.00 C ATOM 612 C VAL A 211 -5.939 -1.457 -9.863 1.00 0.00 C ATOM 613 O VAL A 211 -6.460 -2.253 -9.115 1.00 0.00 O ATOM 614 CB VAL A 211 -7.106 -0.986 -12.029 1.00 0.00 C ATOM 615 CG1 VAL A 211 -5.809 -1.231 -12.809 1.00 0.00 C ATOM 616 CG2 VAL A 211 -7.877 -2.302 -11.888 1.00 0.00 C ATOM 0 H VAL A 211 -5.973 1.221 -11.710 1.00 0.00 H new ATOM 0 HA VAL A 211 -7.701 -0.244 -10.094 1.00 0.00 H new ATOM 0 HB VAL A 211 -7.718 -0.262 -12.567 1.00 0.00 H new ATOM 0 HG11 VAL A 211 -6.048 -1.621 -13.798 1.00 0.00 H new ATOM 0 HG12 VAL A 211 -5.263 -0.293 -12.911 1.00 0.00 H new ATOM 0 HG13 VAL A 211 -5.193 -1.953 -12.273 1.00 0.00 H new ATOM 0 HG21 VAL A 211 -8.113 -2.693 -12.878 1.00 0.00 H new ATOM 0 HG22 VAL A 211 -7.266 -3.026 -11.348 1.00 0.00 H new ATOM 0 HG23 VAL A 211 -8.801 -2.125 -11.338 1.00 0.00 H new ATOM 626 N TYR A 212 -4.647 -1.429 -10.023 1.00 0.00 N ATOM 627 CA TYR A 212 -3.797 -2.397 -9.268 1.00 0.00 C ATOM 628 C TYR A 212 -3.719 -1.931 -7.809 1.00 0.00 C ATOM 629 O TYR A 212 -3.979 -2.679 -6.889 1.00 0.00 O ATOM 630 CB TYR A 212 -2.396 -2.430 -9.890 1.00 0.00 C ATOM 631 CG TYR A 212 -1.643 -3.661 -9.432 1.00 0.00 C ATOM 632 CD1 TYR A 212 -2.014 -4.925 -9.911 1.00 0.00 C ATOM 633 CD2 TYR A 212 -0.557 -3.538 -8.555 1.00 0.00 C ATOM 634 CE1 TYR A 212 -1.301 -6.063 -9.514 1.00 0.00 C ATOM 635 CE2 TYR A 212 0.157 -4.685 -8.154 1.00 0.00 C ATOM 636 CZ TYR A 212 -0.218 -5.943 -8.639 1.00 0.00 C ATOM 637 OH TYR A 212 0.479 -7.070 -8.260 1.00 0.00 O ATOM 0 H TYR A 212 -4.144 -0.787 -10.636 1.00 0.00 H new ATOM 0 HA TYR A 212 -4.223 -3.399 -9.311 1.00 0.00 H new ATOM 0 HB2 TYR A 212 -2.474 -2.427 -10.977 1.00 0.00 H new ATOM 0 HB3 TYR A 212 -1.845 -1.533 -9.608 1.00 0.00 H new ATOM 0 HD1 TYR A 212 -2.851 -5.021 -10.587 1.00 0.00 H new ATOM 0 HD2 TYR A 212 -0.267 -2.565 -8.187 1.00 0.00 H new ATOM 0 HE1 TYR A 212 -1.589 -7.036 -9.885 1.00 0.00 H new ATOM 0 HE2 TYR A 212 0.991 -4.593 -7.474 1.00 0.00 H new ATOM 0 HH TYR A 212 1.396 -6.822 -8.018 1.00 0.00 H new ATOM 647 N LEU A 213 -3.379 -0.683 -7.607 1.00 0.00 N ATOM 648 CA LEU A 213 -3.290 -0.126 -6.222 1.00 0.00 C ATOM 649 C LEU A 213 -4.655 -0.240 -5.543 1.00 0.00 C ATOM 650 O LEU A 213 -4.760 -0.635 -4.398 1.00 0.00 O ATOM 651 CB LEU A 213 -2.916 1.365 -6.301 1.00 0.00 C ATOM 652 CG LEU A 213 -1.441 1.542 -6.713 1.00 0.00 C ATOM 653 CD1 LEU A 213 -1.250 2.926 -7.344 1.00 0.00 C ATOM 654 CD2 LEU A 213 -0.534 1.441 -5.477 1.00 0.00 C ATOM 0 H LEU A 213 -3.157 -0.020 -8.349 1.00 0.00 H new ATOM 0 HA LEU A 213 -2.539 -0.678 -5.657 1.00 0.00 H new ATOM 0 HB2 LEU A 213 -3.562 1.868 -7.021 1.00 0.00 H new ATOM 0 HB3 LEU A 213 -3.087 1.838 -5.334 1.00 0.00 H new ATOM 0 HG LEU A 213 -1.179 0.761 -7.427 1.00 0.00 H new ATOM 0 HD11 LEU A 213 -0.207 3.052 -7.636 1.00 0.00 H new ATOM 0 HD12 LEU A 213 -1.886 3.015 -8.224 1.00 0.00 H new ATOM 0 HD13 LEU A 213 -1.520 3.696 -6.621 1.00 0.00 H new ATOM 0 HD21 LEU A 213 0.506 1.567 -5.778 1.00 0.00 H new ATOM 0 HD22 LEU A 213 -0.803 2.220 -4.764 1.00 0.00 H new ATOM 0 HD23 LEU A 213 -0.661 0.464 -5.011 1.00 0.00 H new ATOM 666 N LYS A 214 -5.707 0.090 -6.240 1.00 0.00 N ATOM 667 CA LYS A 214 -7.061 -0.005 -5.628 1.00 0.00 C ATOM 668 C LYS A 214 -7.294 -1.434 -5.148 1.00 0.00 C ATOM 669 O LYS A 214 -7.818 -1.661 -4.078 1.00 0.00 O ATOM 670 CB LYS A 214 -8.115 0.358 -6.671 1.00 0.00 C ATOM 671 CG LYS A 214 -8.076 1.862 -6.946 1.00 0.00 C ATOM 672 CD LYS A 214 -9.263 2.223 -7.833 1.00 0.00 C ATOM 673 CE LYS A 214 -9.293 3.733 -8.058 1.00 0.00 C ATOM 674 NZ LYS A 214 -10.631 4.125 -8.578 1.00 0.00 N ATOM 0 H LYS A 214 -5.687 0.421 -7.205 1.00 0.00 H new ATOM 0 HA LYS A 214 -7.133 0.682 -4.785 1.00 0.00 H new ATOM 0 HB2 LYS A 214 -7.933 -0.194 -7.593 1.00 0.00 H new ATOM 0 HB3 LYS A 214 -9.105 0.069 -6.317 1.00 0.00 H new ATOM 0 HG2 LYS A 214 -8.119 2.419 -6.010 1.00 0.00 H new ATOM 0 HG3 LYS A 214 -7.141 2.133 -7.436 1.00 0.00 H new ATOM 0 HD2 LYS A 214 -9.187 1.704 -8.789 1.00 0.00 H new ATOM 0 HD3 LYS A 214 -10.192 1.896 -7.366 1.00 0.00 H new ATOM 0 HE2 LYS A 214 -9.085 4.256 -7.124 1.00 0.00 H new ATOM 0 HE3 LYS A 214 -8.516 4.023 -8.765 1.00 0.00 H new ATOM 0 HZ1 LYS A 214 -10.656 5.153 -8.733 1.00 0.00 H new ATOM 0 HZ2 LYS A 214 -10.811 3.635 -9.478 1.00 0.00 H new ATOM 0 HZ3 LYS A 214 -11.363 3.861 -7.888 1.00 0.00 H new ATOM 688 N GLU A 215 -6.892 -2.401 -5.924 1.00 0.00 N ATOM 689 CA GLU A 215 -7.075 -3.818 -5.505 1.00 0.00 C ATOM 690 C GLU A 215 -6.222 -4.081 -4.265 1.00 0.00 C ATOM 691 O GLU A 215 -6.645 -4.735 -3.332 1.00 0.00 O ATOM 692 CB GLU A 215 -6.648 -4.740 -6.645 1.00 0.00 C ATOM 693 CG GLU A 215 -7.689 -4.670 -7.763 1.00 0.00 C ATOM 694 CD GLU A 215 -7.136 -5.336 -9.024 1.00 0.00 C ATOM 695 OE1 GLU A 215 -5.924 -5.424 -9.141 1.00 0.00 O ATOM 696 OE2 GLU A 215 -7.933 -5.751 -9.849 1.00 0.00 O ATOM 0 H GLU A 215 -6.444 -2.271 -6.831 1.00 0.00 H new ATOM 0 HA GLU A 215 -8.122 -4.010 -5.269 1.00 0.00 H new ATOM 0 HB2 GLU A 215 -5.670 -4.442 -7.023 1.00 0.00 H new ATOM 0 HB3 GLU A 215 -6.552 -5.764 -6.284 1.00 0.00 H new ATOM 0 HG2 GLU A 215 -8.607 -5.167 -7.450 1.00 0.00 H new ATOM 0 HG3 GLU A 215 -7.944 -3.631 -7.971 1.00 0.00 H new ATOM 703 N ILE A 216 -5.031 -3.555 -4.242 1.00 0.00 N ATOM 704 CA ILE A 216 -4.155 -3.746 -3.058 1.00 0.00 C ATOM 705 C ILE A 216 -4.740 -2.960 -1.893 1.00 0.00 C ATOM 706 O ILE A 216 -4.784 -3.423 -0.770 1.00 0.00 O ATOM 707 CB ILE A 216 -2.760 -3.219 -3.383 1.00 0.00 C ATOM 708 CG1 ILE A 216 -2.145 -4.086 -4.483 1.00 0.00 C ATOM 709 CG2 ILE A 216 -1.885 -3.257 -2.130 1.00 0.00 C ATOM 710 CD1 ILE A 216 -0.877 -3.421 -5.012 1.00 0.00 C ATOM 0 H ILE A 216 -4.626 -2.999 -4.996 1.00 0.00 H new ATOM 0 HA ILE A 216 -4.091 -4.802 -2.797 1.00 0.00 H new ATOM 0 HB ILE A 216 -2.827 -2.187 -3.728 1.00 0.00 H new ATOM 0 HG12 ILE A 216 -1.912 -5.076 -4.092 1.00 0.00 H new ATOM 0 HG13 ILE A 216 -2.860 -4.224 -5.294 1.00 0.00 H new ATOM 0 HG21 ILE A 216 -0.891 -2.880 -2.369 1.00 0.00 H new ATOM 0 HG22 ILE A 216 -2.333 -2.635 -1.355 1.00 0.00 H new ATOM 0 HG23 ILE A 216 -1.807 -4.283 -1.772 1.00 0.00 H new ATOM 0 HD11 ILE A 216 -0.441 -4.041 -5.795 1.00 0.00 H new ATOM 0 HD12 ILE A 216 -1.123 -2.441 -5.420 1.00 0.00 H new ATOM 0 HD13 ILE A 216 -0.160 -3.306 -4.199 1.00 0.00 H new ATOM 722 N LEU A 217 -5.203 -1.778 -2.158 1.00 0.00 N ATOM 723 CA LEU A 217 -5.808 -0.965 -1.079 1.00 0.00 C ATOM 724 C LEU A 217 -7.170 -1.568 -0.719 1.00 0.00 C ATOM 725 O LEU A 217 -7.600 -1.536 0.407 1.00 0.00 O ATOM 726 CB LEU A 217 -5.986 0.461 -1.578 1.00 0.00 C ATOM 727 CG LEU A 217 -4.604 1.077 -1.869 1.00 0.00 C ATOM 728 CD1 LEU A 217 -4.771 2.383 -2.663 1.00 0.00 C ATOM 729 CD2 LEU A 217 -3.852 1.356 -0.547 1.00 0.00 C ATOM 0 H LEU A 217 -5.188 -1.339 -3.078 1.00 0.00 H new ATOM 0 HA LEU A 217 -5.167 -0.959 -0.197 1.00 0.00 H new ATOM 0 HB2 LEU A 217 -6.597 0.469 -2.480 1.00 0.00 H new ATOM 0 HB3 LEU A 217 -6.512 1.056 -0.832 1.00 0.00 H new ATOM 0 HG LEU A 217 -4.022 0.370 -2.460 1.00 0.00 H new ATOM 0 HD11 LEU A 217 -3.790 2.814 -2.866 1.00 0.00 H new ATOM 0 HD12 LEU A 217 -5.277 2.174 -3.605 1.00 0.00 H new ATOM 0 HD13 LEU A 217 -5.364 3.089 -2.082 1.00 0.00 H new ATOM 0 HD21 LEU A 217 -2.877 1.791 -0.768 1.00 0.00 H new ATOM 0 HD22 LEU A 217 -4.431 2.052 0.061 1.00 0.00 H new ATOM 0 HD23 LEU A 217 -3.717 0.422 -0.001 1.00 0.00 H new ATOM 741 N LYS A 218 -7.859 -2.114 -1.674 1.00 0.00 N ATOM 742 CA LYS A 218 -9.188 -2.710 -1.365 1.00 0.00 C ATOM 743 C LYS A 218 -9.036 -3.846 -0.349 1.00 0.00 C ATOM 744 O LYS A 218 -9.839 -3.986 0.551 1.00 0.00 O ATOM 745 CB LYS A 218 -9.809 -3.275 -2.638 1.00 0.00 C ATOM 746 CG LYS A 218 -11.212 -3.803 -2.326 1.00 0.00 C ATOM 747 CD LYS A 218 -11.890 -4.273 -3.619 1.00 0.00 C ATOM 748 CE LYS A 218 -11.383 -5.668 -4.007 1.00 0.00 C ATOM 749 NZ LYS A 218 -12.188 -6.174 -5.151 1.00 0.00 N ATOM 0 H LYS A 218 -7.566 -2.175 -2.649 1.00 0.00 H new ATOM 0 HA LYS A 218 -9.828 -1.931 -0.950 1.00 0.00 H new ATOM 0 HB2 LYS A 218 -9.861 -2.502 -3.405 1.00 0.00 H new ATOM 0 HB3 LYS A 218 -9.186 -4.077 -3.035 1.00 0.00 H new ATOM 0 HG2 LYS A 218 -11.150 -4.628 -1.616 1.00 0.00 H new ATOM 0 HG3 LYS A 218 -11.808 -3.021 -1.855 1.00 0.00 H new ATOM 0 HD2 LYS A 218 -12.971 -4.296 -3.484 1.00 0.00 H new ATOM 0 HD3 LYS A 218 -11.684 -3.567 -4.423 1.00 0.00 H new ATOM 0 HE2 LYS A 218 -10.328 -5.623 -4.279 1.00 0.00 H new ATOM 0 HE3 LYS A 218 -11.465 -6.348 -3.159 1.00 0.00 H new ATOM 0 HZ1 LYS A 218 -11.851 -7.120 -5.421 1.00 0.00 H new ATOM 0 HZ2 LYS A 218 -13.189 -6.229 -4.874 1.00 0.00 H new ATOM 0 HZ3 LYS A 218 -12.088 -5.527 -5.959 1.00 0.00 H new ATOM 763 N GLU A 219 -8.036 -4.679 -0.498 1.00 0.00 N ATOM 764 CA GLU A 219 -7.883 -5.816 0.459 1.00 0.00 C ATOM 765 C GLU A 219 -7.365 -5.337 1.822 1.00 0.00 C ATOM 766 O GLU A 219 -7.917 -5.691 2.842 1.00 0.00 O ATOM 767 CB GLU A 219 -6.911 -6.858 -0.114 1.00 0.00 C ATOM 768 CG GLU A 219 -7.569 -7.612 -1.274 1.00 0.00 C ATOM 769 CD GLU A 219 -6.590 -8.653 -1.824 1.00 0.00 C ATOM 770 OE1 GLU A 219 -5.592 -8.903 -1.167 1.00 0.00 O ATOM 771 OE2 GLU A 219 -6.854 -9.181 -2.892 1.00 0.00 O ATOM 0 H GLU A 219 -7.328 -4.622 -1.230 1.00 0.00 H new ATOM 0 HA GLU A 219 -8.867 -6.263 0.601 1.00 0.00 H new ATOM 0 HB2 GLU A 219 -6.001 -6.367 -0.459 1.00 0.00 H new ATOM 0 HB3 GLU A 219 -6.617 -7.560 0.666 1.00 0.00 H new ATOM 0 HG2 GLU A 219 -8.482 -8.100 -0.934 1.00 0.00 H new ATOM 0 HG3 GLU A 219 -7.855 -6.914 -2.061 1.00 0.00 H new ATOM 778 N ILE A 220 -6.308 -4.552 1.862 1.00 0.00 N ATOM 779 CA ILE A 220 -5.765 -4.083 3.190 1.00 0.00 C ATOM 780 C ILE A 220 -6.035 -2.595 3.415 1.00 0.00 C ATOM 781 O ILE A 220 -5.837 -2.087 4.499 1.00 0.00 O ATOM 782 CB ILE A 220 -4.251 -4.336 3.263 1.00 0.00 C ATOM 783 CG1 ILE A 220 -3.513 -3.592 2.132 1.00 0.00 C ATOM 784 CG2 ILE A 220 -3.978 -5.839 3.148 1.00 0.00 C ATOM 785 CD1 ILE A 220 -2.013 -3.515 2.450 1.00 0.00 C ATOM 0 H ILE A 220 -5.800 -4.217 1.043 1.00 0.00 H new ATOM 0 HA ILE A 220 -6.275 -4.649 3.969 1.00 0.00 H new ATOM 0 HB ILE A 220 -3.884 -3.963 4.219 1.00 0.00 H new ATOM 0 HG12 ILE A 220 -3.667 -4.108 1.184 1.00 0.00 H new ATOM 0 HG13 ILE A 220 -3.922 -2.588 2.018 1.00 0.00 H new ATOM 0 HG21 ILE A 220 -2.904 -6.019 3.200 1.00 0.00 H new ATOM 0 HG22 ILE A 220 -4.473 -6.362 3.966 1.00 0.00 H new ATOM 0 HG23 ILE A 220 -4.362 -6.207 2.196 1.00 0.00 H new ATOM 0 HD11 ILE A 220 -1.497 -2.988 1.647 1.00 0.00 H new ATOM 0 HD12 ILE A 220 -1.867 -2.979 3.388 1.00 0.00 H new ATOM 0 HD13 ILE A 220 -1.608 -4.523 2.541 1.00 0.00 H new ATOM 797 N GLY A 221 -6.454 -1.884 2.413 1.00 0.00 N ATOM 798 CA GLY A 221 -6.700 -0.419 2.594 1.00 0.00 C ATOM 799 C GLY A 221 -8.129 -0.151 3.069 1.00 0.00 C ATOM 800 O GLY A 221 -8.917 -1.052 3.284 1.00 0.00 O ATOM 0 H GLY A 221 -6.638 -2.245 1.477 1.00 0.00 H new ATOM 0 HA2 GLY A 221 -5.992 -0.016 3.318 1.00 0.00 H new ATOM 0 HA3 GLY A 221 -6.524 0.101 1.652 1.00 0.00 H new ATOM 804 N VAL A 222 -8.460 1.102 3.215 1.00 0.00 N ATOM 805 CA VAL A 222 -9.828 1.499 3.657 1.00 0.00 C ATOM 806 C VAL A 222 -10.188 2.772 2.894 1.00 0.00 C ATOM 807 O VAL A 222 -9.367 3.303 2.189 1.00 0.00 O ATOM 808 CB VAL A 222 -9.822 1.780 5.166 1.00 0.00 C ATOM 809 CG1 VAL A 222 -11.238 2.150 5.632 1.00 0.00 C ATOM 810 CG2 VAL A 222 -9.339 0.530 5.906 1.00 0.00 C ATOM 0 H VAL A 222 -7.827 1.884 3.043 1.00 0.00 H new ATOM 0 HA VAL A 222 -10.551 0.707 3.460 1.00 0.00 H new ATOM 0 HB VAL A 222 -9.152 2.613 5.381 1.00 0.00 H new ATOM 0 HG11 VAL A 222 -11.228 2.348 6.704 1.00 0.00 H new ATOM 0 HG12 VAL A 222 -11.575 3.040 5.101 1.00 0.00 H new ATOM 0 HG13 VAL A 222 -11.918 1.324 5.422 1.00 0.00 H new ATOM 0 HG21 VAL A 222 -9.332 0.722 6.979 1.00 0.00 H new ATOM 0 HG22 VAL A 222 -10.009 -0.302 5.691 1.00 0.00 H new ATOM 0 HG23 VAL A 222 -8.331 0.279 5.576 1.00 0.00 H new ATOM 820 N GLN A 223 -11.398 3.266 3.008 1.00 0.00 N ATOM 821 CA GLN A 223 -11.779 4.514 2.261 1.00 0.00 C ATOM 822 C GLN A 223 -12.608 5.433 3.162 1.00 0.00 C ATOM 823 O GLN A 223 -13.301 4.988 4.055 1.00 0.00 O ATOM 824 CB GLN A 223 -12.593 4.143 1.009 1.00 0.00 C ATOM 825 CG GLN A 223 -13.058 5.413 0.277 1.00 0.00 C ATOM 826 CD GLN A 223 -11.855 6.293 -0.073 1.00 0.00 C ATOM 827 OE1 GLN A 223 -11.013 5.904 -0.859 1.00 0.00 O ATOM 828 NE2 GLN A 223 -11.737 7.469 0.480 1.00 0.00 N ATOM 0 H GLN A 223 -12.138 2.863 3.583 1.00 0.00 H new ATOM 0 HA GLN A 223 -10.871 5.037 1.959 1.00 0.00 H new ATOM 0 HB2 GLN A 223 -11.986 3.532 0.341 1.00 0.00 H new ATOM 0 HB3 GLN A 223 -13.457 3.543 1.294 1.00 0.00 H new ATOM 0 HG2 GLN A 223 -13.596 5.141 -0.632 1.00 0.00 H new ATOM 0 HG3 GLN A 223 -13.754 5.969 0.905 1.00 0.00 H new ATOM 0 HE21 GLN A 223 -12.443 7.796 1.139 1.00 0.00 H new ATOM 0 HE22 GLN A 223 -10.939 8.062 0.253 1.00 0.00 H new ATOM 837 N ASN A 224 -12.525 6.725 2.938 1.00 0.00 N ATOM 838 CA ASN A 224 -13.289 7.685 3.779 1.00 0.00 C ATOM 839 C ASN A 224 -13.648 8.920 2.953 1.00 0.00 C ATOM 840 O ASN A 224 -12.792 9.602 2.420 1.00 0.00 O ATOM 841 CB ASN A 224 -12.420 8.144 4.957 1.00 0.00 C ATOM 842 CG ASN A 224 -11.592 6.970 5.466 1.00 0.00 C ATOM 843 OD1 ASN A 224 -11.984 6.283 6.387 1.00 0.00 O ATOM 844 ND2 ASN A 224 -10.446 6.715 4.893 1.00 0.00 N ATOM 0 H ASN A 224 -11.957 7.151 2.205 1.00 0.00 H new ATOM 0 HA ASN A 224 -14.192 7.192 4.140 1.00 0.00 H new ATOM 0 HB2 ASN A 224 -11.764 8.957 4.644 1.00 0.00 H new ATOM 0 HB3 ASN A 224 -13.050 8.533 5.757 1.00 0.00 H new ATOM 0 HD21 ASN A 224 -9.875 5.935 5.219 1.00 0.00 H new ATOM 0 HD22 ASN A 224 -10.122 7.296 4.120 1.00 0.00 H new ATOM 851 N VAL A 225 -14.905 9.224 2.884 1.00 0.00 N ATOM 852 CA VAL A 225 -15.360 10.435 2.149 1.00 0.00 C ATOM 853 C VAL A 225 -15.549 11.534 3.188 1.00 0.00 C ATOM 854 O VAL A 225 -15.966 11.269 4.300 1.00 0.00 O ATOM 855 CB VAL A 225 -16.699 10.152 1.479 1.00 0.00 C ATOM 856 CG1 VAL A 225 -16.541 9.042 0.434 1.00 0.00 C ATOM 857 CG2 VAL A 225 -17.694 9.720 2.554 1.00 0.00 C ATOM 0 H VAL A 225 -15.653 8.678 3.312 1.00 0.00 H new ATOM 0 HA VAL A 225 -14.637 10.724 1.386 1.00 0.00 H new ATOM 0 HB VAL A 225 -17.060 11.049 0.975 1.00 0.00 H new ATOM 0 HG11 VAL A 225 -17.504 8.848 -0.039 1.00 0.00 H new ATOM 0 HG12 VAL A 225 -15.822 9.355 -0.323 1.00 0.00 H new ATOM 0 HG13 VAL A 225 -16.185 8.133 0.919 1.00 0.00 H new ATOM 0 HG21 VAL A 225 -18.660 9.513 2.094 1.00 0.00 H new ATOM 0 HG22 VAL A 225 -17.327 8.821 3.049 1.00 0.00 H new ATOM 0 HG23 VAL A 225 -17.806 10.518 3.288 1.00 0.00 H new ATOM 867 N LYS A 226 -15.219 12.747 2.859 1.00 0.00 N ATOM 868 CA LYS A 226 -15.344 13.863 3.848 1.00 0.00 C ATOM 869 C LYS A 226 -16.183 15.001 3.263 1.00 0.00 C ATOM 870 O LYS A 226 -16.750 14.874 2.200 1.00 0.00 O ATOM 871 CB LYS A 226 -13.932 14.327 4.175 1.00 0.00 C ATOM 872 CG LYS A 226 -13.161 13.107 4.699 1.00 0.00 C ATOM 873 CD LYS A 226 -11.736 13.500 5.134 1.00 0.00 C ATOM 874 CE LYS A 226 -11.288 12.648 6.331 1.00 0.00 C ATOM 875 NZ LYS A 226 -11.180 11.223 5.907 1.00 0.00 N ATOM 0 H LYS A 226 -14.865 13.022 1.943 1.00 0.00 H new ATOM 0 HA LYS A 226 -15.851 13.532 4.754 1.00 0.00 H new ATOM 0 HB2 LYS A 226 -13.447 14.737 3.289 1.00 0.00 H new ATOM 0 HB3 LYS A 226 -13.951 15.120 4.923 1.00 0.00 H new ATOM 0 HG2 LYS A 226 -13.695 12.670 5.543 1.00 0.00 H new ATOM 0 HG3 LYS A 226 -13.111 12.343 3.923 1.00 0.00 H new ATOM 0 HD2 LYS A 226 -11.044 13.363 4.303 1.00 0.00 H new ATOM 0 HD3 LYS A 226 -11.709 14.556 5.401 1.00 0.00 H new ATOM 0 HE2 LYS A 226 -10.327 13.002 6.705 1.00 0.00 H new ATOM 0 HE3 LYS A 226 -12.003 12.743 7.148 1.00 0.00 H new ATOM 0 HZ1 LYS A 226 -10.734 10.668 6.665 1.00 0.00 H new ATOM 0 HZ2 LYS A 226 -12.130 10.845 5.715 1.00 0.00 H new ATOM 0 HZ3 LYS A 226 -10.601 11.160 5.045 1.00 0.00 H new ATOM 889 N GLY A 227 -16.296 16.099 3.973 1.00 0.00 N ATOM 890 CA GLY A 227 -17.125 17.253 3.487 1.00 0.00 C ATOM 891 C GLY A 227 -17.025 17.400 1.959 1.00 0.00 C ATOM 892 O GLY A 227 -17.911 16.984 1.237 1.00 0.00 O ATOM 0 H GLY A 227 -15.846 16.248 4.876 1.00 0.00 H new ATOM 0 HA2 GLY A 227 -18.166 17.104 3.774 1.00 0.00 H new ATOM 0 HA3 GLY A 227 -16.791 18.173 3.967 1.00 0.00 H new ATOM 896 N ILE A 228 -15.960 17.966 1.452 1.00 0.00 N ATOM 897 CA ILE A 228 -15.835 18.104 -0.032 1.00 0.00 C ATOM 898 C ILE A 228 -15.634 16.713 -0.650 1.00 0.00 C ATOM 899 O ILE A 228 -15.286 16.581 -1.804 1.00 0.00 O ATOM 900 CB ILE A 228 -14.663 19.037 -0.390 1.00 0.00 C ATOM 901 CG1 ILE A 228 -13.349 18.446 0.126 1.00 0.00 C ATOM 902 CG2 ILE A 228 -14.887 20.418 0.239 1.00 0.00 C ATOM 903 CD1 ILE A 228 -12.181 19.367 -0.245 1.00 0.00 C ATOM 0 H ILE A 228 -15.179 18.335 1.994 1.00 0.00 H new ATOM 0 HA ILE A 228 -16.746 18.546 -0.435 1.00 0.00 H new ATOM 0 HB ILE A 228 -14.609 19.138 -1.474 1.00 0.00 H new ATOM 0 HG12 ILE A 228 -13.396 18.322 1.208 1.00 0.00 H new ATOM 0 HG13 ILE A 228 -13.193 17.456 -0.302 1.00 0.00 H new ATOM 0 HG21 ILE A 228 -14.055 21.074 -0.017 1.00 0.00 H new ATOM 0 HG22 ILE A 228 -15.816 20.844 -0.141 1.00 0.00 H new ATOM 0 HG23 ILE A 228 -14.950 20.318 1.323 1.00 0.00 H new ATOM 0 HD11 ILE A 228 -11.249 18.940 0.125 1.00 0.00 H new ATOM 0 HD12 ILE A 228 -12.128 19.469 -1.329 1.00 0.00 H new ATOM 0 HD13 ILE A 228 -12.334 20.348 0.204 1.00 0.00 H new ATOM 915 N HIS A 229 -15.853 15.679 0.131 1.00 0.00 N ATOM 916 CA HIS A 229 -15.694 14.274 -0.361 1.00 0.00 C ATOM 917 C HIS A 229 -14.222 13.996 -0.625 1.00 0.00 C ATOM 918 O HIS A 229 -13.833 13.642 -1.722 1.00 0.00 O ATOM 919 CB HIS A 229 -16.492 14.057 -1.652 1.00 0.00 C ATOM 920 CG HIS A 229 -17.868 14.650 -1.519 1.00 0.00 C ATOM 921 ND1 HIS A 229 -18.782 14.219 -0.569 1.00 0.00 N ATOM 922 CD2 HIS A 229 -18.500 15.635 -2.231 1.00 0.00 C ATOM 923 CE1 HIS A 229 -19.907 14.941 -0.737 1.00 0.00 C ATOM 924 NE2 HIS A 229 -19.787 15.818 -1.736 1.00 0.00 N ATOM 0 H HIS A 229 -16.141 15.753 1.107 1.00 0.00 H new ATOM 0 HA HIS A 229 -16.072 13.593 0.401 1.00 0.00 H new ATOM 0 HB2 HIS A 229 -15.970 14.516 -2.492 1.00 0.00 H new ATOM 0 HB3 HIS A 229 -16.567 12.991 -1.867 1.00 0.00 H new ATOM 0 HD2 HIS A 229 -18.065 16.186 -3.052 1.00 0.00 H new ATOM 0 HE1 HIS A 229 -20.797 14.824 -0.137 1.00 0.00 H new ATOM 0 HE2 HIS A 229 -20.489 16.481 -2.066 1.00 0.00 H new ATOM 932 N LYS A 230 -13.388 14.153 0.367 1.00 0.00 N ATOM 933 CA LYS A 230 -11.942 13.892 0.152 1.00 0.00 C ATOM 934 C LYS A 230 -11.695 12.389 0.180 1.00 0.00 C ATOM 935 O LYS A 230 -11.987 11.716 1.148 1.00 0.00 O ATOM 936 CB LYS A 230 -11.123 14.562 1.255 1.00 0.00 C ATOM 937 CG LYS A 230 -11.309 16.077 1.180 1.00 0.00 C ATOM 938 CD LYS A 230 -10.289 16.766 2.093 1.00 0.00 C ATOM 939 CE LYS A 230 -10.564 16.391 3.552 1.00 0.00 C ATOM 940 NZ LYS A 230 -9.904 17.378 4.453 1.00 0.00 N ATOM 0 H LYS A 230 -13.645 14.448 1.309 1.00 0.00 H new ATOM 0 HA LYS A 230 -11.641 14.299 -0.814 1.00 0.00 H new ATOM 0 HB2 LYS A 230 -11.439 14.194 2.231 1.00 0.00 H new ATOM 0 HB3 LYS A 230 -10.069 14.309 1.145 1.00 0.00 H new ATOM 0 HG2 LYS A 230 -11.182 16.419 0.153 1.00 0.00 H new ATOM 0 HG3 LYS A 230 -12.322 16.345 1.482 1.00 0.00 H new ATOM 0 HD2 LYS A 230 -9.278 16.467 1.815 1.00 0.00 H new ATOM 0 HD3 LYS A 230 -10.347 17.847 1.968 1.00 0.00 H new ATOM 0 HE2 LYS A 230 -11.638 16.375 3.738 1.00 0.00 H new ATOM 0 HE3 LYS A 230 -10.190 15.388 3.757 1.00 0.00 H new ATOM 0 HZ1 LYS A 230 -10.091 17.123 5.444 1.00 0.00 H new ATOM 0 HZ2 LYS A 230 -8.878 17.373 4.282 1.00 0.00 H new ATOM 0 HZ3 LYS A 230 -10.282 18.328 4.263 1.00 0.00 H new ATOM 954 N ASN A 231 -11.154 11.863 -0.879 1.00 0.00 N ATOM 955 CA ASN A 231 -10.877 10.405 -0.929 1.00 0.00 C ATOM 956 C ASN A 231 -9.610 10.118 -0.125 1.00 0.00 C ATOM 957 O ASN A 231 -8.548 10.576 -0.476 1.00 0.00 O ATOM 958 CB ASN A 231 -10.646 9.996 -2.390 1.00 0.00 C ATOM 959 CG ASN A 231 -11.640 10.733 -3.288 1.00 0.00 C ATOM 960 OD1 ASN A 231 -12.831 10.518 -3.204 1.00 0.00 O ATOM 961 ND2 ASN A 231 -11.194 11.620 -4.138 1.00 0.00 N ATOM 0 H ASN A 231 -10.891 12.383 -1.716 1.00 0.00 H new ATOM 0 HA ASN A 231 -11.716 9.847 -0.514 1.00 0.00 H new ATOM 0 HB2 ASN A 231 -9.625 10.233 -2.688 1.00 0.00 H new ATOM 0 HB3 ASN A 231 -10.768 8.919 -2.501 1.00 0.00 H new ATOM 0 HD21 ASN A 231 -11.847 12.132 -4.731 1.00 0.00 H new ATOM 0 HD22 ASN A 231 -10.193 11.801 -4.208 1.00 0.00 H new ATOM 968 N THR A 232 -9.699 9.366 0.944 1.00 0.00 N ATOM 969 CA THR A 232 -8.468 9.062 1.746 1.00 0.00 C ATOM 970 C THR A 232 -8.420 7.569 2.050 1.00 0.00 C ATOM 971 O THR A 232 -9.410 6.970 2.420 1.00 0.00 O ATOM 972 CB THR A 232 -8.507 9.836 3.060 1.00 0.00 C ATOM 973 OG1 THR A 232 -9.650 9.448 3.802 1.00 0.00 O ATOM 974 CG2 THR A 232 -8.564 11.332 2.770 1.00 0.00 C ATOM 0 H THR A 232 -10.562 8.951 1.296 1.00 0.00 H new ATOM 0 HA THR A 232 -7.586 9.354 1.176 1.00 0.00 H new ATOM 0 HB THR A 232 -7.610 9.617 3.639 1.00 0.00 H new ATOM 0 HG1 THR A 232 -9.415 9.377 4.751 1.00 0.00 H new ATOM 0 HG21 THR A 232 -8.592 11.884 3.710 1.00 0.00 H new ATOM 0 HG22 THR A 232 -7.681 11.626 2.202 1.00 0.00 H new ATOM 0 HG23 THR A 232 -9.460 11.556 2.191 1.00 0.00 H new ATOM 982 N TRP A 233 -7.265 6.961 1.886 1.00 0.00 N ATOM 983 CA TRP A 233 -7.125 5.497 2.149 1.00 0.00 C ATOM 984 C TRP A 233 -6.204 5.260 3.344 1.00 0.00 C ATOM 985 O TRP A 233 -5.317 6.042 3.618 1.00 0.00 O ATOM 986 CB TRP A 233 -6.541 4.810 0.911 1.00 0.00 C ATOM 987 CG TRP A 233 -7.555 4.809 -0.188 1.00 0.00 C ATOM 988 CD1 TRP A 233 -7.828 5.853 -1.005 1.00 0.00 C ATOM 989 CD2 TRP A 233 -8.435 3.725 -0.598 1.00 0.00 C ATOM 990 NE1 TRP A 233 -8.822 5.475 -1.895 1.00 0.00 N ATOM 991 CE2 TRP A 233 -9.231 4.170 -1.680 1.00 0.00 C ATOM 992 CE3 TRP A 233 -8.620 2.409 -0.135 1.00 0.00 C ATOM 993 CZ2 TRP A 233 -10.175 3.333 -2.284 1.00 0.00 C ATOM 994 CZ3 TRP A 233 -9.567 1.567 -0.737 1.00 0.00 C ATOM 995 CH2 TRP A 233 -10.345 2.027 -1.808 1.00 0.00 C ATOM 0 H TRP A 233 -6.410 7.424 1.579 1.00 0.00 H new ATOM 0 HA TRP A 233 -8.108 5.082 2.372 1.00 0.00 H new ATOM 0 HB2 TRP A 233 -5.639 5.329 0.587 1.00 0.00 H new ATOM 0 HB3 TRP A 233 -6.251 3.787 1.153 1.00 0.00 H new ATOM 0 HD1 TRP A 233 -7.350 6.821 -0.970 1.00 0.00 H new ATOM 0 HE1 TRP A 233 -9.205 6.083 -2.619 1.00 0.00 H new ATOM 0 HE3 TRP A 233 -8.028 2.044 0.691 1.00 0.00 H new ATOM 0 HZ2 TRP A 233 -10.769 3.692 -3.112 1.00 0.00 H new ATOM 0 HZ3 TRP A 233 -9.697 0.559 -0.373 1.00 0.00 H new ATOM 0 HH2 TRP A 233 -11.075 1.375 -2.266 1.00 0.00 H new ATOM 1006 N GLU A 234 -6.410 4.175 4.057 1.00 0.00 N ATOM 1007 CA GLU A 234 -5.542 3.858 5.239 1.00 0.00 C ATOM 1008 C GLU A 234 -5.247 2.358 5.250 1.00 0.00 C ATOM 1009 O GLU A 234 -6.125 1.549 5.033 1.00 0.00 O ATOM 1010 CB GLU A 234 -6.266 4.203 6.544 1.00 0.00 C ATOM 1011 CG GLU A 234 -6.501 5.709 6.640 1.00 0.00 C ATOM 1012 CD GLU A 234 -7.221 6.022 7.954 1.00 0.00 C ATOM 1013 OE1 GLU A 234 -8.406 5.741 8.037 1.00 0.00 O ATOM 1014 OE2 GLU A 234 -6.581 6.548 8.848 1.00 0.00 O ATOM 0 H GLU A 234 -7.145 3.493 3.870 1.00 0.00 H new ATOM 0 HA GLU A 234 -4.624 4.441 5.163 1.00 0.00 H new ATOM 0 HB2 GLU A 234 -7.219 3.676 6.589 1.00 0.00 H new ATOM 0 HB3 GLU A 234 -5.675 3.866 7.395 1.00 0.00 H new ATOM 0 HG2 GLU A 234 -5.551 6.241 6.596 1.00 0.00 H new ATOM 0 HG3 GLU A 234 -7.097 6.051 5.794 1.00 0.00 H new ATOM 1021 N LEU A 235 -4.032 1.971 5.524 1.00 0.00 N ATOM 1022 CA LEU A 235 -3.726 0.513 5.563 1.00 0.00 C ATOM 1023 C LEU A 235 -4.448 -0.090 6.767 1.00 0.00 C ATOM 1024 O LEU A 235 -4.087 0.158 7.899 1.00 0.00 O ATOM 1025 CB LEU A 235 -2.218 0.299 5.721 1.00 0.00 C ATOM 1026 CG LEU A 235 -1.471 0.869 4.508 1.00 0.00 C ATOM 1027 CD1 LEU A 235 0.037 0.740 4.744 1.00 0.00 C ATOM 1028 CD2 LEU A 235 -1.857 0.098 3.232 1.00 0.00 C ATOM 0 H LEU A 235 -3.247 2.592 5.720 1.00 0.00 H new ATOM 0 HA LEU A 235 -4.054 0.038 4.638 1.00 0.00 H new ATOM 0 HB2 LEU A 235 -1.868 0.783 6.633 1.00 0.00 H new ATOM 0 HB3 LEU A 235 -2.003 -0.765 5.822 1.00 0.00 H new ATOM 0 HG LEU A 235 -1.742 1.917 4.381 1.00 0.00 H new ATOM 0 HD11 LEU A 235 0.575 1.143 3.886 1.00 0.00 H new ATOM 0 HD12 LEU A 235 0.314 1.296 5.640 1.00 0.00 H new ATOM 0 HD13 LEU A 235 0.296 -0.311 4.874 1.00 0.00 H new ATOM 0 HD21 LEU A 235 -1.320 0.513 2.379 1.00 0.00 H new ATOM 0 HD22 LEU A 235 -1.595 -0.954 3.349 1.00 0.00 H new ATOM 0 HD23 LEU A 235 -2.930 0.188 3.063 1.00 0.00 H new ATOM 1040 N LYS A 236 -5.469 -0.871 6.537 1.00 0.00 N ATOM 1041 CA LYS A 236 -6.216 -1.478 7.677 1.00 0.00 C ATOM 1042 C LYS A 236 -5.244 -2.381 8.478 1.00 0.00 C ATOM 1043 O LYS A 236 -4.785 -3.384 7.965 1.00 0.00 O ATOM 1044 CB LYS A 236 -7.376 -2.320 7.108 1.00 0.00 C ATOM 1045 CG LYS A 236 -8.436 -2.574 8.190 1.00 0.00 C ATOM 1046 CD LYS A 236 -9.760 -3.035 7.553 1.00 0.00 C ATOM 1047 CE LYS A 236 -9.605 -4.422 6.918 1.00 0.00 C ATOM 1048 NZ LYS A 236 -8.804 -4.325 5.662 1.00 0.00 N ATOM 0 H LYS A 236 -5.818 -1.115 5.610 1.00 0.00 H new ATOM 0 HA LYS A 236 -6.617 -0.707 8.335 1.00 0.00 H new ATOM 0 HB2 LYS A 236 -7.828 -1.803 6.262 1.00 0.00 H new ATOM 0 HB3 LYS A 236 -6.994 -3.270 6.734 1.00 0.00 H new ATOM 0 HG2 LYS A 236 -8.078 -3.332 8.887 1.00 0.00 H new ATOM 0 HG3 LYS A 236 -8.601 -1.664 8.766 1.00 0.00 H new ATOM 0 HD2 LYS A 236 -10.543 -3.062 8.311 1.00 0.00 H new ATOM 0 HD3 LYS A 236 -10.074 -2.317 6.796 1.00 0.00 H new ATOM 0 HE2 LYS A 236 -9.116 -5.099 7.619 1.00 0.00 H new ATOM 0 HE3 LYS A 236 -10.587 -4.843 6.701 1.00 0.00 H new ATOM 0 HZ1 LYS A 236 -9.233 -4.926 4.929 1.00 0.00 H new ATOM 0 HZ2 LYS A 236 -8.789 -3.338 5.335 1.00 0.00 H new ATOM 0 HZ3 LYS A 236 -7.831 -4.644 5.845 1.00 0.00 H new ATOM 1062 N PRO A 237 -4.912 -2.044 9.713 1.00 0.00 N ATOM 1063 CA PRO A 237 -3.966 -2.861 10.535 1.00 0.00 C ATOM 1064 C PRO A 237 -4.665 -4.024 11.242 1.00 0.00 C ATOM 1065 O PRO A 237 -4.076 -4.737 12.030 1.00 0.00 O ATOM 1066 CB PRO A 237 -3.437 -1.855 11.556 1.00 0.00 C ATOM 1067 CG PRO A 237 -4.569 -0.898 11.782 1.00 0.00 C ATOM 1068 CD PRO A 237 -5.390 -0.866 10.476 1.00 0.00 C ATOM 0 HA PRO A 237 -3.189 -3.326 9.928 1.00 0.00 H new ATOM 0 HB2 PRO A 237 -3.147 -2.349 12.483 1.00 0.00 H new ATOM 0 HB3 PRO A 237 -2.553 -1.339 11.180 1.00 0.00 H new ATOM 0 HG2 PRO A 237 -5.187 -1.221 12.620 1.00 0.00 H new ATOM 0 HG3 PRO A 237 -4.193 0.095 12.027 1.00 0.00 H new ATOM 0 HD2 PRO A 237 -6.459 -0.930 10.677 1.00 0.00 H new ATOM 0 HD3 PRO A 237 -5.224 0.059 9.924 1.00 0.00 H new ATOM 1076 N GLU A 238 -5.927 -4.177 11.002 1.00 0.00 N ATOM 1077 CA GLU A 238 -6.710 -5.241 11.687 1.00 0.00 C ATOM 1078 C GLU A 238 -6.035 -6.617 11.578 1.00 0.00 C ATOM 1079 O GLU A 238 -5.984 -7.347 12.548 1.00 0.00 O ATOM 1080 CB GLU A 238 -8.100 -5.324 11.050 1.00 0.00 C ATOM 1081 CG GLU A 238 -8.916 -4.077 11.410 1.00 0.00 C ATOM 1082 CD GLU A 238 -9.265 -4.093 12.900 1.00 0.00 C ATOM 1083 OE1 GLU A 238 -10.014 -4.967 13.304 1.00 0.00 O ATOM 1084 OE2 GLU A 238 -8.779 -3.226 13.610 1.00 0.00 O ATOM 0 H GLU A 238 -6.463 -3.604 10.351 1.00 0.00 H new ATOM 0 HA GLU A 238 -6.774 -4.979 12.743 1.00 0.00 H new ATOM 0 HB2 GLU A 238 -8.009 -5.409 9.967 1.00 0.00 H new ATOM 0 HB3 GLU A 238 -8.616 -6.219 11.398 1.00 0.00 H new ATOM 0 HG2 GLU A 238 -8.347 -3.178 11.171 1.00 0.00 H new ATOM 0 HG3 GLU A 238 -9.828 -4.045 10.815 1.00 0.00 H new ATOM 1091 N TYR A 239 -5.542 -7.000 10.421 1.00 0.00 N ATOM 1092 CA TYR A 239 -4.901 -8.359 10.290 1.00 0.00 C ATOM 1093 C TYR A 239 -3.553 -8.288 9.562 1.00 0.00 C ATOM 1094 O TYR A 239 -3.108 -9.262 8.990 1.00 0.00 O ATOM 1095 CB TYR A 239 -5.837 -9.272 9.512 1.00 0.00 C ATOM 1096 CG TYR A 239 -5.973 -8.753 8.109 1.00 0.00 C ATOM 1097 CD1 TYR A 239 -6.818 -7.671 7.850 1.00 0.00 C ATOM 1098 CD2 TYR A 239 -5.254 -9.351 7.072 1.00 0.00 C ATOM 1099 CE1 TYR A 239 -6.948 -7.189 6.549 1.00 0.00 C ATOM 1100 CE2 TYR A 239 -5.382 -8.872 5.767 1.00 0.00 C ATOM 1101 CZ TYR A 239 -6.233 -7.788 5.504 1.00 0.00 C ATOM 1102 OH TYR A 239 -6.369 -7.310 4.215 1.00 0.00 O ATOM 0 H TYR A 239 -5.553 -6.440 9.568 1.00 0.00 H new ATOM 0 HA TYR A 239 -4.721 -8.746 11.293 1.00 0.00 H new ATOM 0 HB2 TYR A 239 -5.447 -10.290 9.501 1.00 0.00 H new ATOM 0 HB3 TYR A 239 -6.813 -9.310 9.995 1.00 0.00 H new ATOM 0 HD1 TYR A 239 -7.369 -7.209 8.656 1.00 0.00 H new ATOM 0 HD2 TYR A 239 -4.599 -10.184 7.280 1.00 0.00 H new ATOM 0 HE1 TYR A 239 -7.601 -6.353 6.346 1.00 0.00 H new ATOM 0 HE2 TYR A 239 -4.828 -9.334 4.963 1.00 0.00 H new ATOM 0 HH TYR A 239 -7.101 -6.660 4.183 1.00 0.00 H new ATOM 1112 N ARG A 240 -2.883 -7.168 9.579 1.00 0.00 N ATOM 1113 CA ARG A 240 -1.562 -7.100 8.888 1.00 0.00 C ATOM 1114 C ARG A 240 -0.484 -7.727 9.765 1.00 0.00 C ATOM 1115 O ARG A 240 -0.155 -7.234 10.826 1.00 0.00 O ATOM 1116 CB ARG A 240 -1.211 -5.638 8.563 1.00 0.00 C ATOM 1117 CG ARG A 240 -1.883 -5.218 7.235 1.00 0.00 C ATOM 1118 CD ARG A 240 -1.027 -5.657 6.021 1.00 0.00 C ATOM 1119 NE ARG A 240 -1.460 -7.008 5.566 1.00 0.00 N ATOM 1120 CZ ARG A 240 -1.103 -7.443 4.385 1.00 0.00 C ATOM 1121 NH1 ARG A 240 -0.341 -6.708 3.619 1.00 0.00 N ATOM 1122 NH2 ARG A 240 -1.504 -8.612 3.970 1.00 0.00 N ATOM 0 H ARG A 240 -3.187 -6.307 10.035 1.00 0.00 H new ATOM 0 HA ARG A 240 -1.619 -7.658 7.953 1.00 0.00 H new ATOM 0 HB2 ARG A 240 -1.544 -4.987 9.371 1.00 0.00 H new ATOM 0 HB3 ARG A 240 -0.130 -5.523 8.486 1.00 0.00 H new ATOM 0 HG2 ARG A 240 -2.875 -5.665 7.167 1.00 0.00 H new ATOM 0 HG3 ARG A 240 -2.019 -4.137 7.217 1.00 0.00 H new ATOM 0 HD2 ARG A 240 -1.133 -4.937 5.209 1.00 0.00 H new ATOM 0 HD3 ARG A 240 0.028 -5.675 6.295 1.00 0.00 H new ATOM 0 HE ARG A 240 -2.034 -7.593 6.174 1.00 0.00 H new ATOM 0 HH11 ARG A 240 -0.024 -5.794 3.942 1.00 0.00 H new ATOM 0 HH12 ARG A 240 -0.063 -7.048 2.698 1.00 0.00 H new ATOM 0 HH21 ARG A 240 -2.097 -9.189 4.566 1.00 0.00 H new ATOM 0 HH22 ARG A 240 -1.225 -8.950 3.049 1.00 0.00 H new