USER MOD reduce.3.24.130724 H: found=0, std=0, add=556, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 559 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 267 GLN : amide:sc= 0.36 K(o=0.65,f=-0.043) USER MOD Set 1.2: A 296 THR OG1 : rot 170:sc= 0.29 USER MOD Set 2.1: A 248 THR OG1 : rot 180:sc= -0.0808 USER MOD Set 2.2: A 312 THR OG1 : rot -119:sc= -0.0933 USER MOD Set 3.1: A 232 THR OG1 : rot 150:sc= 0.965 USER MOD Set 3.2: A 250 THR OG1 : rot 180:sc= 0 USER MOD Single : A 227 THR OG1 : rot 180:sc= 0 USER MOD Single : A 229 THR OG1 : rot 180:sc= 0 USER MOD Single : A 231 LYS NZ :NH3+ 126:sc= 1.3 (180deg=0.144) USER MOD Single : A 233 GLN : amide:sc= -3.02 K(o=-3,f=-7.7!) USER MOD Single : A 235 THR OG1 : rot 180:sc= 0 USER MOD Single : A 237 THR OG1 : rot 180:sc= 0 USER MOD Single : A 238 TYR OH : rot -42:sc= 0.347 USER MOD Single : A 239 ASN : amide:sc= -0.916 K(o=-0.92,f=-5.6!) USER MOD Single : A 242 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 244 SER OG : rot 180:sc= 0 USER MOD Single : A 245 TYR OH : rot 150:sc= -0.239 USER MOD Single : A 246 GLN : amide:sc= -0.362 X(o=-0.36,f=0) USER MOD Single : A 252 THR OG1 : rot 180:sc= -1.89! USER MOD Single : A 255 THR OG1 : rot 95:sc= 0.29 USER MOD Single : A 257 SER OG : rot -59:sc= 0.292 USER MOD Single : A 259 THR OG1 : rot 180:sc= 0 USER MOD Single : A 263 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 269 LYS NZ :NH3+ -132:sc= -0.285 (180deg=-1.57!) USER MOD Single : A 271 THR OG1 : rot 180:sc= 0 USER MOD Single : A 272 ASN : amide:sc= 0.15 K(o=0.15,f=-5.2!) USER MOD Single : A 292 SER OG : rot -29:sc= 0.168 USER MOD Single : A 294 THR OG1 : rot 180:sc= 0 USER MOD Single : A 298 THR OG1 : rot -44:sc= 0.345 USER MOD Single : A 302 ASN : amide:sc= -0.0393 X(o=-0.039,f=-0.31) USER MOD Single : A 303 SER OG : rot 104:sc= 0.163 USER MOD Single : A 305 SER OG : rot -41:sc= 0.0191 USER MOD Single : A 310 THR OG1 : rot -175:sc= -2.39! USER MOD Single : A 314 SER OG : rot 180:sc= 0 USER MOD Single : A 340 SER OG : rot 66:sc= 1.15 USER MOD ----------------------------------------------------------------- ATOM 47 N GLY A 226 12.044 -5.209 -9.130 1.00 0.00 N ATOM 48 CA GLY A 226 11.620 -6.561 -8.844 1.00 0.00 C ATOM 49 C GLY A 226 10.575 -6.633 -7.751 1.00 0.00 C ATOM 50 O GLY A 226 9.712 -5.760 -7.638 1.00 0.00 O ATOM 0 HA2 GLY A 226 11.219 -7.010 -9.753 1.00 0.00 H new ATOM 0 HA3 GLY A 226 12.487 -7.154 -8.551 1.00 0.00 H new ATOM 54 N THR A 227 10.661 -7.671 -6.942 1.00 0.00 N ATOM 55 CA THR A 227 9.664 -7.940 -5.922 1.00 0.00 C ATOM 56 C THR A 227 10.194 -7.605 -4.531 1.00 0.00 C ATOM 57 O THR A 227 11.391 -7.717 -4.265 1.00 0.00 O ATOM 58 CB THR A 227 9.286 -9.426 -5.937 1.00 0.00 C ATOM 59 OG1 THR A 227 9.153 -9.880 -7.292 1.00 0.00 O ATOM 60 CG2 THR A 227 7.983 -9.686 -5.190 1.00 0.00 C ATOM 0 H THR A 227 11.421 -8.350 -6.972 1.00 0.00 H new ATOM 0 HA THR A 227 8.796 -7.318 -6.141 1.00 0.00 H new ATOM 0 HB THR A 227 10.082 -9.974 -5.432 1.00 0.00 H new ATOM 0 HG1 THR A 227 8.913 -10.830 -7.297 1.00 0.00 H new ATOM 0 HG21 THR A 227 7.750 -10.750 -5.224 1.00 0.00 H new ATOM 0 HG22 THR A 227 8.089 -9.371 -4.152 1.00 0.00 H new ATOM 0 HG23 THR A 227 7.176 -9.123 -5.659 1.00 0.00 H new ATOM 68 N LEU A 228 9.300 -7.175 -3.665 1.00 0.00 N ATOM 69 CA LEU A 228 9.575 -7.074 -2.248 1.00 0.00 C ATOM 70 C LEU A 228 8.409 -7.704 -1.497 1.00 0.00 C ATOM 71 O LEU A 228 7.474 -8.207 -2.117 1.00 0.00 O ATOM 72 CB LEU A 228 9.791 -5.619 -1.808 1.00 0.00 C ATOM 73 CG LEU A 228 10.900 -4.858 -2.582 1.00 0.00 C ATOM 74 CD1 LEU A 228 10.341 -4.013 -3.729 1.00 0.00 C ATOM 75 CD2 LEU A 228 11.699 -3.978 -1.634 1.00 0.00 C ATOM 0 H LEU A 228 8.358 -6.884 -3.926 1.00 0.00 H new ATOM 0 HA LEU A 228 10.501 -7.602 -2.021 1.00 0.00 H new ATOM 0 HB2 LEU A 228 8.852 -5.077 -1.922 1.00 0.00 H new ATOM 0 HB3 LEU A 228 10.038 -5.609 -0.746 1.00 0.00 H new ATOM 0 HG LEU A 228 11.553 -5.612 -3.021 1.00 0.00 H new ATOM 0 HD11 LEU A 228 11.159 -3.502 -4.237 1.00 0.00 H new ATOM 0 HD12 LEU A 228 9.821 -4.659 -4.437 1.00 0.00 H new ATOM 0 HD13 LEU A 228 9.644 -3.275 -3.331 1.00 0.00 H new ATOM 0 HD21 LEU A 228 12.473 -3.451 -2.192 1.00 0.00 H new ATOM 0 HD22 LEU A 228 11.035 -3.254 -1.163 1.00 0.00 H new ATOM 0 HD23 LEU A 228 12.163 -4.598 -0.867 1.00 0.00 H new ATOM 87 N THR A 229 8.454 -7.689 -0.186 1.00 0.00 N ATOM 88 CA THR A 229 7.456 -8.381 0.608 1.00 0.00 C ATOM 89 C THR A 229 6.834 -7.445 1.648 1.00 0.00 C ATOM 90 O THR A 229 7.441 -6.447 2.034 1.00 0.00 O ATOM 91 CB THR A 229 8.116 -9.578 1.311 1.00 0.00 C ATOM 92 OG1 THR A 229 8.848 -10.358 0.357 1.00 0.00 O ATOM 93 CG2 THR A 229 7.100 -10.473 2.016 1.00 0.00 C ATOM 0 H THR A 229 9.170 -7.206 0.357 1.00 0.00 H new ATOM 0 HA THR A 229 6.660 -8.727 -0.052 1.00 0.00 H new ATOM 0 HB THR A 229 8.786 -9.174 2.070 1.00 0.00 H new ATOM 0 HG1 THR A 229 9.268 -11.119 0.810 1.00 0.00 H new ATOM 0 HG21 THR A 229 7.618 -11.303 2.496 1.00 0.00 H new ATOM 0 HG22 THR A 229 6.566 -9.894 2.769 1.00 0.00 H new ATOM 0 HG23 THR A 229 6.390 -10.862 1.286 1.00 0.00 H new ATOM 101 N VAL A 230 5.622 -7.766 2.080 1.00 0.00 N ATOM 102 CA VAL A 230 4.933 -6.996 3.110 1.00 0.00 C ATOM 103 C VAL A 230 4.806 -7.794 4.407 1.00 0.00 C ATOM 104 O VAL A 230 4.517 -8.992 4.385 1.00 0.00 O ATOM 105 CB VAL A 230 3.532 -6.545 2.614 1.00 0.00 C ATOM 106 CG1 VAL A 230 2.471 -6.687 3.704 1.00 0.00 C ATOM 107 CG2 VAL A 230 3.592 -5.095 2.150 1.00 0.00 C ATOM 0 H VAL A 230 5.090 -8.563 1.730 1.00 0.00 H new ATOM 0 HA VAL A 230 5.532 -6.109 3.316 1.00 0.00 H new ATOM 0 HB VAL A 230 3.251 -7.193 1.784 1.00 0.00 H new ATOM 0 HG11 VAL A 230 1.506 -6.361 3.317 1.00 0.00 H new ATOM 0 HG12 VAL A 230 2.405 -7.730 4.013 1.00 0.00 H new ATOM 0 HG13 VAL A 230 2.745 -6.071 4.561 1.00 0.00 H new ATOM 0 HG21 VAL A 230 2.607 -4.783 1.803 1.00 0.00 H new ATOM 0 HG22 VAL A 230 3.902 -4.460 2.980 1.00 0.00 H new ATOM 0 HG23 VAL A 230 4.310 -5.003 1.335 1.00 0.00 H new ATOM 117 N LYS A 231 5.048 -7.127 5.533 1.00 0.00 N ATOM 118 CA LYS A 231 4.857 -7.741 6.843 1.00 0.00 C ATOM 119 C LYS A 231 3.655 -7.131 7.556 1.00 0.00 C ATOM 120 O LYS A 231 3.015 -7.780 8.381 1.00 0.00 O ATOM 121 CB LYS A 231 6.107 -7.581 7.710 1.00 0.00 C ATOM 122 CG LYS A 231 7.312 -8.342 7.184 1.00 0.00 C ATOM 123 CD LYS A 231 8.485 -8.279 8.150 1.00 0.00 C ATOM 124 CE LYS A 231 9.071 -6.878 8.243 1.00 0.00 C ATOM 125 NZ LYS A 231 10.255 -6.837 9.138 1.00 0.00 N1+ ATOM 0 H LYS A 231 5.377 -6.162 5.564 1.00 0.00 H new ATOM 0 HA LYS A 231 4.673 -8.804 6.686 1.00 0.00 H new ATOM 0 HB2 LYS A 231 6.358 -6.523 7.780 1.00 0.00 H new ATOM 0 HB3 LYS A 231 5.884 -7.923 8.721 1.00 0.00 H new ATOM 0 HG2 LYS A 231 7.038 -9.383 7.012 1.00 0.00 H new ATOM 0 HG3 LYS A 231 7.611 -7.928 6.221 1.00 0.00 H new ATOM 0 HD2 LYS A 231 8.159 -8.602 9.139 1.00 0.00 H new ATOM 0 HD3 LYS A 231 9.259 -8.975 7.827 1.00 0.00 H new ATOM 0 HE2 LYS A 231 9.355 -6.535 7.248 1.00 0.00 H new ATOM 0 HE3 LYS A 231 8.311 -6.189 8.613 1.00 0.00 H new ATOM 0 HZ1 LYS A 231 11.060 -6.419 8.629 1.00 0.00 H new ATOM 0 HZ2 LYS A 231 10.037 -6.260 9.975 1.00 0.00 H new ATOM 0 HZ3 LYS A 231 10.498 -7.803 9.437 1.00 0.00 H new ATOM 139 N THR A 232 3.342 -5.888 7.224 1.00 0.00 N ATOM 140 CA THR A 232 2.235 -5.183 7.845 1.00 0.00 C ATOM 141 C THR A 232 1.456 -4.432 6.780 1.00 0.00 C ATOM 142 O THR A 232 1.792 -4.493 5.602 1.00 0.00 O ATOM 143 CB THR A 232 2.696 -4.206 8.950 1.00 0.00 C ATOM 144 OG1 THR A 232 3.641 -3.272 8.430 1.00 0.00 O ATOM 145 CG2 THR A 232 3.312 -4.954 10.124 1.00 0.00 C ATOM 0 H THR A 232 3.844 -5.344 6.522 1.00 0.00 H new ATOM 0 HA THR A 232 1.600 -5.927 8.325 1.00 0.00 H new ATOM 0 HB THR A 232 1.816 -3.669 9.303 1.00 0.00 H new ATOM 0 HG1 THR A 232 3.568 -2.426 8.920 1.00 0.00 H new ATOM 0 HG21 THR A 232 3.627 -4.240 10.885 1.00 0.00 H new ATOM 0 HG22 THR A 232 2.575 -5.636 10.548 1.00 0.00 H new ATOM 0 HG23 THR A 232 4.176 -5.522 9.780 1.00 0.00 H new ATOM 153 N GLN A 233 0.420 -3.735 7.187 1.00 0.00 N ATOM 154 CA GLN A 233 -0.549 -3.219 6.245 1.00 0.00 C ATOM 155 C GLN A 233 -0.612 -1.705 6.214 1.00 0.00 C ATOM 156 O GLN A 233 -0.248 -1.031 7.177 1.00 0.00 O ATOM 157 CB GLN A 233 -1.907 -3.802 6.563 1.00 0.00 C ATOM 158 CG GLN A 233 -2.091 -5.186 5.983 1.00 0.00 C ATOM 159 CD GLN A 233 -2.004 -5.197 4.465 1.00 0.00 C ATOM 160 OE1 GLN A 233 -3.011 -5.025 3.779 1.00 0.00 O ATOM 161 NE2 GLN A 233 -0.804 -5.394 3.934 1.00 0.00 N ATOM 0 H GLN A 233 0.226 -3.512 8.163 1.00 0.00 H new ATOM 0 HA GLN A 233 -0.229 -3.523 5.248 1.00 0.00 H new ATOM 0 HB2 GLN A 233 -2.037 -3.844 7.644 1.00 0.00 H new ATOM 0 HB3 GLN A 233 -2.683 -3.142 6.174 1.00 0.00 H new ATOM 0 HG2 GLN A 233 -1.331 -5.852 6.392 1.00 0.00 H new ATOM 0 HG3 GLN A 233 -3.060 -5.580 6.291 1.00 0.00 H new ATOM 0 HE21 GLN A 233 0.005 -5.532 4.539 1.00 0.00 H new ATOM 0 HE22 GLN A 233 -0.691 -5.407 2.920 1.00 0.00 H new ATOM 170 N PRO A 234 -1.096 -1.158 5.090 1.00 0.00 N ATOM 171 CA PRO A 234 -1.252 0.281 4.908 1.00 0.00 C ATOM 172 C PRO A 234 -2.413 0.865 5.711 1.00 0.00 C ATOM 173 O PRO A 234 -3.579 0.702 5.345 1.00 0.00 O ATOM 174 CB PRO A 234 -1.548 0.400 3.409 1.00 0.00 C ATOM 175 CG PRO A 234 -2.205 -0.881 3.058 1.00 0.00 C ATOM 176 CD PRO A 234 -1.509 -1.913 3.888 1.00 0.00 C ATOM 0 HA PRO A 234 -0.373 0.828 5.248 1.00 0.00 H new ATOM 0 HB2 PRO A 234 -2.197 1.250 3.199 1.00 0.00 H new ATOM 0 HB3 PRO A 234 -0.634 0.548 2.834 1.00 0.00 H new ATOM 0 HG2 PRO A 234 -3.272 -0.851 3.279 1.00 0.00 H new ATOM 0 HG3 PRO A 234 -2.106 -1.097 1.994 1.00 0.00 H new ATOM 0 HD2 PRO A 234 -2.172 -2.741 4.140 1.00 0.00 H new ATOM 0 HD3 PRO A 234 -0.652 -2.339 3.366 1.00 0.00 H new ATOM 184 N THR A 235 -2.096 1.546 6.804 1.00 0.00 N ATOM 185 CA THR A 235 -3.097 2.309 7.530 1.00 0.00 C ATOM 186 C THR A 235 -2.456 3.430 8.376 1.00 0.00 C ATOM 187 O THR A 235 -1.708 3.148 9.307 1.00 0.00 O ATOM 188 CB THR A 235 -3.979 1.375 8.405 1.00 0.00 C ATOM 189 OG1 THR A 235 -4.985 2.135 9.086 1.00 0.00 O ATOM 190 CG2 THR A 235 -3.146 0.595 9.422 1.00 0.00 C ATOM 0 H THR A 235 -1.159 1.585 7.204 1.00 0.00 H new ATOM 0 HA THR A 235 -3.742 2.790 6.795 1.00 0.00 H new ATOM 0 HB THR A 235 -4.454 0.657 7.737 1.00 0.00 H new ATOM 0 HG1 THR A 235 -5.535 1.535 9.632 1.00 0.00 H new ATOM 0 HG21 THR A 235 -3.800 -0.046 10.013 1.00 0.00 H new ATOM 0 HG22 THR A 235 -2.414 -0.019 8.898 1.00 0.00 H new ATOM 0 HG23 THR A 235 -2.629 1.293 10.081 1.00 0.00 H new ATOM 198 N VAL A 236 -2.677 4.697 7.970 1.00 0.00 N ATOM 199 CA VAL A 236 -2.403 5.882 8.815 1.00 0.00 C ATOM 200 C VAL A 236 -3.298 7.048 8.371 1.00 0.00 C ATOM 201 O VAL A 236 -2.882 7.918 7.626 1.00 0.00 O ATOM 202 CB VAL A 236 -0.918 6.369 8.796 1.00 0.00 C ATOM 203 CG1 VAL A 236 -0.767 7.688 9.549 1.00 0.00 C ATOM 204 CG2 VAL A 236 0.022 5.354 9.415 1.00 0.00 C ATOM 0 H VAL A 236 -3.050 4.929 7.049 1.00 0.00 H new ATOM 0 HA VAL A 236 -2.616 5.565 9.836 1.00 0.00 H new ATOM 0 HB VAL A 236 -0.653 6.503 7.747 1.00 0.00 H new ATOM 0 HG11 VAL A 236 0.275 8.006 9.521 1.00 0.00 H new ATOM 0 HG12 VAL A 236 -1.391 8.449 9.079 1.00 0.00 H new ATOM 0 HG13 VAL A 236 -1.078 7.553 10.585 1.00 0.00 H new ATOM 0 HG21 VAL A 236 1.043 5.735 9.380 1.00 0.00 H new ATOM 0 HG22 VAL A 236 -0.264 5.178 10.452 1.00 0.00 H new ATOM 0 HG23 VAL A 236 -0.035 4.418 8.859 1.00 0.00 H new ATOM 214 N THR A 237 -4.540 7.021 8.806 1.00 0.00 N ATOM 215 CA THR A 237 -5.486 8.110 8.583 1.00 0.00 C ATOM 216 C THR A 237 -6.095 8.016 7.188 1.00 0.00 C ATOM 217 O THR A 237 -5.533 8.505 6.204 1.00 0.00 O ATOM 218 CB THR A 237 -4.843 9.501 8.796 1.00 0.00 C ATOM 219 OG1 THR A 237 -4.183 9.541 10.071 1.00 0.00 O ATOM 220 CG2 THR A 237 -5.893 10.600 8.736 1.00 0.00 C ATOM 0 H THR A 237 -4.931 6.238 9.330 1.00 0.00 H new ATOM 0 HA THR A 237 -6.276 8.001 9.326 1.00 0.00 H new ATOM 0 HB THR A 237 -4.118 9.668 7.999 1.00 0.00 H new ATOM 0 HG1 THR A 237 -3.776 10.423 10.201 1.00 0.00 H new ATOM 0 HG21 THR A 237 -5.416 11.568 8.889 1.00 0.00 H new ATOM 0 HG22 THR A 237 -6.380 10.585 7.761 1.00 0.00 H new ATOM 0 HG23 THR A 237 -6.637 10.435 9.515 1.00 0.00 H new ATOM 228 N TYR A 238 -7.235 7.349 7.112 1.00 0.00 N ATOM 229 CA TYR A 238 -7.958 7.206 5.863 1.00 0.00 C ATOM 230 C TYR A 238 -9.203 8.079 5.870 1.00 0.00 C ATOM 231 O TYR A 238 -10.196 7.757 6.532 1.00 0.00 O ATOM 232 CB TYR A 238 -8.348 5.733 5.636 1.00 0.00 C ATOM 233 CG TYR A 238 -7.445 5.008 4.673 1.00 0.00 C ATOM 234 CD1 TYR A 238 -6.163 4.628 5.039 1.00 0.00 C ATOM 235 CD2 TYR A 238 -7.884 4.699 3.396 1.00 0.00 C ATOM 236 CE1 TYR A 238 -5.342 3.959 4.157 1.00 0.00 C ATOM 237 CE2 TYR A 238 -7.072 4.031 2.508 1.00 0.00 C ATOM 238 CZ TYR A 238 -5.800 3.662 2.890 1.00 0.00 C ATOM 239 OH TYR A 238 -4.985 2.993 2.005 1.00 0.00 O ATOM 0 H TYR A 238 -7.681 6.895 7.909 1.00 0.00 H new ATOM 0 HA TYR A 238 -7.308 7.527 5.049 1.00 0.00 H new ATOM 0 HB2 TYR A 238 -8.336 5.212 6.593 1.00 0.00 H new ATOM 0 HB3 TYR A 238 -9.371 5.691 5.262 1.00 0.00 H new ATOM 0 HD1 TYR A 238 -5.802 4.860 6.030 1.00 0.00 H new ATOM 0 HD2 TYR A 238 -8.880 4.987 3.092 1.00 0.00 H new ATOM 0 HE1 TYR A 238 -4.346 3.669 4.456 1.00 0.00 H new ATOM 0 HE2 TYR A 238 -7.430 3.797 1.516 1.00 0.00 H new ATOM 0 HH TYR A 238 -4.075 3.351 2.064 1.00 0.00 H new ATOM 249 N ASN A 239 -9.153 9.183 5.144 1.00 0.00 N ATOM 250 CA ASN A 239 -10.284 10.084 5.066 1.00 0.00 C ATOM 251 C ASN A 239 -10.593 10.383 3.608 1.00 0.00 C ATOM 252 O ASN A 239 -9.727 10.798 2.846 1.00 0.00 O ATOM 253 CB ASN A 239 -10.000 11.371 5.842 1.00 0.00 C ATOM 254 CG ASN A 239 -11.265 12.142 6.168 1.00 0.00 C ATOM 255 OD1 ASN A 239 -12.226 12.147 5.397 1.00 0.00 O ATOM 256 ND2 ASN A 239 -11.279 12.787 7.323 1.00 0.00 N ATOM 0 H ASN A 239 -8.340 9.475 4.601 1.00 0.00 H new ATOM 0 HA ASN A 239 -11.154 9.610 5.520 1.00 0.00 H new ATOM 0 HB2 ASN A 239 -9.479 11.126 6.767 1.00 0.00 H new ATOM 0 HB3 ASN A 239 -9.332 12.004 5.258 1.00 0.00 H new ATOM 0 HD21 ASN A 239 -12.107 13.313 7.603 1.00 0.00 H new ATOM 0 HD22 ASN A 239 -10.462 12.758 7.933 1.00 0.00 H new ATOM 263 N ALA A 240 -11.832 10.172 3.237 1.00 0.00 N ATOM 264 CA ALA A 240 -12.234 10.211 1.841 1.00 0.00 C ATOM 265 C ALA A 240 -12.942 11.509 1.499 1.00 0.00 C ATOM 266 O ALA A 240 -12.683 12.109 0.460 1.00 0.00 O ATOM 267 CB ALA A 240 -13.125 9.027 1.530 1.00 0.00 C ATOM 0 H ALA A 240 -12.592 9.969 3.886 1.00 0.00 H new ATOM 0 HA ALA A 240 -11.334 10.157 1.228 1.00 0.00 H new ATOM 0 HB1 ALA A 240 -13.423 9.061 0.482 1.00 0.00 H new ATOM 0 HB2 ALA A 240 -12.581 8.102 1.722 1.00 0.00 H new ATOM 0 HB3 ALA A 240 -14.013 9.064 2.161 1.00 0.00 H new ATOM 273 N VAL A 241 -13.829 11.944 2.383 1.00 0.00 N ATOM 274 CA VAL A 241 -14.548 13.199 2.194 1.00 0.00 C ATOM 275 C VAL A 241 -13.561 14.362 2.150 1.00 0.00 C ATOM 276 O VAL A 241 -13.809 15.389 1.521 1.00 0.00 O ATOM 277 CB VAL A 241 -15.573 13.424 3.335 1.00 0.00 C ATOM 278 CG1 VAL A 241 -16.328 14.738 3.160 1.00 0.00 C ATOM 279 CG2 VAL A 241 -16.550 12.261 3.412 1.00 0.00 C ATOM 0 H VAL A 241 -14.069 11.446 3.240 1.00 0.00 H new ATOM 0 HA VAL A 241 -15.088 13.146 1.249 1.00 0.00 H new ATOM 0 HB VAL A 241 -15.016 13.481 4.270 1.00 0.00 H new ATOM 0 HG11 VAL A 241 -17.038 14.862 3.978 1.00 0.00 H new ATOM 0 HG12 VAL A 241 -15.621 15.567 3.165 1.00 0.00 H new ATOM 0 HG13 VAL A 241 -16.866 14.725 2.212 1.00 0.00 H new ATOM 0 HG21 VAL A 241 -17.262 12.437 4.219 1.00 0.00 H new ATOM 0 HG22 VAL A 241 -17.087 12.173 2.467 1.00 0.00 H new ATOM 0 HG23 VAL A 241 -16.003 11.338 3.605 1.00 0.00 H new ATOM 289 N LYS A 242 -12.429 14.172 2.804 1.00 0.00 N ATOM 290 CA LYS A 242 -11.394 15.190 2.866 1.00 0.00 C ATOM 291 C LYS A 242 -10.296 14.910 1.849 1.00 0.00 C ATOM 292 O LYS A 242 -9.365 15.699 1.679 1.00 0.00 O ATOM 293 CB LYS A 242 -10.808 15.220 4.271 1.00 0.00 C ATOM 294 CG LYS A 242 -11.873 15.280 5.350 1.00 0.00 C ATOM 295 CD LYS A 242 -12.586 16.621 5.382 1.00 0.00 C ATOM 296 CE LYS A 242 -11.612 17.770 5.575 1.00 0.00 C ATOM 297 NZ LYS A 242 -12.305 19.080 5.683 1.00 0.00 N1+ ATOM 0 H LYS A 242 -12.201 13.313 3.305 1.00 0.00 H new ATOM 0 HA LYS A 242 -11.835 16.158 2.628 1.00 0.00 H new ATOM 0 HB2 LYS A 242 -10.193 14.333 4.422 1.00 0.00 H new ATOM 0 HB3 LYS A 242 -10.150 16.084 4.367 1.00 0.00 H new ATOM 0 HG2 LYS A 242 -12.602 14.487 5.182 1.00 0.00 H new ATOM 0 HG3 LYS A 242 -11.415 15.091 6.321 1.00 0.00 H new ATOM 0 HD2 LYS A 242 -13.137 16.763 4.452 1.00 0.00 H new ATOM 0 HD3 LYS A 242 -13.318 16.625 6.190 1.00 0.00 H new ATOM 0 HE2 LYS A 242 -11.023 17.597 6.475 1.00 0.00 H new ATOM 0 HE3 LYS A 242 -10.915 17.798 4.738 1.00 0.00 H new ATOM 0 HZ1 LYS A 242 -11.602 19.835 5.814 1.00 0.00 H new ATOM 0 HZ2 LYS A 242 -12.847 19.259 4.814 1.00 0.00 H new ATOM 0 HZ3 LYS A 242 -12.952 19.065 6.497 1.00 0.00 H new ATOM 311 N ASP A 243 -10.435 13.764 1.185 1.00 0.00 N ATOM 312 CA ASP A 243 -9.461 13.271 0.208 1.00 0.00 C ATOM 313 C ASP A 243 -8.063 13.226 0.805 1.00 0.00 C ATOM 314 O ASP A 243 -7.131 13.836 0.286 1.00 0.00 O ATOM 315 CB ASP A 243 -9.460 14.123 -1.072 1.00 0.00 C ATOM 316 CG ASP A 243 -10.741 14.004 -1.872 1.00 0.00 C ATOM 317 OD1 ASP A 243 -11.573 14.936 -1.822 1.00 0.00 O ATOM 318 OD2 ASP A 243 -10.925 12.981 -2.569 1.00 0.00 O1- ATOM 0 H ASP A 243 -11.235 13.144 1.310 1.00 0.00 H new ATOM 0 HA ASP A 243 -9.761 12.258 -0.059 1.00 0.00 H new ATOM 0 HB2 ASP A 243 -9.303 15.168 -0.805 1.00 0.00 H new ATOM 0 HB3 ASP A 243 -8.620 13.824 -1.698 1.00 0.00 H new ATOM 323 N SER A 244 -7.917 12.488 1.891 1.00 0.00 N ATOM 324 CA SER A 244 -6.647 12.411 2.595 1.00 0.00 C ATOM 325 C SER A 244 -6.366 10.979 3.031 1.00 0.00 C ATOM 326 O SER A 244 -7.050 10.437 3.898 1.00 0.00 O ATOM 327 CB SER A 244 -6.665 13.344 3.806 1.00 0.00 C ATOM 328 OG SER A 244 -6.988 14.670 3.416 1.00 0.00 O ATOM 0 H SER A 244 -8.664 11.931 2.306 1.00 0.00 H new ATOM 0 HA SER A 244 -5.851 12.726 1.920 1.00 0.00 H new ATOM 0 HB2 SER A 244 -7.393 12.987 4.535 1.00 0.00 H new ATOM 0 HB3 SER A 244 -5.691 13.331 4.295 1.00 0.00 H new ATOM 0 HG SER A 244 -6.996 15.251 4.206 1.00 0.00 H new ATOM 334 N TYR A 245 -5.369 10.364 2.416 1.00 0.00 N ATOM 335 CA TYR A 245 -5.037 8.980 2.709 1.00 0.00 C ATOM 336 C TYR A 245 -3.553 8.847 3.021 1.00 0.00 C ATOM 337 O TYR A 245 -2.705 9.188 2.189 1.00 0.00 O ATOM 338 CB TYR A 245 -5.383 8.073 1.519 1.00 0.00 C ATOM 339 CG TYR A 245 -6.815 8.175 1.034 1.00 0.00 C ATOM 340 CD1 TYR A 245 -7.114 8.724 -0.207 1.00 0.00 C ATOM 341 CD2 TYR A 245 -7.864 7.707 1.808 1.00 0.00 C ATOM 342 CE1 TYR A 245 -8.418 8.800 -0.654 1.00 0.00 C ATOM 343 CE2 TYR A 245 -9.167 7.779 1.373 1.00 0.00 C ATOM 344 CZ TYR A 245 -9.440 8.326 0.139 1.00 0.00 C ATOM 345 OH TYR A 245 -10.737 8.393 -0.305 1.00 0.00 O ATOM 0 H TYR A 245 -4.776 10.801 1.711 1.00 0.00 H new ATOM 0 HA TYR A 245 -5.622 8.672 3.575 1.00 0.00 H new ATOM 0 HB2 TYR A 245 -4.716 8.314 0.691 1.00 0.00 H new ATOM 0 HB3 TYR A 245 -5.182 7.039 1.799 1.00 0.00 H new ATOM 0 HD1 TYR A 245 -6.315 9.097 -0.831 1.00 0.00 H new ATOM 0 HD2 TYR A 245 -7.654 7.276 2.776 1.00 0.00 H new ATOM 0 HE1 TYR A 245 -8.636 9.229 -1.621 1.00 0.00 H new ATOM 0 HE2 TYR A 245 -9.969 7.410 1.994 1.00 0.00 H new ATOM 0 HH TYR A 245 -11.252 7.651 0.076 1.00 0.00 H new ATOM 355 N GLN A 246 -3.228 8.375 4.218 1.00 0.00 N ATOM 356 CA GLN A 246 -1.849 8.086 4.560 1.00 0.00 C ATOM 357 C GLN A 246 -1.774 6.679 5.109 1.00 0.00 C ATOM 358 O GLN A 246 -2.804 6.104 5.475 1.00 0.00 O ATOM 359 CB GLN A 246 -1.323 9.067 5.607 1.00 0.00 C ATOM 360 CG GLN A 246 -1.413 10.528 5.207 1.00 0.00 C ATOM 361 CD GLN A 246 -0.977 11.450 6.327 1.00 0.00 C ATOM 362 OE1 GLN A 246 -1.788 11.864 7.154 1.00 0.00 O ATOM 363 NE2 GLN A 246 0.305 11.772 6.367 1.00 0.00 N ATOM 0 H GLN A 246 -3.900 8.186 4.962 1.00 0.00 H new ATOM 0 HA GLN A 246 -1.235 8.184 3.665 1.00 0.00 H new ATOM 0 HB2 GLN A 246 -1.880 8.923 6.533 1.00 0.00 H new ATOM 0 HB3 GLN A 246 -0.282 8.826 5.820 1.00 0.00 H new ATOM 0 HG2 GLN A 246 -0.790 10.703 4.330 1.00 0.00 H new ATOM 0 HG3 GLN A 246 -2.438 10.763 4.922 1.00 0.00 H new ATOM 0 HE21 GLN A 246 0.945 11.407 5.661 1.00 0.00 H new ATOM 0 HE22 GLN A 246 0.654 12.385 7.103 1.00 0.00 H new ATOM 372 N PHE A 247 -0.581 6.110 5.162 1.00 0.00 N ATOM 373 CA PHE A 247 -0.414 4.819 5.793 1.00 0.00 C ATOM 374 C PHE A 247 1.040 4.439 6.010 1.00 0.00 C ATOM 375 O PHE A 247 1.917 4.853 5.267 1.00 0.00 O ATOM 376 CB PHE A 247 -1.142 3.728 5.021 1.00 0.00 C ATOM 377 CG PHE A 247 -0.946 3.706 3.535 1.00 0.00 C ATOM 378 CD1 PHE A 247 0.122 3.035 2.974 1.00 0.00 C ATOM 379 CD2 PHE A 247 -1.881 4.291 2.698 1.00 0.00 C ATOM 380 CE1 PHE A 247 0.256 2.948 1.608 1.00 0.00 C ATOM 381 CE2 PHE A 247 -1.742 4.220 1.330 1.00 0.00 C ATOM 382 CZ PHE A 247 -0.673 3.544 0.783 1.00 0.00 C ATOM 0 H PHE A 247 0.273 6.517 4.781 1.00 0.00 H new ATOM 0 HA PHE A 247 -0.863 4.911 6.782 1.00 0.00 H new ATOM 0 HB2 PHE A 247 -0.828 2.763 5.419 1.00 0.00 H new ATOM 0 HB3 PHE A 247 -2.209 3.824 5.222 1.00 0.00 H new ATOM 0 HD1 PHE A 247 0.860 2.574 3.614 1.00 0.00 H new ATOM 0 HD2 PHE A 247 -2.728 4.809 3.123 1.00 0.00 H new ATOM 0 HE1 PHE A 247 1.091 2.412 1.181 1.00 0.00 H new ATOM 0 HE2 PHE A 247 -2.469 4.693 0.687 1.00 0.00 H new ATOM 0 HZ PHE A 247 -0.564 3.481 -0.290 1.00 0.00 H new ATOM 392 N THR A 248 1.288 3.638 7.038 1.00 0.00 N ATOM 393 CA THR A 248 2.640 3.201 7.351 1.00 0.00 C ATOM 394 C THR A 248 2.754 1.710 7.140 1.00 0.00 C ATOM 395 O THR A 248 1.838 0.965 7.497 1.00 0.00 O ATOM 396 CB THR A 248 3.012 3.534 8.818 1.00 0.00 C ATOM 397 OG1 THR A 248 3.074 4.953 9.008 1.00 0.00 O ATOM 398 CG2 THR A 248 4.338 2.901 9.222 1.00 0.00 C ATOM 0 H THR A 248 0.571 3.279 7.668 1.00 0.00 H new ATOM 0 HA THR A 248 3.326 3.729 6.689 1.00 0.00 H new ATOM 0 HB THR A 248 2.232 3.117 9.454 1.00 0.00 H new ATOM 0 HG1 THR A 248 3.309 5.148 9.939 1.00 0.00 H new ATOM 0 HG21 THR A 248 4.563 3.158 10.257 1.00 0.00 H new ATOM 0 HG22 THR A 248 4.269 1.818 9.124 1.00 0.00 H new ATOM 0 HG23 THR A 248 5.132 3.274 8.575 1.00 0.00 H new ATOM 406 N VAL A 249 3.860 1.263 6.559 1.00 0.00 N ATOM 407 CA VAL A 249 4.017 -0.166 6.304 1.00 0.00 C ATOM 408 C VAL A 249 5.432 -0.643 6.635 1.00 0.00 C ATOM 409 O VAL A 249 6.414 0.051 6.375 1.00 0.00 O ATOM 410 CB VAL A 249 3.675 -0.546 4.839 1.00 0.00 C ATOM 411 CG1 VAL A 249 3.703 -2.055 4.640 1.00 0.00 C ATOM 412 CG2 VAL A 249 2.322 0.010 4.422 1.00 0.00 C ATOM 0 H VAL A 249 4.641 1.848 6.262 1.00 0.00 H new ATOM 0 HA VAL A 249 3.307 -0.668 6.962 1.00 0.00 H new ATOM 0 HB VAL A 249 4.440 -0.098 4.205 1.00 0.00 H new ATOM 0 HG11 VAL A 249 3.459 -2.290 3.604 1.00 0.00 H new ATOM 0 HG12 VAL A 249 4.698 -2.434 4.874 1.00 0.00 H new ATOM 0 HG13 VAL A 249 2.972 -2.523 5.300 1.00 0.00 H new ATOM 0 HG21 VAL A 249 2.114 -0.275 3.391 1.00 0.00 H new ATOM 0 HG22 VAL A 249 1.547 -0.393 5.073 1.00 0.00 H new ATOM 0 HG23 VAL A 249 2.335 1.097 4.503 1.00 0.00 H new ATOM 422 N THR A 250 5.524 -1.820 7.234 1.00 0.00 N ATOM 423 CA THR A 250 6.794 -2.473 7.467 1.00 0.00 C ATOM 424 C THR A 250 6.976 -3.572 6.422 1.00 0.00 C ATOM 425 O THR A 250 6.223 -4.551 6.401 1.00 0.00 O ATOM 426 CB THR A 250 6.837 -3.080 8.884 1.00 0.00 C ATOM 427 OG1 THR A 250 6.395 -2.102 9.840 1.00 0.00 O ATOM 428 CG2 THR A 250 8.242 -3.539 9.242 1.00 0.00 C ATOM 0 H THR A 250 4.718 -2.346 7.571 1.00 0.00 H new ATOM 0 HA THR A 250 7.600 -1.743 7.386 1.00 0.00 H new ATOM 0 HB THR A 250 6.176 -3.947 8.905 1.00 0.00 H new ATOM 0 HG1 THR A 250 6.421 -2.489 10.740 1.00 0.00 H new ATOM 0 HG21 THR A 250 8.242 -3.962 10.246 1.00 0.00 H new ATOM 0 HG22 THR A 250 8.570 -4.296 8.529 1.00 0.00 H new ATOM 0 HG23 THR A 250 8.923 -2.688 9.207 1.00 0.00 H new ATOM 436 N LEU A 251 7.951 -3.404 5.548 1.00 0.00 N ATOM 437 CA LEU A 251 8.108 -4.286 4.409 1.00 0.00 C ATOM 438 C LEU A 251 9.360 -5.147 4.582 1.00 0.00 C ATOM 439 O LEU A 251 10.150 -4.939 5.506 1.00 0.00 O ATOM 440 CB LEU A 251 8.197 -3.467 3.099 1.00 0.00 C ATOM 441 CG LEU A 251 6.992 -2.581 2.753 1.00 0.00 C ATOM 442 CD1 LEU A 251 7.021 -1.278 3.537 1.00 0.00 C ATOM 443 CD2 LEU A 251 6.976 -2.283 1.266 1.00 0.00 C ATOM 0 H LEU A 251 8.648 -2.662 5.607 1.00 0.00 H new ATOM 0 HA LEU A 251 7.237 -4.938 4.349 1.00 0.00 H new ATOM 0 HB2 LEU A 251 9.081 -2.832 3.155 1.00 0.00 H new ATOM 0 HB3 LEU A 251 8.356 -4.162 2.274 1.00 0.00 H new ATOM 0 HG LEU A 251 6.087 -3.124 3.026 1.00 0.00 H new ATOM 0 HD11 LEU A 251 6.155 -0.673 3.269 1.00 0.00 H new ATOM 0 HD12 LEU A 251 6.996 -1.495 4.605 1.00 0.00 H new ATOM 0 HD13 LEU A 251 7.933 -0.731 3.299 1.00 0.00 H new ATOM 0 HD21 LEU A 251 6.118 -1.654 1.030 1.00 0.00 H new ATOM 0 HD22 LEU A 251 7.893 -1.764 0.989 1.00 0.00 H new ATOM 0 HD23 LEU A 251 6.905 -3.217 0.708 1.00 0.00 H new ATOM 455 N THR A 252 9.521 -6.126 3.715 1.00 0.00 N ATOM 456 CA THR A 252 10.693 -6.977 3.716 1.00 0.00 C ATOM 457 C THR A 252 11.337 -7.004 2.320 1.00 0.00 C ATOM 458 O THR A 252 10.681 -7.366 1.342 1.00 0.00 O ATOM 459 CB THR A 252 10.291 -8.401 4.117 1.00 0.00 C ATOM 460 OG1 THR A 252 8.859 -8.527 4.053 1.00 0.00 O ATOM 461 CG2 THR A 252 10.770 -8.746 5.526 1.00 0.00 C ATOM 0 H THR A 252 8.842 -6.354 2.989 1.00 0.00 H new ATOM 0 HA THR A 252 11.414 -6.580 4.431 1.00 0.00 H new ATOM 0 HB THR A 252 10.764 -9.095 3.422 1.00 0.00 H new ATOM 0 HG1 THR A 252 8.599 -9.437 4.307 1.00 0.00 H new ATOM 0 HG21 THR A 252 10.466 -9.763 5.775 1.00 0.00 H new ATOM 0 HG22 THR A 252 11.857 -8.671 5.570 1.00 0.00 H new ATOM 0 HG23 THR A 252 10.329 -8.051 6.241 1.00 0.00 H new ATOM 469 N GLY A 253 12.599 -6.599 2.214 1.00 0.00 N ATOM 470 CA GLY A 253 13.286 -6.636 0.938 1.00 0.00 C ATOM 471 C GLY A 253 14.784 -6.687 1.120 1.00 0.00 C ATOM 472 O GLY A 253 15.335 -5.941 1.928 1.00 0.00 O ATOM 0 H GLY A 253 13.158 -6.246 2.991 1.00 0.00 H new ATOM 0 HA2 GLY A 253 12.957 -7.507 0.371 1.00 0.00 H new ATOM 0 HA3 GLY A 253 13.019 -5.756 0.354 1.00 0.00 H new ATOM 476 N ALA A 254 15.449 -7.556 0.376 1.00 0.00 N ATOM 477 CA ALA A 254 16.870 -7.782 0.580 1.00 0.00 C ATOM 478 C ALA A 254 17.703 -7.297 -0.596 1.00 0.00 C ATOM 479 O ALA A 254 17.895 -8.014 -1.578 1.00 0.00 O ATOM 480 CB ALA A 254 17.128 -9.258 0.830 1.00 0.00 C ATOM 0 H ALA A 254 15.031 -8.113 -0.369 1.00 0.00 H new ATOM 0 HA ALA A 254 17.173 -7.203 1.452 1.00 0.00 H new ATOM 0 HB1 ALA A 254 18.195 -9.420 0.982 1.00 0.00 H new ATOM 0 HB2 ALA A 254 16.582 -9.577 1.718 1.00 0.00 H new ATOM 0 HB3 ALA A 254 16.792 -9.837 -0.030 1.00 0.00 H new ATOM 486 N THR A 255 18.177 -6.068 -0.506 1.00 0.00 N ATOM 487 CA THR A 255 19.157 -5.563 -1.449 1.00 0.00 C ATOM 488 C THR A 255 20.365 -5.020 -0.687 1.00 0.00 C ATOM 489 O THR A 255 20.306 -3.940 -0.095 1.00 0.00 O ATOM 490 CB THR A 255 18.557 -4.478 -2.367 1.00 0.00 C ATOM 491 OG1 THR A 255 17.314 -4.951 -2.910 1.00 0.00 O ATOM 492 CG2 THR A 255 19.513 -4.148 -3.518 1.00 0.00 C ATOM 0 H THR A 255 17.898 -5.400 0.212 1.00 0.00 H new ATOM 0 HA THR A 255 19.474 -6.386 -2.090 1.00 0.00 H new ATOM 0 HB THR A 255 18.394 -3.576 -1.777 1.00 0.00 H new ATOM 0 HG1 THR A 255 16.572 -4.628 -2.357 1.00 0.00 H new ATOM 0 HG21 THR A 255 19.068 -3.381 -4.152 1.00 0.00 H new ATOM 0 HG22 THR A 255 20.457 -3.782 -3.114 1.00 0.00 H new ATOM 0 HG23 THR A 255 19.695 -5.046 -4.109 1.00 0.00 H new ATOM 500 N ALA A 256 21.439 -5.803 -0.670 1.00 0.00 N ATOM 501 CA ALA A 256 22.642 -5.473 0.088 1.00 0.00 C ATOM 502 C ALA A 256 23.218 -4.109 -0.280 1.00 0.00 C ATOM 503 O ALA A 256 23.326 -3.762 -1.458 1.00 0.00 O ATOM 504 CB ALA A 256 23.697 -6.548 -0.122 1.00 0.00 C ATOM 0 H ALA A 256 21.500 -6.684 -1.181 1.00 0.00 H new ATOM 0 HA ALA A 256 22.353 -5.428 1.138 1.00 0.00 H new ATOM 0 HB1 ALA A 256 24.592 -6.295 0.446 1.00 0.00 H new ATOM 0 HB2 ALA A 256 23.310 -7.509 0.218 1.00 0.00 H new ATOM 0 HB3 ALA A 256 23.946 -6.612 -1.181 1.00 0.00 H new ATOM 510 N SER A 257 23.576 -3.348 0.754 1.00 0.00 N ATOM 511 CA SER A 257 24.288 -2.083 0.601 1.00 0.00 C ATOM 512 C SER A 257 23.457 -1.049 -0.161 1.00 0.00 C ATOM 513 O SER A 257 23.911 -0.481 -1.158 1.00 0.00 O ATOM 514 CB SER A 257 25.635 -2.319 -0.097 1.00 0.00 C ATOM 515 OG SER A 257 26.416 -1.137 -0.140 1.00 0.00 O ATOM 0 H SER A 257 23.379 -3.594 1.724 1.00 0.00 H new ATOM 0 HA SER A 257 24.468 -1.678 1.597 1.00 0.00 H new ATOM 0 HB2 SER A 257 26.185 -3.100 0.428 1.00 0.00 H new ATOM 0 HB3 SER A 257 25.462 -2.678 -1.111 1.00 0.00 H new ATOM 0 HG SER A 257 25.922 -0.436 -0.613 1.00 0.00 H new ATOM 521 N VAL A 258 22.241 -0.806 0.307 1.00 0.00 N ATOM 522 CA VAL A 258 21.398 0.226 -0.281 1.00 0.00 C ATOM 523 C VAL A 258 20.793 1.104 0.811 1.00 0.00 C ATOM 524 O VAL A 258 19.771 0.761 1.419 1.00 0.00 O ATOM 525 CB VAL A 258 20.274 -0.372 -1.161 1.00 0.00 C ATOM 526 CG1 VAL A 258 19.371 0.722 -1.713 1.00 0.00 C ATOM 527 CG2 VAL A 258 20.861 -1.187 -2.301 1.00 0.00 C ATOM 0 H VAL A 258 21.817 -1.306 1.088 1.00 0.00 H new ATOM 0 HA VAL A 258 22.034 0.834 -0.925 1.00 0.00 H new ATOM 0 HB VAL A 258 19.674 -1.029 -0.532 1.00 0.00 H new ATOM 0 HG11 VAL A 258 18.590 0.274 -2.328 1.00 0.00 H new ATOM 0 HG12 VAL A 258 18.914 1.268 -0.887 1.00 0.00 H new ATOM 0 HG13 VAL A 258 19.961 1.409 -2.320 1.00 0.00 H new ATOM 0 HG21 VAL A 258 20.054 -1.598 -2.907 1.00 0.00 H new ATOM 0 HG22 VAL A 258 21.490 -0.547 -2.920 1.00 0.00 H new ATOM 0 HG23 VAL A 258 21.461 -2.001 -1.895 1.00 0.00 H new ATOM 537 N THR A 259 21.442 2.231 1.072 1.00 0.00 N ATOM 538 CA THR A 259 20.953 3.178 2.056 1.00 0.00 C ATOM 539 C THR A 259 19.774 3.960 1.482 1.00 0.00 C ATOM 540 O THR A 259 19.933 5.045 0.914 1.00 0.00 O ATOM 541 CB THR A 259 22.064 4.147 2.507 1.00 0.00 C ATOM 542 OG1 THR A 259 23.225 3.401 2.905 1.00 0.00 O ATOM 543 CG2 THR A 259 21.594 5.009 3.671 1.00 0.00 C ATOM 0 H THR A 259 22.310 2.509 0.613 1.00 0.00 H new ATOM 0 HA THR A 259 20.625 2.617 2.931 1.00 0.00 H new ATOM 0 HB THR A 259 22.311 4.798 1.669 1.00 0.00 H new ATOM 0 HG1 THR A 259 23.930 4.020 3.189 1.00 0.00 H new ATOM 0 HG21 THR A 259 22.396 5.684 3.971 1.00 0.00 H new ATOM 0 HG22 THR A 259 20.725 5.591 3.365 1.00 0.00 H new ATOM 0 HG23 THR A 259 21.325 4.370 4.512 1.00 0.00 H new ATOM 551 N GLY A 260 18.595 3.384 1.625 1.00 0.00 N ATOM 552 CA GLY A 260 17.400 3.977 1.081 1.00 0.00 C ATOM 553 C GLY A 260 17.046 3.410 -0.280 1.00 0.00 C ATOM 554 O GLY A 260 17.560 3.876 -1.297 1.00 0.00 O ATOM 0 H GLY A 260 18.445 2.503 2.116 1.00 0.00 H new ATOM 0 HA2 GLY A 260 16.570 3.812 1.768 1.00 0.00 H new ATOM 0 HA3 GLY A 260 17.537 5.055 0.999 1.00 0.00 H new ATOM 558 N PHE A 261 16.206 2.372 -0.288 1.00 0.00 N ATOM 559 CA PHE A 261 15.604 1.866 -1.522 1.00 0.00 C ATOM 560 C PHE A 261 15.092 3.025 -2.363 1.00 0.00 C ATOM 561 O PHE A 261 15.500 3.226 -3.507 1.00 0.00 O ATOM 562 CB PHE A 261 14.380 0.971 -1.226 1.00 0.00 C ATOM 563 CG PHE A 261 14.654 -0.498 -1.103 1.00 0.00 C ATOM 564 CD1 PHE A 261 14.246 -1.196 0.019 1.00 0.00 C ATOM 565 CD2 PHE A 261 15.276 -1.189 -2.126 1.00 0.00 C ATOM 566 CE1 PHE A 261 14.450 -2.558 0.117 1.00 0.00 C ATOM 567 CE2 PHE A 261 15.491 -2.547 -2.031 1.00 0.00 C ATOM 568 CZ PHE A 261 15.073 -3.236 -0.911 1.00 0.00 C ATOM 0 H PHE A 261 15.927 1.864 0.551 1.00 0.00 H new ATOM 0 HA PHE A 261 16.376 1.297 -2.040 1.00 0.00 H new ATOM 0 HB2 PHE A 261 13.920 1.313 -0.299 1.00 0.00 H new ATOM 0 HB3 PHE A 261 13.647 1.118 -2.019 1.00 0.00 H new ATOM 0 HD1 PHE A 261 13.762 -0.669 0.828 1.00 0.00 H new ATOM 0 HD2 PHE A 261 15.597 -0.658 -3.010 1.00 0.00 H new ATOM 0 HE1 PHE A 261 14.123 -3.092 0.997 1.00 0.00 H new ATOM 0 HE2 PHE A 261 15.987 -3.072 -2.834 1.00 0.00 H new ATOM 0 HZ PHE A 261 15.233 -4.302 -0.839 1.00 0.00 H new ATOM 578 N LEU A 262 14.190 3.780 -1.754 1.00 0.00 N ATOM 579 CA LEU A 262 13.503 4.879 -2.398 1.00 0.00 C ATOM 580 C LEU A 262 13.361 6.001 -1.387 1.00 0.00 C ATOM 581 O LEU A 262 13.631 5.792 -0.199 1.00 0.00 O ATOM 582 CB LEU A 262 12.115 4.429 -2.874 1.00 0.00 C ATOM 583 CG LEU A 262 12.091 3.265 -3.869 1.00 0.00 C ATOM 584 CD1 LEU A 262 10.665 2.801 -4.102 1.00 0.00 C ATOM 585 CD2 LEU A 262 12.734 3.666 -5.186 1.00 0.00 C ATOM 0 H LEU A 262 13.913 3.640 -0.782 1.00 0.00 H new ATOM 0 HA LEU A 262 14.069 5.218 -3.265 1.00 0.00 H new ATOM 0 HB2 LEU A 262 11.527 4.146 -2.001 1.00 0.00 H new ATOM 0 HB3 LEU A 262 11.615 5.283 -3.332 1.00 0.00 H new ATOM 0 HG LEU A 262 12.665 2.442 -3.444 1.00 0.00 H new ATOM 0 HD11 LEU A 262 10.663 1.973 -4.811 1.00 0.00 H new ATOM 0 HD12 LEU A 262 10.231 2.471 -3.158 1.00 0.00 H new ATOM 0 HD13 LEU A 262 10.075 3.625 -4.504 1.00 0.00 H new ATOM 0 HD21 LEU A 262 12.705 2.823 -5.876 1.00 0.00 H new ATOM 0 HD22 LEU A 262 12.189 4.506 -5.616 1.00 0.00 H new ATOM 0 HD23 LEU A 262 13.770 3.957 -5.011 1.00 0.00 H new ATOM 597 N LYS A 263 12.944 7.174 -1.836 1.00 0.00 N ATOM 598 CA LYS A 263 12.791 8.310 -0.943 1.00 0.00 C ATOM 599 C LYS A 263 11.508 9.069 -1.246 1.00 0.00 C ATOM 600 O LYS A 263 10.679 8.605 -2.030 1.00 0.00 O ATOM 601 CB LYS A 263 13.999 9.241 -1.048 1.00 0.00 C ATOM 602 CG LYS A 263 15.304 8.574 -0.660 1.00 0.00 C ATOM 603 CD LYS A 263 16.450 9.568 -0.628 1.00 0.00 C ATOM 604 CE LYS A 263 17.758 8.887 -0.269 1.00 0.00 C ATOM 605 NZ LYS A 263 18.890 9.847 -0.221 1.00 0.00 N1+ ATOM 0 H LYS A 263 12.706 7.364 -2.810 1.00 0.00 H new ATOM 0 HA LYS A 263 12.731 7.933 0.078 1.00 0.00 H new ATOM 0 HB2 LYS A 263 14.077 9.610 -2.071 1.00 0.00 H new ATOM 0 HB3 LYS A 263 13.838 10.108 -0.408 1.00 0.00 H new ATOM 0 HG2 LYS A 263 15.198 8.108 0.320 1.00 0.00 H new ATOM 0 HG3 LYS A 263 15.531 7.778 -1.369 1.00 0.00 H new ATOM 0 HD2 LYS A 263 16.543 10.051 -1.601 1.00 0.00 H new ATOM 0 HD3 LYS A 263 16.234 10.352 0.098 1.00 0.00 H new ATOM 0 HE2 LYS A 263 17.657 8.396 0.699 1.00 0.00 H new ATOM 0 HE3 LYS A 263 17.974 8.108 -1.000 1.00 0.00 H new ATOM 0 HZ1 LYS A 263 19.764 9.341 0.028 1.00 0.00 H new ATOM 0 HZ2 LYS A 263 19.003 10.297 -1.152 1.00 0.00 H new ATOM 0 HZ3 LYS A 263 18.697 10.576 0.495 1.00 0.00 H new ATOM 619 N ALA A 264 11.350 10.227 -0.617 1.00 0.00 N ATOM 620 CA ALA A 264 10.167 11.051 -0.792 1.00 0.00 C ATOM 621 C ALA A 264 9.911 11.351 -2.263 1.00 0.00 C ATOM 622 O ALA A 264 10.703 12.025 -2.926 1.00 0.00 O ATOM 623 CB ALA A 264 10.309 12.342 -0.003 1.00 0.00 C ATOM 0 H ALA A 264 12.038 10.618 0.027 1.00 0.00 H new ATOM 0 HA ALA A 264 9.309 10.495 -0.414 1.00 0.00 H new ATOM 0 HB1 ALA A 264 9.417 12.953 -0.141 1.00 0.00 H new ATOM 0 HB2 ALA A 264 10.430 12.110 1.055 1.00 0.00 H new ATOM 0 HB3 ALA A 264 11.182 12.890 -0.357 1.00 0.00 H new ATOM 629 N GLY A 265 8.813 10.825 -2.767 1.00 0.00 N ATOM 630 CA GLY A 265 8.423 11.087 -4.137 1.00 0.00 C ATOM 631 C GLY A 265 8.492 9.852 -5.013 1.00 0.00 C ATOM 632 O GLY A 265 8.079 9.883 -6.174 1.00 0.00 O ATOM 0 H GLY A 265 8.178 10.216 -2.251 1.00 0.00 H new ATOM 0 HA2 GLY A 265 7.407 11.481 -4.152 1.00 0.00 H new ATOM 0 HA3 GLY A 265 9.070 11.859 -4.553 1.00 0.00 H new ATOM 636 N ASP A 266 9.018 8.765 -4.469 1.00 0.00 N ATOM 637 CA ASP A 266 9.114 7.515 -5.217 1.00 0.00 C ATOM 638 C ASP A 266 7.862 6.674 -5.002 1.00 0.00 C ATOM 639 O ASP A 266 7.379 6.544 -3.876 1.00 0.00 O ATOM 640 CB ASP A 266 10.356 6.721 -4.804 1.00 0.00 C ATOM 641 CG ASP A 266 11.651 7.346 -5.289 1.00 0.00 C ATOM 642 OD1 ASP A 266 12.398 7.908 -4.460 1.00 0.00 O ATOM 643 OD2 ASP A 266 11.940 7.265 -6.503 1.00 0.00 O1- ATOM 0 H ASP A 266 9.384 8.720 -3.518 1.00 0.00 H new ATOM 0 HA ASP A 266 9.201 7.761 -6.275 1.00 0.00 H new ATOM 0 HB2 ASP A 266 10.383 6.640 -3.717 1.00 0.00 H new ATOM 0 HB3 ASP A 266 10.279 5.707 -5.197 1.00 0.00 H new ATOM 648 N GLN A 267 7.336 6.101 -6.077 1.00 0.00 N ATOM 649 CA GLN A 267 6.081 5.370 -6.000 1.00 0.00 C ATOM 650 C GLN A 267 6.291 3.862 -6.104 1.00 0.00 C ATOM 651 O GLN A 267 7.126 3.379 -6.873 1.00 0.00 O ATOM 652 CB GLN A 267 5.115 5.832 -7.092 1.00 0.00 C ATOM 653 CG GLN A 267 4.847 7.328 -7.081 1.00 0.00 C ATOM 654 CD GLN A 267 3.580 7.693 -7.824 1.00 0.00 C ATOM 655 OE1 GLN A 267 3.599 7.943 -9.029 1.00 0.00 O ATOM 656 NE2 GLN A 267 2.468 7.733 -7.106 1.00 0.00 N ATOM 0 H GLN A 267 7.757 6.129 -7.006 1.00 0.00 H new ATOM 0 HA GLN A 267 5.649 5.585 -5.022 1.00 0.00 H new ATOM 0 HB2 GLN A 267 5.520 5.552 -8.064 1.00 0.00 H new ATOM 0 HB3 GLN A 267 4.170 5.302 -6.976 1.00 0.00 H new ATOM 0 HG2 GLN A 267 4.772 7.673 -6.050 1.00 0.00 H new ATOM 0 HG3 GLN A 267 5.692 7.849 -7.531 1.00 0.00 H new ATOM 0 HE21 GLN A 267 2.497 7.519 -6.109 1.00 0.00 H new ATOM 0 HE22 GLN A 267 1.583 7.978 -7.550 1.00 0.00 H new ATOM 665 N VAL A 268 5.503 3.130 -5.334 1.00 0.00 N ATOM 666 CA VAL A 268 5.545 1.672 -5.315 1.00 0.00 C ATOM 667 C VAL A 268 4.155 1.120 -5.573 1.00 0.00 C ATOM 668 O VAL A 268 3.176 1.846 -5.454 1.00 0.00 O ATOM 669 CB VAL A 268 6.029 1.114 -3.948 1.00 0.00 C ATOM 670 CG1 VAL A 268 7.547 1.073 -3.882 1.00 0.00 C ATOM 671 CG2 VAL A 268 5.481 1.955 -2.798 1.00 0.00 C ATOM 0 H VAL A 268 4.811 3.530 -4.700 1.00 0.00 H new ATOM 0 HA VAL A 268 6.248 1.365 -6.089 1.00 0.00 H new ATOM 0 HB VAL A 268 5.651 0.096 -3.852 1.00 0.00 H new ATOM 0 HG11 VAL A 268 7.859 0.679 -2.915 1.00 0.00 H new ATOM 0 HG12 VAL A 268 7.928 0.431 -4.676 1.00 0.00 H new ATOM 0 HG13 VAL A 268 7.944 2.080 -4.008 1.00 0.00 H new ATOM 0 HG21 VAL A 268 5.832 1.547 -1.850 1.00 0.00 H new ATOM 0 HG22 VAL A 268 5.828 2.983 -2.902 1.00 0.00 H new ATOM 0 HG23 VAL A 268 4.391 1.936 -2.820 1.00 0.00 H new ATOM 681 N LYS A 269 4.054 -0.154 -5.910 1.00 0.00 N ATOM 682 CA LYS A 269 2.741 -0.768 -6.046 1.00 0.00 C ATOM 683 C LYS A 269 2.716 -2.138 -5.379 1.00 0.00 C ATOM 684 O LYS A 269 3.730 -2.837 -5.333 1.00 0.00 O ATOM 685 CB LYS A 269 2.277 -0.850 -7.514 1.00 0.00 C ATOM 686 CG LYS A 269 2.748 -2.066 -8.306 1.00 0.00 C ATOM 687 CD LYS A 269 4.218 -1.992 -8.686 1.00 0.00 C ATOM 688 CE LYS A 269 4.518 -2.845 -9.914 1.00 0.00 C ATOM 689 NZ LYS A 269 4.015 -4.241 -9.783 1.00 0.00 N1+ ATOM 0 H LYS A 269 4.844 -0.773 -6.091 1.00 0.00 H new ATOM 0 HA LYS A 269 2.029 -0.122 -5.533 1.00 0.00 H new ATOM 0 HB2 LYS A 269 1.187 -0.833 -7.530 1.00 0.00 H new ATOM 0 HB3 LYS A 269 2.617 0.047 -8.031 1.00 0.00 H new ATOM 0 HG2 LYS A 269 2.575 -2.966 -7.716 1.00 0.00 H new ATOM 0 HG3 LYS A 269 2.148 -2.158 -9.211 1.00 0.00 H new ATOM 0 HD2 LYS A 269 4.492 -0.956 -8.885 1.00 0.00 H new ATOM 0 HD3 LYS A 269 4.829 -2.329 -7.849 1.00 0.00 H new ATOM 0 HE2 LYS A 269 4.067 -2.382 -10.792 1.00 0.00 H new ATOM 0 HE3 LYS A 269 5.595 -2.866 -10.082 1.00 0.00 H new ATOM 0 HZ1 LYS A 269 4.766 -4.907 -10.055 1.00 0.00 H new ATOM 0 HZ2 LYS A 269 3.735 -4.418 -8.797 1.00 0.00 H new ATOM 0 HZ3 LYS A 269 3.193 -4.374 -10.406 1.00 0.00 H new ATOM 703 N PHE A 270 1.559 -2.504 -4.851 1.00 0.00 N ATOM 704 CA PHE A 270 1.413 -3.731 -4.091 1.00 0.00 C ATOM 705 C PHE A 270 0.564 -4.709 -4.877 1.00 0.00 C ATOM 706 O PHE A 270 -0.511 -4.354 -5.370 1.00 0.00 O ATOM 707 CB PHE A 270 0.748 -3.458 -2.733 1.00 0.00 C ATOM 708 CG PHE A 270 1.469 -2.460 -1.863 1.00 0.00 C ATOM 709 CD1 PHE A 270 1.655 -1.155 -2.288 1.00 0.00 C ATOM 710 CD2 PHE A 270 1.935 -2.821 -0.608 1.00 0.00 C ATOM 711 CE1 PHE A 270 2.289 -0.234 -1.486 1.00 0.00 C ATOM 712 CE2 PHE A 270 2.575 -1.899 0.199 1.00 0.00 C ATOM 713 CZ PHE A 270 2.751 -0.601 -0.242 1.00 0.00 C ATOM 0 H PHE A 270 0.700 -1.961 -4.937 1.00 0.00 H new ATOM 0 HA PHE A 270 2.404 -4.150 -3.915 1.00 0.00 H new ATOM 0 HB2 PHE A 270 -0.267 -3.100 -2.907 1.00 0.00 H new ATOM 0 HB3 PHE A 270 0.665 -4.399 -2.189 1.00 0.00 H new ATOM 0 HD1 PHE A 270 1.297 -0.856 -3.262 1.00 0.00 H new ATOM 0 HD2 PHE A 270 1.797 -3.833 -0.257 1.00 0.00 H new ATOM 0 HE1 PHE A 270 2.425 0.780 -1.833 1.00 0.00 H new ATOM 0 HE2 PHE A 270 2.937 -2.193 1.173 1.00 0.00 H new ATOM 0 HZ PHE A 270 3.249 0.122 0.387 1.00 0.00 H new ATOM 723 N THR A 271 1.046 -5.926 -5.014 1.00 0.00 N ATOM 724 CA THR A 271 0.300 -6.951 -5.702 1.00 0.00 C ATOM 725 C THR A 271 -0.296 -7.911 -4.683 1.00 0.00 C ATOM 726 O THR A 271 0.414 -8.479 -3.851 1.00 0.00 O ATOM 727 CB THR A 271 1.192 -7.715 -6.703 1.00 0.00 C ATOM 728 OG1 THR A 271 1.813 -6.785 -7.599 1.00 0.00 O ATOM 729 CG2 THR A 271 0.389 -8.743 -7.510 1.00 0.00 C ATOM 0 H THR A 271 1.953 -6.227 -4.657 1.00 0.00 H new ATOM 0 HA THR A 271 -0.501 -6.478 -6.269 1.00 0.00 H new ATOM 0 HB THR A 271 1.950 -8.252 -6.133 1.00 0.00 H new ATOM 0 HG1 THR A 271 2.381 -7.271 -8.233 1.00 0.00 H new ATOM 0 HG21 THR A 271 1.052 -9.260 -8.203 1.00 0.00 H new ATOM 0 HG22 THR A 271 -0.062 -9.467 -6.831 1.00 0.00 H new ATOM 0 HG23 THR A 271 -0.395 -8.234 -8.070 1.00 0.00 H new ATOM 737 N ASN A 272 -1.593 -8.113 -4.772 1.00 0.00 N ATOM 738 CA ASN A 272 -2.345 -8.700 -3.676 1.00 0.00 C ATOM 739 C ASN A 272 -2.779 -10.131 -3.947 1.00 0.00 C ATOM 740 O ASN A 272 -3.037 -10.529 -5.085 1.00 0.00 O ATOM 741 CB ASN A 272 -3.594 -7.856 -3.401 1.00 0.00 C ATOM 742 CG ASN A 272 -4.585 -7.845 -4.551 1.00 0.00 C ATOM 743 OD1 ASN A 272 -4.207 -7.872 -5.722 1.00 0.00 O ATOM 744 ND2 ASN A 272 -5.866 -7.814 -4.222 1.00 0.00 N ATOM 0 H ASN A 272 -2.153 -7.880 -5.592 1.00 0.00 H new ATOM 0 HA ASN A 272 -1.678 -8.715 -2.814 1.00 0.00 H new ATOM 0 HB2 ASN A 272 -4.090 -8.237 -2.508 1.00 0.00 H new ATOM 0 HB3 ASN A 272 -3.290 -6.832 -3.184 1.00 0.00 H new ATOM 0 HD21 ASN A 272 -6.580 -7.812 -4.951 1.00 0.00 H new ATOM 0 HD22 ASN A 272 -6.140 -7.792 -3.240 1.00 0.00 H new ATOM 1061 N SER A 292 -5.263 -4.473 -4.652 1.00 0.00 N ATOM 1062 CA SER A 292 -4.083 -4.014 -5.383 1.00 0.00 C ATOM 1063 C SER A 292 -4.084 -2.482 -5.448 1.00 0.00 C ATOM 1064 O SER A 292 -5.123 -1.878 -5.732 1.00 0.00 O ATOM 1065 CB SER A 292 -4.110 -4.589 -6.803 1.00 0.00 C ATOM 1066 OG SER A 292 -5.346 -4.312 -7.445 1.00 0.00 O ATOM 0 HA SER A 292 -3.182 -4.352 -4.871 1.00 0.00 H new ATOM 0 HB2 SER A 292 -3.292 -4.166 -7.385 1.00 0.00 H new ATOM 0 HB3 SER A 292 -3.950 -5.667 -6.765 1.00 0.00 H new ATOM 0 HG SER A 292 -6.055 -4.241 -6.772 1.00 0.00 H new ATOM 1072 N PHE A 293 -2.939 -1.843 -5.200 1.00 0.00 N ATOM 1073 CA PHE A 293 -2.888 -0.383 -5.174 1.00 0.00 C ATOM 1074 C PHE A 293 -1.458 0.127 -5.326 1.00 0.00 C ATOM 1075 O PHE A 293 -0.510 -0.656 -5.402 1.00 0.00 O ATOM 1076 CB PHE A 293 -3.504 0.153 -3.872 1.00 0.00 C ATOM 1077 CG PHE A 293 -2.744 -0.217 -2.627 1.00 0.00 C ATOM 1078 CD1 PHE A 293 -1.890 0.694 -2.029 1.00 0.00 C ATOM 1079 CD2 PHE A 293 -2.891 -1.470 -2.054 1.00 0.00 C ATOM 1080 CE1 PHE A 293 -1.194 0.363 -0.885 1.00 0.00 C ATOM 1081 CE2 PHE A 293 -2.196 -1.807 -0.910 1.00 0.00 C ATOM 1082 CZ PHE A 293 -1.347 -0.890 -0.325 1.00 0.00 C ATOM 0 H PHE A 293 -2.049 -2.306 -5.017 1.00 0.00 H new ATOM 0 HA PHE A 293 -3.469 -0.016 -6.020 1.00 0.00 H new ATOM 0 HB2 PHE A 293 -3.568 1.239 -3.935 1.00 0.00 H new ATOM 0 HB3 PHE A 293 -4.524 -0.222 -3.785 1.00 0.00 H new ATOM 0 HD1 PHE A 293 -1.767 1.675 -2.463 1.00 0.00 H new ATOM 0 HD2 PHE A 293 -3.556 -2.190 -2.507 1.00 0.00 H new ATOM 0 HE1 PHE A 293 -0.531 1.082 -0.428 1.00 0.00 H new ATOM 0 HE2 PHE A 293 -2.317 -2.787 -0.473 1.00 0.00 H new ATOM 0 HZ PHE A 293 -0.803 -1.152 0.570 1.00 0.00 H new ATOM 1092 N THR A 294 -1.318 1.447 -5.372 1.00 0.00 N ATOM 1093 CA THR A 294 -0.025 2.091 -5.540 1.00 0.00 C ATOM 1094 C THR A 294 0.237 3.075 -4.396 1.00 0.00 C ATOM 1095 O THR A 294 -0.636 3.868 -4.046 1.00 0.00 O ATOM 1096 CB THR A 294 0.019 2.829 -6.900 1.00 0.00 C ATOM 1097 OG1 THR A 294 -0.065 1.868 -7.964 1.00 0.00 O ATOM 1098 CG2 THR A 294 1.282 3.678 -7.067 1.00 0.00 C ATOM 0 H THR A 294 -2.099 2.099 -5.294 1.00 0.00 H new ATOM 0 HA THR A 294 0.753 1.328 -5.522 1.00 0.00 H new ATOM 0 HB THR A 294 -0.831 3.510 -6.933 1.00 0.00 H new ATOM 0 HG1 THR A 294 -0.039 2.332 -8.827 1.00 0.00 H new ATOM 0 HG21 THR A 294 1.262 4.173 -8.038 1.00 0.00 H new ATOM 0 HG22 THR A 294 1.323 4.428 -6.277 1.00 0.00 H new ATOM 0 HG23 THR A 294 2.162 3.038 -7.005 1.00 0.00 H new ATOM 1106 N ALA A 295 1.430 3.015 -3.805 1.00 0.00 N ATOM 1107 CA ALA A 295 1.766 3.901 -2.699 1.00 0.00 C ATOM 1108 C ALA A 295 2.889 4.850 -3.076 1.00 0.00 C ATOM 1109 O ALA A 295 3.397 4.812 -4.197 1.00 0.00 O ATOM 1110 CB ALA A 295 2.167 3.101 -1.480 1.00 0.00 C ATOM 0 H ALA A 295 2.171 2.368 -4.073 1.00 0.00 H new ATOM 0 HA ALA A 295 0.878 4.489 -2.468 1.00 0.00 H new ATOM 0 HB1 ALA A 295 2.414 3.780 -0.664 1.00 0.00 H new ATOM 0 HB2 ALA A 295 1.340 2.458 -1.179 1.00 0.00 H new ATOM 0 HB3 ALA A 295 3.036 2.487 -1.717 1.00 0.00 H new ATOM 1116 N THR A 296 3.283 5.702 -2.141 1.00 0.00 N ATOM 1117 CA THR A 296 4.370 6.626 -2.385 1.00 0.00 C ATOM 1118 C THR A 296 5.221 6.836 -1.138 1.00 0.00 C ATOM 1119 O THR A 296 4.730 7.254 -0.081 1.00 0.00 O ATOM 1120 CB THR A 296 3.839 7.978 -2.921 1.00 0.00 C ATOM 1121 OG1 THR A 296 3.146 7.746 -4.154 1.00 0.00 O ATOM 1122 CG2 THR A 296 4.959 9.005 -3.142 1.00 0.00 C ATOM 0 H THR A 296 2.866 5.769 -1.213 1.00 0.00 H new ATOM 0 HA THR A 296 5.009 6.182 -3.149 1.00 0.00 H new ATOM 0 HB THR A 296 3.168 8.396 -2.171 1.00 0.00 H new ATOM 0 HG1 THR A 296 2.670 8.560 -4.420 1.00 0.00 H new ATOM 0 HG21 THR A 296 4.531 9.934 -3.518 1.00 0.00 H new ATOM 0 HG22 THR A 296 5.469 9.196 -2.198 1.00 0.00 H new ATOM 0 HG23 THR A 296 5.673 8.614 -3.867 1.00 0.00 H new ATOM 1130 N VAL A 297 6.502 6.526 -1.297 1.00 0.00 N ATOM 1131 CA VAL A 297 7.492 6.607 -0.234 1.00 0.00 C ATOM 1132 C VAL A 297 7.719 8.057 0.176 1.00 0.00 C ATOM 1133 O VAL A 297 7.776 8.944 -0.678 1.00 0.00 O ATOM 1134 CB VAL A 297 8.821 5.974 -0.711 1.00 0.00 C ATOM 1135 CG1 VAL A 297 9.939 6.198 0.289 1.00 0.00 C ATOM 1136 CG2 VAL A 297 8.636 4.488 -0.983 1.00 0.00 C ATOM 0 H VAL A 297 6.887 6.206 -2.185 1.00 0.00 H new ATOM 0 HA VAL A 297 7.123 6.059 0.633 1.00 0.00 H new ATOM 0 HB VAL A 297 9.107 6.468 -1.640 1.00 0.00 H new ATOM 0 HG11 VAL A 297 10.856 5.739 -0.081 1.00 0.00 H new ATOM 0 HG12 VAL A 297 10.098 7.268 0.424 1.00 0.00 H new ATOM 0 HG13 VAL A 297 9.668 5.748 1.244 1.00 0.00 H new ATOM 0 HG21 VAL A 297 9.581 4.059 -1.318 1.00 0.00 H new ATOM 0 HG22 VAL A 297 8.314 3.988 -0.069 1.00 0.00 H new ATOM 0 HG23 VAL A 297 7.881 4.351 -1.757 1.00 0.00 H new ATOM 1146 N THR A 298 7.840 8.305 1.478 1.00 0.00 N ATOM 1147 CA THR A 298 7.964 9.677 1.953 1.00 0.00 C ATOM 1148 C THR A 298 9.260 9.900 2.740 1.00 0.00 C ATOM 1149 O THR A 298 9.475 10.975 3.304 1.00 0.00 O ATOM 1150 CB THR A 298 6.745 10.081 2.818 1.00 0.00 C ATOM 1151 OG1 THR A 298 6.697 11.506 2.966 1.00 0.00 O ATOM 1152 CG2 THR A 298 6.802 9.435 4.196 1.00 0.00 C ATOM 0 H THR A 298 7.855 7.591 2.207 1.00 0.00 H new ATOM 0 HA THR A 298 7.996 10.312 1.068 1.00 0.00 H new ATOM 0 HB THR A 298 5.848 9.731 2.308 1.00 0.00 H new ATOM 0 HG1 THR A 298 7.595 11.845 3.165 1.00 0.00 H new ATOM 0 HG21 THR A 298 5.932 9.740 4.777 1.00 0.00 H new ATOM 0 HG22 THR A 298 6.806 8.350 4.089 1.00 0.00 H new ATOM 0 HG23 THR A 298 7.710 9.752 4.709 1.00 0.00 H new ATOM 1160 N ALA A 299 10.126 8.895 2.765 1.00 0.00 N ATOM 1161 CA ALA A 299 11.392 8.996 3.480 1.00 0.00 C ATOM 1162 C ALA A 299 12.349 7.910 3.019 1.00 0.00 C ATOM 1163 O ALA A 299 12.108 7.263 2.006 1.00 0.00 O ATOM 1164 CB ALA A 299 11.170 8.907 4.984 1.00 0.00 C ATOM 0 H ALA A 299 9.975 8.001 2.298 1.00 0.00 H new ATOM 0 HA ALA A 299 11.835 9.967 3.257 1.00 0.00 H new ATOM 0 HB1 ALA A 299 12.128 8.985 5.498 1.00 0.00 H new ATOM 0 HB2 ALA A 299 10.519 9.720 5.304 1.00 0.00 H new ATOM 0 HB3 ALA A 299 10.704 7.952 5.227 1.00 0.00 H new ATOM 1170 N ASP A 300 13.427 7.712 3.756 1.00 0.00 N ATOM 1171 CA ASP A 300 14.397 6.687 3.414 1.00 0.00 C ATOM 1172 C ASP A 300 13.825 5.310 3.707 1.00 0.00 C ATOM 1173 O ASP A 300 13.577 4.953 4.860 1.00 0.00 O ATOM 1174 CB ASP A 300 15.704 6.885 4.186 1.00 0.00 C ATOM 1175 CG ASP A 300 16.364 8.215 3.887 1.00 0.00 C ATOM 1176 OD1 ASP A 300 17.247 8.265 3.004 1.00 0.00 O ATOM 1177 OD2 ASP A 300 16.003 9.219 4.538 1.00 0.00 O1- ATOM 0 H ASP A 300 13.653 8.247 4.595 1.00 0.00 H new ATOM 0 HA ASP A 300 14.615 6.768 2.349 1.00 0.00 H new ATOM 0 HB2 ASP A 300 15.504 6.816 5.255 1.00 0.00 H new ATOM 0 HB3 ASP A 300 16.393 6.078 3.938 1.00 0.00 H new ATOM 1182 N ALA A 301 13.613 4.546 2.656 1.00 0.00 N ATOM 1183 CA ALA A 301 13.102 3.184 2.800 1.00 0.00 C ATOM 1184 C ALA A 301 14.272 2.213 2.889 1.00 0.00 C ATOM 1185 O ALA A 301 14.890 1.876 1.887 1.00 0.00 O ATOM 1186 CB ALA A 301 12.146 2.806 1.659 1.00 0.00 C ATOM 0 H ALA A 301 13.783 4.836 1.693 1.00 0.00 H new ATOM 0 HA ALA A 301 12.520 3.128 3.720 1.00 0.00 H new ATOM 0 HB1 ALA A 301 11.790 1.786 1.805 1.00 0.00 H new ATOM 0 HB2 ALA A 301 11.297 3.490 1.654 1.00 0.00 H new ATOM 0 HB3 ALA A 301 12.672 2.874 0.706 1.00 0.00 H new ATOM 1192 N ASN A 302 14.571 1.790 4.109 1.00 0.00 N ATOM 1193 CA ASN A 302 15.785 1.033 4.414 1.00 0.00 C ATOM 1194 C ASN A 302 15.914 -0.242 3.579 1.00 0.00 C ATOM 1195 O ASN A 302 14.953 -0.984 3.434 1.00 0.00 O ATOM 1196 CB ASN A 302 15.801 0.660 5.896 1.00 0.00 C ATOM 1197 CG ASN A 302 15.728 1.871 6.800 1.00 0.00 C ATOM 1198 OD1 ASN A 302 14.641 2.320 7.165 1.00 0.00 O ATOM 1199 ND2 ASN A 302 16.877 2.413 7.161 1.00 0.00 N ATOM 0 H ASN A 302 13.978 1.961 4.921 1.00 0.00 H new ATOM 0 HA ASN A 302 16.629 1.676 4.167 1.00 0.00 H new ATOM 0 HB2 ASN A 302 14.960 -0.000 6.110 1.00 0.00 H new ATOM 0 HB3 ASN A 302 16.710 0.100 6.117 1.00 0.00 H new ATOM 0 HD21 ASN A 302 16.886 3.235 7.765 1.00 0.00 H new ATOM 0 HD22 ASN A 302 17.756 2.009 6.836 1.00 0.00 H new ATOM 1206 N SER A 303 17.097 -0.487 3.024 1.00 0.00 N ATOM 1207 CA SER A 303 17.369 -1.726 2.331 1.00 0.00 C ATOM 1208 C SER A 303 18.646 -2.374 2.857 1.00 0.00 C ATOM 1209 O SER A 303 19.747 -1.852 2.665 1.00 0.00 O ATOM 1210 CB SER A 303 17.514 -1.460 0.835 1.00 0.00 C ATOM 1211 OG SER A 303 17.898 -2.633 0.138 1.00 0.00 O ATOM 0 H SER A 303 17.881 0.165 3.045 1.00 0.00 H new ATOM 0 HA SER A 303 16.535 -2.406 2.506 1.00 0.00 H new ATOM 0 HB2 SER A 303 16.569 -1.090 0.436 1.00 0.00 H new ATOM 0 HB3 SER A 303 18.256 -0.679 0.673 1.00 0.00 H new ATOM 0 HG SER A 303 17.124 -2.997 -0.340 1.00 0.00 H new ATOM 1217 N ASP A 304 18.504 -3.498 3.533 1.00 0.00 N ATOM 1218 CA ASP A 304 19.655 -4.289 3.928 1.00 0.00 C ATOM 1219 C ASP A 304 19.433 -5.725 3.481 1.00 0.00 C ATOM 1220 O ASP A 304 18.298 -6.150 3.264 1.00 0.00 O ATOM 1221 CB ASP A 304 19.900 -4.218 5.441 1.00 0.00 C ATOM 1222 CG ASP A 304 19.082 -5.219 6.227 1.00 0.00 C ATOM 1223 OD1 ASP A 304 17.911 -4.929 6.541 1.00 0.00 O ATOM 1224 OD2 ASP A 304 19.618 -6.296 6.548 1.00 0.00 O1- ATOM 0 H ASP A 304 17.605 -3.884 3.820 1.00 0.00 H new ATOM 0 HA ASP A 304 20.546 -3.885 3.448 1.00 0.00 H new ATOM 0 HB2 ASP A 304 20.958 -4.388 5.639 1.00 0.00 H new ATOM 0 HB3 ASP A 304 19.668 -3.213 5.793 1.00 0.00 H new ATOM 1229 N SER A 305 20.523 -6.462 3.335 1.00 0.00 N ATOM 1230 CA SER A 305 20.483 -7.790 2.736 1.00 0.00 C ATOM 1231 C SER A 305 19.812 -8.809 3.650 1.00 0.00 C ATOM 1232 O SER A 305 19.532 -9.932 3.232 1.00 0.00 O ATOM 1233 CB SER A 305 21.893 -8.246 2.412 1.00 0.00 C ATOM 1234 OG SER A 305 21.900 -9.259 1.420 1.00 0.00 O ATOM 0 H SER A 305 21.454 -6.161 3.625 1.00 0.00 H new ATOM 0 HA SER A 305 19.891 -7.724 1.823 1.00 0.00 H new ATOM 0 HB2 SER A 305 22.481 -7.395 2.068 1.00 0.00 H new ATOM 0 HB3 SER A 305 22.372 -8.619 3.317 1.00 0.00 H new ATOM 0 HG SER A 305 21.172 -9.892 1.594 1.00 0.00 H new ATOM 1240 N GLY A 306 19.561 -8.421 4.894 1.00 0.00 N ATOM 1241 CA GLY A 306 18.794 -9.263 5.786 1.00 0.00 C ATOM 1242 C GLY A 306 17.353 -9.329 5.339 1.00 0.00 C ATOM 1243 O GLY A 306 16.588 -10.196 5.766 1.00 0.00 O ATOM 0 H GLY A 306 19.875 -7.539 5.299 1.00 0.00 H new ATOM 0 HA2 GLY A 306 19.221 -10.266 5.807 1.00 0.00 H new ATOM 0 HA3 GLY A 306 18.849 -8.872 6.802 1.00 0.00 H new ATOM 1247 N GLY A 307 16.995 -8.403 4.458 1.00 0.00 N ATOM 1248 CA GLY A 307 15.676 -8.415 3.860 1.00 0.00 C ATOM 1249 C GLY A 307 14.634 -7.625 4.627 1.00 0.00 C ATOM 1250 O GLY A 307 13.503 -8.074 4.750 1.00 0.00 O ATOM 0 H GLY A 307 17.598 -7.642 4.147 1.00 0.00 H new ATOM 0 HA2 GLY A 307 15.745 -8.015 2.848 1.00 0.00 H new ATOM 0 HA3 GLY A 307 15.339 -9.448 3.772 1.00 0.00 H new ATOM 1254 N ASP A 308 14.989 -6.455 5.141 1.00 0.00 N ATOM 1255 CA ASP A 308 14.021 -5.632 5.870 1.00 0.00 C ATOM 1256 C ASP A 308 13.949 -4.213 5.297 1.00 0.00 C ATOM 1257 O ASP A 308 14.977 -3.570 5.088 1.00 0.00 O ATOM 1258 CB ASP A 308 14.385 -5.577 7.350 1.00 0.00 C ATOM 1259 CG ASP A 308 13.397 -4.782 8.183 1.00 0.00 C ATOM 1260 OD1 ASP A 308 13.608 -3.567 8.370 1.00 0.00 O ATOM 1261 OD2 ASP A 308 12.415 -5.376 8.679 1.00 0.00 O1- ATOM 0 H ASP A 308 15.925 -6.055 5.071 1.00 0.00 H new ATOM 0 HA ASP A 308 13.040 -6.093 5.756 1.00 0.00 H new ATOM 0 HB2 ASP A 308 14.444 -6.593 7.740 1.00 0.00 H new ATOM 0 HB3 ASP A 308 15.376 -5.137 7.457 1.00 0.00 H new ATOM 1266 N VAL A 309 12.731 -3.740 5.037 1.00 0.00 N ATOM 1267 CA VAL A 309 12.507 -2.371 4.568 1.00 0.00 C ATOM 1268 C VAL A 309 11.247 -1.765 5.187 1.00 0.00 C ATOM 1269 O VAL A 309 10.146 -2.186 4.893 1.00 0.00 O ATOM 1270 CB VAL A 309 12.397 -2.297 3.014 1.00 0.00 C ATOM 1271 CG1 VAL A 309 11.638 -3.482 2.437 1.00 0.00 C ATOM 1272 CG2 VAL A 309 11.750 -0.993 2.550 1.00 0.00 C ATOM 0 H VAL A 309 11.878 -4.288 5.144 1.00 0.00 H new ATOM 0 HA VAL A 309 13.376 -1.795 4.886 1.00 0.00 H new ATOM 0 HB VAL A 309 13.420 -2.329 2.638 1.00 0.00 H new ATOM 0 HG11 VAL A 309 11.586 -3.388 1.352 1.00 0.00 H new ATOM 0 HG12 VAL A 309 12.154 -4.406 2.697 1.00 0.00 H new ATOM 0 HG13 VAL A 309 10.629 -3.502 2.848 1.00 0.00 H new ATOM 0 HG21 VAL A 309 11.693 -0.982 1.462 1.00 0.00 H new ATOM 0 HG22 VAL A 309 10.746 -0.917 2.967 1.00 0.00 H new ATOM 0 HG23 VAL A 309 12.349 -0.148 2.890 1.00 0.00 H new ATOM 1282 N THR A 310 11.399 -0.772 6.039 1.00 0.00 N ATOM 1283 CA THR A 310 10.236 -0.116 6.618 1.00 0.00 C ATOM 1284 C THR A 310 10.089 1.304 6.068 1.00 0.00 C ATOM 1285 O THR A 310 11.053 2.077 6.063 1.00 0.00 O ATOM 1286 CB THR A 310 10.346 -0.072 8.165 1.00 0.00 C ATOM 1287 OG1 THR A 310 10.399 -1.406 8.681 1.00 0.00 O ATOM 1288 CG2 THR A 310 9.182 0.687 8.824 1.00 0.00 C ATOM 0 H THR A 310 12.300 -0.403 6.345 1.00 0.00 H new ATOM 0 HA THR A 310 9.353 -0.693 6.344 1.00 0.00 H new ATOM 0 HB THR A 310 11.261 0.468 8.406 1.00 0.00 H new ATOM 0 HG1 THR A 310 10.390 -1.378 9.661 1.00 0.00 H new ATOM 0 HG21 THR A 310 9.313 0.685 9.906 1.00 0.00 H new ATOM 0 HG22 THR A 310 9.167 1.715 8.462 1.00 0.00 H new ATOM 0 HG23 THR A 310 8.240 0.200 8.571 1.00 0.00 H new ATOM 1296 N VAL A 311 8.893 1.639 5.592 1.00 0.00 N ATOM 1297 CA VAL A 311 8.627 2.985 5.075 1.00 0.00 C ATOM 1298 C VAL A 311 7.156 3.360 5.240 1.00 0.00 C ATOM 1299 O VAL A 311 6.268 2.517 5.125 1.00 0.00 O ATOM 1300 CB VAL A 311 9.029 3.121 3.579 1.00 0.00 C ATOM 1301 CG1 VAL A 311 8.448 1.965 2.752 1.00 0.00 C ATOM 1302 CG2 VAL A 311 8.558 4.456 3.003 1.00 0.00 C ATOM 0 H VAL A 311 8.095 1.004 5.552 1.00 0.00 H new ATOM 0 HA VAL A 311 9.240 3.670 5.662 1.00 0.00 H new ATOM 0 HB VAL A 311 10.117 3.083 3.525 1.00 0.00 H new ATOM 0 HG11 VAL A 311 8.742 2.080 1.709 1.00 0.00 H new ATOM 0 HG12 VAL A 311 8.829 1.018 3.133 1.00 0.00 H new ATOM 0 HG13 VAL A 311 7.361 1.975 2.826 1.00 0.00 H new ATOM 0 HG21 VAL A 311 8.852 4.525 1.956 1.00 0.00 H new ATOM 0 HG22 VAL A 311 7.473 4.523 3.080 1.00 0.00 H new ATOM 0 HG23 VAL A 311 9.012 5.274 3.562 1.00 0.00 H new ATOM 1312 N THR A 312 6.914 4.629 5.520 1.00 0.00 N ATOM 1313 CA THR A 312 5.571 5.150 5.608 1.00 0.00 C ATOM 1314 C THR A 312 5.218 5.877 4.319 1.00 0.00 C ATOM 1315 O THR A 312 6.072 6.499 3.676 1.00 0.00 O ATOM 1316 CB THR A 312 5.447 6.104 6.822 1.00 0.00 C ATOM 1317 OG1 THR A 312 5.539 5.359 8.036 1.00 0.00 O ATOM 1318 CG2 THR A 312 4.150 6.940 6.813 1.00 0.00 C ATOM 0 H THR A 312 7.644 5.321 5.691 1.00 0.00 H new ATOM 0 HA THR A 312 4.874 4.324 5.748 1.00 0.00 H new ATOM 0 HB THR A 312 6.273 6.811 6.750 1.00 0.00 H new ATOM 0 HG1 THR A 312 4.710 5.464 8.548 1.00 0.00 H new ATOM 0 HG21 THR A 312 4.127 7.586 7.691 1.00 0.00 H new ATOM 0 HG22 THR A 312 4.118 7.552 5.911 1.00 0.00 H new ATOM 0 HG23 THR A 312 3.288 6.274 6.831 1.00 0.00 H new ATOM 1326 N LEU A 313 3.963 5.773 3.945 1.00 0.00 N ATOM 1327 CA LEU A 313 3.487 6.251 2.675 1.00 0.00 C ATOM 1328 C LEU A 313 2.390 7.279 2.899 1.00 0.00 C ATOM 1329 O LEU A 313 1.451 7.035 3.654 1.00 0.00 O ATOM 1330 CB LEU A 313 2.952 5.067 1.867 1.00 0.00 C ATOM 1331 CG LEU A 313 3.919 3.877 1.695 1.00 0.00 C ATOM 1332 CD1 LEU A 313 5.321 4.336 1.339 1.00 0.00 C ATOM 1333 CD2 LEU A 313 3.929 2.980 2.925 1.00 0.00 C ATOM 0 H LEU A 313 3.239 5.348 4.524 1.00 0.00 H new ATOM 0 HA LEU A 313 4.300 6.723 2.123 1.00 0.00 H new ATOM 0 HB2 LEU A 313 2.043 4.705 2.348 1.00 0.00 H new ATOM 0 HB3 LEU A 313 2.668 5.426 0.878 1.00 0.00 H new ATOM 0 HG LEU A 313 3.548 3.285 0.858 1.00 0.00 H new ATOM 0 HD11 LEU A 313 5.971 3.468 1.227 1.00 0.00 H new ATOM 0 HD12 LEU A 313 5.295 4.893 0.402 1.00 0.00 H new ATOM 0 HD13 LEU A 313 5.706 4.977 2.132 1.00 0.00 H new ATOM 0 HD21 LEU A 313 4.621 2.153 2.767 1.00 0.00 H new ATOM 0 HD22 LEU A 313 4.246 3.557 3.794 1.00 0.00 H new ATOM 0 HD23 LEU A 313 2.927 2.586 3.096 1.00 0.00 H new ATOM 1345 N SER A 314 2.496 8.427 2.264 1.00 0.00 N ATOM 1346 CA SER A 314 1.543 9.492 2.523 1.00 0.00 C ATOM 1347 C SER A 314 1.231 10.291 1.270 1.00 0.00 C ATOM 1348 O SER A 314 2.055 10.388 0.359 1.00 0.00 O ATOM 1349 CB SER A 314 2.077 10.407 3.627 1.00 0.00 C ATOM 1350 OG SER A 314 3.415 10.795 3.368 1.00 0.00 O ATOM 0 H SER A 314 3.217 8.647 1.577 1.00 0.00 H new ATOM 0 HA SER A 314 0.609 9.036 2.852 1.00 0.00 H new ATOM 0 HB2 SER A 314 1.447 11.293 3.705 1.00 0.00 H new ATOM 0 HB3 SER A 314 2.024 9.893 4.587 1.00 0.00 H new ATOM 0 HG SER A 314 3.731 11.380 4.088 1.00 0.00 H new ATOM 1632 N VAL A 333 -7.536 -4.069 6.087 1.00 0.00 N ATOM 1633 CA VAL A 333 -6.256 -4.499 5.554 1.00 0.00 C ATOM 1634 C VAL A 333 -5.901 -5.924 5.990 1.00 0.00 C ATOM 1635 O VAL A 333 -6.454 -6.443 6.959 1.00 0.00 O ATOM 1636 CB VAL A 333 -5.136 -3.527 5.953 1.00 0.00 C ATOM 1637 CG1 VAL A 333 -5.293 -2.208 5.212 1.00 0.00 C ATOM 1638 CG2 VAL A 333 -5.127 -3.294 7.458 1.00 0.00 C ATOM 0 HA VAL A 333 -6.350 -4.498 4.468 1.00 0.00 H new ATOM 0 HB VAL A 333 -4.182 -3.974 5.675 1.00 0.00 H new ATOM 0 HG11 VAL A 333 -4.492 -1.529 5.505 1.00 0.00 H new ATOM 0 HG12 VAL A 333 -5.243 -2.386 4.138 1.00 0.00 H new ATOM 0 HG13 VAL A 333 -6.256 -1.763 5.462 1.00 0.00 H new ATOM 0 HG21 VAL A 333 -4.325 -2.602 7.714 1.00 0.00 H new ATOM 0 HG22 VAL A 333 -6.083 -2.871 7.766 1.00 0.00 H new ATOM 0 HG23 VAL A 333 -4.967 -4.242 7.972 1.00 0.00 H new ATOM 1648 N GLU A 334 -4.964 -6.536 5.267 1.00 0.00 N ATOM 1649 CA GLU A 334 -4.592 -7.939 5.464 1.00 0.00 C ATOM 1650 C GLU A 334 -3.162 -8.166 4.954 1.00 0.00 C ATOM 1651 O GLU A 334 -2.909 -8.083 3.753 1.00 0.00 O ATOM 1652 CB GLU A 334 -5.583 -8.828 4.706 1.00 0.00 C ATOM 1653 CG GLU A 334 -5.238 -10.305 4.699 1.00 0.00 C ATOM 1654 CD GLU A 334 -5.559 -11.004 5.994 1.00 0.00 C ATOM 1655 OE1 GLU A 334 -4.704 -10.998 6.896 1.00 0.00 O ATOM 1656 OE2 GLU A 334 -6.659 -11.588 6.095 1.00 0.00 O1- ATOM 0 H GLU A 334 -4.439 -6.072 4.525 1.00 0.00 H new ATOM 0 HA GLU A 334 -4.626 -8.192 6.524 1.00 0.00 H new ATOM 0 HB2 GLU A 334 -6.572 -8.703 5.147 1.00 0.00 H new ATOM 0 HB3 GLU A 334 -5.647 -8.480 3.675 1.00 0.00 H new ATOM 0 HG2 GLU A 334 -5.780 -10.792 3.888 1.00 0.00 H new ATOM 0 HG3 GLU A 334 -4.175 -10.421 4.487 1.00 0.00 H new ATOM 1663 N ALA A 335 -2.236 -8.442 5.870 1.00 0.00 N ATOM 1664 CA ALA A 335 -0.807 -8.500 5.539 1.00 0.00 C ATOM 1665 C ALA A 335 -0.441 -9.774 4.769 1.00 0.00 C ATOM 1666 O ALA A 335 -0.965 -10.855 5.062 1.00 0.00 O ATOM 1667 CB ALA A 335 0.018 -8.415 6.815 1.00 0.00 C ATOM 0 H ALA A 335 -2.447 -8.630 6.850 1.00 0.00 H new ATOM 0 HA ALA A 335 -0.585 -7.652 4.891 1.00 0.00 H new ATOM 0 HB1 ALA A 335 1.078 -8.458 6.566 1.00 0.00 H new ATOM 0 HB2 ALA A 335 -0.197 -7.476 7.325 1.00 0.00 H new ATOM 0 HB3 ALA A 335 -0.236 -9.250 7.469 1.00 0.00 H new ATOM 1673 N GLY A 336 0.494 -9.657 3.818 1.00 0.00 N ATOM 1674 CA GLY A 336 0.973 -10.826 3.097 1.00 0.00 C ATOM 1675 C GLY A 336 1.003 -10.658 1.583 1.00 0.00 C ATOM 1676 O GLY A 336 1.192 -11.636 0.859 1.00 0.00 O ATOM 0 H GLY A 336 0.924 -8.775 3.538 1.00 0.00 H new ATOM 0 HA2 GLY A 336 1.978 -11.067 3.444 1.00 0.00 H new ATOM 0 HA3 GLY A 336 0.338 -11.677 3.344 1.00 0.00 H new ATOM 1680 N ASP A 337 0.829 -9.433 1.098 1.00 0.00 N ATOM 1681 CA ASP A 337 0.934 -9.147 -0.331 1.00 0.00 C ATOM 1682 C ASP A 337 2.389 -9.098 -0.801 1.00 0.00 C ATOM 1683 O ASP A 337 3.331 -9.192 0.000 1.00 0.00 O ATOM 1684 CB ASP A 337 0.255 -7.818 -0.648 1.00 0.00 C ATOM 1685 CG ASP A 337 0.819 -6.671 0.161 1.00 0.00 C ATOM 1686 OD1 ASP A 337 0.318 -6.437 1.287 1.00 0.00 O ATOM 1687 OD2 ASP A 337 1.761 -6.015 -0.320 1.00 0.00 O1- ATOM 0 H ASP A 337 0.614 -8.619 1.674 1.00 0.00 H new ATOM 0 HA ASP A 337 0.436 -9.958 -0.862 1.00 0.00 H new ATOM 0 HB2 ASP A 337 0.369 -7.600 -1.710 1.00 0.00 H new ATOM 0 HB3 ASP A 337 -0.814 -7.904 -0.453 1.00 0.00 H new ATOM 1692 N ALA A 338 2.555 -8.956 -2.111 1.00 0.00 N ATOM 1693 CA ALA A 338 3.870 -8.885 -2.728 1.00 0.00 C ATOM 1694 C ALA A 338 4.101 -7.488 -3.286 1.00 0.00 C ATOM 1695 O ALA A 338 3.260 -6.947 -3.996 1.00 0.00 O ATOM 1696 CB ALA A 338 4.005 -9.932 -3.828 1.00 0.00 C ATOM 0 H ALA A 338 1.782 -8.887 -2.773 1.00 0.00 H new ATOM 0 HA ALA A 338 4.627 -9.093 -1.971 1.00 0.00 H new ATOM 0 HB1 ALA A 338 4.996 -9.862 -4.277 1.00 0.00 H new ATOM 0 HB2 ALA A 338 3.868 -10.926 -3.403 1.00 0.00 H new ATOM 0 HB3 ALA A 338 3.247 -9.757 -4.592 1.00 0.00 H new ATOM 1702 N VAL A 339 5.251 -6.926 -2.984 1.00 0.00 N ATOM 1703 CA VAL A 339 5.516 -5.525 -3.254 1.00 0.00 C ATOM 1704 C VAL A 339 6.398 -5.345 -4.492 1.00 0.00 C ATOM 1705 O VAL A 339 7.163 -6.235 -4.853 1.00 0.00 O ATOM 1706 CB VAL A 339 6.194 -4.888 -2.008 1.00 0.00 C ATOM 1707 CG1 VAL A 339 6.710 -3.483 -2.293 1.00 0.00 C ATOM 1708 CG2 VAL A 339 5.215 -4.852 -0.849 1.00 0.00 C ATOM 0 H VAL A 339 6.027 -7.422 -2.546 1.00 0.00 H new ATOM 0 HA VAL A 339 4.569 -5.025 -3.458 1.00 0.00 H new ATOM 0 HB VAL A 339 7.052 -5.508 -1.748 1.00 0.00 H new ATOM 0 HG11 VAL A 339 7.176 -3.077 -1.395 1.00 0.00 H new ATOM 0 HG12 VAL A 339 7.445 -3.521 -3.097 1.00 0.00 H new ATOM 0 HG13 VAL A 339 5.879 -2.844 -2.591 1.00 0.00 H new ATOM 0 HG21 VAL A 339 5.697 -4.405 0.020 1.00 0.00 H new ATOM 0 HG22 VAL A 339 4.344 -4.259 -1.127 1.00 0.00 H new ATOM 0 HG23 VAL A 339 4.900 -5.867 -0.607 1.00 0.00 H new ATOM 1718 N SER A 340 6.260 -4.200 -5.152 1.00 0.00 N ATOM 1719 CA SER A 340 7.108 -3.847 -6.276 1.00 0.00 C ATOM 1720 C SER A 340 7.112 -2.327 -6.461 1.00 0.00 C ATOM 1721 O SER A 340 6.411 -1.607 -5.747 1.00 0.00 O ATOM 1722 CB SER A 340 6.622 -4.557 -7.542 1.00 0.00 C ATOM 1723 OG SER A 340 7.519 -4.369 -8.622 1.00 0.00 O ATOM 0 H SER A 340 5.559 -3.496 -4.921 1.00 0.00 H new ATOM 0 HA SER A 340 8.130 -4.172 -6.079 1.00 0.00 H new ATOM 0 HB2 SER A 340 6.510 -5.623 -7.342 1.00 0.00 H new ATOM 0 HB3 SER A 340 5.637 -4.179 -7.816 1.00 0.00 H new ATOM 0 HG SER A 340 8.369 -4.813 -8.422 1.00 0.00 H new ATOM 1729 N VAL A 341 7.892 -1.845 -7.418 1.00 0.00 N ATOM 1730 CA VAL A 341 8.084 -0.411 -7.613 1.00 0.00 C ATOM 1731 C VAL A 341 7.462 0.044 -8.930 1.00 0.00 C ATOM 1732 O VAL A 341 7.574 -0.639 -9.944 1.00 0.00 O ATOM 1733 CB VAL A 341 9.589 -0.052 -7.615 1.00 0.00 C ATOM 1734 CG1 VAL A 341 9.797 1.452 -7.736 1.00 0.00 C ATOM 1735 CG2 VAL A 341 10.277 -0.584 -6.365 1.00 0.00 C ATOM 0 H VAL A 341 8.407 -2.429 -8.077 1.00 0.00 H new ATOM 0 HA VAL A 341 7.593 0.101 -6.785 1.00 0.00 H new ATOM 0 HB VAL A 341 10.040 -0.528 -8.486 1.00 0.00 H new ATOM 0 HG11 VAL A 341 10.864 1.673 -7.735 1.00 0.00 H new ATOM 0 HG12 VAL A 341 9.354 1.807 -8.667 1.00 0.00 H new ATOM 0 HG13 VAL A 341 9.321 1.954 -6.893 1.00 0.00 H new ATOM 0 HG21 VAL A 341 11.334 -0.319 -6.390 1.00 0.00 H new ATOM 0 HG22 VAL A 341 9.814 -0.146 -5.481 1.00 0.00 H new ATOM 0 HG23 VAL A 341 10.176 -1.669 -6.328 1.00 0.00 H new ATOM 1745 N VAL A 342 6.804 1.200 -8.903 1.00 0.00 N ATOM 1746 CA VAL A 342 6.161 1.750 -10.092 1.00 0.00 C ATOM 1747 C VAL A 342 7.170 2.502 -10.954 1.00 0.00 C ATOM 1748 O VAL A 342 7.100 2.462 -12.184 1.00 0.00 O ATOM 1749 CB VAL A 342 4.994 2.693 -9.716 1.00 0.00 C ATOM 1750 CG1 VAL A 342 4.470 3.441 -10.937 1.00 0.00 C ATOM 1751 CG2 VAL A 342 3.865 1.906 -9.071 1.00 0.00 C ATOM 0 H VAL A 342 6.702 1.776 -8.067 1.00 0.00 H new ATOM 0 HA VAL A 342 5.759 0.912 -10.661 1.00 0.00 H new ATOM 0 HB VAL A 342 5.376 3.425 -9.004 1.00 0.00 H new ATOM 0 HG11 VAL A 342 3.651 4.095 -10.639 1.00 0.00 H new ATOM 0 HG12 VAL A 342 5.272 4.039 -11.370 1.00 0.00 H new ATOM 0 HG13 VAL A 342 4.112 2.725 -11.676 1.00 0.00 H new ATOM 0 HG21 VAL A 342 3.051 2.583 -8.812 1.00 0.00 H new ATOM 0 HG22 VAL A 342 3.502 1.152 -9.769 1.00 0.00 H new ATOM 0 HG23 VAL A 342 4.232 1.417 -8.168 1.00 0.00 H new