USER MOD reduce.3.24.130724 H: found=0, std=0, add=579, rem=0, adj=8 USER MOD reduce.3.24.130724 removed 582 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 85 GLN : amide:sc= -0.651 K(o=-0.71,f=-2.3) USER MOD Set 1.2: A 89 GLN : amide:sc= -0.0628 X(o=-0.71,f=-0.65) USER MOD Single : A 65 THR OG1 : rot 180:sc= 0 USER MOD Single : A 66 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 GLN : amide:sc= -0.15 X(o=-0.15,f=-0.15) USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 LYS NZ :NH3+ 163:sc= 0 (180deg=-0.252) USER MOD Single : A 80 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 83 LYS NZ :NH3+ -171:sc= 1.17 (180deg=1.06) USER MOD Single : A 84 HIS : no HD1:sc= -0.0102 X(o=-0.01,f=0) USER MOD Single : B 168 SER OG : rot -53:sc= 0.0368 USER MOD Single : B 169 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 174 GLN : amide:sc= 0 K(o=0,f=-0.59) USER MOD Single : B 175 ASN : amide:sc= 0 K(o=0,f=-1.3) USER MOD Single : B 176 MET CE :methyl 152:sc= -6.41! (180deg=-8.43!) USER MOD Single : B 184 THR OG1 : rot 94:sc= 0.911 USER MOD Single : B 185 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 188 GLN : amide:sc= -0.208 X(o=-0.21,f=-0.21) USER MOD Single : B 189 GLN : amide:sc= -0.31 X(o=-0.31,f=0) USER MOD Single : B 191 SER OG : rot -4:sc= -1.42 USER MOD Single : B 192 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 194 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 195 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 196 LYS NZ :NH3+ -179:sc= 0 (180deg=-0.00164) USER MOD Single : B 197 GLN : amide:sc= -2.93 K(o=-2.9,f=-5.9!) USER MOD Single : B 198 GLN : amide:sc= -0.303 X(o=-0.3,f=-0.11) USER MOD Single : B 199 GLN : amide:sc= -0.319 X(o=-0.32,f=-0.18) USER MOD ----------------------------------------------------------------- ATOM 161 N LEU A 62 0.000 -18.321 2.290 1.00 0.00 N ATOM 162 CA LEU A 62 -0.247 -17.200 1.330 1.00 0.00 C ATOM 163 C LEU A 62 -1.499 -16.425 1.742 1.00 0.00 C ATOM 164 O LEU A 62 -1.614 -15.239 1.493 1.00 0.00 O ATOM 165 CB LEU A 62 -0.453 -17.870 -0.031 1.00 0.00 C ATOM 166 CG LEU A 62 -0.006 -16.919 -1.141 1.00 0.00 C ATOM 167 CD1 LEU A 62 1.452 -17.205 -1.504 1.00 0.00 C ATOM 168 CD2 LEU A 62 -0.888 -17.126 -2.374 1.00 0.00 C ATOM 0 HA LEU A 62 0.578 -16.488 1.307 1.00 0.00 H new ATOM 0 HB2 LEU A 62 0.117 -18.798 -0.081 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -1.502 -18.133 -0.164 1.00 0.00 H new ATOM 0 HG LEU A 62 -0.098 -15.889 -0.795 1.00 0.00 H new ATOM 0 HD11 LEU A 62 1.770 -16.526 -2.296 1.00 0.00 H new ATOM 0 HD12 LEU A 62 2.081 -17.058 -0.626 1.00 0.00 H new ATOM 0 HD13 LEU A 62 1.546 -18.235 -1.849 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -0.570 -16.448 -3.166 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -0.796 -18.156 -2.719 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -1.927 -16.921 -2.117 1.00 0.00 H new ATOM 180 N GLU A 63 -2.435 -17.088 2.374 1.00 0.00 N ATOM 181 CA GLU A 63 -3.684 -16.394 2.811 1.00 0.00 C ATOM 182 C GLU A 63 -3.389 -15.499 4.015 1.00 0.00 C ATOM 183 O GLU A 63 -3.983 -14.449 4.179 1.00 0.00 O ATOM 184 CB GLU A 63 -4.654 -17.513 3.196 1.00 0.00 C ATOM 185 CG GLU A 63 -5.572 -17.824 2.012 1.00 0.00 C ATOM 186 CD GLU A 63 -6.926 -18.313 2.531 1.00 0.00 C ATOM 187 OE1 GLU A 63 -6.962 -19.380 3.121 1.00 0.00 O ATOM 188 OE2 GLU A 63 -7.904 -17.612 2.328 1.00 0.00 O ATOM 0 H GLU A 63 -2.388 -18.080 2.606 1.00 0.00 H new ATOM 0 HA GLU A 63 -4.097 -15.756 2.030 1.00 0.00 H new ATOM 0 HB2 GLU A 63 -4.099 -18.406 3.484 1.00 0.00 H new ATOM 0 HB3 GLU A 63 -5.247 -17.213 4.060 1.00 0.00 H new ATOM 0 HG2 GLU A 63 -5.706 -16.933 1.398 1.00 0.00 H new ATOM 0 HG3 GLU A 63 -5.118 -18.584 1.376 1.00 0.00 H new ATOM 195 N GLU A 64 -2.471 -15.906 4.852 1.00 0.00 N ATOM 196 CA GLU A 64 -2.123 -15.081 6.047 1.00 0.00 C ATOM 197 C GLU A 64 -1.297 -13.871 5.616 1.00 0.00 C ATOM 198 O GLU A 64 -1.467 -12.778 6.122 1.00 0.00 O ATOM 199 CB GLU A 64 -1.300 -16.002 6.950 1.00 0.00 C ATOM 200 CG GLU A 64 -1.010 -15.293 8.275 1.00 0.00 C ATOM 201 CD GLU A 64 -2.314 -15.104 9.050 1.00 0.00 C ATOM 202 OE1 GLU A 64 -3.005 -16.089 9.258 1.00 0.00 O ATOM 203 OE2 GLU A 64 -2.601 -13.979 9.423 1.00 0.00 O ATOM 0 H GLU A 64 -1.946 -16.776 4.760 1.00 0.00 H new ATOM 0 HA GLU A 64 -3.006 -14.703 6.561 1.00 0.00 H new ATOM 0 HB2 GLU A 64 -1.843 -16.929 7.133 1.00 0.00 H new ATOM 0 HB3 GLU A 64 -0.366 -16.271 6.458 1.00 0.00 H new ATOM 0 HG2 GLU A 64 -0.305 -15.878 8.866 1.00 0.00 H new ATOM 0 HG3 GLU A 64 -0.543 -14.326 8.087 1.00 0.00 H new ATOM 210 N THR A 65 -0.411 -14.062 4.673 1.00 0.00 N ATOM 211 CA THR A 65 0.427 -12.927 4.186 1.00 0.00 C ATOM 212 C THR A 65 -0.438 -11.973 3.362 1.00 0.00 C ATOM 213 O THR A 65 -0.228 -10.776 3.360 1.00 0.00 O ATOM 214 CB THR A 65 1.510 -13.565 3.315 1.00 0.00 C ATOM 215 OG1 THR A 65 2.208 -14.544 4.071 1.00 0.00 O ATOM 216 CG2 THR A 65 2.490 -12.488 2.844 1.00 0.00 C ATOM 0 H THR A 65 -0.232 -14.957 4.219 1.00 0.00 H new ATOM 0 HA THR A 65 0.864 -12.350 5.001 1.00 0.00 H new ATOM 0 HB THR A 65 1.047 -14.036 2.448 1.00 0.00 H new ATOM 0 HG1 THR A 65 2.901 -14.955 3.513 1.00 0.00 H new ATOM 0 HG21 THR A 65 3.261 -12.944 2.223 1.00 0.00 H new ATOM 0 HG22 THR A 65 1.954 -11.737 2.263 1.00 0.00 H new ATOM 0 HG23 THR A 65 2.954 -12.014 3.709 1.00 0.00 H new ATOM 224 N LYS A 66 -1.418 -12.502 2.674 1.00 0.00 N ATOM 225 CA LYS A 66 -2.315 -11.633 1.855 1.00 0.00 C ATOM 226 C LYS A 66 -3.162 -10.755 2.779 1.00 0.00 C ATOM 227 O LYS A 66 -3.543 -9.654 2.426 1.00 0.00 O ATOM 228 CB LYS A 66 -3.205 -12.595 1.064 1.00 0.00 C ATOM 229 CG LYS A 66 -2.631 -12.782 -0.343 1.00 0.00 C ATOM 230 CD LYS A 66 -2.729 -11.462 -1.113 1.00 0.00 C ATOM 231 CE LYS A 66 -2.695 -11.745 -2.617 1.00 0.00 C ATOM 232 NZ LYS A 66 -3.552 -10.689 -3.225 1.00 0.00 N ATOM 0 H LYS A 66 -1.635 -13.498 2.644 1.00 0.00 H new ATOM 0 HA LYS A 66 -1.758 -10.970 1.193 1.00 0.00 H new ATOM 0 HB2 LYS A 66 -3.264 -13.556 1.575 1.00 0.00 H new ATOM 0 HB3 LYS A 66 -4.220 -12.203 1.005 1.00 0.00 H new ATOM 0 HG2 LYS A 66 -1.592 -13.105 -0.284 1.00 0.00 H new ATOM 0 HG3 LYS A 66 -3.178 -13.564 -0.870 1.00 0.00 H new ATOM 0 HD2 LYS A 66 -3.651 -10.943 -0.851 1.00 0.00 H new ATOM 0 HD3 LYS A 66 -1.904 -10.805 -0.837 1.00 0.00 H new ATOM 0 HE2 LYS A 66 -1.677 -11.700 -3.005 1.00 0.00 H new ATOM 0 HE3 LYS A 66 -3.077 -12.741 -2.840 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 -3.579 -10.815 -4.257 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 -4.516 -10.761 -2.842 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 -3.160 -9.752 -3.001 1.00 0.00 H new ATOM 246 N GLU A 67 -3.452 -11.235 3.963 1.00 0.00 N ATOM 247 CA GLU A 67 -4.269 -10.430 4.921 1.00 0.00 C ATOM 248 C GLU A 67 -3.523 -9.147 5.288 1.00 0.00 C ATOM 249 O GLU A 67 -4.118 -8.098 5.446 1.00 0.00 O ATOM 250 CB GLU A 67 -4.447 -11.320 6.153 1.00 0.00 C ATOM 251 CG GLU A 67 -5.489 -10.700 7.086 1.00 0.00 C ATOM 252 CD GLU A 67 -4.790 -9.808 8.113 1.00 0.00 C ATOM 253 OE1 GLU A 67 -3.970 -10.325 8.855 1.00 0.00 O ATOM 254 OE2 GLU A 67 -5.085 -8.625 8.141 1.00 0.00 O ATOM 0 H GLU A 67 -3.158 -12.149 4.307 1.00 0.00 H new ATOM 0 HA GLU A 67 -5.230 -10.136 4.498 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -4.763 -12.318 5.851 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -3.496 -11.431 6.675 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -6.206 -10.116 6.510 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -6.051 -11.484 7.593 1.00 0.00 H new ATOM 261 N GLN A 68 -2.224 -9.226 5.413 1.00 0.00 N ATOM 262 CA GLN A 68 -1.428 -8.010 5.759 1.00 0.00 C ATOM 263 C GLN A 68 -1.312 -7.111 4.530 1.00 0.00 C ATOM 264 O GLN A 68 -1.314 -5.898 4.632 1.00 0.00 O ATOM 265 CB GLN A 68 -0.053 -8.532 6.181 1.00 0.00 C ATOM 266 CG GLN A 68 0.801 -7.368 6.687 1.00 0.00 C ATOM 267 CD GLN A 68 0.205 -6.823 7.986 1.00 0.00 C ATOM 268 OE1 GLN A 68 0.225 -7.486 9.003 1.00 0.00 O ATOM 269 NE2 GLN A 68 -0.331 -5.633 7.994 1.00 0.00 N ATOM 0 H GLN A 68 -1.679 -10.080 5.291 1.00 0.00 H new ATOM 0 HA GLN A 68 -1.888 -7.420 6.551 1.00 0.00 H new ATOM 0 HB2 GLN A 68 -0.162 -9.284 6.963 1.00 0.00 H new ATOM 0 HB3 GLN A 68 0.438 -9.018 5.338 1.00 0.00 H new ATOM 0 HG2 GLN A 68 1.825 -7.701 6.856 1.00 0.00 H new ATOM 0 HG3 GLN A 68 0.842 -6.580 5.935 1.00 0.00 H new ATOM 0 HE21 GLN A 68 -0.348 -5.076 7.140 1.00 0.00 H new ATOM 0 HE22 GLN A 68 -0.733 -5.260 8.854 1.00 0.00 H new ATOM 278 N ILE A 69 -1.226 -7.703 3.368 1.00 0.00 N ATOM 279 CA ILE A 69 -1.126 -6.895 2.116 1.00 0.00 C ATOM 280 C ILE A 69 -2.479 -6.240 1.824 1.00 0.00 C ATOM 281 O ILE A 69 -2.550 -5.183 1.226 1.00 0.00 O ATOM 282 CB ILE A 69 -0.755 -7.894 1.013 1.00 0.00 C ATOM 283 CG1 ILE A 69 0.579 -8.564 1.360 1.00 0.00 C ATOM 284 CG2 ILE A 69 -0.617 -7.158 -0.322 1.00 0.00 C ATOM 285 CD1 ILE A 69 0.813 -9.750 0.423 1.00 0.00 C ATOM 0 H ILE A 69 -1.221 -8.714 3.231 1.00 0.00 H new ATOM 0 HA ILE A 69 -0.387 -6.097 2.191 1.00 0.00 H new ATOM 0 HB ILE A 69 -1.536 -8.650 0.933 1.00 0.00 H new ATOM 0 HG12 ILE A 69 1.394 -7.846 1.266 1.00 0.00 H new ATOM 0 HG13 ILE A 69 0.570 -8.902 2.396 1.00 0.00 H new ATOM 0 HG21 ILE A 69 -0.353 -7.870 -1.104 1.00 0.00 H new ATOM 0 HG22 ILE A 69 -1.563 -6.678 -0.572 1.00 0.00 H new ATOM 0 HG23 ILE A 69 0.164 -6.402 -0.241 1.00 0.00 H new ATOM 0 HD11 ILE A 69 1.762 -10.227 0.669 1.00 0.00 H new ATOM 0 HD12 ILE A 69 0.004 -10.471 0.539 1.00 0.00 H new ATOM 0 HD13 ILE A 69 0.841 -9.399 -0.609 1.00 0.00 H new ATOM 297 N LEU A 70 -3.552 -6.861 2.251 1.00 0.00 N ATOM 298 CA LEU A 70 -4.907 -6.277 2.011 1.00 0.00 C ATOM 299 C LEU A 70 -5.082 -5.013 2.855 1.00 0.00 C ATOM 300 O LEU A 70 -5.631 -4.026 2.401 1.00 0.00 O ATOM 301 CB LEU A 70 -5.898 -7.358 2.449 1.00 0.00 C ATOM 302 CG LEU A 70 -7.268 -7.072 1.834 1.00 0.00 C ATOM 303 CD1 LEU A 70 -7.293 -7.568 0.388 1.00 0.00 C ATOM 304 CD2 LEU A 70 -8.347 -7.800 2.640 1.00 0.00 C ATOM 0 H LEU A 70 -3.547 -7.747 2.756 1.00 0.00 H new ATOM 0 HA LEU A 70 -5.058 -5.994 0.969 1.00 0.00 H new ATOM 0 HB2 LEU A 70 -5.544 -8.340 2.135 1.00 0.00 H new ATOM 0 HB3 LEU A 70 -5.973 -7.379 3.536 1.00 0.00 H new ATOM 0 HG LEU A 70 -7.458 -5.999 1.852 1.00 0.00 H new ATOM 0 HD11 LEU A 70 -8.270 -7.364 -0.050 1.00 0.00 H new ATOM 0 HD12 LEU A 70 -6.523 -7.053 -0.187 1.00 0.00 H new ATOM 0 HD13 LEU A 70 -7.104 -8.641 0.368 1.00 0.00 H new ATOM 0 HD21 LEU A 70 -9.325 -7.598 2.204 1.00 0.00 H new ATOM 0 HD22 LEU A 70 -8.155 -8.873 2.619 1.00 0.00 H new ATOM 0 HD23 LEU A 70 -8.330 -7.448 3.672 1.00 0.00 H new ATOM 316 N LYS A 71 -4.614 -5.035 4.079 1.00 0.00 N ATOM 317 CA LYS A 71 -4.744 -3.829 4.954 1.00 0.00 C ATOM 318 C LYS A 71 -3.956 -2.667 4.350 1.00 0.00 C ATOM 319 O LYS A 71 -4.324 -1.516 4.488 1.00 0.00 O ATOM 320 CB LYS A 71 -4.146 -4.239 6.301 1.00 0.00 C ATOM 321 CG LYS A 71 -4.503 -3.194 7.359 1.00 0.00 C ATOM 322 CD LYS A 71 -5.800 -3.600 8.062 1.00 0.00 C ATOM 323 CE LYS A 71 -5.470 -4.433 9.303 1.00 0.00 C ATOM 324 NZ LYS A 71 -6.437 -3.977 10.339 1.00 0.00 N ATOM 0 H LYS A 71 -4.149 -5.834 4.509 1.00 0.00 H new ATOM 0 HA LYS A 71 -5.779 -3.502 5.058 1.00 0.00 H new ATOM 0 HB2 LYS A 71 -4.527 -5.216 6.597 1.00 0.00 H new ATOM 0 HB3 LYS A 71 -3.063 -4.331 6.217 1.00 0.00 H new ATOM 0 HG2 LYS A 71 -3.695 -3.106 8.086 1.00 0.00 H new ATOM 0 HG3 LYS A 71 -4.620 -2.215 6.893 1.00 0.00 H new ATOM 0 HD2 LYS A 71 -6.365 -2.712 8.347 1.00 0.00 H new ATOM 0 HD3 LYS A 71 -6.430 -4.174 7.383 1.00 0.00 H new ATOM 0 HE2 LYS A 71 -5.578 -5.499 9.103 1.00 0.00 H new ATOM 0 HE3 LYS A 71 -4.441 -4.272 9.625 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 -6.274 -4.503 11.221 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 -6.306 -2.960 10.513 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 -7.408 -4.149 10.008 1.00 0.00 H new ATOM 338 N LEU A 72 -2.876 -2.967 3.675 1.00 0.00 N ATOM 339 CA LEU A 72 -2.055 -1.889 3.045 1.00 0.00 C ATOM 340 C LEU A 72 -2.821 -1.273 1.874 1.00 0.00 C ATOM 341 O LEU A 72 -2.667 -0.105 1.566 1.00 0.00 O ATOM 342 CB LEU A 72 -0.785 -2.587 2.554 1.00 0.00 C ATOM 343 CG LEU A 72 0.324 -2.421 3.595 1.00 0.00 C ATOM 344 CD1 LEU A 72 1.469 -3.385 3.280 1.00 0.00 C ATOM 345 CD2 LEU A 72 0.845 -0.981 3.563 1.00 0.00 C ATOM 0 H LEU A 72 -2.526 -3.915 3.533 1.00 0.00 H new ATOM 0 HA LEU A 72 -1.825 -1.081 3.739 1.00 0.00 H new ATOM 0 HB2 LEU A 72 -0.982 -3.645 2.383 1.00 0.00 H new ATOM 0 HB3 LEU A 72 -0.470 -2.163 1.601 1.00 0.00 H new ATOM 0 HG LEU A 72 -0.073 -2.641 4.586 1.00 0.00 H new ATOM 0 HD11 LEU A 72 2.259 -3.266 4.022 1.00 0.00 H new ATOM 0 HD12 LEU A 72 1.099 -4.410 3.305 1.00 0.00 H new ATOM 0 HD13 LEU A 72 1.866 -3.166 2.289 1.00 0.00 H new ATOM 0 HD21 LEU A 72 1.635 -0.863 4.305 1.00 0.00 H new ATOM 0 HD22 LEU A 72 1.242 -0.760 2.572 1.00 0.00 H new ATOM 0 HD23 LEU A 72 0.030 -0.294 3.789 1.00 0.00 H new ATOM 357 N GLU A 73 -3.650 -2.051 1.223 1.00 0.00 N ATOM 358 CA GLU A 73 -4.438 -1.514 0.073 1.00 0.00 C ATOM 359 C GLU A 73 -5.487 -0.526 0.582 1.00 0.00 C ATOM 360 O GLU A 73 -5.797 0.454 -0.068 1.00 0.00 O ATOM 361 CB GLU A 73 -5.110 -2.734 -0.563 1.00 0.00 C ATOM 362 CG GLU A 73 -5.110 -2.582 -2.085 1.00 0.00 C ATOM 363 CD GLU A 73 -3.750 -3.009 -2.641 1.00 0.00 C ATOM 364 OE1 GLU A 73 -3.308 -4.093 -2.301 1.00 0.00 O ATOM 365 OE2 GLU A 73 -3.174 -2.242 -3.396 1.00 0.00 O ATOM 0 H GLU A 73 -3.814 -3.034 1.439 1.00 0.00 H new ATOM 0 HA GLU A 73 -3.814 -0.982 -0.645 1.00 0.00 H new ATOM 0 HB2 GLU A 73 -4.581 -3.643 -0.278 1.00 0.00 H new ATOM 0 HB3 GLU A 73 -6.132 -2.831 -0.197 1.00 0.00 H new ATOM 0 HG2 GLU A 73 -5.901 -3.192 -2.522 1.00 0.00 H new ATOM 0 HG3 GLU A 73 -5.318 -1.547 -2.358 1.00 0.00 H new ATOM 372 N GLU A 74 -6.024 -0.775 1.749 1.00 0.00 N ATOM 373 CA GLU A 74 -7.046 0.152 2.319 1.00 0.00 C ATOM 374 C GLU A 74 -6.357 1.415 2.838 1.00 0.00 C ATOM 375 O GLU A 74 -6.913 2.496 2.808 1.00 0.00 O ATOM 376 CB GLU A 74 -7.701 -0.620 3.472 1.00 0.00 C ATOM 377 CG GLU A 74 -9.123 -1.028 3.081 1.00 0.00 C ATOM 378 CD GLU A 74 -9.517 -2.300 3.833 1.00 0.00 C ATOM 379 OE1 GLU A 74 -9.560 -2.254 5.052 1.00 0.00 O ATOM 380 OE2 GLU A 74 -9.766 -3.299 3.179 1.00 0.00 O ATOM 0 H GLU A 74 -5.798 -1.581 2.332 1.00 0.00 H new ATOM 0 HA GLU A 74 -7.784 0.463 1.580 1.00 0.00 H new ATOM 0 HB2 GLU A 74 -7.111 -1.505 3.710 1.00 0.00 H new ATOM 0 HB3 GLU A 74 -7.724 -0.001 4.369 1.00 0.00 H new ATOM 0 HG2 GLU A 74 -9.820 -0.224 3.316 1.00 0.00 H new ATOM 0 HG3 GLU A 74 -9.181 -1.196 2.006 1.00 0.00 H new ATOM 387 N LYS A 75 -5.142 1.277 3.306 1.00 0.00 N ATOM 388 CA LYS A 75 -4.395 2.464 3.823 1.00 0.00 C ATOM 389 C LYS A 75 -3.998 3.368 2.653 1.00 0.00 C ATOM 390 O LYS A 75 -3.904 4.572 2.792 1.00 0.00 O ATOM 391 CB LYS A 75 -3.150 1.892 4.519 1.00 0.00 C ATOM 392 CG LYS A 75 -3.164 2.273 6.002 1.00 0.00 C ATOM 393 CD LYS A 75 -2.426 3.600 6.196 1.00 0.00 C ATOM 394 CE LYS A 75 -2.869 4.243 7.513 1.00 0.00 C ATOM 395 NZ LYS A 75 -2.311 3.364 8.577 1.00 0.00 N ATOM 0 H LYS A 75 -4.635 0.393 3.352 1.00 0.00 H new ATOM 0 HA LYS A 75 -4.990 3.066 4.510 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -3.129 0.807 4.413 1.00 0.00 H new ATOM 0 HB3 LYS A 75 -2.248 2.276 4.044 1.00 0.00 H new ATOM 0 HG2 LYS A 75 -4.191 2.361 6.356 1.00 0.00 H new ATOM 0 HG3 LYS A 75 -2.689 1.491 6.594 1.00 0.00 H new ATOM 0 HD2 LYS A 75 -1.349 3.431 6.205 1.00 0.00 H new ATOM 0 HD3 LYS A 75 -2.636 4.271 5.363 1.00 0.00 H new ATOM 0 HE2 LYS A 75 -2.490 5.261 7.603 1.00 0.00 H new ATOM 0 HE3 LYS A 75 -3.956 4.301 7.578 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 -2.316 3.872 9.485 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 -2.892 2.505 8.658 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 -1.335 3.100 8.333 1.00 0.00 H new ATOM 409 N LEU A 76 -3.773 2.790 1.498 1.00 0.00 N ATOM 410 CA LEU A 76 -3.390 3.610 0.309 1.00 0.00 C ATOM 411 C LEU A 76 -4.613 4.364 -0.213 1.00 0.00 C ATOM 412 O LEU A 76 -4.503 5.455 -0.740 1.00 0.00 O ATOM 413 CB LEU A 76 -2.891 2.605 -0.732 1.00 0.00 C ATOM 414 CG LEU A 76 -2.409 3.354 -1.975 1.00 0.00 C ATOM 415 CD1 LEU A 76 -0.991 3.874 -1.741 1.00 0.00 C ATOM 416 CD2 LEU A 76 -2.412 2.402 -3.175 1.00 0.00 C ATOM 0 H LEU A 76 -3.838 1.786 1.329 1.00 0.00 H new ATOM 0 HA LEU A 76 -2.628 4.353 0.545 1.00 0.00 H new ATOM 0 HB2 LEU A 76 -2.079 2.008 -0.317 1.00 0.00 H new ATOM 0 HB3 LEU A 76 -3.691 1.914 -0.998 1.00 0.00 H new ATOM 0 HG LEU A 76 -3.074 4.194 -2.174 1.00 0.00 H new ATOM 0 HD11 LEU A 76 -0.648 4.408 -2.627 1.00 0.00 H new ATOM 0 HD12 LEU A 76 -0.988 4.550 -0.886 1.00 0.00 H new ATOM 0 HD13 LEU A 76 -0.324 3.035 -1.542 1.00 0.00 H new ATOM 0 HD21 LEU A 76 -2.069 2.934 -4.062 1.00 0.00 H new ATOM 0 HD22 LEU A 76 -1.746 1.562 -2.975 1.00 0.00 H new ATOM 0 HD23 LEU A 76 -3.423 2.031 -3.343 1.00 0.00 H new ATOM 428 N LEU A 77 -5.778 3.789 -0.061 1.00 0.00 N ATOM 429 CA LEU A 77 -7.021 4.467 -0.537 1.00 0.00 C ATOM 430 C LEU A 77 -7.363 5.629 0.395 1.00 0.00 C ATOM 431 O LEU A 77 -7.804 6.677 -0.040 1.00 0.00 O ATOM 432 CB LEU A 77 -8.112 3.396 -0.485 1.00 0.00 C ATOM 433 CG LEU A 77 -9.201 3.726 -1.508 1.00 0.00 C ATOM 434 CD1 LEU A 77 -8.874 3.047 -2.839 1.00 0.00 C ATOM 435 CD2 LEU A 77 -10.550 3.219 -0.996 1.00 0.00 C ATOM 0 H LEU A 77 -5.922 2.877 0.373 1.00 0.00 H new ATOM 0 HA LEU A 77 -6.912 4.878 -1.541 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -7.685 2.416 -0.697 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -8.541 3.347 0.516 1.00 0.00 H new ATOM 0 HG LEU A 77 -9.248 4.805 -1.653 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -9.650 3.282 -3.568 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -7.912 3.407 -3.204 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -8.827 1.968 -2.695 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -11.327 3.453 -1.724 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -10.502 2.140 -0.851 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -10.784 3.702 -0.047 1.00 0.00 H new ATOM 447 N ALA A 78 -7.151 5.449 1.672 1.00 0.00 N ATOM 448 CA ALA A 78 -7.450 6.544 2.646 1.00 0.00 C ATOM 449 C ALA A 78 -6.483 7.707 2.423 1.00 0.00 C ATOM 450 O ALA A 78 -6.821 8.857 2.640 1.00 0.00 O ATOM 451 CB ALA A 78 -7.239 5.925 4.030 1.00 0.00 C ATOM 0 H ALA A 78 -6.784 4.591 2.084 1.00 0.00 H new ATOM 0 HA ALA A 78 -8.461 6.936 2.534 1.00 0.00 H new ATOM 0 HB1 ALA A 78 -7.441 6.672 4.797 1.00 0.00 H new ATOM 0 HB2 ALA A 78 -7.917 5.081 4.158 1.00 0.00 H new ATOM 0 HB3 ALA A 78 -6.209 5.580 4.121 1.00 0.00 H new ATOM 457 N LEU A 79 -5.286 7.414 1.984 1.00 0.00 N ATOM 458 CA LEU A 79 -4.289 8.498 1.732 1.00 0.00 C ATOM 459 C LEU A 79 -4.707 9.305 0.502 1.00 0.00 C ATOM 460 O LEU A 79 -4.705 10.522 0.518 1.00 0.00 O ATOM 461 CB LEU A 79 -2.952 7.776 1.483 1.00 0.00 C ATOM 462 CG LEU A 79 -1.951 8.096 2.606 1.00 0.00 C ATOM 463 CD1 LEU A 79 -1.668 9.603 2.643 1.00 0.00 C ATOM 464 CD2 LEU A 79 -2.521 7.646 3.956 1.00 0.00 C ATOM 0 H LEU A 79 -4.955 6.469 1.789 1.00 0.00 H new ATOM 0 HA LEU A 79 -4.213 9.196 2.566 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -3.117 6.700 1.430 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -2.540 8.083 0.522 1.00 0.00 H new ATOM 0 HG LEU A 79 -1.021 7.562 2.412 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -0.958 9.820 3.441 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -1.248 9.918 1.688 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -2.597 10.143 2.826 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -1.807 7.876 4.747 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -3.457 8.170 4.149 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -2.705 6.572 3.934 1.00 0.00 H new ATOM 476 N GLN A 80 -5.077 8.632 -0.559 1.00 0.00 N ATOM 477 CA GLN A 80 -5.510 9.356 -1.793 1.00 0.00 C ATOM 478 C GLN A 80 -6.811 10.112 -1.516 1.00 0.00 C ATOM 479 O GLN A 80 -7.079 11.142 -2.107 1.00 0.00 O ATOM 480 CB GLN A 80 -5.734 8.267 -2.845 1.00 0.00 C ATOM 481 CG GLN A 80 -5.530 8.856 -4.242 1.00 0.00 C ATOM 482 CD GLN A 80 -4.966 7.782 -5.174 1.00 0.00 C ATOM 483 OE1 GLN A 80 -5.709 7.034 -5.778 1.00 0.00 O ATOM 484 NE2 GLN A 80 -3.673 7.673 -5.316 1.00 0.00 N ATOM 0 H GLN A 80 -5.098 7.614 -0.624 1.00 0.00 H new ATOM 0 HA GLN A 80 -4.773 10.087 -2.126 1.00 0.00 H new ATOM 0 HB2 GLN A 80 -5.041 7.442 -2.682 1.00 0.00 H new ATOM 0 HB3 GLN A 80 -6.741 7.860 -2.754 1.00 0.00 H new ATOM 0 HG2 GLN A 80 -6.477 9.230 -4.632 1.00 0.00 H new ATOM 0 HG3 GLN A 80 -4.848 9.705 -4.194 1.00 0.00 H new ATOM 0 HE21 GLN A 80 -3.050 8.301 -4.809 1.00 0.00 H new ATOM 0 HE22 GLN A 80 -3.286 6.960 -5.934 1.00 0.00 H new ATOM 493 N GLU A 81 -7.615 9.608 -0.615 1.00 0.00 N ATOM 494 CA GLU A 81 -8.902 10.293 -0.283 1.00 0.00 C ATOM 495 C GLU A 81 -8.616 11.610 0.441 1.00 0.00 C ATOM 496 O GLU A 81 -9.366 12.562 0.333 1.00 0.00 O ATOM 497 CB GLU A 81 -9.648 9.324 0.637 1.00 0.00 C ATOM 498 CG GLU A 81 -11.134 9.687 0.663 1.00 0.00 C ATOM 499 CD GLU A 81 -11.344 10.915 1.551 1.00 0.00 C ATOM 500 OE1 GLU A 81 -11.159 10.793 2.750 1.00 0.00 O ATOM 501 OE2 GLU A 81 -11.688 11.957 1.016 1.00 0.00 O ATOM 0 H GLU A 81 -7.436 8.750 -0.094 1.00 0.00 H new ATOM 0 HA GLU A 81 -9.486 10.533 -1.172 1.00 0.00 H new ATOM 0 HB2 GLU A 81 -9.519 8.300 0.286 1.00 0.00 H new ATOM 0 HB3 GLU A 81 -9.234 9.370 1.644 1.00 0.00 H new ATOM 0 HG2 GLU A 81 -11.487 9.891 -0.348 1.00 0.00 H new ATOM 0 HG3 GLU A 81 -11.718 8.848 1.041 1.00 0.00 H new ATOM 508 N GLU A 82 -7.533 11.668 1.174 1.00 0.00 N ATOM 509 CA GLU A 82 -7.185 12.924 1.905 1.00 0.00 C ATOM 510 C GLU A 82 -6.768 14.005 0.908 1.00 0.00 C ATOM 511 O GLU A 82 -7.225 15.132 0.976 1.00 0.00 O ATOM 512 CB GLU A 82 -6.015 12.550 2.821 1.00 0.00 C ATOM 513 CG GLU A 82 -6.515 12.383 4.257 1.00 0.00 C ATOM 514 CD GLU A 82 -5.321 12.311 5.210 1.00 0.00 C ATOM 515 OE1 GLU A 82 -4.599 11.329 5.149 1.00 0.00 O ATOM 516 OE2 GLU A 82 -5.147 13.238 5.984 1.00 0.00 O ATOM 0 H GLU A 82 -6.874 10.899 1.298 1.00 0.00 H new ATOM 0 HA GLU A 82 -8.026 13.319 2.474 1.00 0.00 H new ATOM 0 HB2 GLU A 82 -5.553 11.625 2.477 1.00 0.00 H new ATOM 0 HB3 GLU A 82 -5.248 13.323 2.781 1.00 0.00 H new ATOM 0 HG2 GLU A 82 -7.160 13.219 4.528 1.00 0.00 H new ATOM 0 HG3 GLU A 82 -7.115 11.477 4.341 1.00 0.00 H new ATOM 523 N LYS A 83 -5.913 13.668 -0.025 1.00 0.00 N ATOM 524 CA LYS A 83 -5.473 14.673 -1.039 1.00 0.00 C ATOM 525 C LYS A 83 -6.679 15.136 -1.860 1.00 0.00 C ATOM 526 O LYS A 83 -6.729 16.258 -2.328 1.00 0.00 O ATOM 527 CB LYS A 83 -4.464 13.942 -1.929 1.00 0.00 C ATOM 528 CG LYS A 83 -3.906 14.910 -2.973 1.00 0.00 C ATOM 529 CD LYS A 83 -2.720 14.261 -3.689 1.00 0.00 C ATOM 530 CE LYS A 83 -2.540 14.902 -5.068 1.00 0.00 C ATOM 531 NZ LYS A 83 -1.879 13.856 -5.896 1.00 0.00 N ATOM 0 H LYS A 83 -5.501 12.741 -0.128 1.00 0.00 H new ATOM 0 HA LYS A 83 -5.031 15.558 -0.581 1.00 0.00 H new ATOM 0 HB2 LYS A 83 -3.653 13.539 -1.322 1.00 0.00 H new ATOM 0 HB3 LYS A 83 -4.944 13.097 -2.422 1.00 0.00 H new ATOM 0 HG2 LYS A 83 -4.681 15.171 -3.694 1.00 0.00 H new ATOM 0 HG3 LYS A 83 -3.592 15.837 -2.494 1.00 0.00 H new ATOM 0 HD2 LYS A 83 -1.813 14.385 -3.098 1.00 0.00 H new ATOM 0 HD3 LYS A 83 -2.888 13.189 -3.794 1.00 0.00 H new ATOM 0 HE2 LYS A 83 -3.499 15.196 -5.495 1.00 0.00 H new ATOM 0 HE3 LYS A 83 -1.929 15.802 -5.008 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 -1.585 14.267 -6.805 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 -1.044 13.492 -5.394 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 -2.546 13.077 -6.068 1.00 0.00 H new ATOM 545 N HIS A 84 -7.653 14.278 -2.027 1.00 0.00 N ATOM 546 CA HIS A 84 -8.869 14.658 -2.808 1.00 0.00 C ATOM 547 C HIS A 84 -9.595 15.808 -2.107 1.00 0.00 C ATOM 548 O HIS A 84 -10.206 16.646 -2.743 1.00 0.00 O ATOM 549 CB HIS A 84 -9.745 13.403 -2.832 1.00 0.00 C ATOM 550 CG HIS A 84 -10.963 13.656 -3.677 1.00 0.00 C ATOM 551 ND1 HIS A 84 -10.978 13.417 -5.043 1.00 0.00 N ATOM 552 CD2 HIS A 84 -12.216 14.123 -3.367 1.00 0.00 C ATOM 553 CE1 HIS A 84 -12.202 13.740 -5.499 1.00 0.00 C ATOM 554 NE2 HIS A 84 -12.996 14.176 -4.518 1.00 0.00 N ATOM 0 H HIS A 84 -7.659 13.328 -1.655 1.00 0.00 H new ATOM 0 HA HIS A 84 -8.626 14.995 -3.816 1.00 0.00 H new ATOM 0 HB2 HIS A 84 -9.181 12.561 -3.232 1.00 0.00 H new ATOM 0 HB3 HIS A 84 -10.042 13.135 -1.818 1.00 0.00 H new ATOM 0 HD2 HIS A 84 -12.547 14.407 -2.379 1.00 0.00 H new ATOM 0 HE1 HIS A 84 -12.505 13.657 -6.532 1.00 0.00 H new ATOM 0 HE2 HIS A 84 -13.966 14.482 -4.596 1.00 0.00 H new ATOM 562 N GLN A 85 -9.525 15.853 -0.801 1.00 0.00 N ATOM 563 CA GLN A 85 -10.204 16.952 -0.049 1.00 0.00 C ATOM 564 C GLN A 85 -9.521 18.285 -0.354 1.00 0.00 C ATOM 565 O GLN A 85 -10.151 19.326 -0.374 1.00 0.00 O ATOM 566 CB GLN A 85 -10.045 16.591 1.429 1.00 0.00 C ATOM 567 CG GLN A 85 -11.251 17.110 2.214 1.00 0.00 C ATOM 568 CD GLN A 85 -11.173 18.633 2.324 1.00 0.00 C ATOM 569 OE1 GLN A 85 -10.107 19.186 2.514 1.00 0.00 O ATOM 570 NE2 GLN A 85 -12.263 19.341 2.212 1.00 0.00 N ATOM 0 H GLN A 85 -9.027 15.176 -0.223 1.00 0.00 H new ATOM 0 HA GLN A 85 -11.254 17.056 -0.324 1.00 0.00 H new ATOM 0 HB2 GLN A 85 -9.961 15.510 1.543 1.00 0.00 H new ATOM 0 HB3 GLN A 85 -9.127 17.026 1.824 1.00 0.00 H new ATOM 0 HG2 GLN A 85 -12.175 16.818 1.716 1.00 0.00 H new ATOM 0 HG3 GLN A 85 -11.270 16.664 3.208 1.00 0.00 H new ATOM 0 HE21 GLN A 85 -13.158 18.878 2.053 1.00 0.00 H new ATOM 0 HE22 GLN A 85 -12.220 20.358 2.284 1.00 0.00 H new ATOM 579 N LEU A 86 -8.235 18.257 -0.595 1.00 0.00 N ATOM 580 CA LEU A 86 -7.499 19.519 -0.908 1.00 0.00 C ATOM 581 C LEU A 86 -7.958 20.063 -2.262 1.00 0.00 C ATOM 582 O LEU A 86 -7.983 21.259 -2.485 1.00 0.00 O ATOM 583 CB LEU A 86 -6.022 19.124 -0.960 1.00 0.00 C ATOM 584 CG LEU A 86 -5.363 19.425 0.389 1.00 0.00 C ATOM 585 CD1 LEU A 86 -4.310 18.357 0.693 1.00 0.00 C ATOM 586 CD2 LEU A 86 -4.693 20.801 0.336 1.00 0.00 C ATOM 0 H LEU A 86 -7.662 17.413 -0.588 1.00 0.00 H new ATOM 0 HA LEU A 86 -7.679 20.298 -0.168 1.00 0.00 H new ATOM 0 HB2 LEU A 86 -5.927 18.064 -1.194 1.00 0.00 H new ATOM 0 HB3 LEU A 86 -5.516 19.673 -1.754 1.00 0.00 H new ATOM 0 HG LEU A 86 -6.122 19.421 1.171 1.00 0.00 H new ATOM 0 HD11 LEU A 86 -3.841 18.571 1.653 1.00 0.00 H new ATOM 0 HD12 LEU A 86 -4.786 17.377 0.732 1.00 0.00 H new ATOM 0 HD13 LEU A 86 -3.552 18.360 -0.090 1.00 0.00 H new ATOM 0 HD21 LEU A 86 -4.224 21.015 1.297 1.00 0.00 H new ATOM 0 HD22 LEU A 86 -3.935 20.807 -0.447 1.00 0.00 H new ATOM 0 HD23 LEU A 86 -5.443 21.563 0.121 1.00 0.00 H new ATOM 598 N PHE A 87 -8.327 19.188 -3.165 1.00 0.00 N ATOM 599 CA PHE A 87 -8.795 19.645 -4.509 1.00 0.00 C ATOM 600 C PHE A 87 -10.057 20.493 -4.359 1.00 0.00 C ATOM 601 O PHE A 87 -10.263 21.449 -5.082 1.00 0.00 O ATOM 602 CB PHE A 87 -9.099 18.363 -5.291 1.00 0.00 C ATOM 603 CG PHE A 87 -7.885 17.961 -6.094 1.00 0.00 C ATOM 604 CD1 PHE A 87 -6.666 17.720 -5.448 1.00 0.00 C ATOM 605 CD2 PHE A 87 -7.979 17.827 -7.484 1.00 0.00 C ATOM 606 CE1 PHE A 87 -5.541 17.345 -6.193 1.00 0.00 C ATOM 607 CE2 PHE A 87 -6.854 17.453 -8.229 1.00 0.00 C ATOM 608 CZ PHE A 87 -5.635 17.213 -7.584 1.00 0.00 C ATOM 0 H PHE A 87 -8.324 18.177 -3.029 1.00 0.00 H new ATOM 0 HA PHE A 87 -8.052 20.259 -5.018 1.00 0.00 H new ATOM 0 HB2 PHE A 87 -9.375 17.563 -4.604 1.00 0.00 H new ATOM 0 HB3 PHE A 87 -9.950 18.522 -5.954 1.00 0.00 H new ATOM 0 HD1 PHE A 87 -6.594 17.823 -4.375 1.00 0.00 H new ATOM 0 HD2 PHE A 87 -8.919 18.012 -7.982 1.00 0.00 H new ATOM 0 HE1 PHE A 87 -4.601 17.158 -5.695 1.00 0.00 H new ATOM 0 HE2 PHE A 87 -6.927 17.350 -9.302 1.00 0.00 H new ATOM 0 HZ PHE A 87 -4.767 16.926 -8.159 1.00 0.00 H new ATOM 618 N LEU A 88 -10.897 20.151 -3.417 1.00 0.00 N ATOM 619 CA LEU A 88 -12.150 20.937 -3.201 1.00 0.00 C ATOM 620 C LEU A 88 -11.809 22.287 -2.566 1.00 0.00 C ATOM 621 O LEU A 88 -12.483 23.276 -2.786 1.00 0.00 O ATOM 622 CB LEU A 88 -13.000 20.090 -2.249 1.00 0.00 C ATOM 623 CG LEU A 88 -14.462 20.123 -2.697 1.00 0.00 C ATOM 624 CD1 LEU A 88 -14.701 19.033 -3.742 1.00 0.00 C ATOM 625 CD2 LEU A 88 -15.370 19.878 -1.489 1.00 0.00 C ATOM 0 H LEU A 88 -10.770 19.360 -2.786 1.00 0.00 H new ATOM 0 HA LEU A 88 -12.678 21.142 -4.132 1.00 0.00 H new ATOM 0 HB2 LEU A 88 -12.636 19.063 -2.237 1.00 0.00 H new ATOM 0 HB3 LEU A 88 -12.913 20.471 -1.231 1.00 0.00 H new ATOM 0 HG LEU A 88 -14.687 21.097 -3.131 1.00 0.00 H new ATOM 0 HD11 LEU A 88 -15.743 19.057 -4.061 1.00 0.00 H new ATOM 0 HD12 LEU A 88 -14.054 19.206 -4.602 1.00 0.00 H new ATOM 0 HD13 LEU A 88 -14.476 18.058 -3.309 1.00 0.00 H new ATOM 0 HD21 LEU A 88 -16.412 19.901 -1.807 1.00 0.00 H new ATOM 0 HD22 LEU A 88 -15.144 18.904 -1.056 1.00 0.00 H new ATOM 0 HD23 LEU A 88 -15.201 20.655 -0.743 1.00 0.00 H new ATOM 637 N GLN A 89 -10.760 22.331 -1.786 1.00 0.00 N ATOM 638 CA GLN A 89 -10.353 23.610 -1.133 1.00 0.00 C ATOM 639 C GLN A 89 -9.403 24.400 -2.043 1.00 0.00 C ATOM 640 O GLN A 89 -9.215 25.589 -1.867 1.00 0.00 O ATOM 641 CB GLN A 89 -9.638 23.187 0.150 1.00 0.00 C ATOM 642 CG GLN A 89 -10.670 22.755 1.194 1.00 0.00 C ATOM 643 CD GLN A 89 -10.026 22.753 2.580 1.00 0.00 C ATOM 644 OE1 GLN A 89 -10.625 23.194 3.542 1.00 0.00 O ATOM 645 NE2 GLN A 89 -8.822 22.272 2.727 1.00 0.00 N ATOM 0 H GLN A 89 -10.165 21.531 -1.572 1.00 0.00 H new ATOM 0 HA GLN A 89 -11.206 24.258 -0.933 1.00 0.00 H new ATOM 0 HB2 GLN A 89 -8.951 22.367 -0.058 1.00 0.00 H new ATOM 0 HB3 GLN A 89 -9.041 24.013 0.535 1.00 0.00 H new ATOM 0 HG2 GLN A 89 -11.523 23.433 1.179 1.00 0.00 H new ATOM 0 HG3 GLN A 89 -11.049 21.761 0.956 1.00 0.00 H new ATOM 0 HE21 GLN A 89 -8.319 21.902 1.921 1.00 0.00 H new ATOM 0 HE22 GLN A 89 -8.384 22.266 3.648 1.00 0.00 H new ATOM 654 N LEU A 90 -8.799 23.751 -3.013 1.00 0.00 N ATOM 655 CA LEU A 90 -7.856 24.465 -3.937 1.00 0.00 C ATOM 656 C LEU A 90 -8.533 25.696 -4.556 1.00 0.00 C ATOM 657 O LEU A 90 -8.076 26.795 -4.290 1.00 0.00 O ATOM 658 CB LEU A 90 -7.513 23.442 -5.025 1.00 0.00 C ATOM 659 CG LEU A 90 -6.510 24.049 -6.010 1.00 0.00 C ATOM 660 CD1 LEU A 90 -5.141 24.176 -5.337 1.00 0.00 C ATOM 661 CD2 LEU A 90 -6.394 23.144 -7.239 1.00 0.00 C ATOM 662 OXT LEU A 90 -9.494 25.515 -5.286 1.00 0.00 O ATOM 0 H LEU A 90 -8.918 22.756 -3.205 1.00 0.00 H new ATOM 0 HA LEU A 90 -6.969 24.823 -3.415 1.00 0.00 H new ATOM 0 HB2 LEU A 90 -7.094 22.543 -4.573 1.00 0.00 H new ATOM 0 HB3 LEU A 90 -8.418 23.141 -5.553 1.00 0.00 H new ATOM 0 HG LEU A 90 -6.854 25.037 -6.316 1.00 0.00 H new ATOM 0 HD11 LEU A 90 -4.429 24.608 -6.040 1.00 0.00 H new ATOM 0 HD12 LEU A 90 -5.224 24.821 -4.462 1.00 0.00 H new ATOM 0 HD13 LEU A 90 -4.794 23.190 -5.029 1.00 0.00 H new ATOM 0 HD21 LEU A 90 -5.680 23.574 -7.942 1.00 0.00 H new ATOM 0 HD22 LEU A 90 -6.051 22.156 -6.932 1.00 0.00 H new ATOM 0 HD23 LEU A 90 -7.368 23.056 -7.720 1.00 0.00 H new ATOM 675 N GLY B 166 -9.160 27.886 0.507 1.00 0.00 N ATOM 676 CA GLY B 166 -8.538 28.822 -0.473 1.00 0.00 C ATOM 677 C GLY B 166 -7.918 30.006 0.272 1.00 0.00 C ATOM 678 O GLY B 166 -8.608 30.780 0.907 1.00 0.00 O ATOM 0 HA2 GLY B 166 -7.774 28.303 -1.052 1.00 0.00 H new ATOM 0 HA3 GLY B 166 -9.288 29.176 -1.180 1.00 0.00 H new ATOM 684 N LEU B 167 -6.619 30.148 0.196 1.00 0.00 N ATOM 685 CA LEU B 167 -5.939 31.286 0.900 1.00 0.00 C ATOM 686 C LEU B 167 -5.426 32.281 -0.139 1.00 0.00 C ATOM 687 O LEU B 167 -5.839 33.424 -0.183 1.00 0.00 O ATOM 688 CB LEU B 167 -4.743 30.695 1.679 1.00 0.00 C ATOM 689 CG LEU B 167 -5.049 29.287 2.214 1.00 0.00 C ATOM 690 CD1 LEU B 167 -4.521 28.243 1.223 1.00 0.00 C ATOM 691 CD2 LEU B 167 -4.366 29.096 3.571 1.00 0.00 C ATOM 0 H LEU B 167 -5.997 29.527 -0.322 1.00 0.00 H new ATOM 0 HA LEU B 167 -6.626 31.797 1.574 1.00 0.00 H new ATOM 0 HB2 LEU B 167 -3.870 30.654 1.028 1.00 0.00 H new ATOM 0 HB3 LEU B 167 -4.490 31.353 2.511 1.00 0.00 H new ATOM 0 HG LEU B 167 -6.126 29.167 2.332 1.00 0.00 H new ATOM 0 HD11 LEU B 167 -4.736 27.243 1.599 1.00 0.00 H new ATOM 0 HD12 LEU B 167 -5.007 28.380 0.257 1.00 0.00 H new ATOM 0 HD13 LEU B 167 -3.444 28.363 1.107 1.00 0.00 H new ATOM 0 HD21 LEU B 167 -4.583 28.097 3.950 1.00 0.00 H new ATOM 0 HD22 LEU B 167 -3.289 29.214 3.456 1.00 0.00 H new ATOM 0 HD23 LEU B 167 -4.739 29.840 4.274 1.00 0.00 H new ATOM 703 N SER B 168 -4.524 31.841 -0.977 1.00 0.00 N ATOM 704 CA SER B 168 -3.963 32.732 -2.029 1.00 0.00 C ATOM 705 C SER B 168 -3.469 31.888 -3.203 1.00 0.00 C ATOM 706 O SER B 168 -2.464 32.187 -3.817 1.00 0.00 O ATOM 707 CB SER B 168 -2.798 33.457 -1.358 1.00 0.00 C ATOM 708 OG SER B 168 -2.459 34.608 -2.121 1.00 0.00 O ATOM 0 H SER B 168 -4.150 30.892 -0.975 1.00 0.00 H new ATOM 0 HA SER B 168 -4.699 33.434 -2.421 1.00 0.00 H new ATOM 0 HB2 SER B 168 -3.071 33.747 -0.343 1.00 0.00 H new ATOM 0 HB3 SER B 168 -1.938 32.792 -1.279 1.00 0.00 H new ATOM 0 HG SER B 168 -2.313 34.350 -3.055 1.00 0.00 H new ATOM 714 N LYS B 169 -4.165 30.815 -3.505 1.00 0.00 N ATOM 715 CA LYS B 169 -3.742 29.916 -4.627 1.00 0.00 C ATOM 716 C LYS B 169 -2.270 29.518 -4.458 1.00 0.00 C ATOM 717 O LYS B 169 -1.583 29.213 -5.414 1.00 0.00 O ATOM 718 CB LYS B 169 -3.944 30.731 -5.909 1.00 0.00 C ATOM 719 CG LYS B 169 -3.921 29.800 -7.126 1.00 0.00 C ATOM 720 CD LYS B 169 -5.085 28.807 -7.042 1.00 0.00 C ATOM 721 CE LYS B 169 -5.424 28.294 -8.444 1.00 0.00 C ATOM 722 NZ LYS B 169 -6.588 29.112 -8.882 1.00 0.00 N ATOM 0 H LYS B 169 -5.013 30.523 -3.019 1.00 0.00 H new ATOM 0 HA LYS B 169 -4.320 28.992 -4.651 1.00 0.00 H new ATOM 0 HB2 LYS B 169 -4.894 31.264 -5.866 1.00 0.00 H new ATOM 0 HB3 LYS B 169 -3.160 31.483 -6.000 1.00 0.00 H new ATOM 0 HG2 LYS B 169 -3.995 30.384 -8.043 1.00 0.00 H new ATOM 0 HG3 LYS B 169 -2.974 29.262 -7.166 1.00 0.00 H new ATOM 0 HD2 LYS B 169 -4.819 27.973 -6.393 1.00 0.00 H new ATOM 0 HD3 LYS B 169 -5.957 29.289 -6.600 1.00 0.00 H new ATOM 0 HE2 LYS B 169 -4.580 28.414 -9.123 1.00 0.00 H new ATOM 0 HE3 LYS B 169 -5.671 27.233 -8.427 1.00 0.00 H new ATOM 0 HZ1 LYS B 169 -6.879 28.819 -9.836 1.00 0.00 H new ATOM 0 HZ2 LYS B 169 -7.379 28.973 -8.221 1.00 0.00 H new ATOM 0 HZ3 LYS B 169 -6.321 30.117 -8.895 1.00 0.00 H new ATOM 736 N GLU B 170 -1.790 29.525 -3.240 1.00 0.00 N ATOM 737 CA GLU B 170 -0.372 29.154 -2.986 1.00 0.00 C ATOM 738 C GLU B 170 -0.247 28.475 -1.626 1.00 0.00 C ATOM 739 O GLU B 170 0.402 27.453 -1.496 1.00 0.00 O ATOM 740 CB GLU B 170 0.399 30.475 -3.008 1.00 0.00 C ATOM 741 CG GLU B 170 1.827 30.225 -3.492 1.00 0.00 C ATOM 742 CD GLU B 170 2.539 31.565 -3.698 1.00 0.00 C ATOM 743 OE1 GLU B 170 1.975 32.415 -4.368 1.00 0.00 O ATOM 744 OE2 GLU B 170 3.634 31.717 -3.183 1.00 0.00 O ATOM 0 H GLU B 170 -2.326 29.774 -2.408 1.00 0.00 H new ATOM 0 HA GLU B 170 0.013 28.454 -3.727 1.00 0.00 H new ATOM 0 HB2 GLU B 170 -0.099 31.188 -3.665 1.00 0.00 H new ATOM 0 HB3 GLU B 170 0.414 30.916 -2.011 1.00 0.00 H new ATOM 0 HG2 GLU B 170 2.369 29.622 -2.764 1.00 0.00 H new ATOM 0 HG3 GLU B 170 1.813 29.662 -4.425 1.00 0.00 H new ATOM 751 N GLU B 171 -0.871 29.024 -0.613 1.00 0.00 N ATOM 752 CA GLU B 171 -0.790 28.389 0.735 1.00 0.00 C ATOM 753 C GLU B 171 -1.468 27.018 0.687 1.00 0.00 C ATOM 754 O GLU B 171 -1.084 26.100 1.389 1.00 0.00 O ATOM 755 CB GLU B 171 -1.525 29.338 1.691 1.00 0.00 C ATOM 756 CG GLU B 171 -0.538 29.913 2.711 1.00 0.00 C ATOM 757 CD GLU B 171 -0.022 28.790 3.613 1.00 0.00 C ATOM 758 OE1 GLU B 171 -0.647 28.539 4.630 1.00 0.00 O ATOM 759 OE2 GLU B 171 0.990 28.199 3.270 1.00 0.00 O ATOM 0 H GLU B 171 -1.428 29.877 -0.662 1.00 0.00 H new ATOM 0 HA GLU B 171 0.238 28.233 1.063 1.00 0.00 H new ATOM 0 HB2 GLU B 171 -1.992 30.146 1.128 1.00 0.00 H new ATOM 0 HB3 GLU B 171 -2.324 28.804 2.205 1.00 0.00 H new ATOM 0 HG2 GLU B 171 0.295 30.392 2.196 1.00 0.00 H new ATOM 0 HG3 GLU B 171 -1.026 30.681 3.312 1.00 0.00 H new ATOM 766 N LEU B 172 -2.456 26.871 -0.157 1.00 0.00 N ATOM 767 CA LEU B 172 -3.149 25.559 -0.287 1.00 0.00 C ATOM 768 C LEU B 172 -2.326 24.648 -1.203 1.00 0.00 C ATOM 769 O LEU B 172 -2.362 23.438 -1.088 1.00 0.00 O ATOM 770 CB LEU B 172 -4.512 25.880 -0.917 1.00 0.00 C ATOM 771 CG LEU B 172 -5.634 25.321 -0.039 1.00 0.00 C ATOM 772 CD1 LEU B 172 -6.945 26.038 -0.365 1.00 0.00 C ATOM 773 CD2 LEU B 172 -5.793 23.823 -0.310 1.00 0.00 C ATOM 0 H LEU B 172 -2.813 27.609 -0.764 1.00 0.00 H new ATOM 0 HA LEU B 172 -3.268 25.046 0.667 1.00 0.00 H new ATOM 0 HB2 LEU B 172 -4.627 26.958 -1.027 1.00 0.00 H new ATOM 0 HB3 LEU B 172 -4.571 25.449 -1.917 1.00 0.00 H new ATOM 0 HG LEU B 172 -5.386 25.479 1.011 1.00 0.00 H new ATOM 0 HD11 LEU B 172 -7.743 25.639 0.261 1.00 0.00 H new ATOM 0 HD12 LEU B 172 -6.833 27.105 -0.174 1.00 0.00 H new ATOM 0 HD13 LEU B 172 -7.194 25.881 -1.415 1.00 0.00 H new ATOM 0 HD21 LEU B 172 -6.592 23.423 0.315 1.00 0.00 H new ATOM 0 HD22 LEU B 172 -6.041 23.668 -1.360 1.00 0.00 H new ATOM 0 HD23 LEU B 172 -4.860 23.310 -0.078 1.00 0.00 H new ATOM 785 N ILE B 173 -1.575 25.234 -2.106 1.00 0.00 N ATOM 786 CA ILE B 173 -0.733 24.420 -3.029 1.00 0.00 C ATOM 787 C ILE B 173 0.414 23.781 -2.244 1.00 0.00 C ATOM 788 O ILE B 173 0.876 22.704 -2.569 1.00 0.00 O ATOM 789 CB ILE B 173 -0.182 25.408 -4.068 1.00 0.00 C ATOM 790 CG1 ILE B 173 -1.335 26.147 -4.773 1.00 0.00 C ATOM 791 CG2 ILE B 173 0.648 24.647 -5.105 1.00 0.00 C ATOM 792 CD1 ILE B 173 -2.259 25.147 -5.478 1.00 0.00 C ATOM 0 H ILE B 173 -1.511 26.243 -2.241 1.00 0.00 H new ATOM 0 HA ILE B 173 -1.299 23.618 -3.503 1.00 0.00 H new ATOM 0 HB ILE B 173 0.445 26.141 -3.559 1.00 0.00 H new ATOM 0 HG12 ILE B 173 -1.903 26.726 -4.045 1.00 0.00 H new ATOM 0 HG13 ILE B 173 -0.933 26.854 -5.499 1.00 0.00 H new ATOM 0 HG21 ILE B 173 1.039 25.347 -5.843 1.00 0.00 H new ATOM 0 HG22 ILE B 173 1.477 24.142 -4.608 1.00 0.00 H new ATOM 0 HG23 ILE B 173 0.020 23.909 -5.603 1.00 0.00 H new ATOM 0 HD11 ILE B 173 -3.069 25.685 -5.971 1.00 0.00 H new ATOM 0 HD12 ILE B 173 -1.690 24.587 -6.220 1.00 0.00 H new ATOM 0 HD13 ILE B 173 -2.676 24.457 -4.744 1.00 0.00 H new ATOM 804 N GLN B 174 0.871 24.441 -1.206 1.00 0.00 N ATOM 805 CA GLN B 174 1.987 23.874 -0.390 1.00 0.00 C ATOM 806 C GLN B 174 1.488 22.671 0.412 1.00 0.00 C ATOM 807 O GLN B 174 2.229 21.747 0.689 1.00 0.00 O ATOM 808 CB GLN B 174 2.417 25.004 0.549 1.00 0.00 C ATOM 809 CG GLN B 174 3.938 24.981 0.713 1.00 0.00 C ATOM 810 CD GLN B 174 4.576 25.912 -0.319 1.00 0.00 C ATOM 811 OE1 GLN B 174 4.347 25.773 -1.504 1.00 0.00 O ATOM 812 NE2 GLN B 174 5.376 26.862 0.082 1.00 0.00 N ATOM 0 H GLN B 174 0.519 25.345 -0.891 1.00 0.00 H new ATOM 0 HA GLN B 174 2.815 23.528 -1.008 1.00 0.00 H new ATOM 0 HB2 GLN B 174 2.099 25.966 0.147 1.00 0.00 H new ATOM 0 HB3 GLN B 174 1.934 24.888 1.519 1.00 0.00 H new ATOM 0 HG2 GLN B 174 4.211 25.296 1.720 1.00 0.00 H new ATOM 0 HG3 GLN B 174 4.313 23.966 0.584 1.00 0.00 H new ATOM 0 HE21 GLN B 174 5.569 26.980 1.077 1.00 0.00 H new ATOM 0 HE22 GLN B 174 5.808 27.486 -0.599 1.00 0.00 H new ATOM 821 N ASN B 175 0.232 22.676 0.777 1.00 0.00 N ATOM 822 CA ASN B 175 -0.332 21.532 1.555 1.00 0.00 C ATOM 823 C ASN B 175 -0.586 20.345 0.624 1.00 0.00 C ATOM 824 O ASN B 175 -0.525 19.200 1.032 1.00 0.00 O ATOM 825 CB ASN B 175 -1.647 22.051 2.139 1.00 0.00 C ATOM 826 CG ASN B 175 -1.353 23.140 3.172 1.00 0.00 C ATOM 827 OD1 ASN B 175 -0.310 23.139 3.794 1.00 0.00 O ATOM 828 ND2 ASN B 175 -2.237 24.077 3.383 1.00 0.00 N ATOM 0 H ASN B 175 -0.429 23.425 0.569 1.00 0.00 H new ATOM 0 HA ASN B 175 0.346 21.188 2.336 1.00 0.00 H new ATOM 0 HB2 ASN B 175 -2.278 22.450 1.344 1.00 0.00 H new ATOM 0 HB3 ASN B 175 -2.198 21.234 2.604 1.00 0.00 H new ATOM 0 HD21 ASN B 175 -2.052 24.808 4.070 1.00 0.00 H new ATOM 0 HD22 ASN B 175 -3.113 24.078 2.861 1.00 0.00 H new ATOM 835 N MET B 176 -0.865 20.615 -0.627 1.00 0.00 N ATOM 836 CA MET B 176 -1.120 19.508 -1.598 1.00 0.00 C ATOM 837 C MET B 176 0.200 18.840 -1.991 1.00 0.00 C ATOM 838 O MET B 176 0.237 17.670 -2.323 1.00 0.00 O ATOM 839 CB MET B 176 -1.763 20.182 -2.816 1.00 0.00 C ATOM 840 CG MET B 176 -3.280 19.959 -2.790 1.00 0.00 C ATOM 841 SD MET B 176 -3.896 19.746 -4.481 1.00 0.00 S ATOM 842 CE MET B 176 -5.415 20.713 -4.294 1.00 0.00 C ATOM 0 H MET B 176 -0.927 21.555 -1.018 1.00 0.00 H new ATOM 0 HA MET B 176 -1.760 18.732 -1.179 1.00 0.00 H new ATOM 0 HB2 MET B 176 -1.543 21.249 -2.811 1.00 0.00 H new ATOM 0 HB3 MET B 176 -1.341 19.773 -3.734 1.00 0.00 H new ATOM 0 HG2 MET B 176 -3.518 19.079 -2.193 1.00 0.00 H new ATOM 0 HG3 MET B 176 -3.774 20.808 -2.317 1.00 0.00 H new ATOM 0 HE1 MET B 176 -5.698 21.136 -5.258 1.00 0.00 H new ATOM 0 HE2 MET B 176 -6.215 20.067 -3.932 1.00 0.00 H new ATOM 0 HE3 MET B 176 -5.248 21.519 -3.579 1.00 0.00 H new ATOM 852 N ASP B 177 1.283 19.577 -1.952 1.00 0.00 N ATOM 853 CA ASP B 177 2.606 18.990 -2.320 1.00 0.00 C ATOM 854 C ASP B 177 3.131 18.122 -1.176 1.00 0.00 C ATOM 855 O ASP B 177 3.806 17.133 -1.394 1.00 0.00 O ATOM 856 CB ASP B 177 3.528 20.188 -2.554 1.00 0.00 C ATOM 857 CG ASP B 177 3.541 20.540 -4.042 1.00 0.00 C ATOM 858 OD1 ASP B 177 2.484 20.846 -4.568 1.00 0.00 O ATOM 859 OD2 ASP B 177 4.609 20.496 -4.631 1.00 0.00 O ATOM 0 H ASP B 177 1.306 20.560 -1.681 1.00 0.00 H new ATOM 0 HA ASP B 177 2.543 18.352 -3.202 1.00 0.00 H new ATOM 0 HB2 ASP B 177 3.186 21.043 -1.970 1.00 0.00 H new ATOM 0 HB3 ASP B 177 4.538 19.955 -2.216 1.00 0.00 H new ATOM 864 N ARG B 178 2.818 18.484 0.042 1.00 0.00 N ATOM 865 CA ARG B 178 3.289 17.682 1.211 1.00 0.00 C ATOM 866 C ARG B 178 2.469 16.396 1.324 1.00 0.00 C ATOM 867 O ARG B 178 2.954 15.379 1.786 1.00 0.00 O ATOM 868 CB ARG B 178 3.061 18.575 2.431 1.00 0.00 C ATOM 869 CG ARG B 178 4.183 19.615 2.523 1.00 0.00 C ATOM 870 CD ARG B 178 4.544 19.852 3.991 1.00 0.00 C ATOM 871 NE ARG B 178 3.303 20.393 4.610 1.00 0.00 N ATOM 872 CZ ARG B 178 3.362 21.445 5.379 1.00 0.00 C ATOM 873 NH1 ARG B 178 3.798 21.335 6.604 1.00 0.00 N ATOM 874 NH2 ARG B 178 2.986 22.609 4.923 1.00 0.00 N ATOM 0 H ARG B 178 2.256 19.302 0.278 1.00 0.00 H new ATOM 0 HA ARG B 178 4.335 17.389 1.118 1.00 0.00 H new ATOM 0 HB2 ARG B 178 2.095 19.073 2.354 1.00 0.00 H new ATOM 0 HB3 ARG B 178 3.036 17.970 3.338 1.00 0.00 H new ATOM 0 HG2 ARG B 178 5.059 19.269 1.974 1.00 0.00 H new ATOM 0 HG3 ARG B 178 3.865 20.550 2.061 1.00 0.00 H new ATOM 0 HD2 ARG B 178 4.856 18.927 4.475 1.00 0.00 H new ATOM 0 HD3 ARG B 178 5.371 20.555 4.085 1.00 0.00 H new ATOM 0 HE ARG B 178 2.406 19.941 4.433 1.00 0.00 H new ATOM 0 HH11 ARG B 178 4.093 20.426 6.961 1.00 0.00 H new ATOM 0 HH12 ARG B 178 3.844 22.158 7.205 1.00 0.00 H new ATOM 0 HH21 ARG B 178 2.646 22.696 3.965 1.00 0.00 H new ATOM 0 HH22 ARG B 178 3.032 23.432 5.524 1.00 0.00 H new ATOM 888 N VAL B 179 1.233 16.435 0.899 1.00 0.00 N ATOM 889 CA VAL B 179 0.373 15.217 0.970 1.00 0.00 C ATOM 890 C VAL B 179 0.804 14.217 -0.106 1.00 0.00 C ATOM 891 O VAL B 179 0.668 13.019 0.058 1.00 0.00 O ATOM 892 CB VAL B 179 -1.055 15.714 0.712 1.00 0.00 C ATOM 893 CG1 VAL B 179 -2.030 14.534 0.749 1.00 0.00 C ATOM 894 CG2 VAL B 179 -1.448 16.729 1.792 1.00 0.00 C ATOM 0 H VAL B 179 0.781 17.260 0.505 1.00 0.00 H new ATOM 0 HA VAL B 179 0.450 14.708 1.931 1.00 0.00 H new ATOM 0 HB VAL B 179 -1.096 16.187 -0.269 1.00 0.00 H new ATOM 0 HG11 VAL B 179 -3.043 14.893 0.565 1.00 0.00 H new ATOM 0 HG12 VAL B 179 -1.756 13.811 -0.020 1.00 0.00 H new ATOM 0 HG13 VAL B 179 -1.986 14.057 1.728 1.00 0.00 H new ATOM 0 HG21 VAL B 179 -2.463 17.082 1.608 1.00 0.00 H new ATOM 0 HG22 VAL B 179 -1.401 16.254 2.772 1.00 0.00 H new ATOM 0 HG23 VAL B 179 -0.760 17.574 1.765 1.00 0.00 H new ATOM 904 N ASP B 180 1.328 14.703 -1.202 1.00 0.00 N ATOM 905 CA ASP B 180 1.777 13.786 -2.294 1.00 0.00 C ATOM 906 C ASP B 180 3.026 13.021 -1.855 1.00 0.00 C ATOM 907 O ASP B 180 3.265 11.909 -2.287 1.00 0.00 O ATOM 908 CB ASP B 180 2.094 14.697 -3.483 1.00 0.00 C ATOM 909 CG ASP B 180 0.881 14.764 -4.413 1.00 0.00 C ATOM 910 OD1 ASP B 180 0.574 13.757 -5.029 1.00 0.00 O ATOM 911 OD2 ASP B 180 0.280 15.823 -4.493 1.00 0.00 O ATOM 0 H ASP B 180 1.465 15.696 -1.389 1.00 0.00 H new ATOM 0 HA ASP B 180 1.019 13.044 -2.546 1.00 0.00 H new ATOM 0 HB2 ASP B 180 2.351 15.696 -3.131 1.00 0.00 H new ATOM 0 HB3 ASP B 180 2.960 14.317 -4.025 1.00 0.00 H new ATOM 916 N ARG B 181 3.822 13.610 -0.999 1.00 0.00 N ATOM 917 CA ARG B 181 5.061 12.921 -0.524 1.00 0.00 C ATOM 918 C ARG B 181 4.700 11.814 0.468 1.00 0.00 C ATOM 919 O ARG B 181 5.400 10.825 0.588 1.00 0.00 O ATOM 920 CB ARG B 181 5.888 14.010 0.164 1.00 0.00 C ATOM 921 CG ARG B 181 6.908 14.579 -0.824 1.00 0.00 C ATOM 922 CD ARG B 181 7.343 15.972 -0.363 1.00 0.00 C ATOM 923 NE ARG B 181 8.000 15.751 0.955 1.00 0.00 N ATOM 924 CZ ARG B 181 9.083 16.411 1.263 1.00 0.00 C ATOM 925 NH1 ARG B 181 8.995 17.582 1.832 1.00 0.00 N ATOM 926 NH2 ARG B 181 10.255 15.900 1.000 1.00 0.00 N ATOM 0 H ARG B 181 3.667 14.539 -0.608 1.00 0.00 H new ATOM 0 HA ARG B 181 5.610 12.452 -1.340 1.00 0.00 H new ATOM 0 HB2 ARG B 181 5.234 14.804 0.525 1.00 0.00 H new ATOM 0 HB3 ARG B 181 6.400 13.598 1.034 1.00 0.00 H new ATOM 0 HG2 ARG B 181 7.773 13.919 -0.890 1.00 0.00 H new ATOM 0 HG3 ARG B 181 6.472 14.634 -1.822 1.00 0.00 H new ATOM 0 HD2 ARG B 181 8.030 16.427 -1.076 1.00 0.00 H new ATOM 0 HD3 ARG B 181 6.489 16.643 -0.271 1.00 0.00 H new ATOM 0 HE ARG B 181 7.604 15.084 1.617 1.00 0.00 H new ATOM 0 HH11 ARG B 181 8.079 17.982 2.036 1.00 0.00 H new ATOM 0 HH12 ARG B 181 9.842 18.097 2.072 1.00 0.00 H new ATOM 0 HH21 ARG B 181 10.324 14.985 0.554 1.00 0.00 H new ATOM 0 HH22 ARG B 181 11.102 16.415 1.240 1.00 0.00 H new ATOM 940 N GLU B 182 3.613 11.974 1.180 1.00 0.00 N ATOM 941 CA GLU B 182 3.199 10.932 2.168 1.00 0.00 C ATOM 942 C GLU B 182 2.595 9.729 1.443 1.00 0.00 C ATOM 943 O GLU B 182 2.753 8.598 1.862 1.00 0.00 O ATOM 944 CB GLU B 182 2.150 11.609 3.052 1.00 0.00 C ATOM 945 CG GLU B 182 2.253 11.062 4.477 1.00 0.00 C ATOM 946 CD GLU B 182 1.530 12.006 5.439 1.00 0.00 C ATOM 947 OE1 GLU B 182 1.702 13.206 5.302 1.00 0.00 O ATOM 948 OE2 GLU B 182 0.818 11.513 6.299 1.00 0.00 O ATOM 0 H GLU B 182 2.994 12.782 1.120 1.00 0.00 H new ATOM 0 HA GLU B 182 4.041 10.562 2.752 1.00 0.00 H new ATOM 0 HB2 GLU B 182 2.302 12.688 3.054 1.00 0.00 H new ATOM 0 HB3 GLU B 182 1.152 11.429 2.653 1.00 0.00 H new ATOM 0 HG2 GLU B 182 1.813 10.066 4.528 1.00 0.00 H new ATOM 0 HG3 GLU B 182 3.300 10.963 4.765 1.00 0.00 H new ATOM 955 N ILE B 183 1.908 9.968 0.356 1.00 0.00 N ATOM 956 CA ILE B 183 1.292 8.841 -0.409 1.00 0.00 C ATOM 957 C ILE B 183 2.379 8.074 -1.166 1.00 0.00 C ATOM 958 O ILE B 183 2.260 6.886 -1.401 1.00 0.00 O ATOM 959 CB ILE B 183 0.307 9.499 -1.382 1.00 0.00 C ATOM 960 CG1 ILE B 183 -0.744 10.286 -0.592 1.00 0.00 C ATOM 961 CG2 ILE B 183 -0.393 8.420 -2.214 1.00 0.00 C ATOM 962 CD1 ILE B 183 -1.635 11.067 -1.560 1.00 0.00 C ATOM 0 H ILE B 183 1.746 10.896 -0.036 1.00 0.00 H new ATOM 0 HA ILE B 183 0.788 8.125 0.240 1.00 0.00 H new ATOM 0 HB ILE B 183 0.851 10.174 -2.043 1.00 0.00 H new ATOM 0 HG12 ILE B 183 -1.349 9.605 0.006 1.00 0.00 H new ATOM 0 HG13 ILE B 183 -0.255 10.971 0.101 1.00 0.00 H new ATOM 0 HG21 ILE B 183 -1.093 8.890 -2.905 1.00 0.00 H new ATOM 0 HG22 ILE B 183 0.350 7.856 -2.778 1.00 0.00 H new ATOM 0 HG23 ILE B 183 -0.935 7.745 -1.552 1.00 0.00 H new ATOM 0 HD11 ILE B 183 -2.382 11.626 -0.996 1.00 0.00 H new ATOM 0 HD12 ILE B 183 -1.024 11.759 -2.139 1.00 0.00 H new ATOM 0 HD13 ILE B 183 -2.135 10.373 -2.235 1.00 0.00 H new ATOM 974 N THR B 184 3.441 8.744 -1.537 1.00 0.00 N ATOM 975 CA THR B 184 4.545 8.054 -2.271 1.00 0.00 C ATOM 976 C THR B 184 5.335 7.170 -1.303 1.00 0.00 C ATOM 977 O THR B 184 5.816 6.115 -1.666 1.00 0.00 O ATOM 978 CB THR B 184 5.430 9.176 -2.819 1.00 0.00 C ATOM 979 OG1 THR B 184 4.611 10.225 -3.313 1.00 0.00 O ATOM 980 CG2 THR B 184 6.304 8.632 -3.951 1.00 0.00 C ATOM 0 H THR B 184 3.591 9.738 -1.364 1.00 0.00 H new ATOM 0 HA THR B 184 4.174 7.411 -3.069 1.00 0.00 H new ATOM 0 HB THR B 184 6.068 9.558 -2.022 1.00 0.00 H new ATOM 0 HG1 THR B 184 4.486 10.900 -2.613 1.00 0.00 H new ATOM 0 HG21 THR B 184 6.934 9.432 -4.341 1.00 0.00 H new ATOM 0 HG22 THR B 184 6.933 7.827 -3.570 1.00 0.00 H new ATOM 0 HG23 THR B 184 5.668 8.249 -4.749 1.00 0.00 H new ATOM 988 N MET B 185 5.462 7.596 -0.070 1.00 0.00 N ATOM 989 CA MET B 185 6.214 6.781 0.932 1.00 0.00 C ATOM 990 C MET B 185 5.428 5.510 1.260 1.00 0.00 C ATOM 991 O MET B 185 5.994 4.443 1.414 1.00 0.00 O ATOM 992 CB MET B 185 6.337 7.671 2.170 1.00 0.00 C ATOM 993 CG MET B 185 7.698 7.441 2.832 1.00 0.00 C ATOM 994 SD MET B 185 8.097 8.850 3.895 1.00 0.00 S ATOM 995 CE MET B 185 8.499 7.904 5.384 1.00 0.00 C ATOM 0 H MET B 185 5.078 8.472 0.285 1.00 0.00 H new ATOM 0 HA MET B 185 7.192 6.471 0.563 1.00 0.00 H new ATOM 0 HB2 MET B 185 6.230 8.719 1.890 1.00 0.00 H new ATOM 0 HB3 MET B 185 5.536 7.446 2.874 1.00 0.00 H new ATOM 0 HG2 MET B 185 7.678 6.523 3.419 1.00 0.00 H new ATOM 0 HG3 MET B 185 8.468 7.316 2.071 1.00 0.00 H new ATOM 0 HE1 MET B 185 8.779 8.588 6.185 1.00 0.00 H new ATOM 0 HE2 MET B 185 7.630 7.322 5.691 1.00 0.00 H new ATOM 0 HE3 MET B 185 9.330 7.231 5.174 1.00 0.00 H new ATOM 1005 N VAL B 186 4.128 5.619 1.361 1.00 0.00 N ATOM 1006 CA VAL B 186 3.296 4.415 1.671 1.00 0.00 C ATOM 1007 C VAL B 186 3.280 3.477 0.462 1.00 0.00 C ATOM 1008 O VAL B 186 3.168 2.274 0.600 1.00 0.00 O ATOM 1009 CB VAL B 186 1.890 4.955 1.959 1.00 0.00 C ATOM 1010 CG1 VAL B 186 0.953 3.794 2.305 1.00 0.00 C ATOM 1011 CG2 VAL B 186 1.945 5.927 3.140 1.00 0.00 C ATOM 0 H VAL B 186 3.606 6.488 1.243 1.00 0.00 H new ATOM 0 HA VAL B 186 3.684 3.847 2.516 1.00 0.00 H new ATOM 0 HB VAL B 186 1.518 5.474 1.075 1.00 0.00 H new ATOM 0 HG11 VAL B 186 -0.045 4.181 2.509 1.00 0.00 H new ATOM 0 HG12 VAL B 186 0.909 3.100 1.466 1.00 0.00 H new ATOM 0 HG13 VAL B 186 1.328 3.274 3.187 1.00 0.00 H new ATOM 0 HG21 VAL B 186 0.945 6.310 3.343 1.00 0.00 H new ATOM 0 HG22 VAL B 186 2.321 5.408 4.022 1.00 0.00 H new ATOM 0 HG23 VAL B 186 2.609 6.757 2.898 1.00 0.00 H new ATOM 1021 N GLU B 187 3.396 4.024 -0.722 1.00 0.00 N ATOM 1022 CA GLU B 187 3.395 3.172 -1.949 1.00 0.00 C ATOM 1023 C GLU B 187 4.700 2.378 -2.038 1.00 0.00 C ATOM 1024 O GLU B 187 4.740 1.297 -2.596 1.00 0.00 O ATOM 1025 CB GLU B 187 3.282 4.151 -3.121 1.00 0.00 C ATOM 1026 CG GLU B 187 2.562 3.471 -4.286 1.00 0.00 C ATOM 1027 CD GLU B 187 3.553 2.603 -5.064 1.00 0.00 C ATOM 1028 OE1 GLU B 187 4.603 3.111 -5.419 1.00 0.00 O ATOM 1029 OE2 GLU B 187 3.245 1.444 -5.290 1.00 0.00 O ATOM 0 H GLU B 187 3.491 5.025 -0.891 1.00 0.00 H new ATOM 0 HA GLU B 187 2.579 2.449 -1.947 1.00 0.00 H new ATOM 0 HB2 GLU B 187 2.736 5.042 -2.813 1.00 0.00 H new ATOM 0 HB3 GLU B 187 4.274 4.477 -3.433 1.00 0.00 H new ATOM 0 HG2 GLU B 187 1.742 2.858 -3.912 1.00 0.00 H new ATOM 0 HG3 GLU B 187 2.125 4.221 -4.945 1.00 0.00 H new ATOM 1036 N GLN B 188 5.766 2.907 -1.491 1.00 0.00 N ATOM 1037 CA GLN B 188 7.074 2.183 -1.540 1.00 0.00 C ATOM 1038 C GLN B 188 7.021 0.947 -0.643 1.00 0.00 C ATOM 1039 O GLN B 188 7.618 -0.071 -0.940 1.00 0.00 O ATOM 1040 CB GLN B 188 8.110 3.181 -1.017 1.00 0.00 C ATOM 1041 CG GLN B 188 8.366 4.259 -2.073 1.00 0.00 C ATOM 1042 CD GLN B 188 9.004 3.626 -3.310 1.00 0.00 C ATOM 1043 OE1 GLN B 188 10.139 3.192 -3.268 1.00 0.00 O ATOM 1044 NE2 GLN B 188 8.319 3.555 -4.418 1.00 0.00 N ATOM 0 H GLN B 188 5.787 3.808 -1.013 1.00 0.00 H new ATOM 0 HA GLN B 188 7.317 1.841 -2.546 1.00 0.00 H new ATOM 0 HB2 GLN B 188 7.754 3.639 -0.094 1.00 0.00 H new ATOM 0 HB3 GLN B 188 9.039 2.664 -0.778 1.00 0.00 H new ATOM 0 HG2 GLN B 188 7.429 4.746 -2.344 1.00 0.00 H new ATOM 0 HG3 GLN B 188 9.021 5.030 -1.668 1.00 0.00 H new ATOM 0 HE21 GLN B 188 7.367 3.919 -4.453 1.00 0.00 H new ATOM 0 HE22 GLN B 188 8.736 3.135 -5.249 1.00 0.00 H new ATOM 1053 N GLN B 189 6.306 1.029 0.448 1.00 0.00 N ATOM 1054 CA GLN B 189 6.203 -0.141 1.370 1.00 0.00 C ATOM 1055 C GLN B 189 5.276 -1.196 0.763 1.00 0.00 C ATOM 1056 O GLN B 189 5.517 -2.383 0.871 1.00 0.00 O ATOM 1057 CB GLN B 189 5.613 0.417 2.673 1.00 0.00 C ATOM 1058 CG GLN B 189 6.474 -0.021 3.865 1.00 0.00 C ATOM 1059 CD GLN B 189 7.401 1.125 4.282 1.00 0.00 C ATOM 1060 OE1 GLN B 189 7.614 1.350 5.456 1.00 0.00 O ATOM 1061 NE2 GLN B 189 7.964 1.862 3.364 1.00 0.00 N ATOM 0 H GLN B 189 5.788 1.857 0.741 1.00 0.00 H new ATOM 0 HA GLN B 189 7.167 -0.620 1.543 1.00 0.00 H new ATOM 0 HB2 GLN B 189 5.568 1.505 2.626 1.00 0.00 H new ATOM 0 HB3 GLN B 189 4.591 0.061 2.801 1.00 0.00 H new ATOM 0 HG2 GLN B 189 5.836 -0.308 4.701 1.00 0.00 H new ATOM 0 HG3 GLN B 189 7.063 -0.899 3.598 1.00 0.00 H new ATOM 0 HE21 GLN B 189 7.785 1.673 2.378 1.00 0.00 H new ATOM 0 HE22 GLN B 189 8.583 2.627 3.633 1.00 0.00 H new ATOM 1070 N ILE B 190 4.222 -0.765 0.118 1.00 0.00 N ATOM 1071 CA ILE B 190 3.275 -1.736 -0.509 1.00 0.00 C ATOM 1072 C ILE B 190 3.914 -2.345 -1.760 1.00 0.00 C ATOM 1073 O ILE B 190 3.627 -3.469 -2.128 1.00 0.00 O ATOM 1074 CB ILE B 190 2.031 -0.916 -0.871 1.00 0.00 C ATOM 1075 CG1 ILE B 190 1.442 -0.300 0.403 1.00 0.00 C ATOM 1076 CG2 ILE B 190 0.988 -1.826 -1.525 1.00 0.00 C ATOM 1077 CD1 ILE B 190 0.266 0.610 0.046 1.00 0.00 C ATOM 0 H ILE B 190 3.976 0.218 -0.002 1.00 0.00 H new ATOM 0 HA ILE B 190 3.023 -2.562 0.156 1.00 0.00 H new ATOM 0 HB ILE B 190 2.308 -0.125 -1.568 1.00 0.00 H new ATOM 0 HG12 ILE B 190 1.111 -1.088 1.079 1.00 0.00 H new ATOM 0 HG13 ILE B 190 2.208 0.270 0.929 1.00 0.00 H new ATOM 0 HG21 ILE B 190 0.105 -1.241 -1.781 1.00 0.00 H new ATOM 0 HG22 ILE B 190 1.406 -2.267 -2.430 1.00 0.00 H new ATOM 0 HG23 ILE B 190 0.709 -2.618 -0.830 1.00 0.00 H new ATOM 0 HD11 ILE B 190 -0.147 1.044 0.956 1.00 0.00 H new ATOM 0 HD12 ILE B 190 0.610 1.407 -0.613 1.00 0.00 H new ATOM 0 HD13 ILE B 190 -0.504 0.028 -0.460 1.00 0.00 H new ATOM 1089 N SER B 191 4.785 -1.613 -2.408 1.00 0.00 N ATOM 1090 CA SER B 191 5.456 -2.148 -3.631 1.00 0.00 C ATOM 1091 C SER B 191 6.492 -3.199 -3.234 1.00 0.00 C ATOM 1092 O SER B 191 6.697 -4.174 -3.932 1.00 0.00 O ATOM 1093 CB SER B 191 6.133 -0.942 -4.283 1.00 0.00 C ATOM 1094 OG SER B 191 6.913 -0.259 -3.310 1.00 0.00 O ATOM 0 H SER B 191 5.060 -0.667 -2.142 1.00 0.00 H new ATOM 0 HA SER B 191 4.754 -2.628 -4.313 1.00 0.00 H new ATOM 0 HB2 SER B 191 6.765 -1.268 -5.109 1.00 0.00 H new ATOM 0 HB3 SER B 191 5.383 -0.271 -4.701 1.00 0.00 H new ATOM 0 HG SER B 191 6.779 -0.675 -2.433 1.00 0.00 H new ATOM 1100 N LYS B 192 7.138 -3.011 -2.111 1.00 0.00 N ATOM 1101 CA LYS B 192 8.154 -4.004 -1.655 1.00 0.00 C ATOM 1102 C LYS B 192 7.446 -5.222 -1.063 1.00 0.00 C ATOM 1103 O LYS B 192 7.913 -6.340 -1.178 1.00 0.00 O ATOM 1104 CB LYS B 192 8.976 -3.279 -0.588 1.00 0.00 C ATOM 1105 CG LYS B 192 9.669 -2.064 -1.211 1.00 0.00 C ATOM 1106 CD LYS B 192 11.082 -2.452 -1.653 1.00 0.00 C ATOM 1107 CE LYS B 192 12.007 -2.484 -0.433 1.00 0.00 C ATOM 1108 NZ LYS B 192 12.583 -1.113 -0.353 1.00 0.00 N ATOM 0 H LYS B 192 7.005 -2.212 -1.491 1.00 0.00 H new ATOM 0 HA LYS B 192 8.787 -4.361 -2.468 1.00 0.00 H new ATOM 0 HB2 LYS B 192 8.329 -2.962 0.230 1.00 0.00 H new ATOM 0 HB3 LYS B 192 9.718 -3.956 -0.164 1.00 0.00 H new ATOM 0 HG2 LYS B 192 9.096 -1.704 -2.065 1.00 0.00 H new ATOM 0 HG3 LYS B 192 9.714 -1.248 -0.490 1.00 0.00 H new ATOM 0 HD2 LYS B 192 11.068 -3.428 -2.138 1.00 0.00 H new ATOM 0 HD3 LYS B 192 11.454 -1.737 -2.387 1.00 0.00 H new ATOM 0 HE2 LYS B 192 11.457 -2.735 0.474 1.00 0.00 H new ATOM 0 HE3 LYS B 192 12.789 -3.235 -0.549 1.00 0.00 H new ATOM 0 HZ1 LYS B 192 13.229 -1.055 0.460 1.00 0.00 H new ATOM 0 HZ2 LYS B 192 13.107 -0.905 -1.227 1.00 0.00 H new ATOM 0 HZ3 LYS B 192 11.816 -0.421 -0.236 1.00 0.00 H new ATOM 1122 N LEU B 193 6.314 -5.010 -0.442 1.00 0.00 N ATOM 1123 CA LEU B 193 5.555 -6.152 0.151 1.00 0.00 C ATOM 1124 C LEU B 193 4.883 -6.951 -0.968 1.00 0.00 C ATOM 1125 O LEU B 193 4.700 -8.149 -0.864 1.00 0.00 O ATOM 1126 CB LEU B 193 4.507 -5.510 1.070 1.00 0.00 C ATOM 1127 CG LEU B 193 4.542 -6.184 2.447 1.00 0.00 C ATOM 1128 CD1 LEU B 193 4.335 -5.132 3.538 1.00 0.00 C ATOM 1129 CD2 LEU B 193 3.430 -7.233 2.532 1.00 0.00 C ATOM 0 H LEU B 193 5.882 -4.094 -0.320 1.00 0.00 H new ATOM 0 HA LEU B 193 6.195 -6.841 0.703 1.00 0.00 H new ATOM 0 HB2 LEU B 193 4.704 -4.443 1.172 1.00 0.00 H new ATOM 0 HB3 LEU B 193 3.514 -5.610 0.631 1.00 0.00 H new ATOM 0 HG LEU B 193 5.509 -6.667 2.588 1.00 0.00 H new ATOM 0 HD11 LEU B 193 4.360 -5.612 4.516 1.00 0.00 H new ATOM 0 HD12 LEU B 193 5.128 -4.386 3.480 1.00 0.00 H new ATOM 0 HD13 LEU B 193 3.369 -4.647 3.397 1.00 0.00 H new ATOM 0 HD21 LEU B 193 3.455 -7.712 3.511 1.00 0.00 H new ATOM 0 HD22 LEU B 193 2.463 -6.751 2.389 1.00 0.00 H new ATOM 0 HD23 LEU B 193 3.579 -7.985 1.757 1.00 0.00 H new ATOM 1141 N LYS B 194 4.526 -6.292 -2.045 1.00 0.00 N ATOM 1142 CA LYS B 194 3.875 -7.009 -3.183 1.00 0.00 C ATOM 1143 C LYS B 194 4.888 -7.943 -3.845 1.00 0.00 C ATOM 1144 O LYS B 194 4.555 -9.033 -4.270 1.00 0.00 O ATOM 1145 CB LYS B 194 3.437 -5.912 -4.157 1.00 0.00 C ATOM 1146 CG LYS B 194 2.326 -6.449 -5.063 1.00 0.00 C ATOM 1147 CD LYS B 194 1.001 -6.453 -4.298 1.00 0.00 C ATOM 1148 CE LYS B 194 -0.088 -7.086 -5.166 1.00 0.00 C ATOM 1149 NZ LYS B 194 -0.753 -5.940 -5.846 1.00 0.00 N ATOM 0 H LYS B 194 4.658 -5.290 -2.183 1.00 0.00 H new ATOM 0 HA LYS B 194 3.030 -7.618 -2.863 1.00 0.00 H new ATOM 0 HB2 LYS B 194 3.082 -5.041 -3.605 1.00 0.00 H new ATOM 0 HB3 LYS B 194 4.285 -5.585 -4.758 1.00 0.00 H new ATOM 0 HG2 LYS B 194 2.240 -5.831 -5.957 1.00 0.00 H new ATOM 0 HG3 LYS B 194 2.569 -7.458 -5.396 1.00 0.00 H new ATOM 0 HD2 LYS B 194 1.108 -7.010 -3.367 1.00 0.00 H new ATOM 0 HD3 LYS B 194 0.721 -5.434 -4.030 1.00 0.00 H new ATOM 0 HE2 LYS B 194 0.338 -7.781 -5.890 1.00 0.00 H new ATOM 0 HE3 LYS B 194 -0.797 -7.651 -4.561 1.00 0.00 H new ATOM 0 HZ1 LYS B 194 -1.513 -6.295 -6.461 1.00 0.00 H new ATOM 0 HZ2 LYS B 194 -1.155 -5.299 -5.133 1.00 0.00 H new ATOM 0 HZ3 LYS B 194 -0.056 -5.425 -6.420 1.00 0.00 H new ATOM 1163 N LYS B 195 6.127 -7.524 -3.922 1.00 0.00 N ATOM 1164 CA LYS B 195 7.175 -8.388 -4.544 1.00 0.00 C ATOM 1165 C LYS B 195 7.431 -9.605 -3.652 1.00 0.00 C ATOM 1166 O LYS B 195 7.773 -10.673 -4.126 1.00 0.00 O ATOM 1167 CB LYS B 195 8.423 -7.509 -4.633 1.00 0.00 C ATOM 1168 CG LYS B 195 9.351 -8.047 -5.724 1.00 0.00 C ATOM 1169 CD LYS B 195 8.752 -7.748 -7.099 1.00 0.00 C ATOM 1170 CE LYS B 195 9.857 -7.785 -8.158 1.00 0.00 C ATOM 1171 NZ LYS B 195 9.876 -9.193 -8.643 1.00 0.00 N ATOM 0 H LYS B 195 6.457 -6.621 -3.581 1.00 0.00 H new ATOM 0 HA LYS B 195 6.881 -8.761 -5.525 1.00 0.00 H new ATOM 0 HB2 LYS B 195 8.141 -6.480 -4.856 1.00 0.00 H new ATOM 0 HB3 LYS B 195 8.941 -7.497 -3.674 1.00 0.00 H new ATOM 0 HG2 LYS B 195 10.336 -7.588 -5.637 1.00 0.00 H new ATOM 0 HG3 LYS B 195 9.488 -9.121 -5.602 1.00 0.00 H new ATOM 0 HD2 LYS B 195 7.980 -8.480 -7.338 1.00 0.00 H new ATOM 0 HD3 LYS B 195 8.272 -6.769 -7.093 1.00 0.00 H new ATOM 0 HE2 LYS B 195 9.648 -7.090 -8.971 1.00 0.00 H new ATOM 0 HE3 LYS B 195 10.820 -7.500 -7.734 1.00 0.00 H new ATOM 0 HZ1 LYS B 195 10.609 -9.299 -9.373 1.00 0.00 H new ATOM 0 HZ2 LYS B 195 10.084 -9.831 -7.848 1.00 0.00 H new ATOM 0 HZ3 LYS B 195 8.948 -9.434 -9.047 1.00 0.00 H new ATOM 1185 N LYS B 196 7.258 -9.450 -2.364 1.00 0.00 N ATOM 1186 CA LYS B 196 7.478 -10.595 -1.428 1.00 0.00 C ATOM 1187 C LYS B 196 6.432 -11.680 -1.694 1.00 0.00 C ATOM 1188 O LYS B 196 6.711 -12.861 -1.598 1.00 0.00 O ATOM 1189 CB LYS B 196 7.305 -10.006 -0.024 1.00 0.00 C ATOM 1190 CG LYS B 196 7.514 -11.101 1.030 1.00 0.00 C ATOM 1191 CD LYS B 196 6.155 -11.635 1.496 1.00 0.00 C ATOM 1192 CE LYS B 196 5.384 -10.524 2.219 1.00 0.00 C ATOM 1193 NZ LYS B 196 5.511 -10.849 3.668 1.00 0.00 N ATOM 0 H LYS B 196 6.973 -8.578 -1.919 1.00 0.00 H new ATOM 0 HA LYS B 196 8.459 -11.054 -1.549 1.00 0.00 H new ATOM 0 HB2 LYS B 196 8.020 -9.198 0.132 1.00 0.00 H new ATOM 0 HB3 LYS B 196 6.309 -9.575 0.079 1.00 0.00 H new ATOM 0 HG2 LYS B 196 8.111 -11.912 0.612 1.00 0.00 H new ATOM 0 HG3 LYS B 196 8.069 -10.701 1.879 1.00 0.00 H new ATOM 0 HD2 LYS B 196 5.581 -11.992 0.641 1.00 0.00 H new ATOM 0 HD3 LYS B 196 6.297 -12.486 2.163 1.00 0.00 H new ATOM 0 HE2 LYS B 196 5.803 -9.543 1.996 1.00 0.00 H new ATOM 0 HE3 LYS B 196 4.339 -10.502 1.909 1.00 0.00 H new ATOM 0 HZ1 LYS B 196 4.994 -10.142 4.229 1.00 0.00 H new ATOM 0 HZ2 LYS B 196 5.113 -11.793 3.848 1.00 0.00 H new ATOM 0 HZ3 LYS B 196 6.515 -10.839 3.939 1.00 0.00 H new ATOM 1207 N GLN B 197 5.235 -11.282 -2.032 1.00 0.00 N ATOM 1208 CA GLN B 197 4.160 -12.282 -2.316 1.00 0.00 C ATOM 1209 C GLN B 197 4.545 -13.125 -3.532 1.00 0.00 C ATOM 1210 O GLN B 197 4.184 -14.281 -3.638 1.00 0.00 O ATOM 1211 CB GLN B 197 2.904 -11.456 -2.609 1.00 0.00 C ATOM 1212 CG GLN B 197 1.692 -12.385 -2.702 1.00 0.00 C ATOM 1213 CD GLN B 197 1.354 -12.924 -1.311 1.00 0.00 C ATOM 1214 OE1 GLN B 197 0.605 -12.313 -0.576 1.00 0.00 O ATOM 1215 NE2 GLN B 197 1.878 -14.052 -0.916 1.00 0.00 N ATOM 0 H GLN B 197 4.953 -10.306 -2.124 1.00 0.00 H new ATOM 0 HA GLN B 197 4.003 -12.968 -1.484 1.00 0.00 H new ATOM 0 HB2 GLN B 197 2.750 -10.718 -1.822 1.00 0.00 H new ATOM 0 HB3 GLN B 197 3.027 -10.907 -3.542 1.00 0.00 H new ATOM 0 HG2 GLN B 197 0.838 -11.846 -3.112 1.00 0.00 H new ATOM 0 HG3 GLN B 197 1.904 -13.210 -3.382 1.00 0.00 H new ATOM 0 HE21 GLN B 197 2.507 -14.566 -1.533 1.00 0.00 H new ATOM 0 HE22 GLN B 197 1.658 -14.420 0.010 1.00 0.00 H new ATOM 1224 N GLN B 198 5.281 -12.547 -4.448 1.00 0.00 N ATOM 1225 CA GLN B 198 5.705 -13.307 -5.665 1.00 0.00 C ATOM 1226 C GLN B 198 6.574 -14.497 -5.259 1.00 0.00 C ATOM 1227 O GLN B 198 6.438 -15.586 -5.785 1.00 0.00 O ATOM 1228 CB GLN B 198 6.513 -12.314 -6.501 1.00 0.00 C ATOM 1229 CG GLN B 198 6.478 -12.735 -7.973 1.00 0.00 C ATOM 1230 CD GLN B 198 6.435 -11.489 -8.859 1.00 0.00 C ATOM 1231 OE1 GLN B 198 7.217 -11.357 -9.780 1.00 0.00 O ATOM 1232 NE2 GLN B 198 5.548 -10.564 -8.618 1.00 0.00 N ATOM 0 H GLN B 198 5.607 -11.581 -4.406 1.00 0.00 H new ATOM 0 HA GLN B 198 4.855 -13.703 -6.221 1.00 0.00 H new ATOM 0 HB2 GLN B 198 6.103 -11.310 -6.389 1.00 0.00 H new ATOM 0 HB3 GLN B 198 7.543 -12.278 -6.147 1.00 0.00 H new ATOM 0 HG2 GLN B 198 7.357 -13.334 -8.212 1.00 0.00 H new ATOM 0 HG3 GLN B 198 5.605 -13.360 -8.163 1.00 0.00 H new ATOM 0 HE21 GLN B 198 4.892 -10.675 -7.845 1.00 0.00 H new ATOM 0 HE22 GLN B 198 5.510 -9.729 -9.203 1.00 0.00 H new ATOM 1241 N GLN B 199 7.462 -14.292 -4.322 1.00 0.00 N ATOM 1242 CA GLN B 199 8.347 -15.407 -3.865 1.00 0.00 C ATOM 1243 C GLN B 199 7.502 -16.532 -3.264 1.00 0.00 C ATOM 1244 O GLN B 199 7.698 -17.694 -3.563 1.00 0.00 O ATOM 1245 CB GLN B 199 9.258 -14.792 -2.800 1.00 0.00 C ATOM 1246 CG GLN B 199 10.641 -15.439 -2.874 1.00 0.00 C ATOM 1247 CD GLN B 199 11.359 -14.967 -4.140 1.00 0.00 C ATOM 1248 OE1 GLN B 199 11.827 -15.770 -4.922 1.00 0.00 O ATOM 1249 NE2 GLN B 199 11.467 -13.688 -4.376 1.00 0.00 N ATOM 0 H GLN B 199 7.614 -13.400 -3.852 1.00 0.00 H new ATOM 0 HA GLN B 199 8.922 -15.839 -4.685 1.00 0.00 H new ATOM 0 HB2 GLN B 199 9.340 -13.716 -2.954 1.00 0.00 H new ATOM 0 HB3 GLN B 199 8.828 -14.940 -1.809 1.00 0.00 H new ATOM 0 HG2 GLN B 199 11.225 -15.175 -1.992 1.00 0.00 H new ATOM 0 HG3 GLN B 199 10.546 -16.525 -2.880 1.00 0.00 H new ATOM 0 HE21 GLN B 199 11.074 -13.013 -3.720 1.00 0.00 H new ATOM 0 HE22 GLN B 199 11.944 -13.363 -5.217 1.00 0.00 H new ATOM 1258 N LEU B 200 6.557 -16.189 -2.425 1.00 0.00 N ATOM 1259 CA LEU B 200 5.685 -17.234 -1.805 1.00 0.00 C ATOM 1260 C LEU B 200 4.752 -17.822 -2.864 1.00 0.00 C ATOM 1261 O LEU B 200 4.408 -18.988 -2.823 1.00 0.00 O ATOM 1262 CB LEU B 200 4.883 -16.501 -0.726 1.00 0.00 C ATOM 1263 CG LEU B 200 4.731 -17.404 0.500 1.00 0.00 C ATOM 1264 CD1 LEU B 200 6.087 -17.562 1.190 1.00 0.00 C ATOM 1265 CD2 LEU B 200 3.734 -16.773 1.475 1.00 0.00 C ATOM 0 H LEU B 200 6.351 -15.231 -2.142 1.00 0.00 H new ATOM 0 HA LEU B 200 6.259 -18.060 -1.386 1.00 0.00 H new ATOM 0 HB2 LEU B 200 5.388 -15.576 -0.449 1.00 0.00 H new ATOM 0 HB3 LEU B 200 3.901 -16.226 -1.112 1.00 0.00 H new ATOM 0 HG LEU B 200 4.367 -18.383 0.188 1.00 0.00 H new ATOM 0 HD11 LEU B 200 5.978 -18.205 2.063 1.00 0.00 H new ATOM 0 HD12 LEU B 200 6.798 -18.010 0.496 1.00 0.00 H new ATOM 0 HD13 LEU B 200 6.452 -16.584 1.503 1.00 0.00 H new ATOM 0 HD21 LEU B 200 3.624 -17.415 2.349 1.00 0.00 H new ATOM 0 HD22 LEU B 200 4.099 -15.795 1.787 1.00 0.00 H new ATOM 0 HD23 LEU B 200 2.767 -16.660 0.984 1.00 0.00 H new ATOM 1277 N GLU B 201 4.348 -17.019 -3.816 1.00 0.00 N ATOM 1278 CA GLU B 201 3.442 -17.521 -4.892 1.00 0.00 C ATOM 1279 C GLU B 201 4.238 -18.358 -5.894 1.00 0.00 C ATOM 1280 O GLU B 201 3.716 -19.269 -6.509 1.00 0.00 O ATOM 1281 CB GLU B 201 2.882 -16.266 -5.564 1.00 0.00 C ATOM 1282 CG GLU B 201 1.622 -15.809 -4.827 1.00 0.00 C ATOM 1283 CD GLU B 201 0.643 -15.187 -5.824 1.00 0.00 C ATOM 1284 OE1 GLU B 201 0.862 -14.050 -6.209 1.00 0.00 O ATOM 1285 OE2 GLU B 201 -0.310 -15.858 -6.184 1.00 0.00 O ATOM 0 H GLU B 201 4.607 -16.036 -3.894 1.00 0.00 H new ATOM 0 HA GLU B 201 2.647 -18.157 -4.501 1.00 0.00 H new ATOM 0 HB2 GLU B 201 3.629 -15.472 -5.555 1.00 0.00 H new ATOM 0 HB3 GLU B 201 2.650 -16.473 -6.609 1.00 0.00 H new ATOM 0 HG2 GLU B 201 1.155 -16.656 -4.324 1.00 0.00 H new ATOM 0 HG3 GLU B 201 1.882 -15.084 -4.056 1.00 0.00 H new