USER MOD reduce.3.24.130724 H: found=0, std=0, add=579, rem=0, adj=9 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 Single : A 65 THR OG1 : rot -170:sc= 0 USER MOD Single : A 66 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 GLN : amide:sc= -0.668 X(o=-0.67,f=-0.26) USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 LYS NZ :NH3+ -130:sc= 0 (180deg=-0.151) USER MOD Single : A 80 GLN : amide:sc= -1.78 K(o=-1.8,f=-0.64) USER MOD Single : A 83 LYS NZ :NH3+ -151:sc= -0.122 (180deg=-0.473) USER MOD Single : A 84 HIS : no HD1:sc= -1.65 K(o=-1.7,f=-0.37) USER MOD Single : A 85 GLN : amide:sc= -0.0804 X(o=-0.08,f=-0.49) USER MOD Single : A 89 GLN : amide:sc= 0 K(o=0,f=-0.7) USER MOD Single : B 168 SER OG : rot 140:sc= -0.145 USER MOD Single : B 169 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 174 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 175 ASN : amide:sc= -0.34 K(o=-0.34,f=-1.1) USER MOD Single : B 176 MET CE :methyl 148:sc= -11.4! (180deg=-17.9!) USER MOD Single : B 184 THR OG1 : rot 80:sc= 1.17 USER MOD Single : B 185 MET CE :methyl -134:sc= -0.0147 (180deg=-0.237) USER MOD Single : B 188 GLN : amide:sc= -0.561 K(o=-0.56,f=0) USER MOD Single : B 189 GLN : amide:sc= -0.35 X(o=-0.35,f=0) USER MOD Single : B 191 SER OG : rot 180:sc= 0.0173 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+ 162:sc= 0 (180deg=-0.412) USER MOD Single : B 197 GLN : amide:sc= -4.32 K(o=-4.3,f=-9.7!) USER MOD Single : B 198 GLN : amide:sc= -0.33 X(o=-0.33,f=-0.1) USER MOD Single : B 199 GLN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 161 N LEU A 62 0.521 -18.541 3.388 1.00 0.00 N ATOM 162 CA LEU A 62 0.411 -17.583 2.246 1.00 0.00 C ATOM 163 C LEU A 62 -0.926 -16.842 2.311 1.00 0.00 C ATOM 164 O LEU A 62 -1.041 -15.711 1.876 1.00 0.00 O ATOM 165 CB LEU A 62 0.485 -18.445 0.984 1.00 0.00 C ATOM 166 CG LEU A 62 0.479 -17.543 -0.252 1.00 0.00 C ATOM 167 CD1 LEU A 62 1.819 -16.813 -0.357 1.00 0.00 C ATOM 168 CD2 LEU A 62 0.266 -18.397 -1.503 1.00 0.00 C ATOM 0 HA LEU A 62 1.198 -16.829 2.265 1.00 0.00 H new ATOM 0 HB2 LEU A 62 1.389 -19.053 0.999 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -0.361 -19.132 0.950 1.00 0.00 H new ATOM 0 HG LEU A 62 -0.327 -16.814 -0.166 1.00 0.00 H new ATOM 0 HD11 LEU A 62 1.815 -16.170 -1.237 1.00 0.00 H new ATOM 0 HD12 LEU A 62 1.973 -16.206 0.535 1.00 0.00 H new ATOM 0 HD13 LEU A 62 2.625 -17.542 -0.443 1.00 0.00 H new ATOM 0 HD21 LEU A 62 0.261 -17.756 -2.385 1.00 0.00 H new ATOM 0 HD22 LEU A 62 1.073 -19.125 -1.588 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -0.688 -18.919 -1.429 1.00 0.00 H new ATOM 180 N GLU A 63 -1.935 -17.473 2.857 1.00 0.00 N ATOM 181 CA GLU A 63 -3.272 -16.812 2.958 1.00 0.00 C ATOM 182 C GLU A 63 -3.235 -15.713 4.023 1.00 0.00 C ATOM 183 O GLU A 63 -3.946 -14.729 3.936 1.00 0.00 O ATOM 184 CB GLU A 63 -4.243 -17.921 3.366 1.00 0.00 C ATOM 185 CG GLU A 63 -5.671 -17.374 3.373 1.00 0.00 C ATOM 186 CD GLU A 63 -6.638 -18.474 3.813 1.00 0.00 C ATOM 187 OE1 GLU A 63 -6.375 -19.097 4.828 1.00 0.00 O ATOM 188 OE2 GLU A 63 -7.627 -18.675 3.126 1.00 0.00 O ATOM 0 H GLU A 63 -1.891 -18.418 3.238 1.00 0.00 H new ATOM 0 HA GLU A 63 -3.569 -16.341 2.021 1.00 0.00 H new ATOM 0 HB2 GLU A 63 -4.167 -18.759 2.673 1.00 0.00 H new ATOM 0 HB3 GLU A 63 -3.983 -18.301 4.354 1.00 0.00 H new ATOM 0 HG2 GLU A 63 -5.742 -16.522 4.049 1.00 0.00 H new ATOM 0 HG3 GLU A 63 -5.939 -17.016 2.379 1.00 0.00 H new ATOM 195 N GLU A 64 -2.407 -15.874 5.023 1.00 0.00 N ATOM 196 CA GLU A 64 -2.312 -14.840 6.097 1.00 0.00 C ATOM 197 C GLU A 64 -1.536 -13.627 5.584 1.00 0.00 C ATOM 198 O GLU A 64 -1.810 -12.501 5.955 1.00 0.00 O ATOM 199 CB GLU A 64 -1.558 -15.517 7.244 1.00 0.00 C ATOM 200 CG GLU A 64 -2.551 -16.261 8.140 1.00 0.00 C ATOM 201 CD GLU A 64 -1.785 -17.143 9.126 1.00 0.00 C ATOM 202 OE1 GLU A 64 -0.977 -17.938 8.676 1.00 0.00 O ATOM 203 OE2 GLU A 64 -2.022 -17.009 10.316 1.00 0.00 O ATOM 0 H GLU A 64 -1.791 -16.678 5.142 1.00 0.00 H new ATOM 0 HA GLU A 64 -3.291 -14.483 6.416 1.00 0.00 H new ATOM 0 HB2 GLU A 64 -0.819 -16.213 6.847 1.00 0.00 H new ATOM 0 HB3 GLU A 64 -1.015 -14.772 7.826 1.00 0.00 H new ATOM 0 HG2 GLU A 64 -3.174 -15.549 8.681 1.00 0.00 H new ATOM 0 HG3 GLU A 64 -3.219 -16.871 7.532 1.00 0.00 H new ATOM 210 N THR A 65 -0.575 -13.852 4.726 1.00 0.00 N ATOM 211 CA THR A 65 0.222 -12.716 4.173 1.00 0.00 C ATOM 212 C THR A 65 -0.641 -11.902 3.208 1.00 0.00 C ATOM 213 O THR A 65 -0.469 -10.706 3.066 1.00 0.00 O ATOM 214 CB THR A 65 1.392 -13.367 3.429 1.00 0.00 C ATOM 215 OG1 THR A 65 2.111 -14.204 4.324 1.00 0.00 O ATOM 216 CG2 THR A 65 2.321 -12.280 2.885 1.00 0.00 C ATOM 0 H THR A 65 -0.307 -14.775 4.384 1.00 0.00 H new ATOM 0 HA THR A 65 0.570 -12.036 4.950 1.00 0.00 H new ATOM 0 HB THR A 65 1.011 -13.963 2.600 1.00 0.00 H new ATOM 0 HG1 THR A 65 2.945 -14.496 3.900 1.00 0.00 H new ATOM 0 HG21 THR A 65 3.153 -12.744 2.356 1.00 0.00 H new ATOM 0 HG22 THR A 65 1.768 -11.638 2.199 1.00 0.00 H new ATOM 0 HG23 THR A 65 2.705 -11.682 3.712 1.00 0.00 H new ATOM 224 N LYS A 66 -1.573 -12.544 2.550 1.00 0.00 N ATOM 225 CA LYS A 66 -2.462 -11.814 1.595 1.00 0.00 C ATOM 226 C LYS A 66 -3.382 -10.862 2.361 1.00 0.00 C ATOM 227 O LYS A 66 -3.788 -9.834 1.852 1.00 0.00 O ATOM 228 CB LYS A 66 -3.280 -12.899 0.892 1.00 0.00 C ATOM 229 CG LYS A 66 -2.507 -13.413 -0.325 1.00 0.00 C ATOM 230 CD LYS A 66 -2.587 -12.383 -1.453 1.00 0.00 C ATOM 231 CE LYS A 66 -3.999 -12.375 -2.041 1.00 0.00 C ATOM 232 NZ LYS A 66 -3.863 -11.697 -3.360 1.00 0.00 N ATOM 0 H LYS A 66 -1.757 -13.544 2.633 1.00 0.00 H new ATOM 0 HA LYS A 66 -1.896 -11.213 0.884 1.00 0.00 H new ATOM 0 HB2 LYS A 66 -3.483 -13.719 1.580 1.00 0.00 H new ATOM 0 HB3 LYS A 66 -4.245 -12.498 0.581 1.00 0.00 H new ATOM 0 HG2 LYS A 66 -1.466 -13.595 -0.058 1.00 0.00 H new ATOM 0 HG3 LYS A 66 -2.922 -14.365 -0.657 1.00 0.00 H new ATOM 0 HD2 LYS A 66 -2.335 -11.393 -1.074 1.00 0.00 H new ATOM 0 HD3 LYS A 66 -1.860 -12.622 -2.229 1.00 0.00 H new ATOM 0 HE2 LYS A 66 -4.385 -13.388 -2.156 1.00 0.00 H new ATOM 0 HE3 LYS A 66 -4.694 -11.841 -1.392 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 -4.792 -11.653 -3.825 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 -3.501 -10.732 -3.219 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 -3.201 -12.231 -3.958 1.00 0.00 H new ATOM 246 N GLU A 67 -3.710 -11.197 3.584 1.00 0.00 N ATOM 247 CA GLU A 67 -4.605 -10.313 4.393 1.00 0.00 C ATOM 248 C GLU A 67 -3.899 -8.991 4.699 1.00 0.00 C ATOM 249 O GLU A 67 -4.523 -7.951 4.791 1.00 0.00 O ATOM 250 CB GLU A 67 -4.880 -11.086 5.684 1.00 0.00 C ATOM 251 CG GLU A 67 -6.069 -10.459 6.414 1.00 0.00 C ATOM 252 CD GLU A 67 -7.360 -11.156 5.981 1.00 0.00 C ATOM 253 OE1 GLU A 67 -7.887 -10.794 4.942 1.00 0.00 O ATOM 254 OE2 GLU A 67 -7.800 -12.041 6.696 1.00 0.00 O ATOM 0 H GLU A 67 -3.397 -12.044 4.057 1.00 0.00 H new ATOM 0 HA GLU A 67 -5.527 -10.070 3.866 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -5.090 -12.131 5.456 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -3.998 -11.070 6.324 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -5.937 -10.552 7.492 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -6.126 -9.394 6.190 1.00 0.00 H new ATOM 261 N GLN A 68 -2.600 -9.028 4.852 1.00 0.00 N ATOM 262 CA GLN A 68 -1.842 -7.775 5.146 1.00 0.00 C ATOM 263 C GLN A 68 -1.693 -6.947 3.870 1.00 0.00 C ATOM 264 O GLN A 68 -1.683 -5.731 3.906 1.00 0.00 O ATOM 265 CB GLN A 68 -0.475 -8.239 5.650 1.00 0.00 C ATOM 266 CG GLN A 68 0.262 -7.059 6.288 1.00 0.00 C ATOM 267 CD GLN A 68 -0.411 -6.692 7.611 1.00 0.00 C ATOM 268 OE1 GLN A 68 -0.092 -7.247 8.644 1.00 0.00 O ATOM 269 NE2 GLN A 68 -1.337 -5.772 7.624 1.00 0.00 N ATOM 0 H GLN A 68 -2.031 -9.872 4.786 1.00 0.00 H new ATOM 0 HA GLN A 68 -2.348 -7.147 5.880 1.00 0.00 H new ATOM 0 HB2 GLN A 68 -0.597 -9.041 6.378 1.00 0.00 H new ATOM 0 HB3 GLN A 68 0.111 -8.644 4.824 1.00 0.00 H new ATOM 0 HG2 GLN A 68 1.307 -7.319 6.459 1.00 0.00 H new ATOM 0 HG3 GLN A 68 0.253 -6.203 5.613 1.00 0.00 H new ATOM 0 HE21 GLN A 68 -1.605 -5.306 6.757 1.00 0.00 H new ATOM 0 HE22 GLN A 68 -1.792 -5.519 8.501 1.00 0.00 H new ATOM 278 N ILE A 69 -1.587 -7.602 2.744 1.00 0.00 N ATOM 279 CA ILE A 69 -1.447 -6.864 1.453 1.00 0.00 C ATOM 280 C ILE A 69 -2.804 -6.282 1.044 1.00 0.00 C ATOM 281 O ILE A 69 -2.876 -5.262 0.384 1.00 0.00 O ATOM 282 CB ILE A 69 -0.974 -7.908 0.435 1.00 0.00 C ATOM 283 CG1 ILE A 69 0.355 -8.512 0.898 1.00 0.00 C ATOM 284 CG2 ILE A 69 -0.776 -7.244 -0.929 1.00 0.00 C ATOM 285 CD1 ILE A 69 0.718 -9.697 0.001 1.00 0.00 C ATOM 0 H ILE A 69 -1.591 -8.619 2.662 1.00 0.00 H new ATOM 0 HA ILE A 69 -0.746 -6.033 1.523 1.00 0.00 H new ATOM 0 HB ILE A 69 -1.725 -8.694 0.353 1.00 0.00 H new ATOM 0 HG12 ILE A 69 1.142 -7.759 0.859 1.00 0.00 H new ATOM 0 HG13 ILE A 69 0.277 -8.838 1.935 1.00 0.00 H new ATOM 0 HG21 ILE A 69 -0.440 -7.988 -1.651 1.00 0.00 H new ATOM 0 HG22 ILE A 69 -1.720 -6.814 -1.265 1.00 0.00 H new ATOM 0 HG23 ILE A 69 -0.027 -6.456 -0.845 1.00 0.00 H new ATOM 0 HD11 ILE A 69 1.664 -10.127 0.331 1.00 0.00 H new ATOM 0 HD12 ILE A 69 -0.065 -10.453 0.062 1.00 0.00 H new ATOM 0 HD13 ILE A 69 0.814 -9.357 -1.030 1.00 0.00 H new ATOM 297 N LEU A 70 -3.876 -6.923 1.438 1.00 0.00 N ATOM 298 CA LEU A 70 -5.233 -6.410 1.084 1.00 0.00 C ATOM 299 C LEU A 70 -5.564 -5.184 1.938 1.00 0.00 C ATOM 300 O LEU A 70 -6.234 -4.271 1.494 1.00 0.00 O ATOM 301 CB LEU A 70 -6.194 -7.558 1.396 1.00 0.00 C ATOM 302 CG LEU A 70 -7.613 -7.164 0.985 1.00 0.00 C ATOM 303 CD1 LEU A 70 -7.793 -7.394 -0.516 1.00 0.00 C ATOM 304 CD2 LEU A 70 -8.623 -8.018 1.756 1.00 0.00 C ATOM 0 H LEU A 70 -3.869 -7.781 1.990 1.00 0.00 H new ATOM 0 HA LEU A 70 -5.300 -6.104 0.040 1.00 0.00 H new ATOM 0 HB2 LEU A 70 -5.887 -8.458 0.863 1.00 0.00 H new ATOM 0 HB3 LEU A 70 -6.164 -7.792 2.460 1.00 0.00 H new ATOM 0 HG LEU A 70 -7.777 -6.111 1.213 1.00 0.00 H new ATOM 0 HD11 LEU A 70 -8.805 -7.113 -0.808 1.00 0.00 H new ATOM 0 HD12 LEU A 70 -7.074 -6.786 -1.066 1.00 0.00 H new ATOM 0 HD13 LEU A 70 -7.628 -8.447 -0.745 1.00 0.00 H new ATOM 0 HD21 LEU A 70 -9.635 -7.738 1.463 1.00 0.00 H new ATOM 0 HD22 LEU A 70 -8.458 -9.071 1.528 1.00 0.00 H new ATOM 0 HD23 LEU A 70 -8.496 -7.854 2.826 1.00 0.00 H new ATOM 316 N LYS A 71 -5.094 -5.160 3.160 1.00 0.00 N ATOM 317 CA LYS A 71 -5.372 -3.992 4.051 1.00 0.00 C ATOM 318 C LYS A 71 -4.571 -2.778 3.579 1.00 0.00 C ATOM 319 O LYS A 71 -5.031 -1.654 3.650 1.00 0.00 O ATOM 320 CB LYS A 71 -4.918 -4.429 5.444 1.00 0.00 C ATOM 321 CG LYS A 71 -5.772 -3.730 6.504 1.00 0.00 C ATOM 322 CD LYS A 71 -7.083 -4.497 6.690 1.00 0.00 C ATOM 323 CE LYS A 71 -6.814 -5.783 7.476 1.00 0.00 C ATOM 324 NZ LYS A 71 -7.711 -6.802 6.863 1.00 0.00 N ATOM 0 H LYS A 71 -4.530 -5.899 3.579 1.00 0.00 H new ATOM 0 HA LYS A 71 -6.424 -3.707 4.044 1.00 0.00 H new ATOM 0 HB2 LYS A 71 -5.009 -5.511 5.545 1.00 0.00 H new ATOM 0 HB3 LYS A 71 -3.866 -4.182 5.589 1.00 0.00 H new ATOM 0 HG2 LYS A 71 -5.230 -3.681 7.448 1.00 0.00 H new ATOM 0 HG3 LYS A 71 -5.979 -2.704 6.201 1.00 0.00 H new ATOM 0 HD2 LYS A 71 -7.807 -3.878 7.221 1.00 0.00 H new ATOM 0 HD3 LYS A 71 -7.518 -4.735 5.720 1.00 0.00 H new ATOM 0 HE2 LYS A 71 -5.768 -6.081 7.400 1.00 0.00 H new ATOM 0 HE3 LYS A 71 -7.032 -5.651 8.536 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 -7.584 -7.713 7.349 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 -8.700 -6.495 6.956 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 -7.476 -6.911 5.856 1.00 0.00 H new ATOM 338 N LEU A 72 -3.375 -3.001 3.093 1.00 0.00 N ATOM 339 CA LEU A 72 -2.537 -1.863 2.607 1.00 0.00 C ATOM 340 C LEU A 72 -3.152 -1.270 1.337 1.00 0.00 C ATOM 341 O LEU A 72 -2.992 -0.098 1.052 1.00 0.00 O ATOM 342 CB LEU A 72 -1.157 -2.467 2.320 1.00 0.00 C ATOM 343 CG LEU A 72 -0.072 -1.597 2.963 1.00 0.00 C ATOM 344 CD1 LEU A 72 -0.210 -1.647 4.485 1.00 0.00 C ATOM 345 CD2 LEU A 72 1.308 -2.119 2.559 1.00 0.00 C ATOM 0 H LEU A 72 -2.943 -3.922 3.012 1.00 0.00 H new ATOM 0 HA LEU A 72 -2.471 -1.055 3.335 1.00 0.00 H new ATOM 0 HB2 LEU A 72 -1.104 -3.482 2.713 1.00 0.00 H new ATOM 0 HB3 LEU A 72 -0.994 -2.533 1.244 1.00 0.00 H new ATOM 0 HG LEU A 72 -0.185 -0.568 2.622 1.00 0.00 H new ATOM 0 HD11 LEU A 72 0.562 -1.028 4.941 1.00 0.00 H new ATOM 0 HD12 LEU A 72 -1.192 -1.273 4.774 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -0.099 -2.676 4.827 1.00 0.00 H new ATOM 0 HD21 LEU A 72 2.080 -1.500 3.017 1.00 0.00 H new ATOM 0 HD22 LEU A 72 1.421 -3.149 2.898 1.00 0.00 H new ATOM 0 HD23 LEU A 72 1.408 -2.081 1.474 1.00 0.00 H new ATOM 357 N GLU A 73 -3.865 -2.069 0.580 1.00 0.00 N ATOM 358 CA GLU A 73 -4.503 -1.548 -0.666 1.00 0.00 C ATOM 359 C GLU A 73 -5.601 -0.550 -0.298 1.00 0.00 C ATOM 360 O GLU A 73 -5.810 0.436 -0.980 1.00 0.00 O ATOM 361 CB GLU A 73 -5.099 -2.772 -1.364 1.00 0.00 C ATOM 362 CG GLU A 73 -5.295 -2.468 -2.850 1.00 0.00 C ATOM 363 CD GLU A 73 -5.536 -3.772 -3.612 1.00 0.00 C ATOM 364 OE1 GLU A 73 -6.172 -4.652 -3.055 1.00 0.00 O ATOM 365 OE2 GLU A 73 -5.082 -3.869 -4.740 1.00 0.00 O ATOM 0 H GLU A 73 -4.031 -3.057 0.772 1.00 0.00 H new ATOM 0 HA GLU A 73 -3.793 -1.031 -1.311 1.00 0.00 H new ATOM 0 HB2 GLU A 73 -4.439 -3.631 -1.242 1.00 0.00 H new ATOM 0 HB3 GLU A 73 -6.053 -3.036 -0.907 1.00 0.00 H new ATOM 0 HG2 GLU A 73 -6.141 -1.794 -2.985 1.00 0.00 H new ATOM 0 HG3 GLU A 73 -4.416 -1.960 -3.247 1.00 0.00 H new ATOM 372 N GLU A 74 -6.290 -0.798 0.785 1.00 0.00 N ATOM 373 CA GLU A 74 -7.370 0.139 1.220 1.00 0.00 C ATOM 374 C GLU A 74 -6.739 1.391 1.831 1.00 0.00 C ATOM 375 O GLU A 74 -7.276 2.479 1.736 1.00 0.00 O ATOM 376 CB GLU A 74 -8.177 -0.630 2.274 1.00 0.00 C ATOM 377 CG GLU A 74 -9.541 -1.020 1.698 1.00 0.00 C ATOM 378 CD GLU A 74 -9.405 -2.316 0.895 1.00 0.00 C ATOM 379 OE1 GLU A 74 -8.546 -2.367 0.031 1.00 0.00 O ATOM 380 OE2 GLU A 74 -10.162 -3.235 1.160 1.00 0.00 O ATOM 0 H GLU A 74 -6.152 -1.609 1.388 1.00 0.00 H new ATOM 0 HA GLU A 74 -8.003 0.461 0.393 1.00 0.00 H new ATOM 0 HB2 GLU A 74 -7.633 -1.523 2.582 1.00 0.00 H new ATOM 0 HB3 GLU A 74 -8.310 -0.015 3.164 1.00 0.00 H new ATOM 0 HG2 GLU A 74 -10.263 -1.153 2.504 1.00 0.00 H new ATOM 0 HG3 GLU A 74 -9.919 -0.222 1.059 1.00 0.00 H new ATOM 387 N LYS A 75 -5.596 1.239 2.449 1.00 0.00 N ATOM 388 CA LYS A 75 -4.909 2.414 3.064 1.00 0.00 C ATOM 389 C LYS A 75 -4.357 3.323 1.964 1.00 0.00 C ATOM 390 O LYS A 75 -4.273 4.525 2.124 1.00 0.00 O ATOM 391 CB LYS A 75 -3.769 1.824 3.898 1.00 0.00 C ATOM 392 CG LYS A 75 -3.509 2.717 5.112 1.00 0.00 C ATOM 393 CD LYS A 75 -3.046 1.857 6.290 1.00 0.00 C ATOM 394 CE LYS A 75 -2.323 2.736 7.313 1.00 0.00 C ATOM 395 NZ LYS A 75 -0.939 2.883 6.784 1.00 0.00 N ATOM 0 H LYS A 75 -5.108 0.350 2.554 1.00 0.00 H new ATOM 0 HA LYS A 75 -5.582 3.016 3.675 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -4.026 0.816 4.223 1.00 0.00 H new ATOM 0 HB3 LYS A 75 -2.866 1.743 3.293 1.00 0.00 H new ATOM 0 HG2 LYS A 75 -2.751 3.462 4.872 1.00 0.00 H new ATOM 0 HG3 LYS A 75 -4.416 3.259 5.379 1.00 0.00 H new ATOM 0 HD2 LYS A 75 -3.902 1.368 6.755 1.00 0.00 H new ATOM 0 HD3 LYS A 75 -2.381 1.068 5.938 1.00 0.00 H new ATOM 0 HE2 LYS A 75 -2.811 3.705 7.416 1.00 0.00 H new ATOM 0 HE3 LYS A 75 -2.321 2.273 8.300 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 -0.255 2.662 7.535 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 -0.801 2.230 5.987 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 -0.793 3.860 6.460 1.00 0.00 H new ATOM 409 N LEU A 76 -3.987 2.752 0.844 1.00 0.00 N ATOM 410 CA LEU A 76 -3.447 3.578 -0.279 1.00 0.00 C ATOM 411 C LEU A 76 -4.579 4.381 -0.918 1.00 0.00 C ATOM 412 O LEU A 76 -4.376 5.477 -1.408 1.00 0.00 O ATOM 413 CB LEU A 76 -2.866 2.574 -1.277 1.00 0.00 C ATOM 414 CG LEU A 76 -2.225 3.326 -2.446 1.00 0.00 C ATOM 415 CD1 LEU A 76 -0.822 3.787 -2.048 1.00 0.00 C ATOM 416 CD2 LEU A 76 -2.131 2.398 -3.658 1.00 0.00 C ATOM 0 H LEU A 76 -4.036 1.750 0.659 1.00 0.00 H new ATOM 0 HA LEU A 76 -2.693 4.291 0.054 1.00 0.00 H new ATOM 0 HB2 LEU A 76 -2.124 1.945 -0.785 1.00 0.00 H new ATOM 0 HB3 LEU A 76 -3.652 1.913 -1.643 1.00 0.00 H new ATOM 0 HG LEU A 76 -2.835 4.194 -2.698 1.00 0.00 H new ATOM 0 HD11 LEU A 76 -0.365 4.323 -2.880 1.00 0.00 H new ATOM 0 HD12 LEU A 76 -0.888 4.448 -1.184 1.00 0.00 H new ATOM 0 HD13 LEU A 76 -0.212 2.920 -1.796 1.00 0.00 H new ATOM 0 HD21 LEU A 76 -1.675 2.933 -4.491 1.00 0.00 H new ATOM 0 HD22 LEU A 76 -1.521 1.531 -3.406 1.00 0.00 H new ATOM 0 HD23 LEU A 76 -3.130 2.068 -3.942 1.00 0.00 H new ATOM 428 N LEU A 77 -5.771 3.844 -0.908 1.00 0.00 N ATOM 429 CA LEU A 77 -6.931 4.571 -1.505 1.00 0.00 C ATOM 430 C LEU A 77 -7.398 5.668 -0.549 1.00 0.00 C ATOM 431 O LEU A 77 -7.849 6.717 -0.968 1.00 0.00 O ATOM 432 CB LEU A 77 -8.020 3.511 -1.688 1.00 0.00 C ATOM 433 CG LEU A 77 -8.712 3.711 -3.038 1.00 0.00 C ATOM 434 CD1 LEU A 77 -9.126 2.352 -3.606 1.00 0.00 C ATOM 435 CD2 LEU A 77 -9.956 4.583 -2.849 1.00 0.00 C ATOM 0 H LEU A 77 -5.992 2.931 -0.511 1.00 0.00 H new ATOM 0 HA LEU A 77 -6.680 5.053 -2.450 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -7.583 2.514 -1.637 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -8.749 3.581 -0.881 1.00 0.00 H new ATOM 0 HG LEU A 77 -8.025 4.200 -3.729 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -9.619 2.494 -4.568 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -8.242 1.729 -3.740 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -9.813 1.863 -2.915 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -10.450 4.726 -3.810 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -10.642 4.093 -2.158 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -9.663 5.552 -2.444 1.00 0.00 H new ATOM 447 N ALA A 78 -7.276 5.434 0.731 1.00 0.00 N ATOM 448 CA ALA A 78 -7.697 6.466 1.725 1.00 0.00 C ATOM 449 C ALA A 78 -6.680 7.607 1.733 1.00 0.00 C ATOM 450 O ALA A 78 -7.016 8.752 1.969 1.00 0.00 O ATOM 451 CB ALA A 78 -7.712 5.749 3.076 1.00 0.00 C ATOM 0 H ALA A 78 -6.903 4.573 1.132 1.00 0.00 H new ATOM 0 HA ALA A 78 -8.672 6.896 1.493 1.00 0.00 H new ATOM 0 HB1 ALA A 78 -8.013 6.448 3.856 1.00 0.00 H new ATOM 0 HB2 ALA A 78 -8.418 4.920 3.040 1.00 0.00 H new ATOM 0 HB3 ALA A 78 -6.715 5.367 3.296 1.00 0.00 H new ATOM 457 N LEU A 79 -5.436 7.297 1.464 1.00 0.00 N ATOM 458 CA LEU A 79 -4.385 8.356 1.440 1.00 0.00 C ATOM 459 C LEU A 79 -4.672 9.332 0.297 1.00 0.00 C ATOM 460 O LEU A 79 -4.417 10.517 0.403 1.00 0.00 O ATOM 461 CB LEU A 79 -3.065 7.611 1.203 1.00 0.00 C ATOM 462 CG LEU A 79 -1.990 8.134 2.162 1.00 0.00 C ATOM 463 CD1 LEU A 79 -2.405 7.852 3.610 1.00 0.00 C ATOM 464 CD2 LEU A 79 -0.666 7.427 1.871 1.00 0.00 C ATOM 0 H LEU A 79 -5.104 6.354 1.260 1.00 0.00 H new ATOM 0 HA LEU A 79 -4.352 8.937 2.362 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -3.209 6.541 1.354 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -2.741 7.747 0.171 1.00 0.00 H new ATOM 0 HG LEU A 79 -1.874 9.209 2.022 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -1.638 8.226 4.288 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -3.350 8.352 3.821 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -2.523 6.778 3.752 1.00 0.00 H new ATOM 0 HD21 LEU A 79 0.101 7.797 2.551 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -0.789 6.353 2.011 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -0.365 7.627 0.842 1.00 0.00 H new ATOM 476 N GLN A 80 -5.213 8.839 -0.789 1.00 0.00 N ATOM 477 CA GLN A 80 -5.537 9.735 -1.941 1.00 0.00 C ATOM 478 C GLN A 80 -6.743 10.605 -1.587 1.00 0.00 C ATOM 479 O GLN A 80 -6.861 11.732 -2.032 1.00 0.00 O ATOM 480 CB GLN A 80 -5.873 8.794 -3.102 1.00 0.00 C ATOM 481 CG GLN A 80 -5.403 9.414 -4.422 1.00 0.00 C ATOM 482 CD GLN A 80 -4.062 8.797 -4.831 1.00 0.00 C ATOM 483 OE1 GLN A 80 -3.840 8.514 -5.991 1.00 0.00 O ATOM 484 NE2 GLN A 80 -3.154 8.575 -3.919 1.00 0.00 N ATOM 0 H GLN A 80 -5.444 7.855 -0.928 1.00 0.00 H new ATOM 0 HA GLN A 80 -4.715 10.404 -2.195 1.00 0.00 H new ATOM 0 HB2 GLN A 80 -5.391 7.828 -2.951 1.00 0.00 H new ATOM 0 HB3 GLN A 80 -6.947 8.612 -3.136 1.00 0.00 H new ATOM 0 HG2 GLN A 80 -6.146 9.243 -5.201 1.00 0.00 H new ATOM 0 HG3 GLN A 80 -5.300 10.493 -4.312 1.00 0.00 H new ATOM 0 HE21 GLN A 80 -3.341 8.813 -2.945 1.00 0.00 H new ATOM 0 HE22 GLN A 80 -2.258 8.164 -4.181 1.00 0.00 H new ATOM 493 N GLU A 81 -7.632 10.089 -0.779 1.00 0.00 N ATOM 494 CA GLU A 81 -8.835 10.877 -0.374 1.00 0.00 C ATOM 495 C GLU A 81 -8.410 12.050 0.513 1.00 0.00 C ATOM 496 O GLU A 81 -9.037 13.092 0.524 1.00 0.00 O ATOM 497 CB GLU A 81 -9.714 9.897 0.410 1.00 0.00 C ATOM 498 CG GLU A 81 -11.002 10.598 0.851 1.00 0.00 C ATOM 499 CD GLU A 81 -12.167 9.607 0.797 1.00 0.00 C ATOM 500 OE1 GLU A 81 -12.335 8.868 1.753 1.00 0.00 O ATOM 501 OE2 GLU A 81 -12.872 9.605 -0.199 1.00 0.00 O ATOM 0 H GLU A 81 -7.577 9.152 -0.380 1.00 0.00 H new ATOM 0 HA GLU A 81 -9.366 11.295 -1.229 1.00 0.00 H new ATOM 0 HB2 GLU A 81 -9.953 9.032 -0.209 1.00 0.00 H new ATOM 0 HB3 GLU A 81 -9.174 9.526 1.281 1.00 0.00 H new ATOM 0 HG2 GLU A 81 -10.889 10.987 1.863 1.00 0.00 H new ATOM 0 HG3 GLU A 81 -11.205 11.450 0.202 1.00 0.00 H new ATOM 508 N GLU A 82 -7.342 11.883 1.252 1.00 0.00 N ATOM 509 CA GLU A 82 -6.861 12.982 2.141 1.00 0.00 C ATOM 510 C GLU A 82 -6.381 14.165 1.295 1.00 0.00 C ATOM 511 O GLU A 82 -6.699 15.306 1.574 1.00 0.00 O ATOM 512 CB GLU A 82 -5.696 12.382 2.938 1.00 0.00 C ATOM 513 CG GLU A 82 -6.160 12.049 4.358 1.00 0.00 C ATOM 514 CD GLU A 82 -4.963 11.590 5.191 1.00 0.00 C ATOM 515 OE1 GLU A 82 -4.026 12.360 5.320 1.00 0.00 O ATOM 516 OE2 GLU A 82 -5.003 10.476 5.687 1.00 0.00 O ATOM 0 H GLU A 82 -6.782 11.031 1.277 1.00 0.00 H new ATOM 0 HA GLU A 82 -7.647 13.353 2.799 1.00 0.00 H new ATOM 0 HB2 GLU A 82 -5.330 11.482 2.444 1.00 0.00 H new ATOM 0 HB3 GLU A 82 -4.865 13.087 2.972 1.00 0.00 H new ATOM 0 HG2 GLU A 82 -6.621 12.924 4.816 1.00 0.00 H new ATOM 0 HG3 GLU A 82 -6.919 11.267 4.330 1.00 0.00 H new ATOM 523 N LYS A 83 -5.623 13.897 0.260 1.00 0.00 N ATOM 524 CA LYS A 83 -5.127 15.004 -0.613 1.00 0.00 C ATOM 525 C LYS A 83 -6.301 15.649 -1.352 1.00 0.00 C ATOM 526 O LYS A 83 -6.283 16.826 -1.656 1.00 0.00 O ATOM 527 CB LYS A 83 -4.167 14.343 -1.603 1.00 0.00 C ATOM 528 CG LYS A 83 -3.026 15.308 -1.933 1.00 0.00 C ATOM 529 CD LYS A 83 -2.050 14.636 -2.901 1.00 0.00 C ATOM 530 CE LYS A 83 -2.407 15.021 -4.340 1.00 0.00 C ATOM 531 NZ LYS A 83 -3.184 13.864 -4.865 1.00 0.00 N ATOM 0 H LYS A 83 -5.327 12.961 -0.017 1.00 0.00 H new ATOM 0 HA LYS A 83 -4.634 15.790 -0.041 1.00 0.00 H new ATOM 0 HB2 LYS A 83 -3.767 13.423 -1.178 1.00 0.00 H new ATOM 0 HB3 LYS A 83 -4.700 14.068 -2.514 1.00 0.00 H new ATOM 0 HG2 LYS A 83 -3.425 16.220 -2.377 1.00 0.00 H new ATOM 0 HG3 LYS A 83 -2.506 15.599 -1.020 1.00 0.00 H new ATOM 0 HD2 LYS A 83 -1.029 14.942 -2.675 1.00 0.00 H new ATOM 0 HD3 LYS A 83 -2.092 13.553 -2.782 1.00 0.00 H new ATOM 0 HE2 LYS A 83 -2.996 15.938 -4.369 1.00 0.00 H new ATOM 0 HE3 LYS A 83 -1.511 15.198 -4.935 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 -3.050 13.794 -5.894 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 -2.852 12.989 -4.412 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 -4.194 14.000 -4.656 1.00 0.00 H new ATOM 545 N HIS A 84 -7.324 14.882 -1.631 1.00 0.00 N ATOM 546 CA HIS A 84 -8.513 15.441 -2.344 1.00 0.00 C ATOM 547 C HIS A 84 -9.277 16.389 -1.418 1.00 0.00 C ATOM 548 O HIS A 84 -9.911 17.327 -1.863 1.00 0.00 O ATOM 549 CB HIS A 84 -9.375 14.228 -2.704 1.00 0.00 C ATOM 550 CG HIS A 84 -10.549 14.675 -3.530 1.00 0.00 C ATOM 551 ND1 HIS A 84 -10.761 14.220 -4.822 1.00 0.00 N ATOM 552 CD2 HIS A 84 -11.585 15.536 -3.261 1.00 0.00 C ATOM 553 CE1 HIS A 84 -11.885 14.803 -5.278 1.00 0.00 C ATOM 554 NE2 HIS A 84 -12.427 15.614 -4.367 1.00 0.00 N ATOM 0 H HIS A 84 -7.388 13.892 -1.396 1.00 0.00 H new ATOM 0 HA HIS A 84 -8.234 16.012 -3.229 1.00 0.00 H new ATOM 0 HB2 HIS A 84 -8.783 13.499 -3.258 1.00 0.00 H new ATOM 0 HB3 HIS A 84 -9.722 13.733 -1.797 1.00 0.00 H new ATOM 0 HD2 HIS A 84 -11.725 16.071 -2.333 1.00 0.00 H new ATOM 0 HE1 HIS A 84 -12.298 14.635 -6.262 1.00 0.00 H new ATOM 0 HE2 HIS A 84 -13.276 16.171 -4.461 1.00 0.00 H new ATOM 562 N GLN A 85 -9.217 16.149 -0.132 1.00 0.00 N ATOM 563 CA GLN A 85 -9.935 17.035 0.835 1.00 0.00 C ATOM 564 C GLN A 85 -9.291 18.424 0.845 1.00 0.00 C ATOM 565 O GLN A 85 -9.956 19.424 1.045 1.00 0.00 O ATOM 566 CB GLN A 85 -9.776 16.360 2.200 1.00 0.00 C ATOM 567 CG GLN A 85 -11.071 16.512 3.000 1.00 0.00 C ATOM 568 CD GLN A 85 -11.002 17.782 3.848 1.00 0.00 C ATOM 569 OE1 GLN A 85 -10.032 18.009 4.545 1.00 0.00 O ATOM 570 NE2 GLN A 85 -11.996 18.628 3.818 1.00 0.00 N ATOM 0 H GLN A 85 -8.701 15.377 0.290 1.00 0.00 H new ATOM 0 HA GLN A 85 -10.985 17.167 0.572 1.00 0.00 H new ATOM 0 HB2 GLN A 85 -9.539 15.304 2.070 1.00 0.00 H new ATOM 0 HB3 GLN A 85 -8.945 16.809 2.745 1.00 0.00 H new ATOM 0 HG2 GLN A 85 -11.925 16.560 2.324 1.00 0.00 H new ATOM 0 HG3 GLN A 85 -11.219 15.642 3.640 1.00 0.00 H new ATOM 0 HE21 GLN A 85 -12.810 18.438 3.233 1.00 0.00 H new ATOM 0 HE22 GLN A 85 -11.959 19.479 4.379 1.00 0.00 H new ATOM 579 N LEU A 86 -8.002 18.490 0.626 1.00 0.00 N ATOM 580 CA LEU A 86 -7.305 19.813 0.615 1.00 0.00 C ATOM 581 C LEU A 86 -7.744 20.625 -0.606 1.00 0.00 C ATOM 582 O LEU A 86 -7.787 21.840 -0.572 1.00 0.00 O ATOM 583 CB LEU A 86 -5.810 19.483 0.532 1.00 0.00 C ATOM 584 CG LEU A 86 -5.167 19.655 1.911 1.00 0.00 C ATOM 585 CD1 LEU A 86 -4.049 18.625 2.085 1.00 0.00 C ATOM 586 CD2 LEU A 86 -4.583 21.065 2.027 1.00 0.00 C ATOM 0 H LEU A 86 -7.401 17.684 0.454 1.00 0.00 H new ATOM 0 HA LEU A 86 -7.537 20.408 1.498 1.00 0.00 H new ATOM 0 HB2 LEU A 86 -5.672 18.460 0.181 1.00 0.00 H new ATOM 0 HB3 LEU A 86 -5.323 20.137 -0.191 1.00 0.00 H new ATOM 0 HG LEU A 86 -5.920 19.507 2.685 1.00 0.00 H new ATOM 0 HD11 LEU A 86 -3.591 18.747 3.067 1.00 0.00 H new ATOM 0 HD12 LEU A 86 -4.463 17.620 2.001 1.00 0.00 H new ATOM 0 HD13 LEU A 86 -3.295 18.773 1.312 1.00 0.00 H new ATOM 0 HD21 LEU A 86 -4.125 21.189 3.008 1.00 0.00 H new ATOM 0 HD22 LEU A 86 -3.829 21.211 1.253 1.00 0.00 H new ATOM 0 HD23 LEU A 86 -5.378 21.800 1.902 1.00 0.00 H new ATOM 598 N PHE A 87 -8.076 19.956 -1.683 1.00 0.00 N ATOM 599 CA PHE A 87 -8.520 20.681 -2.913 1.00 0.00 C ATOM 600 C PHE A 87 -9.880 21.341 -2.675 1.00 0.00 C ATOM 601 O PHE A 87 -10.207 22.345 -3.279 1.00 0.00 O ATOM 602 CB PHE A 87 -8.629 19.606 -3.999 1.00 0.00 C ATOM 603 CG PHE A 87 -7.376 19.604 -4.842 1.00 0.00 C ATOM 604 CD1 PHE A 87 -7.088 20.695 -5.670 1.00 0.00 C ATOM 605 CD2 PHE A 87 -6.501 18.511 -4.795 1.00 0.00 C ATOM 606 CE1 PHE A 87 -5.927 20.693 -6.452 1.00 0.00 C ATOM 607 CE2 PHE A 87 -5.340 18.510 -5.577 1.00 0.00 C ATOM 608 CZ PHE A 87 -5.054 19.601 -6.406 1.00 0.00 C ATOM 0 H PHE A 87 -8.059 18.939 -1.763 1.00 0.00 H new ATOM 0 HA PHE A 87 -7.825 21.472 -3.195 1.00 0.00 H new ATOM 0 HB2 PHE A 87 -8.773 18.627 -3.542 1.00 0.00 H new ATOM 0 HB3 PHE A 87 -9.500 19.796 -4.626 1.00 0.00 H new ATOM 0 HD1 PHE A 87 -7.762 21.538 -5.706 1.00 0.00 H new ATOM 0 HD2 PHE A 87 -6.722 17.669 -4.156 1.00 0.00 H new ATOM 0 HE1 PHE A 87 -5.705 21.535 -7.091 1.00 0.00 H new ATOM 0 HE2 PHE A 87 -4.665 17.668 -5.541 1.00 0.00 H new ATOM 0 HZ PHE A 87 -4.159 19.600 -7.010 1.00 0.00 H new ATOM 618 N LEU A 88 -10.674 20.781 -1.797 1.00 0.00 N ATOM 619 CA LEU A 88 -12.020 21.371 -1.511 1.00 0.00 C ATOM 620 C LEU A 88 -11.864 22.679 -0.729 1.00 0.00 C ATOM 621 O LEU A 88 -12.689 23.568 -0.823 1.00 0.00 O ATOM 622 CB LEU A 88 -12.756 20.318 -0.668 1.00 0.00 C ATOM 623 CG LEU A 88 -14.082 19.950 -1.337 1.00 0.00 C ATOM 624 CD1 LEU A 88 -13.841 18.869 -2.392 1.00 0.00 C ATOM 625 CD2 LEU A 88 -15.056 19.421 -0.281 1.00 0.00 C ATOM 0 H LEU A 88 -10.449 19.940 -1.265 1.00 0.00 H new ATOM 0 HA LEU A 88 -12.568 21.608 -2.423 1.00 0.00 H new ATOM 0 HB2 LEU A 88 -12.135 19.429 -0.558 1.00 0.00 H new ATOM 0 HB3 LEU A 88 -12.939 20.705 0.334 1.00 0.00 H new ATOM 0 HG LEU A 88 -14.505 20.835 -1.813 1.00 0.00 H new ATOM 0 HD11 LEU A 88 -14.786 18.608 -2.868 1.00 0.00 H new ATOM 0 HD12 LEU A 88 -13.147 19.243 -3.145 1.00 0.00 H new ATOM 0 HD13 LEU A 88 -13.418 17.984 -1.916 1.00 0.00 H new ATOM 0 HD21 LEU A 88 -16.001 19.159 -0.757 1.00 0.00 H new ATOM 0 HD22 LEU A 88 -14.632 18.537 0.195 1.00 0.00 H new ATOM 0 HD23 LEU A 88 -15.230 20.190 0.471 1.00 0.00 H new ATOM 637 N GLN A 89 -10.811 22.798 0.040 1.00 0.00 N ATOM 638 CA GLN A 89 -10.593 24.046 0.833 1.00 0.00 C ATOM 639 C GLN A 89 -9.297 24.740 0.398 1.00 0.00 C ATOM 640 O GLN A 89 -8.690 25.468 1.161 1.00 0.00 O ATOM 641 CB GLN A 89 -10.495 23.586 2.293 1.00 0.00 C ATOM 642 CG GLN A 89 -9.353 22.575 2.450 1.00 0.00 C ATOM 643 CD GLN A 89 -9.045 22.377 3.936 1.00 0.00 C ATOM 644 OE1 GLN A 89 -9.898 22.577 4.777 1.00 0.00 O ATOM 645 NE2 GLN A 89 -7.853 21.989 4.295 1.00 0.00 N ATOM 0 H GLN A 89 -10.092 22.084 0.153 1.00 0.00 H new ATOM 0 HA GLN A 89 -11.398 24.766 0.688 1.00 0.00 H new ATOM 0 HB2 GLN A 89 -10.323 24.444 2.942 1.00 0.00 H new ATOM 0 HB3 GLN A 89 -11.437 23.134 2.604 1.00 0.00 H new ATOM 0 HG2 GLN A 89 -9.631 21.624 1.996 1.00 0.00 H new ATOM 0 HG3 GLN A 89 -8.465 22.930 1.928 1.00 0.00 H new ATOM 0 HE21 GLN A 89 -7.137 21.821 3.588 1.00 0.00 H new ATOM 0 HE22 GLN A 89 -7.637 21.853 5.283 1.00 0.00 H new ATOM 654 N LEU A 90 -8.871 24.521 -0.822 1.00 0.00 N ATOM 655 CA LEU A 90 -7.615 25.169 -1.308 1.00 0.00 C ATOM 656 C LEU A 90 -7.879 26.640 -1.645 1.00 0.00 C ATOM 657 O LEU A 90 -8.497 26.891 -2.667 1.00 0.00 O ATOM 658 CB LEU A 90 -7.220 24.389 -2.568 1.00 0.00 C ATOM 659 CG LEU A 90 -5.705 24.493 -2.815 1.00 0.00 C ATOM 660 CD1 LEU A 90 -5.307 25.959 -3.013 1.00 0.00 C ATOM 661 CD2 LEU A 90 -4.937 23.907 -1.621 1.00 0.00 C ATOM 662 OXT LEU A 90 -7.458 27.488 -0.876 1.00 0.00 O ATOM 0 H LEU A 90 -9.339 23.921 -1.501 1.00 0.00 H new ATOM 0 HA LEU A 90 -6.824 25.150 -0.558 1.00 0.00 H new ATOM 0 HB2 LEU A 90 -7.505 23.343 -2.459 1.00 0.00 H new ATOM 0 HB3 LEU A 90 -7.762 24.779 -3.429 1.00 0.00 H new ATOM 0 HG LEU A 90 -5.455 23.929 -3.714 1.00 0.00 H new ATOM 0 HD11 LEU A 90 -4.233 26.024 -3.187 1.00 0.00 H new ATOM 0 HD12 LEU A 90 -5.839 26.368 -3.872 1.00 0.00 H new ATOM 0 HD13 LEU A 90 -5.565 26.530 -2.121 1.00 0.00 H new ATOM 0 HD21 LEU A 90 -3.865 23.985 -1.804 1.00 0.00 H new ATOM 0 HD22 LEU A 90 -5.192 24.461 -0.717 1.00 0.00 H new ATOM 0 HD23 LEU A 90 -5.208 22.859 -1.493 1.00 0.00 H new ATOM 675 N GLY B 166 -9.301 29.404 4.038 1.00 0.00 N ATOM 676 CA GLY B 166 -8.088 29.893 3.321 1.00 0.00 C ATOM 677 C GLY B 166 -7.133 30.549 4.320 1.00 0.00 C ATOM 678 O GLY B 166 -7.516 30.893 5.423 1.00 0.00 O ATOM 0 HA2 GLY B 166 -7.591 29.063 2.818 1.00 0.00 H new ATOM 0 HA3 GLY B 166 -8.372 30.609 2.550 1.00 0.00 H new ATOM 684 N LEU B 167 -5.894 30.723 3.941 1.00 0.00 N ATOM 685 CA LEU B 167 -4.899 31.360 4.867 1.00 0.00 C ATOM 686 C LEU B 167 -3.983 32.321 4.095 1.00 0.00 C ATOM 687 O LEU B 167 -4.212 33.515 4.078 1.00 0.00 O ATOM 688 CB LEU B 167 -4.077 30.222 5.528 1.00 0.00 C ATOM 689 CG LEU B 167 -3.940 28.993 4.607 1.00 0.00 C ATOM 690 CD1 LEU B 167 -2.545 28.385 4.762 1.00 0.00 C ATOM 691 CD2 LEU B 167 -4.995 27.953 4.991 1.00 0.00 C ATOM 0 H LEU B 167 -5.524 30.453 3.030 1.00 0.00 H new ATOM 0 HA LEU B 167 -5.409 31.946 5.631 1.00 0.00 H new ATOM 0 HB2 LEU B 167 -3.085 30.594 5.785 1.00 0.00 H new ATOM 0 HB3 LEU B 167 -4.557 29.924 6.460 1.00 0.00 H new ATOM 0 HG LEU B 167 -4.086 29.298 3.571 1.00 0.00 H new ATOM 0 HD11 LEU B 167 -2.452 27.517 4.110 1.00 0.00 H new ATOM 0 HD12 LEU B 167 -1.793 29.126 4.490 1.00 0.00 H new ATOM 0 HD13 LEU B 167 -2.395 28.079 5.797 1.00 0.00 H new ATOM 0 HD21 LEU B 167 -4.901 27.083 4.342 1.00 0.00 H new ATOM 0 HD22 LEU B 167 -4.847 27.650 6.028 1.00 0.00 H new ATOM 0 HD23 LEU B 167 -5.989 28.385 4.878 1.00 0.00 H new ATOM 703 N SER B 168 -2.950 31.817 3.462 1.00 0.00 N ATOM 704 CA SER B 168 -2.026 32.712 2.701 1.00 0.00 C ATOM 705 C SER B 168 -1.785 32.175 1.287 1.00 0.00 C ATOM 706 O SER B 168 -0.808 32.515 0.649 1.00 0.00 O ATOM 707 CB SER B 168 -0.725 32.703 3.503 1.00 0.00 C ATOM 708 OG SER B 168 -0.206 31.382 3.541 1.00 0.00 O ATOM 0 H SER B 168 -2.709 30.826 3.440 1.00 0.00 H new ATOM 0 HA SER B 168 -2.436 33.715 2.585 1.00 0.00 H new ATOM 0 HB2 SER B 168 0.000 33.378 3.049 1.00 0.00 H new ATOM 0 HB3 SER B 168 -0.906 33.064 4.515 1.00 0.00 H new ATOM 0 HG SER B 168 0.768 31.410 3.438 1.00 0.00 H new ATOM 714 N LYS B 169 -2.665 31.334 0.790 1.00 0.00 N ATOM 715 CA LYS B 169 -2.489 30.764 -0.588 1.00 0.00 C ATOM 716 C LYS B 169 -1.082 30.173 -0.756 1.00 0.00 C ATOM 717 O LYS B 169 -0.562 30.087 -1.853 1.00 0.00 O ATOM 718 CB LYS B 169 -2.694 31.940 -1.544 1.00 0.00 C ATOM 719 CG LYS B 169 -2.980 31.408 -2.950 1.00 0.00 C ATOM 720 CD LYS B 169 -4.422 30.898 -3.018 1.00 0.00 C ATOM 721 CE LYS B 169 -4.711 30.371 -4.425 1.00 0.00 C ATOM 722 NZ LYS B 169 -5.977 29.599 -4.293 1.00 0.00 N ATOM 0 H LYS B 169 -3.501 31.017 1.281 1.00 0.00 H new ATOM 0 HA LYS B 169 -3.194 29.955 -0.782 1.00 0.00 H new ATOM 0 HB2 LYS B 169 -3.523 32.560 -1.202 1.00 0.00 H new ATOM 0 HB3 LYS B 169 -1.806 32.572 -1.556 1.00 0.00 H new ATOM 0 HG2 LYS B 169 -2.826 32.196 -3.687 1.00 0.00 H new ATOM 0 HG3 LYS B 169 -2.286 30.604 -3.194 1.00 0.00 H new ATOM 0 HD2 LYS B 169 -4.574 30.107 -2.284 1.00 0.00 H new ATOM 0 HD3 LYS B 169 -5.115 31.702 -2.770 1.00 0.00 H new ATOM 0 HE2 LYS B 169 -4.819 31.188 -5.138 1.00 0.00 H new ATOM 0 HE3 LYS B 169 -3.899 29.739 -4.785 1.00 0.00 H new ATOM 0 HZ1 LYS B 169 -6.242 29.205 -5.218 1.00 0.00 H new ATOM 0 HZ2 LYS B 169 -5.842 28.824 -3.613 1.00 0.00 H new ATOM 0 HZ3 LYS B 169 -6.733 30.228 -3.955 1.00 0.00 H new ATOM 736 N GLU B 170 -0.471 29.771 0.328 1.00 0.00 N ATOM 737 CA GLU B 170 0.897 29.185 0.254 1.00 0.00 C ATOM 738 C GLU B 170 1.089 28.185 1.391 1.00 0.00 C ATOM 739 O GLU B 170 1.571 27.086 1.188 1.00 0.00 O ATOM 740 CB GLU B 170 1.850 30.372 0.409 1.00 0.00 C ATOM 741 CG GLU B 170 2.221 30.914 -0.972 1.00 0.00 C ATOM 742 CD GLU B 170 3.645 31.472 -0.937 1.00 0.00 C ATOM 743 OE1 GLU B 170 4.567 30.681 -0.833 1.00 0.00 O ATOM 744 OE2 GLU B 170 3.789 32.682 -1.015 1.00 0.00 O ATOM 0 H GLU B 170 -0.865 29.825 1.267 1.00 0.00 H new ATOM 0 HA GLU B 170 1.073 28.650 -0.679 1.00 0.00 H new ATOM 0 HB2 GLU B 170 1.379 31.155 1.004 1.00 0.00 H new ATOM 0 HB3 GLU B 170 2.748 30.063 0.943 1.00 0.00 H new ATOM 0 HG2 GLU B 170 2.148 30.121 -1.717 1.00 0.00 H new ATOM 0 HG3 GLU B 170 1.520 31.695 -1.268 1.00 0.00 H new ATOM 751 N GLU B 171 0.703 28.556 2.587 1.00 0.00 N ATOM 752 CA GLU B 171 0.850 27.622 3.741 1.00 0.00 C ATOM 753 C GLU B 171 -0.077 26.420 3.545 1.00 0.00 C ATOM 754 O GLU B 171 0.215 25.323 3.981 1.00 0.00 O ATOM 755 CB GLU B 171 0.442 28.429 4.978 1.00 0.00 C ATOM 756 CG GLU B 171 1.692 28.844 5.760 1.00 0.00 C ATOM 757 CD GLU B 171 2.440 29.930 4.986 1.00 0.00 C ATOM 758 OE1 GLU B 171 2.989 29.616 3.943 1.00 0.00 O ATOM 759 OE2 GLU B 171 2.452 31.058 5.450 1.00 0.00 O ATOM 0 H GLU B 171 0.294 29.463 2.812 1.00 0.00 H new ATOM 0 HA GLU B 171 1.865 27.238 3.840 1.00 0.00 H new ATOM 0 HB2 GLU B 171 -0.121 29.313 4.678 1.00 0.00 H new ATOM 0 HB3 GLU B 171 -0.214 27.833 5.612 1.00 0.00 H new ATOM 0 HG2 GLU B 171 1.411 29.213 6.746 1.00 0.00 H new ATOM 0 HG3 GLU B 171 2.340 27.981 5.915 1.00 0.00 H new ATOM 766 N LEU B 172 -1.184 26.622 2.875 1.00 0.00 N ATOM 767 CA LEU B 172 -2.132 25.498 2.626 1.00 0.00 C ATOM 768 C LEU B 172 -1.645 24.679 1.432 1.00 0.00 C ATOM 769 O LEU B 172 -1.815 23.475 1.378 1.00 0.00 O ATOM 770 CB LEU B 172 -3.469 26.167 2.308 1.00 0.00 C ATOM 771 CG LEU B 172 -4.605 25.159 2.489 1.00 0.00 C ATOM 772 CD1 LEU B 172 -4.746 24.801 3.971 1.00 0.00 C ATOM 773 CD2 LEU B 172 -5.912 25.773 1.982 1.00 0.00 C ATOM 0 H LEU B 172 -1.471 27.521 2.489 1.00 0.00 H new ATOM 0 HA LEU B 172 -2.214 24.821 3.476 1.00 0.00 H new ATOM 0 HB2 LEU B 172 -3.623 27.024 2.963 1.00 0.00 H new ATOM 0 HB3 LEU B 172 -3.464 26.544 1.285 1.00 0.00 H new ATOM 0 HG LEU B 172 -4.383 24.255 1.922 1.00 0.00 H new ATOM 0 HD11 LEU B 172 -5.556 24.083 4.096 1.00 0.00 H new ATOM 0 HD12 LEU B 172 -3.814 24.363 4.330 1.00 0.00 H new ATOM 0 HD13 LEU B 172 -4.968 25.702 4.543 1.00 0.00 H new ATOM 0 HD21 LEU B 172 -6.724 25.057 2.110 1.00 0.00 H new ATOM 0 HD22 LEU B 172 -6.133 26.677 2.549 1.00 0.00 H new ATOM 0 HD23 LEU B 172 -5.811 26.023 0.926 1.00 0.00 H new ATOM 785 N ILE B 173 -1.028 25.331 0.482 1.00 0.00 N ATOM 786 CA ILE B 173 -0.506 24.609 -0.714 1.00 0.00 C ATOM 787 C ILE B 173 0.757 23.842 -0.305 1.00 0.00 C ATOM 788 O ILE B 173 1.043 22.779 -0.825 1.00 0.00 O ATOM 789 CB ILE B 173 -0.214 25.711 -1.758 1.00 0.00 C ATOM 790 CG1 ILE B 173 -1.535 26.192 -2.371 1.00 0.00 C ATOM 791 CG2 ILE B 173 0.676 25.170 -2.886 1.00 0.00 C ATOM 792 CD1 ILE B 173 -2.312 27.026 -1.352 1.00 0.00 C ATOM 0 H ILE B 173 -0.863 26.338 0.484 1.00 0.00 H new ATOM 0 HA ILE B 173 -1.201 23.878 -1.127 1.00 0.00 H new ATOM 0 HB ILE B 173 0.300 26.531 -1.257 1.00 0.00 H new ATOM 0 HG12 ILE B 173 -1.336 26.786 -3.263 1.00 0.00 H new ATOM 0 HG13 ILE B 173 -2.133 25.336 -2.684 1.00 0.00 H new ATOM 0 HG21 ILE B 173 0.869 25.962 -3.609 1.00 0.00 H new ATOM 0 HG22 ILE B 173 1.621 24.822 -2.469 1.00 0.00 H new ATOM 0 HG23 ILE B 173 0.171 24.341 -3.382 1.00 0.00 H new ATOM 0 HD11 ILE B 173 -3.249 27.363 -1.796 1.00 0.00 H new ATOM 0 HD12 ILE B 173 -2.525 26.419 -0.472 1.00 0.00 H new ATOM 0 HD13 ILE B 173 -1.717 27.891 -1.060 1.00 0.00 H new ATOM 804 N GLN B 174 1.497 24.366 0.642 1.00 0.00 N ATOM 805 CA GLN B 174 2.726 23.658 1.108 1.00 0.00 C ATOM 806 C GLN B 174 2.322 22.330 1.745 1.00 0.00 C ATOM 807 O GLN B 174 3.033 21.346 1.664 1.00 0.00 O ATOM 808 CB GLN B 174 3.367 24.585 2.144 1.00 0.00 C ATOM 809 CG GLN B 174 4.725 24.020 2.563 1.00 0.00 C ATOM 810 CD GLN B 174 5.480 25.063 3.389 1.00 0.00 C ATOM 811 OE1 GLN B 174 6.478 25.599 2.948 1.00 0.00 O ATOM 812 NE2 GLN B 174 5.044 25.377 4.578 1.00 0.00 N ATOM 0 H GLN B 174 1.302 25.251 1.110 1.00 0.00 H new ATOM 0 HA GLN B 174 3.420 23.440 0.297 1.00 0.00 H new ATOM 0 HB2 GLN B 174 3.490 25.584 1.727 1.00 0.00 H new ATOM 0 HB3 GLN B 174 2.717 24.681 3.014 1.00 0.00 H new ATOM 0 HG2 GLN B 174 4.587 23.109 3.146 1.00 0.00 H new ATOM 0 HG3 GLN B 174 5.306 23.749 1.681 1.00 0.00 H new ATOM 0 HE21 GLN B 174 4.207 24.928 4.949 1.00 0.00 H new ATOM 0 HE22 GLN B 174 5.540 26.071 5.136 1.00 0.00 H new ATOM 821 N ASN B 175 1.166 22.296 2.360 1.00 0.00 N ATOM 822 CA ASN B 175 0.684 21.034 2.989 1.00 0.00 C ATOM 823 C ASN B 175 0.200 20.084 1.894 1.00 0.00 C ATOM 824 O ASN B 175 0.320 18.879 2.005 1.00 0.00 O ATOM 825 CB ASN B 175 -0.478 21.445 3.896 1.00 0.00 C ATOM 826 CG ASN B 175 0.025 22.418 4.965 1.00 0.00 C ATOM 827 OD1 ASN B 175 1.191 22.416 5.305 1.00 0.00 O ATOM 828 ND2 ASN B 175 -0.814 23.254 5.513 1.00 0.00 N ATOM 0 H ASN B 175 0.535 23.092 2.452 1.00 0.00 H new ATOM 0 HA ASN B 175 1.463 20.523 3.554 1.00 0.00 H new ATOM 0 HB2 ASN B 175 -1.266 21.913 3.305 1.00 0.00 H new ATOM 0 HB3 ASN B 175 -0.914 20.564 4.368 1.00 0.00 H new ATOM 0 HD21 ASN B 175 -0.491 23.906 6.227 1.00 0.00 H new ATOM 0 HD22 ASN B 175 -1.793 23.255 5.227 1.00 0.00 H new ATOM 835 N MET B 176 -0.340 20.628 0.831 1.00 0.00 N ATOM 836 CA MET B 176 -0.827 19.766 -0.289 1.00 0.00 C ATOM 837 C MET B 176 0.362 19.069 -0.953 1.00 0.00 C ATOM 838 O MET B 176 0.257 17.951 -1.420 1.00 0.00 O ATOM 839 CB MET B 176 -1.520 20.721 -1.276 1.00 0.00 C ATOM 840 CG MET B 176 -3.015 20.383 -1.365 1.00 0.00 C ATOM 841 SD MET B 176 -3.576 20.518 -3.083 1.00 0.00 S ATOM 842 CE MET B 176 -5.243 21.128 -2.731 1.00 0.00 C ATOM 0 H MET B 176 -0.464 21.631 0.691 1.00 0.00 H new ATOM 0 HA MET B 176 -1.511 18.989 0.053 1.00 0.00 H new ATOM 0 HB2 MET B 176 -1.390 21.753 -0.950 1.00 0.00 H new ATOM 0 HB3 MET B 176 -1.060 20.638 -2.261 1.00 0.00 H new ATOM 0 HG2 MET B 176 -3.191 19.373 -0.994 1.00 0.00 H new ATOM 0 HG3 MET B 176 -3.588 21.060 -0.732 1.00 0.00 H new ATOM 0 HE1 MET B 176 -5.565 21.791 -3.534 1.00 0.00 H new ATOM 0 HE2 MET B 176 -5.931 20.286 -2.658 1.00 0.00 H new ATOM 0 HE3 MET B 176 -5.239 21.675 -1.788 1.00 0.00 H new ATOM 852 N ASP B 177 1.494 19.725 -0.990 1.00 0.00 N ATOM 853 CA ASP B 177 2.702 19.108 -1.615 1.00 0.00 C ATOM 854 C ASP B 177 3.298 18.067 -0.669 1.00 0.00 C ATOM 855 O ASP B 177 3.863 17.077 -1.095 1.00 0.00 O ATOM 856 CB ASP B 177 3.680 20.264 -1.828 1.00 0.00 C ATOM 857 CG ASP B 177 4.800 19.819 -2.771 1.00 0.00 C ATOM 858 OD1 ASP B 177 4.541 19.715 -3.958 1.00 0.00 O ATOM 859 OD2 ASP B 177 5.898 19.591 -2.289 1.00 0.00 O ATOM 0 H ASP B 177 1.634 20.663 -0.614 1.00 0.00 H new ATOM 0 HA ASP B 177 2.472 18.600 -2.551 1.00 0.00 H new ATOM 0 HB2 ASP B 177 3.157 21.124 -2.247 1.00 0.00 H new ATOM 0 HB3 ASP B 177 4.099 20.580 -0.873 1.00 0.00 H new ATOM 864 N ARG B 178 3.167 18.285 0.614 1.00 0.00 N ATOM 865 CA ARG B 178 3.714 17.310 1.606 1.00 0.00 C ATOM 866 C ARG B 178 2.828 16.064 1.653 1.00 0.00 C ATOM 867 O ARG B 178 3.290 14.974 1.928 1.00 0.00 O ATOM 868 CB ARG B 178 3.685 18.042 2.949 1.00 0.00 C ATOM 869 CG ARG B 178 4.483 17.247 3.985 1.00 0.00 C ATOM 870 CD ARG B 178 3.532 16.363 4.798 1.00 0.00 C ATOM 871 NE ARG B 178 2.760 17.310 5.649 1.00 0.00 N ATOM 872 CZ ARG B 178 2.479 16.997 6.885 1.00 0.00 C ATOM 873 NH1 ARG B 178 2.042 15.800 7.172 1.00 0.00 N ATOM 874 NH2 ARG B 178 2.635 17.879 7.833 1.00 0.00 N ATOM 0 H ARG B 178 2.704 19.098 1.019 1.00 0.00 H new ATOM 0 HA ARG B 178 4.721 16.980 1.350 1.00 0.00 H new ATOM 0 HB2 ARG B 178 4.107 19.041 2.839 1.00 0.00 H new ATOM 0 HB3 ARG B 178 2.655 18.166 3.285 1.00 0.00 H new ATOM 0 HG2 ARG B 178 5.232 16.631 3.487 1.00 0.00 H new ATOM 0 HG3 ARG B 178 5.018 17.928 4.647 1.00 0.00 H new ATOM 0 HD2 ARG B 178 2.872 15.790 4.147 1.00 0.00 H new ATOM 0 HD3 ARG B 178 4.083 15.645 5.406 1.00 0.00 H new ATOM 0 HE ARG B 178 2.451 18.203 5.266 1.00 0.00 H new ATOM 0 HH11 ARG B 178 1.920 15.110 6.431 1.00 0.00 H new ATOM 0 HH12 ARG B 178 1.822 15.555 8.138 1.00 0.00 H new ATOM 0 HH21 ARG B 178 2.977 18.814 7.609 1.00 0.00 H new ATOM 0 HH22 ARG B 178 2.415 17.634 8.799 1.00 0.00 H new ATOM 888 N VAL B 179 1.557 16.223 1.381 1.00 0.00 N ATOM 889 CA VAL B 179 0.629 15.052 1.402 1.00 0.00 C ATOM 890 C VAL B 179 0.878 14.172 0.174 1.00 0.00 C ATOM 891 O VAL B 179 0.679 12.973 0.210 1.00 0.00 O ATOM 892 CB VAL B 179 -0.782 15.652 1.367 1.00 0.00 C ATOM 893 CG1 VAL B 179 -1.823 14.529 1.372 1.00 0.00 C ATOM 894 CG2 VAL B 179 -0.992 16.540 2.599 1.00 0.00 C ATOM 0 H VAL B 179 1.122 17.115 1.145 1.00 0.00 H new ATOM 0 HA VAL B 179 0.772 14.423 2.281 1.00 0.00 H new ATOM 0 HB VAL B 179 -0.895 16.248 0.461 1.00 0.00 H new ATOM 0 HG11 VAL B 179 -2.824 14.960 1.347 1.00 0.00 H new ATOM 0 HG12 VAL B 179 -1.679 13.896 0.497 1.00 0.00 H new ATOM 0 HG13 VAL B 179 -1.708 13.931 2.276 1.00 0.00 H new ATOM 0 HG21 VAL B 179 -1.995 16.966 2.574 1.00 0.00 H new ATOM 0 HG22 VAL B 179 -0.875 15.942 3.503 1.00 0.00 H new ATOM 0 HG23 VAL B 179 -0.256 17.344 2.598 1.00 0.00 H new ATOM 904 N ASP B 180 1.314 14.762 -0.910 1.00 0.00 N ATOM 905 CA ASP B 180 1.581 13.965 -2.146 1.00 0.00 C ATOM 906 C ASP B 180 2.883 13.178 -1.991 1.00 0.00 C ATOM 907 O ASP B 180 3.022 12.084 -2.506 1.00 0.00 O ATOM 908 CB ASP B 180 1.705 14.993 -3.272 1.00 0.00 C ATOM 909 CG ASP B 180 1.745 14.272 -4.620 1.00 0.00 C ATOM 910 OD1 ASP B 180 2.337 13.208 -4.683 1.00 0.00 O ATOM 911 OD2 ASP B 180 1.182 14.797 -5.567 1.00 0.00 O ATOM 0 H ASP B 180 1.497 15.762 -0.993 1.00 0.00 H new ATOM 0 HA ASP B 180 0.791 13.241 -2.347 1.00 0.00 H new ATOM 0 HB2 ASP B 180 0.862 15.684 -3.242 1.00 0.00 H new ATOM 0 HB3 ASP B 180 2.609 15.587 -3.138 1.00 0.00 H new ATOM 916 N ARG B 181 3.831 13.727 -1.277 1.00 0.00 N ATOM 917 CA ARG B 181 5.128 13.014 -1.073 1.00 0.00 C ATOM 918 C ARG B 181 4.933 11.848 -0.103 1.00 0.00 C ATOM 919 O ARG B 181 5.619 10.845 -0.179 1.00 0.00 O ATOM 920 CB ARG B 181 6.074 14.059 -0.476 1.00 0.00 C ATOM 921 CG ARG B 181 6.687 14.894 -1.601 1.00 0.00 C ATOM 922 CD ARG B 181 7.237 16.201 -1.024 1.00 0.00 C ATOM 923 NE ARG B 181 8.480 16.471 -1.801 1.00 0.00 N ATOM 924 CZ ARG B 181 9.622 16.597 -1.182 1.00 0.00 C ATOM 925 NH1 ARG B 181 10.059 15.634 -0.418 1.00 0.00 N ATOM 926 NH2 ARG B 181 10.326 17.686 -1.326 1.00 0.00 N ATOM 0 H ARG B 181 3.763 14.639 -0.826 1.00 0.00 H new ATOM 0 HA ARG B 181 5.523 12.599 -2.000 1.00 0.00 H new ATOM 0 HB2 ARG B 181 5.531 14.704 0.215 1.00 0.00 H new ATOM 0 HB3 ARG B 181 6.861 13.568 0.097 1.00 0.00 H new ATOM 0 HG2 ARG B 181 7.485 14.335 -2.090 1.00 0.00 H new ATOM 0 HG3 ARG B 181 5.936 15.107 -2.361 1.00 0.00 H new ATOM 0 HD2 ARG B 181 6.519 17.014 -1.133 1.00 0.00 H new ATOM 0 HD3 ARG B 181 7.450 16.104 0.041 1.00 0.00 H new ATOM 0 HE ARG B 181 8.438 16.557 -2.816 1.00 0.00 H new ATOM 0 HH11 ARG B 181 9.508 14.783 -0.305 1.00 0.00 H new ATOM 0 HH12 ARG B 181 10.952 15.732 0.066 1.00 0.00 H new ATOM 0 HH21 ARG B 181 9.984 18.439 -1.923 1.00 0.00 H new ATOM 0 HH22 ARG B 181 11.218 17.784 -0.842 1.00 0.00 H new ATOM 940 N GLU B 182 3.995 11.971 0.802 1.00 0.00 N ATOM 941 CA GLU B 182 3.742 10.869 1.778 1.00 0.00 C ATOM 942 C GLU B 182 3.043 9.705 1.079 1.00 0.00 C ATOM 943 O GLU B 182 3.338 8.552 1.329 1.00 0.00 O ATOM 944 CB GLU B 182 2.833 11.478 2.848 1.00 0.00 C ATOM 945 CG GLU B 182 2.940 10.660 4.137 1.00 0.00 C ATOM 946 CD GLU B 182 2.159 11.357 5.251 1.00 0.00 C ATOM 947 OE1 GLU B 182 2.688 12.298 5.820 1.00 0.00 O ATOM 948 OE2 GLU B 182 1.044 10.940 5.517 1.00 0.00 O ATOM 0 H GLU B 182 3.393 12.788 0.907 1.00 0.00 H new ATOM 0 HA GLU B 182 4.664 10.479 2.209 1.00 0.00 H new ATOM 0 HB2 GLU B 182 3.119 12.513 3.037 1.00 0.00 H new ATOM 0 HB3 GLU B 182 1.801 11.491 2.498 1.00 0.00 H new ATOM 0 HG2 GLU B 182 2.547 9.656 3.977 1.00 0.00 H new ATOM 0 HG3 GLU B 182 3.986 10.551 4.425 1.00 0.00 H new ATOM 955 N ILE B 183 2.122 10.003 0.199 1.00 0.00 N ATOM 956 CA ILE B 183 1.399 8.916 -0.530 1.00 0.00 C ATOM 957 C ILE B 183 2.372 8.178 -1.455 1.00 0.00 C ATOM 958 O ILE B 183 2.201 7.007 -1.736 1.00 0.00 O ATOM 959 CB ILE B 183 0.300 9.626 -1.329 1.00 0.00 C ATOM 960 CG1 ILE B 183 -0.665 10.308 -0.358 1.00 0.00 C ATOM 961 CG2 ILE B 183 -0.474 8.608 -2.173 1.00 0.00 C ATOM 962 CD1 ILE B 183 -1.605 11.234 -1.134 1.00 0.00 C ATOM 0 H ILE B 183 1.839 10.952 -0.047 1.00 0.00 H new ATOM 0 HA ILE B 183 0.976 8.169 0.142 1.00 0.00 H new ATOM 0 HB ILE B 183 0.755 10.366 -1.987 1.00 0.00 H new ATOM 0 HG12 ILE B 183 -1.242 9.558 0.184 1.00 0.00 H new ATOM 0 HG13 ILE B 183 -0.107 10.879 0.384 1.00 0.00 H new ATOM 0 HG21 ILE B 183 -1.253 9.121 -2.738 1.00 0.00 H new ATOM 0 HG22 ILE B 183 0.209 8.114 -2.864 1.00 0.00 H new ATOM 0 HG23 ILE B 183 -0.930 7.865 -1.519 1.00 0.00 H new ATOM 0 HD11 ILE B 183 -2.292 11.719 -0.441 1.00 0.00 H new ATOM 0 HD12 ILE B 183 -1.020 11.992 -1.656 1.00 0.00 H new ATOM 0 HD13 ILE B 183 -2.173 10.651 -1.859 1.00 0.00 H new ATOM 974 N THR B 184 3.393 8.854 -1.921 1.00 0.00 N ATOM 975 CA THR B 184 4.383 8.188 -2.819 1.00 0.00 C ATOM 976 C THR B 184 5.167 7.139 -2.032 1.00 0.00 C ATOM 977 O THR B 184 5.485 6.079 -2.540 1.00 0.00 O ATOM 978 CB THR B 184 5.311 9.305 -3.303 1.00 0.00 C ATOM 979 OG1 THR B 184 4.542 10.315 -3.941 1.00 0.00 O ATOM 980 CG2 THR B 184 6.328 8.734 -4.292 1.00 0.00 C ATOM 0 H THR B 184 3.582 9.836 -1.718 1.00 0.00 H new ATOM 0 HA THR B 184 3.906 7.677 -3.655 1.00 0.00 H new ATOM 0 HB THR B 184 5.838 9.734 -2.451 1.00 0.00 H new ATOM 0 HG1 THR B 184 4.133 10.892 -3.263 1.00 0.00 H new ATOM 0 HG21 THR B 184 6.988 9.530 -4.636 1.00 0.00 H new ATOM 0 HG22 THR B 184 6.918 7.960 -3.801 1.00 0.00 H new ATOM 0 HG23 THR B 184 5.804 8.304 -5.145 1.00 0.00 H new ATOM 988 N MET B 185 5.470 7.424 -0.790 1.00 0.00 N ATOM 989 CA MET B 185 6.222 6.438 0.043 1.00 0.00 C ATOM 990 C MET B 185 5.316 5.253 0.372 1.00 0.00 C ATOM 991 O MET B 185 5.718 4.108 0.274 1.00 0.00 O ATOM 992 CB MET B 185 6.611 7.193 1.316 1.00 0.00 C ATOM 993 CG MET B 185 7.868 6.564 1.919 1.00 0.00 C ATOM 994 SD MET B 185 9.326 7.150 1.020 1.00 0.00 S ATOM 995 CE MET B 185 9.480 8.748 1.855 1.00 0.00 C ATOM 0 H MET B 185 5.229 8.296 -0.318 1.00 0.00 H new ATOM 0 HA MET B 185 7.101 6.044 -0.468 1.00 0.00 H new ATOM 0 HB2 MET B 185 6.791 8.244 1.088 1.00 0.00 H new ATOM 0 HB3 MET B 185 5.793 7.159 2.036 1.00 0.00 H new ATOM 0 HG2 MET B 185 7.948 6.826 2.974 1.00 0.00 H new ATOM 0 HG3 MET B 185 7.806 5.477 1.864 1.00 0.00 H new ATOM 0 HE1 MET B 185 9.645 9.531 1.115 1.00 0.00 H new ATOM 0 HE2 MET B 185 8.565 8.959 2.409 1.00 0.00 H new ATOM 0 HE3 MET B 185 10.323 8.718 2.545 1.00 0.00 H new ATOM 1005 N VAL B 186 4.091 5.522 0.748 1.00 0.00 N ATOM 1006 CA VAL B 186 3.145 4.413 1.069 1.00 0.00 C ATOM 1007 C VAL B 186 2.836 3.630 -0.207 1.00 0.00 C ATOM 1008 O VAL B 186 2.678 2.425 -0.182 1.00 0.00 O ATOM 1009 CB VAL B 186 1.882 5.092 1.612 1.00 0.00 C ATOM 1010 CG1 VAL B 186 0.833 4.030 1.963 1.00 0.00 C ATOM 1011 CG2 VAL B 186 2.235 5.889 2.871 1.00 0.00 C ATOM 0 H VAL B 186 3.706 6.462 0.846 1.00 0.00 H new ATOM 0 HA VAL B 186 3.554 3.710 1.795 1.00 0.00 H new ATOM 0 HB VAL B 186 1.479 5.762 0.853 1.00 0.00 H new ATOM 0 HG11 VAL B 186 -0.063 4.517 2.348 1.00 0.00 H new ATOM 0 HG12 VAL B 186 0.580 3.459 1.069 1.00 0.00 H new ATOM 0 HG13 VAL B 186 1.235 3.358 2.721 1.00 0.00 H new ATOM 0 HG21 VAL B 186 1.338 6.373 3.259 1.00 0.00 H new ATOM 0 HG22 VAL B 186 2.640 5.215 3.626 1.00 0.00 H new ATOM 0 HG23 VAL B 186 2.979 6.647 2.625 1.00 0.00 H new ATOM 1021 N GLU B 187 2.756 4.312 -1.322 1.00 0.00 N ATOM 1022 CA GLU B 187 2.463 3.615 -2.611 1.00 0.00 C ATOM 1023 C GLU B 187 3.596 2.646 -2.945 1.00 0.00 C ATOM 1024 O GLU B 187 3.376 1.588 -3.505 1.00 0.00 O ATOM 1025 CB GLU B 187 2.376 4.724 -3.663 1.00 0.00 C ATOM 1026 CG GLU B 187 1.893 4.132 -4.989 1.00 0.00 C ATOM 1027 CD GLU B 187 1.093 5.187 -5.757 1.00 0.00 C ATOM 1028 OE1 GLU B 187 1.506 6.334 -5.752 1.00 0.00 O ATOM 1029 OE2 GLU B 187 0.081 4.828 -6.336 1.00 0.00 O ATOM 0 H GLU B 187 2.881 5.322 -1.395 1.00 0.00 H new ATOM 0 HA GLU B 187 1.542 3.033 -2.566 1.00 0.00 H new ATOM 0 HB2 GLU B 187 1.691 5.504 -3.329 1.00 0.00 H new ATOM 0 HB3 GLU B 187 3.351 5.192 -3.795 1.00 0.00 H new ATOM 0 HG2 GLU B 187 2.745 3.802 -5.584 1.00 0.00 H new ATOM 0 HG3 GLU B 187 1.274 3.254 -4.804 1.00 0.00 H new ATOM 1036 N GLN B 188 4.806 3.000 -2.596 1.00 0.00 N ATOM 1037 CA GLN B 188 5.964 2.100 -2.880 1.00 0.00 C ATOM 1038 C GLN B 188 5.907 0.868 -1.970 1.00 0.00 C ATOM 1039 O GLN B 188 6.437 -0.177 -2.295 1.00 0.00 O ATOM 1040 CB GLN B 188 7.209 2.936 -2.575 1.00 0.00 C ATOM 1041 CG GLN B 188 8.300 2.623 -3.601 1.00 0.00 C ATOM 1042 CD GLN B 188 8.226 3.630 -4.750 1.00 0.00 C ATOM 1043 OE1 GLN B 188 9.235 4.154 -5.181 1.00 0.00 O ATOM 1044 NE2 GLN B 188 7.066 3.926 -5.269 1.00 0.00 N ATOM 0 H GLN B 188 5.042 3.874 -2.126 1.00 0.00 H new ATOM 0 HA GLN B 188 5.963 1.739 -3.909 1.00 0.00 H new ATOM 0 HB2 GLN B 188 6.963 3.997 -2.603 1.00 0.00 H new ATOM 0 HB3 GLN B 188 7.568 2.719 -1.569 1.00 0.00 H new ATOM 0 HG2 GLN B 188 9.281 2.666 -3.128 1.00 0.00 H new ATOM 0 HG3 GLN B 188 8.175 1.610 -3.983 1.00 0.00 H new ATOM 0 HE21 GLN B 188 6.219 3.487 -4.908 1.00 0.00 H new ATOM 0 HE22 GLN B 188 7.006 4.596 -6.035 1.00 0.00 H new ATOM 1053 N GLN B 189 5.265 0.987 -0.833 1.00 0.00 N ATOM 1054 CA GLN B 189 5.170 -0.174 0.104 1.00 0.00 C ATOM 1055 C GLN B 189 4.153 -1.198 -0.413 1.00 0.00 C ATOM 1056 O GLN B 189 4.229 -2.369 -0.090 1.00 0.00 O ATOM 1057 CB GLN B 189 4.700 0.424 1.435 1.00 0.00 C ATOM 1058 CG GLN B 189 5.476 -0.216 2.591 1.00 0.00 C ATOM 1059 CD GLN B 189 6.648 0.686 2.984 1.00 0.00 C ATOM 1060 OE1 GLN B 189 6.926 0.866 4.153 1.00 0.00 O ATOM 1061 NE2 GLN B 189 7.351 1.267 2.050 1.00 0.00 N ATOM 0 H GLN B 189 4.803 1.839 -0.514 1.00 0.00 H new ATOM 0 HA GLN B 189 6.121 -0.697 0.204 1.00 0.00 H new ATOM 0 HB2 GLN B 189 4.854 1.503 1.434 1.00 0.00 H new ATOM 0 HB3 GLN B 189 3.631 0.254 1.564 1.00 0.00 H new ATOM 0 HG2 GLN B 189 4.817 -0.366 3.446 1.00 0.00 H new ATOM 0 HG3 GLN B 189 5.843 -1.199 2.296 1.00 0.00 H new ATOM 0 HE21 GLN B 189 7.118 1.116 1.068 1.00 0.00 H new ATOM 0 HE22 GLN B 189 8.133 1.872 2.302 1.00 0.00 H new ATOM 1070 N ILE B 190 3.203 -0.770 -1.211 1.00 0.00 N ATOM 1071 CA ILE B 190 2.185 -1.729 -1.745 1.00 0.00 C ATOM 1072 C ILE B 190 2.783 -2.514 -2.914 1.00 0.00 C ATOM 1073 O ILE B 190 2.492 -3.680 -3.104 1.00 0.00 O ATOM 1074 CB ILE B 190 0.994 -0.879 -2.227 1.00 0.00 C ATOM 1075 CG1 ILE B 190 0.557 0.127 -1.145 1.00 0.00 C ATOM 1076 CG2 ILE B 190 -0.185 -1.801 -2.554 1.00 0.00 C ATOM 1077 CD1 ILE B 190 0.205 -0.599 0.159 1.00 0.00 C ATOM 0 H ILE B 190 3.089 0.197 -1.514 1.00 0.00 H new ATOM 0 HA ILE B 190 1.871 -2.445 -0.986 1.00 0.00 H new ATOM 0 HB ILE B 190 1.304 -0.325 -3.113 1.00 0.00 H new ATOM 0 HG12 ILE B 190 1.358 0.844 -0.963 1.00 0.00 H new ATOM 0 HG13 ILE B 190 -0.305 0.694 -1.496 1.00 0.00 H new ATOM 0 HG21 ILE B 190 -1.030 -1.204 -2.896 1.00 0.00 H new ATOM 0 HG22 ILE B 190 0.106 -2.500 -3.338 1.00 0.00 H new ATOM 0 HG23 ILE B 190 -0.471 -2.357 -1.661 1.00 0.00 H new ATOM 0 HD11 ILE B 190 -0.101 0.129 0.910 1.00 0.00 H new ATOM 0 HD12 ILE B 190 -0.612 -1.298 -0.023 1.00 0.00 H new ATOM 0 HD13 ILE B 190 1.077 -1.146 0.518 1.00 0.00 H new ATOM 1089 N SER B 191 3.622 -1.879 -3.691 1.00 0.00 N ATOM 1090 CA SER B 191 4.254 -2.579 -4.850 1.00 0.00 C ATOM 1091 C SER B 191 5.352 -3.519 -4.348 1.00 0.00 C ATOM 1092 O SER B 191 5.612 -4.552 -4.936 1.00 0.00 O ATOM 1093 CB SER B 191 4.850 -1.469 -5.714 1.00 0.00 C ATOM 1094 OG SER B 191 3.948 -0.371 -5.756 1.00 0.00 O ATOM 0 H SER B 191 3.897 -0.904 -3.573 1.00 0.00 H new ATOM 0 HA SER B 191 3.541 -3.184 -5.410 1.00 0.00 H new ATOM 0 HB2 SER B 191 5.810 -1.151 -5.307 1.00 0.00 H new ATOM 0 HB3 SER B 191 5.038 -1.838 -6.722 1.00 0.00 H new ATOM 0 HG SER B 191 4.328 0.344 -6.308 1.00 0.00 H new ATOM 1100 N LYS B 192 5.988 -3.169 -3.259 1.00 0.00 N ATOM 1101 CA LYS B 192 7.065 -4.040 -2.704 1.00 0.00 C ATOM 1102 C LYS B 192 6.442 -5.263 -2.030 1.00 0.00 C ATOM 1103 O LYS B 192 7.006 -6.342 -2.038 1.00 0.00 O ATOM 1104 CB LYS B 192 7.800 -3.174 -1.679 1.00 0.00 C ATOM 1105 CG LYS B 192 8.481 -2.004 -2.392 1.00 0.00 C ATOM 1106 CD LYS B 192 9.913 -2.395 -2.761 1.00 0.00 C ATOM 1107 CE LYS B 192 10.496 -1.352 -3.718 1.00 0.00 C ATOM 1108 NZ LYS B 192 11.782 -1.938 -4.189 1.00 0.00 N ATOM 0 H LYS B 192 5.807 -2.316 -2.730 1.00 0.00 H new ATOM 0 HA LYS B 192 7.743 -4.405 -3.476 1.00 0.00 H new ATOM 0 HB2 LYS B 192 7.098 -2.800 -0.933 1.00 0.00 H new ATOM 0 HB3 LYS B 192 8.541 -3.771 -1.148 1.00 0.00 H new ATOM 0 HG2 LYS B 192 7.923 -1.737 -3.289 1.00 0.00 H new ATOM 0 HG3 LYS B 192 8.487 -1.125 -1.747 1.00 0.00 H new ATOM 0 HD2 LYS B 192 10.526 -2.462 -1.862 1.00 0.00 H new ATOM 0 HD3 LYS B 192 9.924 -3.380 -3.229 1.00 0.00 H new ATOM 0 HE2 LYS B 192 9.821 -1.160 -4.552 1.00 0.00 H new ATOM 0 HE3 LYS B 192 10.658 -0.400 -3.213 1.00 0.00 H new ATOM 0 HZ1 LYS B 192 12.242 -1.280 -4.850 1.00 0.00 H new ATOM 0 HZ2 LYS B 192 12.407 -2.103 -3.374 1.00 0.00 H new ATOM 0 HZ3 LYS B 192 11.596 -2.840 -4.672 1.00 0.00 H new ATOM 1122 N LEU B 193 5.275 -5.103 -1.455 1.00 0.00 N ATOM 1123 CA LEU B 193 4.603 -6.259 -0.788 1.00 0.00 C ATOM 1124 C LEU B 193 4.101 -7.237 -1.850 1.00 0.00 C ATOM 1125 O LEU B 193 4.134 -8.439 -1.664 1.00 0.00 O ATOM 1126 CB LEU B 193 3.429 -5.655 -0.006 1.00 0.00 C ATOM 1127 CG LEU B 193 3.735 -5.696 1.494 1.00 0.00 C ATOM 1128 CD1 LEU B 193 3.132 -4.466 2.174 1.00 0.00 C ATOM 1129 CD2 LEU B 193 3.129 -6.963 2.105 1.00 0.00 C ATOM 0 H LEU B 193 4.760 -4.223 -1.419 1.00 0.00 H new ATOM 0 HA LEU B 193 5.275 -6.809 -0.129 1.00 0.00 H new ATOM 0 HB2 LEU B 193 3.258 -4.627 -0.324 1.00 0.00 H new ATOM 0 HB3 LEU B 193 2.515 -6.210 -0.216 1.00 0.00 H new ATOM 0 HG LEU B 193 4.815 -5.700 1.642 1.00 0.00 H new ATOM 0 HD11 LEU B 193 3.351 -4.497 3.241 1.00 0.00 H new ATOM 0 HD12 LEU B 193 3.563 -3.563 1.741 1.00 0.00 H new ATOM 0 HD13 LEU B 193 2.052 -4.460 2.025 1.00 0.00 H new ATOM 0 HD21 LEU B 193 3.347 -6.992 3.173 1.00 0.00 H new ATOM 0 HD22 LEU B 193 2.049 -6.959 1.955 1.00 0.00 H new ATOM 0 HD23 LEU B 193 3.559 -7.841 1.623 1.00 0.00 H new ATOM 1141 N LYS B 194 3.650 -6.727 -2.969 1.00 0.00 N ATOM 1142 CA LYS B 194 3.155 -7.623 -4.058 1.00 0.00 C ATOM 1143 C LYS B 194 4.317 -8.460 -4.595 1.00 0.00 C ATOM 1144 O LYS B 194 4.174 -9.641 -4.855 1.00 0.00 O ATOM 1145 CB LYS B 194 2.620 -6.686 -5.144 1.00 0.00 C ATOM 1146 CG LYS B 194 1.749 -7.481 -6.120 1.00 0.00 C ATOM 1147 CD LYS B 194 0.378 -7.737 -5.490 1.00 0.00 C ATOM 1148 CE LYS B 194 -0.523 -6.521 -5.719 1.00 0.00 C ATOM 1149 NZ LYS B 194 -1.175 -6.770 -7.036 1.00 0.00 N ATOM 0 H LYS B 194 3.603 -5.729 -3.175 1.00 0.00 H new ATOM 0 HA LYS B 194 2.385 -8.313 -3.713 1.00 0.00 H new ATOM 0 HB2 LYS B 194 2.038 -5.883 -4.692 1.00 0.00 H new ATOM 0 HB3 LYS B 194 3.448 -6.219 -5.677 1.00 0.00 H new ATOM 0 HG2 LYS B 194 1.635 -6.930 -7.054 1.00 0.00 H new ATOM 0 HG3 LYS B 194 2.231 -8.428 -6.365 1.00 0.00 H new ATOM 0 HD2 LYS B 194 -0.075 -8.626 -5.928 1.00 0.00 H new ATOM 0 HD3 LYS B 194 0.486 -7.927 -4.422 1.00 0.00 H new ATOM 0 HE2 LYS B 194 -1.263 -6.422 -4.924 1.00 0.00 H new ATOM 0 HE3 LYS B 194 0.056 -5.597 -5.733 1.00 0.00 H new ATOM 0 HZ1 LYS B 194 -1.810 -5.979 -7.264 1.00 0.00 H new ATOM 0 HZ2 LYS B 194 -0.447 -6.853 -7.774 1.00 0.00 H new ATOM 0 HZ3 LYS B 194 -1.724 -7.652 -6.990 1.00 0.00 H new ATOM 1163 N LYS B 195 5.469 -7.857 -4.747 1.00 0.00 N ATOM 1164 CA LYS B 195 6.653 -8.614 -5.251 1.00 0.00 C ATOM 1165 C LYS B 195 7.130 -9.587 -4.172 1.00 0.00 C ATOM 1166 O LYS B 195 7.622 -10.661 -4.463 1.00 0.00 O ATOM 1167 CB LYS B 195 7.720 -7.555 -5.536 1.00 0.00 C ATOM 1168 CG LYS B 195 8.970 -8.226 -6.108 1.00 0.00 C ATOM 1169 CD LYS B 195 8.914 -8.190 -7.637 1.00 0.00 C ATOM 1170 CE LYS B 195 9.892 -9.218 -8.209 1.00 0.00 C ATOM 1171 NZ LYS B 195 10.128 -8.783 -9.613 1.00 0.00 N ATOM 0 H LYS B 195 5.640 -6.872 -4.543 1.00 0.00 H new ATOM 0 HA LYS B 195 6.428 -9.200 -6.142 1.00 0.00 H new ATOM 0 HB2 LYS B 195 7.336 -6.818 -6.241 1.00 0.00 H new ATOM 0 HB3 LYS B 195 7.969 -7.020 -4.620 1.00 0.00 H new ATOM 0 HG2 LYS B 195 9.865 -7.714 -5.754 1.00 0.00 H new ATOM 0 HG3 LYS B 195 9.034 -9.257 -5.760 1.00 0.00 H new ATOM 0 HD2 LYS B 195 7.902 -8.406 -7.979 1.00 0.00 H new ATOM 0 HD3 LYS B 195 9.167 -7.193 -7.997 1.00 0.00 H new ATOM 0 HE2 LYS B 195 10.822 -9.238 -7.640 1.00 0.00 H new ATOM 0 HE3 LYS B 195 9.474 -10.224 -8.172 1.00 0.00 H new ATOM 0 HZ1 LYS B 195 10.790 -9.440 -10.073 1.00 0.00 H new ATOM 0 HZ2 LYS B 195 9.227 -8.780 -10.132 1.00 0.00 H new ATOM 0 HZ3 LYS B 195 10.532 -7.825 -9.616 1.00 0.00 H new ATOM 1185 N LYS B 196 6.968 -9.218 -2.926 1.00 0.00 N ATOM 1186 CA LYS B 196 7.392 -10.119 -1.813 1.00 0.00 C ATOM 1187 C LYS B 196 6.494 -11.357 -1.793 1.00 0.00 C ATOM 1188 O LYS B 196 6.919 -12.441 -1.440 1.00 0.00 O ATOM 1189 CB LYS B 196 7.211 -9.298 -0.534 1.00 0.00 C ATOM 1190 CG LYS B 196 7.664 -10.120 0.675 1.00 0.00 C ATOM 1191 CD LYS B 196 6.949 -9.616 1.930 1.00 0.00 C ATOM 1192 CE LYS B 196 5.449 -9.900 1.814 1.00 0.00 C ATOM 1193 NZ LYS B 196 4.982 -10.078 3.216 1.00 0.00 N ATOM 0 H LYS B 196 6.560 -8.331 -2.632 1.00 0.00 H new ATOM 0 HA LYS B 196 8.421 -10.463 -1.921 1.00 0.00 H new ATOM 0 HB2 LYS B 196 7.790 -8.377 -0.597 1.00 0.00 H new ATOM 0 HB3 LYS B 196 6.166 -9.011 -0.420 1.00 0.00 H new ATOM 0 HG2 LYS B 196 7.441 -11.175 0.515 1.00 0.00 H new ATOM 0 HG3 LYS B 196 8.744 -10.038 0.801 1.00 0.00 H new ATOM 0 HD2 LYS B 196 7.355 -10.107 2.814 1.00 0.00 H new ATOM 0 HD3 LYS B 196 7.119 -8.546 2.053 1.00 0.00 H new ATOM 0 HE2 LYS B 196 4.928 -9.076 1.326 1.00 0.00 H new ATOM 0 HE3 LYS B 196 5.261 -10.794 1.219 1.00 0.00 H new ATOM 0 HZ1 LYS B 196 3.948 -9.972 3.254 1.00 0.00 H new ATOM 0 HZ2 LYS B 196 5.245 -11.026 3.552 1.00 0.00 H new ATOM 0 HZ3 LYS B 196 5.426 -9.360 3.824 1.00 0.00 H new ATOM 1207 N GLN B 197 5.254 -11.197 -2.182 1.00 0.00 N ATOM 1208 CA GLN B 197 4.316 -12.361 -2.202 1.00 0.00 C ATOM 1209 C GLN B 197 4.783 -13.381 -3.242 1.00 0.00 C ATOM 1210 O GLN B 197 4.579 -14.571 -3.094 1.00 0.00 O ATOM 1211 CB GLN B 197 2.956 -11.779 -2.593 1.00 0.00 C ATOM 1212 CG GLN B 197 1.898 -12.883 -2.556 1.00 0.00 C ATOM 1213 CD GLN B 197 1.208 -12.883 -1.189 1.00 0.00 C ATOM 1214 OE1 GLN B 197 0.128 -12.350 -1.041 1.00 0.00 O ATOM 1215 NE2 GLN B 197 1.792 -13.466 -0.179 1.00 0.00 N ATOM 0 H GLN B 197 4.851 -10.311 -2.487 1.00 0.00 H new ATOM 0 HA GLN B 197 4.270 -12.874 -1.241 1.00 0.00 H new ATOM 0 HB2 GLN B 197 2.682 -10.976 -1.909 1.00 0.00 H new ATOM 0 HB3 GLN B 197 3.008 -11.344 -3.591 1.00 0.00 H new ATOM 0 HG2 GLN B 197 1.164 -12.724 -3.346 1.00 0.00 H new ATOM 0 HG3 GLN B 197 2.361 -13.852 -2.741 1.00 0.00 H new ATOM 0 HE21 GLN B 197 2.700 -13.914 -0.304 1.00 0.00 H new ATOM 0 HE22 GLN B 197 1.341 -13.474 0.736 1.00 0.00 H new ATOM 1224 N GLN B 198 5.414 -12.916 -4.291 1.00 0.00 N ATOM 1225 CA GLN B 198 5.907 -13.851 -5.348 1.00 0.00 C ATOM 1226 C GLN B 198 6.940 -14.808 -4.753 1.00 0.00 C ATOM 1227 O GLN B 198 6.922 -15.996 -5.012 1.00 0.00 O ATOM 1228 CB GLN B 198 6.555 -12.958 -6.410 1.00 0.00 C ATOM 1229 CG GLN B 198 6.603 -13.704 -7.746 1.00 0.00 C ATOM 1230 CD GLN B 198 6.392 -12.714 -8.893 1.00 0.00 C ATOM 1231 OE1 GLN B 198 7.160 -12.683 -9.833 1.00 0.00 O ATOM 1232 NE2 GLN B 198 5.374 -11.899 -8.853 1.00 0.00 N ATOM 0 H GLN B 198 5.609 -11.929 -4.461 1.00 0.00 H new ATOM 0 HA GLN B 198 5.105 -14.458 -5.768 1.00 0.00 H new ATOM 0 HB2 GLN B 198 5.988 -12.033 -6.518 1.00 0.00 H new ATOM 0 HB3 GLN B 198 7.562 -12.680 -6.101 1.00 0.00 H new ATOM 0 HG2 GLN B 198 7.563 -14.208 -7.859 1.00 0.00 H new ATOM 0 HG3 GLN B 198 5.833 -14.475 -7.771 1.00 0.00 H new ATOM 0 HE21 GLN B 198 4.730 -11.926 -8.063 1.00 0.00 H new ATOM 0 HE22 GLN B 198 5.222 -11.235 -9.612 1.00 0.00 H new ATOM 1241 N GLN B 199 7.834 -14.292 -3.953 1.00 0.00 N ATOM 1242 CA GLN B 199 8.875 -15.163 -3.324 1.00 0.00 C ATOM 1243 C GLN B 199 8.206 -16.214 -2.438 1.00 0.00 C ATOM 1244 O GLN B 199 8.598 -17.366 -2.422 1.00 0.00 O ATOM 1245 CB GLN B 199 9.739 -14.221 -2.481 1.00 0.00 C ATOM 1246 CG GLN B 199 10.806 -13.575 -3.367 1.00 0.00 C ATOM 1247 CD GLN B 199 11.530 -12.481 -2.580 1.00 0.00 C ATOM 1248 OE1 GLN B 199 12.413 -12.766 -1.795 1.00 0.00 O ATOM 1249 NE2 GLN B 199 11.192 -11.233 -2.757 1.00 0.00 N ATOM 0 H GLN B 199 7.890 -13.304 -3.706 1.00 0.00 H new ATOM 0 HA GLN B 199 9.470 -15.696 -4.066 1.00 0.00 H new ATOM 0 HB2 GLN B 199 9.117 -13.452 -2.024 1.00 0.00 H new ATOM 0 HB3 GLN B 199 10.212 -14.773 -1.669 1.00 0.00 H new ATOM 0 HG2 GLN B 199 11.519 -14.328 -3.703 1.00 0.00 H new ATOM 0 HG3 GLN B 199 10.345 -13.151 -4.259 1.00 0.00 H new ATOM 0 HE21 GLN B 199 10.451 -10.994 -3.416 1.00 0.00 H new ATOM 0 HE22 GLN B 199 11.669 -10.497 -2.237 1.00 0.00 H new ATOM 1258 N LEU B 200 7.191 -15.826 -1.708 1.00 0.00 N ATOM 1259 CA LEU B 200 6.480 -16.799 -0.826 1.00 0.00 C ATOM 1260 C LEU B 200 5.619 -17.731 -1.681 1.00 0.00 C ATOM 1261 O LEU B 200 5.435 -18.890 -1.359 1.00 0.00 O ATOM 1262 CB LEU B 200 5.602 -15.947 0.093 1.00 0.00 C ATOM 1263 CG LEU B 200 5.414 -16.665 1.431 1.00 0.00 C ATOM 1264 CD1 LEU B 200 6.488 -16.199 2.416 1.00 0.00 C ATOM 1265 CD2 LEU B 200 4.029 -16.337 1.995 1.00 0.00 C ATOM 0 H LEU B 200 6.824 -14.875 -1.685 1.00 0.00 H new ATOM 0 HA LEU B 200 7.167 -17.423 -0.255 1.00 0.00 H new ATOM 0 HB2 LEU B 200 6.063 -14.973 0.253 1.00 0.00 H new ATOM 0 HB3 LEU B 200 4.634 -15.768 -0.375 1.00 0.00 H new ATOM 0 HG LEU B 200 5.501 -17.741 1.281 1.00 0.00 H new ATOM 0 HD11 LEU B 200 6.354 -16.710 3.369 1.00 0.00 H new ATOM 0 HD12 LEU B 200 7.475 -16.431 2.015 1.00 0.00 H new ATOM 0 HD13 LEU B 200 6.401 -15.123 2.566 1.00 0.00 H new ATOM 0 HD21 LEU B 200 3.894 -16.848 2.948 1.00 0.00 H new ATOM 0 HD22 LEU B 200 3.943 -15.261 2.145 1.00 0.00 H new ATOM 0 HD23 LEU B 200 3.263 -16.668 1.294 1.00 0.00 H new ATOM 1277 N GLU B 201 5.103 -17.229 -2.773 1.00 0.00 N ATOM 1278 CA GLU B 201 4.261 -18.077 -3.667 1.00 0.00 C ATOM 1279 C GLU B 201 5.156 -18.993 -4.504 1.00 0.00 C ATOM 1280 O GLU B 201 4.777 -20.094 -4.857 1.00 0.00 O ATOM 1281 CB GLU B 201 3.509 -17.094 -4.566 1.00 0.00 C ATOM 1282 CG GLU B 201 2.224 -16.642 -3.869 1.00 0.00 C ATOM 1283 CD GLU B 201 1.148 -16.358 -4.918 1.00 0.00 C ATOM 1284 OE1 GLU B 201 0.999 -17.165 -5.821 1.00 0.00 O ATOM 1285 OE2 GLU B 201 0.490 -15.337 -4.801 1.00 0.00 O ATOM 0 H GLU B 201 5.229 -16.266 -3.084 1.00 0.00 H new ATOM 0 HA GLU B 201 3.576 -18.715 -3.109 1.00 0.00 H new ATOM 0 HB2 GLU B 201 4.138 -16.232 -4.786 1.00 0.00 H new ATOM 0 HB3 GLU B 201 3.271 -17.566 -5.519 1.00 0.00 H new ATOM 0 HG2 GLU B 201 1.881 -17.414 -3.180 1.00 0.00 H new ATOM 0 HG3 GLU B 201 2.414 -15.747 -3.276 1.00 0.00 H new