USER MOD reduce.3.24.130724 H: found=0, std=0, add=556, rem=0, adj=28 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 250 THR OG1 : rot 180:sc= 0 USER MOD Set 1.2: A 310 THR OG1 : rot 89:sc= -2.34! USER MOD Set 2.1: A 248 THR OG1 : rot 180:sc= 1.03 USER MOD Set 2.2: A 312 THR OG1 : rot -117:sc= -0.616 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+ -179:sc= 1.17 (180deg=1.11) USER MOD Single : A 232 THR OG1 : rot -63:sc= 2.01 USER MOD Single : A 233 GLN : amide:sc= 1.02 K(o=1,f=-0.00068) 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 -126:sc= 0.334 USER MOD Single : A 239 ASN : amide:sc= -0.625 K(o=-0.62,f=-8.3!) 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 180:sc= 0 USER MOD Single : A 246 GLN : amide:sc= 0 K(o=0,f=-0.86) USER MOD Single : A 252 THR OG1 : rot 180:sc= -0.294 USER MOD Single : A 255 THR OG1 : rot 180:sc= 0.0466 USER MOD Single : A 257 SER OG : rot -41:sc= 0.392 USER MOD Single : A 259 THR OG1 : rot 180:sc= 0 USER MOD Single : A 263 LYS NZ :NH3+ 158:sc= 1.15 (180deg=0.435) USER MOD Single : A 267 GLN : amide:sc= 0.0891 X(o=0.089,f=0) USER MOD Single : A 269 LYS NZ :NH3+ 173:sc= 1.26 (180deg=1.13) USER MOD Single : A 271 THR OG1 : rot 180:sc= 0 USER MOD Single : A 272 ASN : amide:sc= 0.849 K(o=0.85,f=-0.39) USER MOD Single : A 292 SER OG : rot -21:sc= 0.209 USER MOD Single : A 294 THR OG1 : rot 180:sc= 0 USER MOD Single : A 296 THR OG1 : rot 180:sc= -0.107 USER MOD Single : A 298 THR OG1 : rot -39:sc= 0.82 USER MOD Single : A 302 ASN : amide:sc= 0 X(o=0,f=-0.34) USER MOD Single : A 303 SER OG : rot -72:sc= 0.7 USER MOD Single : A 305 SER OG : rot 180:sc= 0 USER MOD Single : A 314 SER OG : rot 180:sc= 0 USER MOD Single : A 340 SER OG : rot 180:sc= -0.0595 USER MOD ----------------------------------------------------------------- ATOM 47 N GLY A 226 12.854 -3.403 -7.888 1.00 0.00 N ATOM 48 CA GLY A 226 12.159 -4.619 -8.248 1.00 0.00 C ATOM 49 C GLY A 226 11.046 -4.978 -7.283 1.00 0.00 C ATOM 50 O GLY A 226 10.347 -4.104 -6.764 1.00 0.00 O ATOM 0 HA2 GLY A 226 11.742 -4.509 -9.249 1.00 0.00 H new ATOM 0 HA3 GLY A 226 12.874 -5.440 -8.289 1.00 0.00 H new ATOM 54 N THR A 227 10.889 -6.269 -7.053 1.00 0.00 N ATOM 55 CA THR A 227 9.841 -6.786 -6.194 1.00 0.00 C ATOM 56 C THR A 227 10.247 -6.708 -4.725 1.00 0.00 C ATOM 57 O THR A 227 11.420 -6.868 -4.383 1.00 0.00 O ATOM 58 CB THR A 227 9.555 -8.255 -6.543 1.00 0.00 C ATOM 59 OG1 THR A 227 9.498 -8.411 -7.969 1.00 0.00 O ATOM 60 CG2 THR A 227 8.243 -8.736 -5.931 1.00 0.00 C ATOM 0 H THR A 227 11.487 -6.990 -7.458 1.00 0.00 H new ATOM 0 HA THR A 227 8.951 -6.178 -6.353 1.00 0.00 H new ATOM 0 HB THR A 227 10.364 -8.858 -6.129 1.00 0.00 H new ATOM 0 HG1 THR A 227 9.317 -9.349 -8.189 1.00 0.00 H new ATOM 0 HG21 THR A 227 8.077 -9.779 -6.201 1.00 0.00 H new ATOM 0 HG22 THR A 227 8.293 -8.645 -4.846 1.00 0.00 H new ATOM 0 HG23 THR A 227 7.421 -8.128 -6.309 1.00 0.00 H new ATOM 68 N LEU A 228 9.274 -6.446 -3.873 1.00 0.00 N ATOM 69 CA LEU A 228 9.468 -6.493 -2.437 1.00 0.00 C ATOM 70 C LEU A 228 8.284 -7.208 -1.800 1.00 0.00 C ATOM 71 O LEU A 228 7.391 -7.683 -2.501 1.00 0.00 O ATOM 72 CB LEU A 228 9.637 -5.089 -1.853 1.00 0.00 C ATOM 73 CG LEU A 228 10.856 -4.307 -2.406 1.00 0.00 C ATOM 74 CD1 LEU A 228 10.456 -3.232 -3.416 1.00 0.00 C ATOM 75 CD2 LEU A 228 11.639 -3.684 -1.263 1.00 0.00 C ATOM 0 H LEU A 228 8.327 -6.195 -4.157 1.00 0.00 H new ATOM 0 HA LEU A 228 10.384 -7.043 -2.219 1.00 0.00 H new ATOM 0 HB2 LEU A 228 8.732 -4.515 -2.052 1.00 0.00 H new ATOM 0 HB3 LEU A 228 9.733 -5.168 -0.770 1.00 0.00 H new ATOM 0 HG LEU A 228 11.484 -5.025 -2.934 1.00 0.00 H new ATOM 0 HD11 LEU A 228 11.348 -2.716 -3.770 1.00 0.00 H new ATOM 0 HD12 LEU A 228 9.947 -3.697 -4.260 1.00 0.00 H new ATOM 0 HD13 LEU A 228 9.788 -2.515 -2.939 1.00 0.00 H new ATOM 0 HD21 LEU A 228 12.493 -3.137 -1.663 1.00 0.00 H new ATOM 0 HD22 LEU A 228 10.995 -2.999 -0.712 1.00 0.00 H new ATOM 0 HD23 LEU A 228 11.992 -4.468 -0.593 1.00 0.00 H new ATOM 87 N THR A 229 8.271 -7.291 -0.483 1.00 0.00 N ATOM 88 CA THR A 229 7.263 -8.067 0.214 1.00 0.00 C ATOM 89 C THR A 229 6.645 -7.260 1.358 1.00 0.00 C ATOM 90 O THR A 229 7.268 -6.347 1.894 1.00 0.00 O ATOM 91 CB THR A 229 7.904 -9.355 0.759 1.00 0.00 C ATOM 92 OG1 THR A 229 8.550 -10.061 -0.312 1.00 0.00 O ATOM 93 CG2 THR A 229 6.886 -10.274 1.426 1.00 0.00 C ATOM 0 H THR A 229 8.947 -6.830 0.126 1.00 0.00 H new ATOM 0 HA THR A 229 6.466 -8.320 -0.485 1.00 0.00 H new ATOM 0 HB THR A 229 8.630 -9.061 1.517 1.00 0.00 H new ATOM 0 HG1 THR A 229 8.959 -10.880 0.036 1.00 0.00 H new ATOM 0 HG21 THR A 229 7.389 -11.168 1.793 1.00 0.00 H new ATOM 0 HG22 THR A 229 6.417 -9.753 2.261 1.00 0.00 H new ATOM 0 HG23 THR A 229 6.123 -10.559 0.701 1.00 0.00 H new ATOM 101 N VAL A 230 5.411 -7.593 1.714 1.00 0.00 N ATOM 102 CA VAL A 230 4.714 -6.926 2.807 1.00 0.00 C ATOM 103 C VAL A 230 4.767 -7.801 4.055 1.00 0.00 C ATOM 104 O VAL A 230 4.468 -8.994 3.988 1.00 0.00 O ATOM 105 CB VAL A 230 3.234 -6.648 2.453 1.00 0.00 C ATOM 106 CG1 VAL A 230 2.604 -5.726 3.486 1.00 0.00 C ATOM 107 CG2 VAL A 230 3.106 -6.042 1.061 1.00 0.00 C ATOM 0 H VAL A 230 4.869 -8.327 1.258 1.00 0.00 H new ATOM 0 HA VAL A 230 5.211 -5.973 2.986 1.00 0.00 H new ATOM 0 HB VAL A 230 2.704 -7.600 2.460 1.00 0.00 H new ATOM 0 HG11 VAL A 230 1.563 -5.541 3.222 1.00 0.00 H new ATOM 0 HG12 VAL A 230 2.651 -6.195 4.469 1.00 0.00 H new ATOM 0 HG13 VAL A 230 3.146 -4.781 3.509 1.00 0.00 H new ATOM 0 HG21 VAL A 230 2.055 -5.857 0.840 1.00 0.00 H new ATOM 0 HG22 VAL A 230 3.656 -5.102 1.022 1.00 0.00 H new ATOM 0 HG23 VAL A 230 3.516 -6.733 0.324 1.00 0.00 H new ATOM 117 N LYS A 231 5.152 -7.225 5.189 1.00 0.00 N ATOM 118 CA LYS A 231 5.265 -8.002 6.419 1.00 0.00 C ATOM 119 C LYS A 231 4.203 -7.584 7.435 1.00 0.00 C ATOM 120 O LYS A 231 3.766 -8.387 8.260 1.00 0.00 O ATOM 121 CB LYS A 231 6.675 -7.859 7.005 1.00 0.00 C ATOM 122 CG LYS A 231 6.907 -8.680 8.265 1.00 0.00 C ATOM 123 CD LYS A 231 8.382 -8.738 8.635 1.00 0.00 C ATOM 124 CE LYS A 231 9.003 -7.352 8.701 1.00 0.00 C ATOM 125 NZ LYS A 231 10.414 -7.396 9.163 1.00 0.00 N1+ ATOM 0 H LYS A 231 5.388 -6.237 5.283 1.00 0.00 H new ATOM 0 HA LYS A 231 5.093 -9.052 6.181 1.00 0.00 H new ATOM 0 HB2 LYS A 231 7.403 -8.157 6.250 1.00 0.00 H new ATOM 0 HB3 LYS A 231 6.860 -6.808 7.229 1.00 0.00 H new ATOM 0 HG2 LYS A 231 6.341 -8.248 9.090 1.00 0.00 H new ATOM 0 HG3 LYS A 231 6.529 -9.691 8.115 1.00 0.00 H new ATOM 0 HD2 LYS A 231 8.496 -9.233 9.599 1.00 0.00 H new ATOM 0 HD3 LYS A 231 8.917 -9.341 7.902 1.00 0.00 H new ATOM 0 HE2 LYS A 231 8.958 -6.887 7.716 1.00 0.00 H new ATOM 0 HE3 LYS A 231 8.420 -6.725 9.376 1.00 0.00 H new ATOM 0 HZ1 LYS A 231 10.794 -6.429 9.210 1.00 0.00 H new ATOM 0 HZ2 LYS A 231 10.457 -7.831 10.107 1.00 0.00 H new ATOM 0 HZ3 LYS A 231 10.980 -7.959 8.496 1.00 0.00 H new ATOM 139 N THR A 232 3.778 -6.332 7.357 1.00 0.00 N ATOM 140 CA THR A 232 2.740 -5.810 8.237 1.00 0.00 C ATOM 141 C THR A 232 1.592 -5.244 7.410 1.00 0.00 C ATOM 142 O THR A 232 1.520 -5.475 6.208 1.00 0.00 O ATOM 143 CB THR A 232 3.292 -4.723 9.176 1.00 0.00 C ATOM 144 OG1 THR A 232 3.981 -3.736 8.412 1.00 0.00 O ATOM 145 CG2 THR A 232 4.231 -5.320 10.212 1.00 0.00 C ATOM 0 H THR A 232 4.139 -5.652 6.687 1.00 0.00 H new ATOM 0 HA THR A 232 2.376 -6.634 8.851 1.00 0.00 H new ATOM 0 HB THR A 232 2.454 -4.264 9.701 1.00 0.00 H new ATOM 0 HG1 THR A 232 4.753 -4.145 7.969 1.00 0.00 H new ATOM 0 HG21 THR A 232 4.606 -4.529 10.862 1.00 0.00 H new ATOM 0 HG22 THR A 232 3.693 -6.056 10.809 1.00 0.00 H new ATOM 0 HG23 THR A 232 5.068 -5.803 9.709 1.00 0.00 H new ATOM 153 N GLN A 233 0.694 -4.516 8.048 1.00 0.00 N ATOM 154 CA GLN A 233 -0.487 -4.007 7.373 1.00 0.00 C ATOM 155 C GLN A 233 -0.384 -2.496 7.206 1.00 0.00 C ATOM 156 O GLN A 233 -0.225 -1.769 8.189 1.00 0.00 O ATOM 157 CB GLN A 233 -1.749 -4.364 8.166 1.00 0.00 C ATOM 158 CG GLN A 233 -1.935 -5.858 8.410 1.00 0.00 C ATOM 159 CD GLN A 233 -3.073 -6.151 9.367 1.00 0.00 C ATOM 160 OE1 GLN A 233 -2.874 -6.229 10.578 1.00 0.00 O ATOM 161 NE2 GLN A 233 -4.275 -6.307 8.837 1.00 0.00 N ATOM 0 H GLN A 233 0.760 -4.263 9.034 1.00 0.00 H new ATOM 0 HA GLN A 233 -0.552 -4.468 6.387 1.00 0.00 H new ATOM 0 HB2 GLN A 233 -1.717 -3.852 9.128 1.00 0.00 H new ATOM 0 HB3 GLN A 233 -2.620 -3.984 7.632 1.00 0.00 H new ATOM 0 HG2 GLN A 233 -2.125 -6.357 7.460 1.00 0.00 H new ATOM 0 HG3 GLN A 233 -1.011 -6.276 8.810 1.00 0.00 H new ATOM 0 HE21 GLN A 233 -4.400 -6.235 7.827 1.00 0.00 H new ATOM 0 HE22 GLN A 233 -5.076 -6.499 9.438 1.00 0.00 H new ATOM 170 N PRO A 234 -0.442 -2.005 5.959 1.00 0.00 N ATOM 171 CA PRO A 234 -0.385 -0.571 5.674 1.00 0.00 C ATOM 172 C PRO A 234 -1.630 0.149 6.169 1.00 0.00 C ATOM 173 O PRO A 234 -2.690 0.053 5.558 1.00 0.00 O ATOM 174 CB PRO A 234 -0.317 -0.496 4.140 1.00 0.00 C ATOM 175 CG PRO A 234 -0.029 -1.884 3.673 1.00 0.00 C ATOM 176 CD PRO A 234 -0.561 -2.803 4.730 1.00 0.00 C ATOM 0 HA PRO A 234 0.461 -0.095 6.171 1.00 0.00 H new ATOM 0 HB2 PRO A 234 -1.257 -0.132 3.725 1.00 0.00 H new ATOM 0 HB3 PRO A 234 0.463 0.194 3.817 1.00 0.00 H new ATOM 0 HG2 PRO A 234 -0.507 -2.078 2.713 1.00 0.00 H new ATOM 0 HG3 PRO A 234 1.042 -2.032 3.532 1.00 0.00 H new ATOM 0 HD2 PRO A 234 -1.595 -3.088 4.533 1.00 0.00 H new ATOM 0 HD3 PRO A 234 0.018 -3.725 4.791 1.00 0.00 H new ATOM 184 N THR A 235 -1.509 0.884 7.260 1.00 0.00 N ATOM 185 CA THR A 235 -2.668 1.558 7.813 1.00 0.00 C ATOM 186 C THR A 235 -2.301 2.801 8.627 1.00 0.00 C ATOM 187 O THR A 235 -1.487 2.753 9.554 1.00 0.00 O ATOM 188 CB THR A 235 -3.523 0.585 8.663 1.00 0.00 C ATOM 189 OG1 THR A 235 -4.671 1.265 9.185 1.00 0.00 O ATOM 190 CG2 THR A 235 -2.714 -0.020 9.811 1.00 0.00 C ATOM 0 H THR A 235 -0.638 1.028 7.771 1.00 0.00 H new ATOM 0 HA THR A 235 -3.260 1.899 6.963 1.00 0.00 H new ATOM 0 HB THR A 235 -3.845 -0.228 8.012 1.00 0.00 H new ATOM 0 HG1 THR A 235 -5.206 0.641 9.719 1.00 0.00 H new ATOM 0 HG21 THR A 235 -3.347 -0.697 10.385 1.00 0.00 H new ATOM 0 HG22 THR A 235 -1.865 -0.572 9.407 1.00 0.00 H new ATOM 0 HG23 THR A 235 -2.352 0.777 10.461 1.00 0.00 H new ATOM 198 N VAL A 236 -2.886 3.917 8.209 1.00 0.00 N ATOM 199 CA VAL A 236 -2.852 5.190 8.921 1.00 0.00 C ATOM 200 C VAL A 236 -4.101 5.968 8.501 1.00 0.00 C ATOM 201 O VAL A 236 -4.877 5.462 7.693 1.00 0.00 O ATOM 202 CB VAL A 236 -1.507 5.981 8.705 1.00 0.00 C ATOM 203 CG1 VAL A 236 -1.653 7.494 8.745 1.00 0.00 C ATOM 204 CG2 VAL A 236 -0.528 5.589 9.781 1.00 0.00 C ATOM 0 H VAL A 236 -3.414 3.963 7.338 1.00 0.00 H new ATOM 0 HA VAL A 236 -2.869 5.025 9.998 1.00 0.00 H new ATOM 0 HB VAL A 236 -1.165 5.716 7.705 1.00 0.00 H new ATOM 0 HG11 VAL A 236 -0.679 7.958 8.588 1.00 0.00 H new ATOM 0 HG12 VAL A 236 -2.339 7.814 7.960 1.00 0.00 H new ATOM 0 HG13 VAL A 236 -2.046 7.796 9.716 1.00 0.00 H new ATOM 0 HG21 VAL A 236 0.406 6.132 9.639 1.00 0.00 H new ATOM 0 HG22 VAL A 236 -0.944 5.833 10.758 1.00 0.00 H new ATOM 0 HG23 VAL A 236 -0.336 4.517 9.726 1.00 0.00 H new ATOM 214 N THR A 237 -4.331 7.120 9.098 1.00 0.00 N ATOM 215 CA THR A 237 -5.508 7.926 8.866 1.00 0.00 C ATOM 216 C THR A 237 -5.939 7.964 7.390 1.00 0.00 C ATOM 217 O THR A 237 -5.203 8.433 6.518 1.00 0.00 O ATOM 218 CB THR A 237 -5.235 9.353 9.365 1.00 0.00 C ATOM 219 OG1 THR A 237 -4.991 9.321 10.779 1.00 0.00 O ATOM 220 CG2 THR A 237 -6.396 10.290 9.065 1.00 0.00 C ATOM 0 H THR A 237 -3.687 7.530 9.775 1.00 0.00 H new ATOM 0 HA THR A 237 -6.331 7.468 9.414 1.00 0.00 H new ATOM 0 HB THR A 237 -4.360 9.734 8.839 1.00 0.00 H new ATOM 0 HG1 THR A 237 -4.815 10.230 11.101 1.00 0.00 H new ATOM 0 HG21 THR A 237 -6.162 11.289 9.434 1.00 0.00 H new ATOM 0 HG22 THR A 237 -6.562 10.331 7.988 1.00 0.00 H new ATOM 0 HG23 THR A 237 -7.297 9.923 9.557 1.00 0.00 H new ATOM 228 N TYR A 238 -7.126 7.430 7.126 1.00 0.00 N ATOM 229 CA TYR A 238 -7.743 7.530 5.810 1.00 0.00 C ATOM 230 C TYR A 238 -8.919 8.496 5.887 1.00 0.00 C ATOM 231 O TYR A 238 -10.065 8.080 6.051 1.00 0.00 O ATOM 232 CB TYR A 238 -8.247 6.147 5.326 1.00 0.00 C ATOM 233 CG TYR A 238 -7.166 5.222 4.827 1.00 0.00 C ATOM 234 CD1 TYR A 238 -6.633 4.232 5.638 1.00 0.00 C ATOM 235 CD2 TYR A 238 -6.691 5.337 3.533 1.00 0.00 C ATOM 236 CE1 TYR A 238 -5.649 3.384 5.170 1.00 0.00 C ATOM 237 CE2 TYR A 238 -5.712 4.496 3.055 1.00 0.00 C ATOM 238 CZ TYR A 238 -5.193 3.519 3.876 1.00 0.00 C ATOM 239 OH TYR A 238 -4.207 2.680 3.403 1.00 0.00 O ATOM 0 H TYR A 238 -7.683 6.920 7.812 1.00 0.00 H new ATOM 0 HA TYR A 238 -6.998 7.892 5.101 1.00 0.00 H new ATOM 0 HB2 TYR A 238 -8.773 5.660 6.147 1.00 0.00 H new ATOM 0 HB3 TYR A 238 -8.973 6.299 4.528 1.00 0.00 H new ATOM 0 HD1 TYR A 238 -6.993 4.122 6.650 1.00 0.00 H new ATOM 0 HD2 TYR A 238 -7.096 6.101 2.886 1.00 0.00 H new ATOM 0 HE1 TYR A 238 -5.239 2.620 5.814 1.00 0.00 H new ATOM 0 HE2 TYR A 238 -5.353 4.601 2.042 1.00 0.00 H new ATOM 0 HH TYR A 238 -3.471 3.214 3.037 1.00 0.00 H new ATOM 249 N ASN A 239 -8.640 9.782 5.780 1.00 0.00 N ATOM 250 CA ASN A 239 -9.678 10.787 5.930 1.00 0.00 C ATOM 251 C ASN A 239 -9.954 11.442 4.588 1.00 0.00 C ATOM 252 O ASN A 239 -9.036 11.740 3.831 1.00 0.00 O ATOM 253 CB ASN A 239 -9.269 11.826 6.979 1.00 0.00 C ATOM 254 CG ASN A 239 -10.415 12.734 7.398 1.00 0.00 C ATOM 255 OD1 ASN A 239 -11.257 13.126 6.589 1.00 0.00 O ATOM 256 ND2 ASN A 239 -10.465 13.060 8.677 1.00 0.00 N ATOM 0 H ASN A 239 -7.709 10.154 5.591 1.00 0.00 H new ATOM 0 HA ASN A 239 -10.594 10.309 6.276 1.00 0.00 H new ATOM 0 HB2 ASN A 239 -8.880 11.312 7.858 1.00 0.00 H new ATOM 0 HB3 ASN A 239 -8.457 12.435 6.581 1.00 0.00 H new ATOM 0 HD21 ASN A 239 -11.218 13.655 9.023 1.00 0.00 H new ATOM 0 HD22 ASN A 239 -9.750 12.717 9.319 1.00 0.00 H new ATOM 263 N ALA A 240 -11.220 11.664 4.305 1.00 0.00 N ATOM 264 CA ALA A 240 -11.643 12.141 2.996 1.00 0.00 C ATOM 265 C ALA A 240 -12.069 13.600 3.043 1.00 0.00 C ATOM 266 O ALA A 240 -11.741 14.374 2.145 1.00 0.00 O ATOM 267 CB ALA A 240 -12.763 11.276 2.459 1.00 0.00 C ATOM 0 H ALA A 240 -11.983 11.522 4.967 1.00 0.00 H new ATOM 0 HA ALA A 240 -10.789 12.070 2.323 1.00 0.00 H new ATOM 0 HB1 ALA A 240 -13.069 11.644 1.480 1.00 0.00 H new ATOM 0 HB2 ALA A 240 -12.416 10.247 2.368 1.00 0.00 H new ATOM 0 HB3 ALA A 240 -13.611 11.313 3.142 1.00 0.00 H new ATOM 273 N VAL A 241 -12.796 13.973 4.093 1.00 0.00 N ATOM 274 CA VAL A 241 -13.210 15.357 4.287 1.00 0.00 C ATOM 275 C VAL A 241 -11.981 16.246 4.433 1.00 0.00 C ATOM 276 O VAL A 241 -11.980 17.408 4.035 1.00 0.00 O ATOM 277 CB VAL A 241 -14.104 15.506 5.544 1.00 0.00 C ATOM 278 CG1 VAL A 241 -14.617 16.937 5.696 1.00 0.00 C ATOM 279 CG2 VAL A 241 -15.268 14.524 5.504 1.00 0.00 C ATOM 0 H VAL A 241 -13.110 13.334 4.823 1.00 0.00 H new ATOM 0 HA VAL A 241 -13.789 15.661 3.415 1.00 0.00 H new ATOM 0 HB VAL A 241 -13.488 15.275 6.413 1.00 0.00 H new ATOM 0 HG11 VAL A 241 -15.241 17.007 6.587 1.00 0.00 H new ATOM 0 HG12 VAL A 241 -13.772 17.619 5.790 1.00 0.00 H new ATOM 0 HG13 VAL A 241 -15.205 17.208 4.819 1.00 0.00 H new ATOM 0 HG21 VAL A 241 -15.880 14.649 6.397 1.00 0.00 H new ATOM 0 HG22 VAL A 241 -15.875 14.715 4.619 1.00 0.00 H new ATOM 0 HG23 VAL A 241 -14.883 13.505 5.467 1.00 0.00 H new ATOM 289 N LYS A 242 -10.930 15.673 4.999 1.00 0.00 N ATOM 290 CA LYS A 242 -9.670 16.377 5.188 1.00 0.00 C ATOM 291 C LYS A 242 -8.714 16.085 4.040 1.00 0.00 C ATOM 292 O LYS A 242 -7.623 16.653 3.949 1.00 0.00 O ATOM 293 CB LYS A 242 -9.048 15.937 6.504 1.00 0.00 C ATOM 294 CG LYS A 242 -9.991 16.091 7.684 1.00 0.00 C ATOM 295 CD LYS A 242 -10.135 17.543 8.120 1.00 0.00 C ATOM 296 CE LYS A 242 -8.788 18.181 8.423 1.00 0.00 C ATOM 297 NZ LYS A 242 -8.930 19.572 8.928 1.00 0.00 N1+ ATOM 0 H LYS A 242 -10.925 14.711 5.339 1.00 0.00 H new ATOM 0 HA LYS A 242 -9.861 17.450 5.209 1.00 0.00 H new ATOM 0 HB2 LYS A 242 -8.741 14.894 6.424 1.00 0.00 H new ATOM 0 HB3 LYS A 242 -8.146 16.521 6.687 1.00 0.00 H new ATOM 0 HG2 LYS A 242 -10.971 15.695 7.418 1.00 0.00 H new ATOM 0 HG3 LYS A 242 -9.623 15.497 8.521 1.00 0.00 H new ATOM 0 HD2 LYS A 242 -10.637 18.109 7.335 1.00 0.00 H new ATOM 0 HD3 LYS A 242 -10.769 17.595 9.005 1.00 0.00 H new ATOM 0 HE2 LYS A 242 -8.260 17.579 9.163 1.00 0.00 H new ATOM 0 HE3 LYS A 242 -8.177 18.184 7.520 1.00 0.00 H new ATOM 0 HZ1 LYS A 242 -7.988 19.969 9.122 1.00 0.00 H new ATOM 0 HZ2 LYS A 242 -9.410 20.154 8.212 1.00 0.00 H new ATOM 0 HZ3 LYS A 242 -9.491 19.568 9.804 1.00 0.00 H new ATOM 311 N ASP A 243 -9.160 15.173 3.180 1.00 0.00 N ATOM 312 CA ASP A 243 -8.399 14.712 2.016 1.00 0.00 C ATOM 313 C ASP A 243 -7.011 14.247 2.440 1.00 0.00 C ATOM 314 O ASP A 243 -5.995 14.645 1.880 1.00 0.00 O ATOM 315 CB ASP A 243 -8.314 15.817 0.956 1.00 0.00 C ATOM 316 CG ASP A 243 -7.817 15.317 -0.389 1.00 0.00 C ATOM 317 OD1 ASP A 243 -6.767 15.804 -0.862 1.00 0.00 O ATOM 318 OD2 ASP A 243 -8.490 14.457 -0.993 1.00 0.00 O1- ATOM 0 H ASP A 243 -10.072 14.726 3.271 1.00 0.00 H new ATOM 0 HA ASP A 243 -8.919 13.863 1.572 1.00 0.00 H new ATOM 0 HB2 ASP A 243 -9.299 16.266 0.828 1.00 0.00 H new ATOM 0 HB3 ASP A 243 -7.649 16.604 1.313 1.00 0.00 H new ATOM 323 N SER A 244 -6.990 13.381 3.437 1.00 0.00 N ATOM 324 CA SER A 244 -5.747 12.940 4.044 1.00 0.00 C ATOM 325 C SER A 244 -5.682 11.418 4.080 1.00 0.00 C ATOM 326 O SER A 244 -6.244 10.781 4.969 1.00 0.00 O ATOM 327 CB SER A 244 -5.622 13.517 5.455 1.00 0.00 C ATOM 328 OG SER A 244 -5.747 14.930 5.434 1.00 0.00 O ATOM 0 H SER A 244 -7.827 12.966 3.846 1.00 0.00 H new ATOM 0 HA SER A 244 -4.913 13.302 3.442 1.00 0.00 H new ATOM 0 HB2 SER A 244 -6.391 13.089 6.097 1.00 0.00 H new ATOM 0 HB3 SER A 244 -4.659 13.239 5.883 1.00 0.00 H new ATOM 0 HG SER A 244 -5.666 15.279 6.346 1.00 0.00 H new ATOM 334 N TYR A 245 -5.001 10.846 3.103 1.00 0.00 N ATOM 335 CA TYR A 245 -4.878 9.402 2.994 1.00 0.00 C ATOM 336 C TYR A 245 -3.438 8.988 3.214 1.00 0.00 C ATOM 337 O TYR A 245 -2.581 9.196 2.348 1.00 0.00 O ATOM 338 CB TYR A 245 -5.344 8.931 1.622 1.00 0.00 C ATOM 339 CG TYR A 245 -6.779 8.437 1.568 1.00 0.00 C ATOM 340 CD1 TYR A 245 -7.102 7.292 0.849 1.00 0.00 C ATOM 341 CD2 TYR A 245 -7.807 9.102 2.230 1.00 0.00 C ATOM 342 CE1 TYR A 245 -8.401 6.828 0.789 1.00 0.00 C ATOM 343 CE2 TYR A 245 -9.107 8.640 2.175 1.00 0.00 C ATOM 344 CZ TYR A 245 -9.398 7.504 1.455 1.00 0.00 C ATOM 345 OH TYR A 245 -10.693 7.050 1.395 1.00 0.00 O ATOM 0 H TYR A 245 -4.521 11.364 2.367 1.00 0.00 H new ATOM 0 HA TYR A 245 -5.506 8.941 3.756 1.00 0.00 H new ATOM 0 HB2 TYR A 245 -5.231 9.752 0.915 1.00 0.00 H new ATOM 0 HB3 TYR A 245 -4.686 8.129 1.287 1.00 0.00 H new ATOM 0 HD1 TYR A 245 -6.323 6.756 0.328 1.00 0.00 H new ATOM 0 HD2 TYR A 245 -7.584 9.994 2.796 1.00 0.00 H new ATOM 0 HE1 TYR A 245 -8.634 5.939 0.222 1.00 0.00 H new ATOM 0 HE2 TYR A 245 -9.892 9.168 2.695 1.00 0.00 H new ATOM 0 HH TYR A 245 -11.272 7.641 1.921 1.00 0.00 H new ATOM 355 N GLN A 246 -3.171 8.429 4.375 1.00 0.00 N ATOM 356 CA GLN A 246 -1.825 8.016 4.727 1.00 0.00 C ATOM 357 C GLN A 246 -1.839 6.578 5.229 1.00 0.00 C ATOM 358 O GLN A 246 -2.858 6.104 5.726 1.00 0.00 O ATOM 359 CB GLN A 246 -1.270 8.952 5.802 1.00 0.00 C ATOM 360 CG GLN A 246 -1.286 10.421 5.414 1.00 0.00 C ATOM 361 CD GLN A 246 -0.806 11.323 6.534 1.00 0.00 C ATOM 362 OE1 GLN A 246 -0.943 11.000 7.716 1.00 0.00 O ATOM 363 NE2 GLN A 246 -0.260 12.471 6.174 1.00 0.00 N ATOM 0 H GLN A 246 -3.870 8.249 5.095 1.00 0.00 H new ATOM 0 HA GLN A 246 -1.185 8.069 3.846 1.00 0.00 H new ATOM 0 HB2 GLN A 246 -1.850 8.822 6.716 1.00 0.00 H new ATOM 0 HB3 GLN A 246 -0.245 8.659 6.030 1.00 0.00 H new ATOM 0 HG2 GLN A 246 -0.655 10.569 4.537 1.00 0.00 H new ATOM 0 HG3 GLN A 246 -2.299 10.707 5.130 1.00 0.00 H new ATOM 0 HE21 GLN A 246 -0.164 12.702 5.185 1.00 0.00 H new ATOM 0 HE22 GLN A 246 0.066 13.126 6.885 1.00 0.00 H new ATOM 372 N PHE A 247 -0.727 5.874 5.073 1.00 0.00 N ATOM 373 CA PHE A 247 -0.609 4.517 5.596 1.00 0.00 C ATOM 374 C PHE A 247 0.849 4.135 5.865 1.00 0.00 C ATOM 375 O PHE A 247 1.708 4.294 5.005 1.00 0.00 O ATOM 376 CB PHE A 247 -1.281 3.492 4.677 1.00 0.00 C ATOM 377 CG PHE A 247 -0.979 3.633 3.214 1.00 0.00 C ATOM 378 CD1 PHE A 247 -0.151 2.728 2.579 1.00 0.00 C ATOM 379 CD2 PHE A 247 -1.551 4.650 2.467 1.00 0.00 C ATOM 380 CE1 PHE A 247 0.103 2.831 1.232 1.00 0.00 C ATOM 381 CE2 PHE A 247 -1.294 4.762 1.121 1.00 0.00 C ATOM 382 CZ PHE A 247 -0.467 3.852 0.503 1.00 0.00 C ATOM 0 H PHE A 247 0.104 6.216 4.591 1.00 0.00 H new ATOM 0 HA PHE A 247 -1.136 4.503 6.550 1.00 0.00 H new ATOM 0 HB2 PHE A 247 -0.982 2.494 4.996 1.00 0.00 H new ATOM 0 HB3 PHE A 247 -2.360 3.560 4.815 1.00 0.00 H new ATOM 0 HD1 PHE A 247 0.302 1.930 3.148 1.00 0.00 H new ATOM 0 HD2 PHE A 247 -2.206 5.362 2.947 1.00 0.00 H new ATOM 0 HE1 PHE A 247 0.748 2.113 0.746 1.00 0.00 H new ATOM 0 HE2 PHE A 247 -1.740 5.563 0.550 1.00 0.00 H new ATOM 0 HZ PHE A 247 -0.265 3.938 -0.554 1.00 0.00 H new ATOM 392 N THR A 248 1.119 3.621 7.064 1.00 0.00 N ATOM 393 CA THR A 248 2.469 3.252 7.462 1.00 0.00 C ATOM 394 C THR A 248 2.628 1.744 7.390 1.00 0.00 C ATOM 395 O THR A 248 1.692 1.008 7.714 1.00 0.00 O ATOM 396 CB THR A 248 2.744 3.718 8.913 1.00 0.00 C ATOM 397 OG1 THR A 248 2.772 5.147 8.976 1.00 0.00 O ATOM 398 CG2 THR A 248 4.052 3.154 9.457 1.00 0.00 C ATOM 0 H THR A 248 0.412 3.451 7.779 1.00 0.00 H new ATOM 0 HA THR A 248 3.177 3.733 6.787 1.00 0.00 H new ATOM 0 HB THR A 248 1.933 3.338 9.534 1.00 0.00 H new ATOM 0 HG1 THR A 248 2.945 5.430 9.898 1.00 0.00 H new ATOM 0 HG21 THR A 248 4.204 3.507 10.477 1.00 0.00 H new ATOM 0 HG22 THR A 248 4.008 2.065 9.453 1.00 0.00 H new ATOM 0 HG23 THR A 248 4.880 3.486 8.831 1.00 0.00 H new ATOM 406 N VAL A 249 3.794 1.278 6.952 1.00 0.00 N ATOM 407 CA VAL A 249 4.015 -0.163 6.862 1.00 0.00 C ATOM 408 C VAL A 249 5.445 -0.551 7.239 1.00 0.00 C ATOM 409 O VAL A 249 6.394 0.190 6.994 1.00 0.00 O ATOM 410 CB VAL A 249 3.759 -0.720 5.445 1.00 0.00 C ATOM 411 CG1 VAL A 249 3.098 -2.088 5.510 1.00 0.00 C ATOM 412 CG2 VAL A 249 2.954 0.240 4.588 1.00 0.00 C ATOM 0 H VAL A 249 4.581 1.858 6.661 1.00 0.00 H new ATOM 0 HA VAL A 249 3.302 -0.592 7.565 1.00 0.00 H new ATOM 0 HB VAL A 249 4.730 -0.834 4.964 1.00 0.00 H new ATOM 0 HG11 VAL A 249 2.928 -2.459 4.499 1.00 0.00 H new ATOM 0 HG12 VAL A 249 3.747 -2.781 6.046 1.00 0.00 H new ATOM 0 HG13 VAL A 249 2.144 -2.007 6.032 1.00 0.00 H new ATOM 0 HG21 VAL A 249 2.799 -0.196 3.601 1.00 0.00 H new ATOM 0 HG22 VAL A 249 1.988 0.425 5.058 1.00 0.00 H new ATOM 0 HG23 VAL A 249 3.495 1.181 4.489 1.00 0.00 H new ATOM 422 N THR A 250 5.578 -1.719 7.843 1.00 0.00 N ATOM 423 CA THR A 250 6.851 -2.398 7.959 1.00 0.00 C ATOM 424 C THR A 250 6.898 -3.500 6.898 1.00 0.00 C ATOM 425 O THR A 250 6.134 -4.476 6.959 1.00 0.00 O ATOM 426 CB THR A 250 7.025 -3.002 9.370 1.00 0.00 C ATOM 427 OG1 THR A 250 7.066 -1.951 10.348 1.00 0.00 O ATOM 428 CG2 THR A 250 8.287 -3.846 9.469 1.00 0.00 C ATOM 0 H THR A 250 4.800 -2.223 8.268 1.00 0.00 H new ATOM 0 HA THR A 250 7.664 -1.689 7.804 1.00 0.00 H new ATOM 0 HB THR A 250 6.172 -3.652 9.562 1.00 0.00 H new ATOM 0 HG1 THR A 250 7.175 -2.339 11.241 1.00 0.00 H new ATOM 0 HG21 THR A 250 8.374 -4.253 10.476 1.00 0.00 H new ATOM 0 HG22 THR A 250 8.235 -4.664 8.750 1.00 0.00 H new ATOM 0 HG23 THR A 250 9.157 -3.226 9.252 1.00 0.00 H new ATOM 436 N LEU A 251 7.752 -3.338 5.901 1.00 0.00 N ATOM 437 CA LEU A 251 7.743 -4.238 4.770 1.00 0.00 C ATOM 438 C LEU A 251 9.041 -5.029 4.746 1.00 0.00 C ATOM 439 O LEU A 251 9.971 -4.727 5.490 1.00 0.00 O ATOM 440 CB LEU A 251 7.551 -3.452 3.460 1.00 0.00 C ATOM 441 CG LEU A 251 6.376 -2.466 3.434 1.00 0.00 C ATOM 442 CD1 LEU A 251 6.814 -1.077 3.875 1.00 0.00 C ATOM 443 CD2 LEU A 251 5.766 -2.404 2.050 1.00 0.00 C ATOM 0 H LEU A 251 8.452 -2.598 5.855 1.00 0.00 H new ATOM 0 HA LEU A 251 6.909 -4.933 4.865 1.00 0.00 H new ATOM 0 HB2 LEU A 251 8.468 -2.900 3.253 1.00 0.00 H new ATOM 0 HB3 LEU A 251 7.419 -4.166 2.647 1.00 0.00 H new ATOM 0 HG LEU A 251 5.624 -2.825 4.136 1.00 0.00 H new ATOM 0 HD11 LEU A 251 5.960 -0.400 3.846 1.00 0.00 H new ATOM 0 HD12 LEU A 251 7.206 -1.124 4.891 1.00 0.00 H new ATOM 0 HD13 LEU A 251 7.591 -0.710 3.204 1.00 0.00 H new ATOM 0 HD21 LEU A 251 4.934 -1.700 2.050 1.00 0.00 H new ATOM 0 HD22 LEU A 251 6.520 -2.075 1.335 1.00 0.00 H new ATOM 0 HD23 LEU A 251 5.404 -3.393 1.767 1.00 0.00 H new ATOM 455 N THR A 252 9.095 -6.050 3.921 1.00 0.00 N ATOM 456 CA THR A 252 10.285 -6.860 3.797 1.00 0.00 C ATOM 457 C THR A 252 10.944 -6.640 2.433 1.00 0.00 C ATOM 458 O THR A 252 10.261 -6.559 1.408 1.00 0.00 O ATOM 459 CB THR A 252 9.937 -8.341 3.969 1.00 0.00 C ATOM 460 OG1 THR A 252 8.515 -8.519 3.839 1.00 0.00 O ATOM 461 CG2 THR A 252 10.402 -8.859 5.329 1.00 0.00 C ATOM 0 H THR A 252 8.322 -6.340 3.322 1.00 0.00 H new ATOM 0 HA THR A 252 10.985 -6.563 4.578 1.00 0.00 H new ATOM 0 HB THR A 252 10.451 -8.910 3.194 1.00 0.00 H new ATOM 0 HG1 THR A 252 8.293 -9.467 3.947 1.00 0.00 H new ATOM 0 HG21 THR A 252 10.142 -9.913 5.425 1.00 0.00 H new ATOM 0 HG22 THR A 252 11.483 -8.742 5.413 1.00 0.00 H new ATOM 0 HG23 THR A 252 9.913 -8.291 6.121 1.00 0.00 H new ATOM 469 N GLY A 253 12.265 -6.551 2.422 1.00 0.00 N ATOM 470 CA GLY A 253 12.985 -6.248 1.208 1.00 0.00 C ATOM 471 C GLY A 253 14.153 -7.183 1.017 1.00 0.00 C ATOM 472 O GLY A 253 14.059 -8.369 1.339 1.00 0.00 O ATOM 0 H GLY A 253 12.855 -6.685 3.243 1.00 0.00 H new ATOM 0 HA2 GLY A 253 12.312 -6.324 0.354 1.00 0.00 H new ATOM 0 HA3 GLY A 253 13.342 -5.219 1.241 1.00 0.00 H new ATOM 476 N ALA A 254 15.253 -6.662 0.502 1.00 0.00 N ATOM 477 CA ALA A 254 16.425 -7.482 0.259 1.00 0.00 C ATOM 478 C ALA A 254 17.516 -7.199 1.273 1.00 0.00 C ATOM 479 O ALA A 254 17.330 -6.399 2.187 1.00 0.00 O ATOM 480 CB ALA A 254 16.935 -7.283 -1.161 1.00 0.00 C ATOM 0 H ALA A 254 15.358 -5.680 0.246 1.00 0.00 H new ATOM 0 HA ALA A 254 16.133 -8.526 0.373 1.00 0.00 H new ATOM 0 HB1 ALA A 254 17.814 -7.907 -1.323 1.00 0.00 H new ATOM 0 HB2 ALA A 254 16.156 -7.563 -1.870 1.00 0.00 H new ATOM 0 HB3 ALA A 254 17.201 -6.236 -1.309 1.00 0.00 H new ATOM 486 N THR A 255 18.642 -7.870 1.099 1.00 0.00 N ATOM 487 CA THR A 255 19.752 -7.788 2.030 1.00 0.00 C ATOM 488 C THR A 255 20.445 -6.420 1.956 1.00 0.00 C ATOM 489 O THR A 255 20.008 -5.526 1.223 1.00 0.00 O ATOM 490 CB THR A 255 20.763 -8.918 1.725 1.00 0.00 C ATOM 491 OG1 THR A 255 20.053 -10.033 1.167 1.00 0.00 O ATOM 492 CG2 THR A 255 21.499 -9.393 2.988 1.00 0.00 C ATOM 0 H THR A 255 18.811 -8.488 0.306 1.00 0.00 H new ATOM 0 HA THR A 255 19.364 -7.907 3.042 1.00 0.00 H new ATOM 0 HB THR A 255 21.503 -8.525 1.028 1.00 0.00 H new ATOM 0 HG1 THR A 255 20.684 -10.756 0.968 1.00 0.00 H new ATOM 0 HG21 THR A 255 22.198 -10.187 2.725 1.00 0.00 H new ATOM 0 HG22 THR A 255 22.046 -8.558 3.426 1.00 0.00 H new ATOM 0 HG23 THR A 255 20.775 -9.772 3.710 1.00 0.00 H new ATOM 500 N ALA A 256 21.511 -6.263 2.732 1.00 0.00 N ATOM 501 CA ALA A 256 22.280 -5.027 2.783 1.00 0.00 C ATOM 502 C ALA A 256 22.931 -4.711 1.436 1.00 0.00 C ATOM 503 O ALA A 256 22.705 -5.416 0.446 1.00 0.00 O ATOM 504 CB ALA A 256 23.332 -5.128 3.881 1.00 0.00 C ATOM 0 H ALA A 256 21.868 -6.995 3.347 1.00 0.00 H new ATOM 0 HA ALA A 256 21.599 -4.207 3.009 1.00 0.00 H new ATOM 0 HB1 ALA A 256 23.908 -4.203 3.919 1.00 0.00 H new ATOM 0 HB2 ALA A 256 22.842 -5.290 4.841 1.00 0.00 H new ATOM 0 HB3 ALA A 256 24.000 -5.963 3.669 1.00 0.00 H new ATOM 510 N SER A 257 23.715 -3.628 1.410 1.00 0.00 N ATOM 511 CA SER A 257 24.426 -3.181 0.214 1.00 0.00 C ATOM 512 C SER A 257 23.491 -2.419 -0.730 1.00 0.00 C ATOM 513 O SER A 257 23.829 -2.169 -1.890 1.00 0.00 O ATOM 514 CB SER A 257 25.098 -4.368 -0.497 1.00 0.00 C ATOM 515 OG SER A 257 26.001 -3.945 -1.506 1.00 0.00 O ATOM 0 H SER A 257 23.873 -3.035 2.225 1.00 0.00 H new ATOM 0 HA SER A 257 25.211 -2.491 0.523 1.00 0.00 H new ATOM 0 HB2 SER A 257 25.632 -4.974 0.235 1.00 0.00 H new ATOM 0 HB3 SER A 257 24.332 -5.005 -0.940 1.00 0.00 H new ATOM 0 HG SER A 257 25.608 -3.199 -2.005 1.00 0.00 H new ATOM 521 N VAL A 258 22.311 -2.056 -0.229 1.00 0.00 N ATOM 522 CA VAL A 258 21.411 -1.168 -0.948 1.00 0.00 C ATOM 523 C VAL A 258 20.899 -0.081 -0.001 1.00 0.00 C ATOM 524 O VAL A 258 19.868 -0.238 0.674 1.00 0.00 O ATOM 525 CB VAL A 258 20.218 -1.926 -1.575 1.00 0.00 C ATOM 526 CG1 VAL A 258 19.268 -0.964 -2.277 1.00 0.00 C ATOM 527 CG2 VAL A 258 20.706 -2.986 -2.550 1.00 0.00 C ATOM 0 H VAL A 258 21.959 -2.367 0.676 1.00 0.00 H new ATOM 0 HA VAL A 258 21.974 -0.717 -1.765 1.00 0.00 H new ATOM 0 HB VAL A 258 19.675 -2.418 -0.768 1.00 0.00 H new ATOM 0 HG11 VAL A 258 18.438 -1.523 -2.709 1.00 0.00 H new ATOM 0 HG12 VAL A 258 18.883 -0.242 -1.557 1.00 0.00 H new ATOM 0 HG13 VAL A 258 19.802 -0.438 -3.068 1.00 0.00 H new ATOM 0 HG21 VAL A 258 19.850 -3.507 -2.979 1.00 0.00 H new ATOM 0 HG22 VAL A 258 21.279 -2.511 -3.347 1.00 0.00 H new ATOM 0 HG23 VAL A 258 21.339 -3.700 -2.024 1.00 0.00 H new ATOM 537 N THR A 259 21.641 1.016 0.058 1.00 0.00 N ATOM 538 CA THR A 259 21.296 2.124 0.926 1.00 0.00 C ATOM 539 C THR A 259 20.198 2.973 0.301 1.00 0.00 C ATOM 540 O THR A 259 20.460 3.827 -0.552 1.00 0.00 O ATOM 541 CB THR A 259 22.522 3.004 1.221 1.00 0.00 C ATOM 542 OG1 THR A 259 23.633 2.176 1.594 1.00 0.00 O ATOM 543 CG2 THR A 259 22.220 3.986 2.345 1.00 0.00 C ATOM 0 H THR A 259 22.490 1.159 -0.490 1.00 0.00 H new ATOM 0 HA THR A 259 20.935 1.704 1.865 1.00 0.00 H new ATOM 0 HB THR A 259 22.769 3.567 0.321 1.00 0.00 H new ATOM 0 HG1 THR A 259 24.413 2.739 1.780 1.00 0.00 H new ATOM 0 HG21 THR A 259 23.100 4.599 2.539 1.00 0.00 H new ATOM 0 HG22 THR A 259 21.388 4.627 2.054 1.00 0.00 H new ATOM 0 HG23 THR A 259 21.956 3.435 3.248 1.00 0.00 H new ATOM 551 N GLY A 260 18.970 2.719 0.716 1.00 0.00 N ATOM 552 CA GLY A 260 17.843 3.466 0.211 1.00 0.00 C ATOM 553 C GLY A 260 17.386 2.987 -1.148 1.00 0.00 C ATOM 554 O GLY A 260 17.927 3.401 -2.175 1.00 0.00 O ATOM 0 H GLY A 260 18.733 2.001 1.401 1.00 0.00 H new ATOM 0 HA2 GLY A 260 17.015 3.388 0.916 1.00 0.00 H new ATOM 0 HA3 GLY A 260 18.110 4.521 0.149 1.00 0.00 H new ATOM 558 N PHE A 261 16.417 2.085 -1.151 1.00 0.00 N ATOM 559 CA PHE A 261 15.727 1.703 -2.377 1.00 0.00 C ATOM 560 C PHE A 261 15.185 2.940 -3.093 1.00 0.00 C ATOM 561 O PHE A 261 15.276 3.061 -4.312 1.00 0.00 O ATOM 562 CB PHE A 261 14.541 0.765 -2.096 1.00 0.00 C ATOM 563 CG PHE A 261 14.888 -0.695 -2.087 1.00 0.00 C ATOM 564 CD1 PHE A 261 14.588 -1.486 -0.992 1.00 0.00 C ATOM 565 CD2 PHE A 261 15.493 -1.280 -3.188 1.00 0.00 C ATOM 566 CE1 PHE A 261 14.887 -2.836 -0.995 1.00 0.00 C ATOM 567 CE2 PHE A 261 15.799 -2.627 -3.194 1.00 0.00 C ATOM 568 CZ PHE A 261 15.493 -3.406 -2.097 1.00 0.00 C ATOM 0 H PHE A 261 16.088 1.601 -0.315 1.00 0.00 H new ATOM 0 HA PHE A 261 16.458 1.186 -2.999 1.00 0.00 H new ATOM 0 HB2 PHE A 261 14.107 1.028 -1.131 1.00 0.00 H new ATOM 0 HB3 PHE A 261 13.772 0.938 -2.849 1.00 0.00 H new ATOM 0 HD1 PHE A 261 14.116 -1.045 -0.127 1.00 0.00 H new ATOM 0 HD2 PHE A 261 15.728 -0.676 -4.052 1.00 0.00 H new ATOM 0 HE1 PHE A 261 14.647 -3.444 -0.136 1.00 0.00 H new ATOM 0 HE2 PHE A 261 16.277 -3.070 -4.056 1.00 0.00 H new ATOM 0 HZ PHE A 261 15.727 -4.460 -2.100 1.00 0.00 H new ATOM 578 N LEU A 262 14.607 3.846 -2.315 1.00 0.00 N ATOM 579 CA LEU A 262 13.981 5.047 -2.851 1.00 0.00 C ATOM 580 C LEU A 262 13.825 6.089 -1.749 1.00 0.00 C ATOM 581 O LEU A 262 14.100 5.801 -0.584 1.00 0.00 O ATOM 582 CB LEU A 262 12.627 4.692 -3.485 1.00 0.00 C ATOM 583 CG LEU A 262 11.637 3.932 -2.592 1.00 0.00 C ATOM 584 CD1 LEU A 262 10.896 4.877 -1.658 1.00 0.00 C ATOM 585 CD2 LEU A 262 10.653 3.147 -3.443 1.00 0.00 C ATOM 0 H LEU A 262 14.559 3.770 -1.299 1.00 0.00 H new ATOM 0 HA LEU A 262 14.615 5.473 -3.628 1.00 0.00 H new ATOM 0 HB2 LEU A 262 12.151 5.615 -3.815 1.00 0.00 H new ATOM 0 HB3 LEU A 262 12.813 4.093 -4.377 1.00 0.00 H new ATOM 0 HG LEU A 262 12.206 3.234 -1.978 1.00 0.00 H new ATOM 0 HD11 LEU A 262 10.203 4.307 -1.039 1.00 0.00 H new ATOM 0 HD12 LEU A 262 11.613 5.393 -1.019 1.00 0.00 H new ATOM 0 HD13 LEU A 262 10.341 5.608 -2.246 1.00 0.00 H new ATOM 0 HD21 LEU A 262 9.957 2.613 -2.796 1.00 0.00 H new ATOM 0 HD22 LEU A 262 10.099 3.832 -4.084 1.00 0.00 H new ATOM 0 HD23 LEU A 262 11.196 2.431 -4.060 1.00 0.00 H new ATOM 597 N LYS A 263 13.400 7.293 -2.119 1.00 0.00 N ATOM 598 CA LYS A 263 13.238 8.382 -1.169 1.00 0.00 C ATOM 599 C LYS A 263 11.867 9.036 -1.298 1.00 0.00 C ATOM 600 O LYS A 263 10.970 8.504 -1.952 1.00 0.00 O ATOM 601 CB LYS A 263 14.326 9.427 -1.388 1.00 0.00 C ATOM 602 CG LYS A 263 15.717 8.895 -1.139 1.00 0.00 C ATOM 603 CD LYS A 263 16.777 9.949 -1.420 1.00 0.00 C ATOM 604 CE LYS A 263 18.174 9.348 -1.464 1.00 0.00 C ATOM 605 NZ LYS A 263 18.649 8.919 -0.122 1.00 0.00 N1+ ATOM 0 H LYS A 263 13.160 7.538 -3.080 1.00 0.00 H new ATOM 0 HA LYS A 263 13.322 7.966 -0.165 1.00 0.00 H new ATOM 0 HB2 LYS A 263 14.263 9.799 -2.411 1.00 0.00 H new ATOM 0 HB3 LYS A 263 14.145 10.276 -0.728 1.00 0.00 H new ATOM 0 HG2 LYS A 263 15.800 8.561 -0.105 1.00 0.00 H new ATOM 0 HG3 LYS A 263 15.893 8.024 -1.770 1.00 0.00 H new ATOM 0 HD2 LYS A 263 16.561 10.437 -2.370 1.00 0.00 H new ATOM 0 HD3 LYS A 263 16.737 10.719 -0.650 1.00 0.00 H new ATOM 0 HE2 LYS A 263 18.177 8.492 -2.138 1.00 0.00 H new ATOM 0 HE3 LYS A 263 18.869 10.080 -1.875 1.00 0.00 H new ATOM 0 HZ1 LYS A 263 19.398 8.206 -0.231 1.00 0.00 H new ATOM 0 HZ2 LYS A 263 19.025 9.741 0.392 1.00 0.00 H new ATOM 0 HZ3 LYS A 263 17.856 8.510 0.412 1.00 0.00 H new ATOM 619 N ALA A 264 11.723 10.197 -0.672 1.00 0.00 N ATOM 620 CA ALA A 264 10.478 10.941 -0.689 1.00 0.00 C ATOM 621 C ALA A 264 10.090 11.329 -2.104 1.00 0.00 C ATOM 622 O ALA A 264 10.821 12.044 -2.792 1.00 0.00 O ATOM 623 CB ALA A 264 10.602 12.180 0.179 1.00 0.00 C ATOM 0 H ALA A 264 12.468 10.646 -0.139 1.00 0.00 H new ATOM 0 HA ALA A 264 9.693 10.300 -0.289 1.00 0.00 H new ATOM 0 HB1 ALA A 264 9.663 12.733 0.160 1.00 0.00 H new ATOM 0 HB2 ALA A 264 10.829 11.885 1.203 1.00 0.00 H new ATOM 0 HB3 ALA A 264 11.403 12.813 -0.203 1.00 0.00 H new ATOM 629 N GLY A 265 8.951 10.834 -2.540 1.00 0.00 N ATOM 630 CA GLY A 265 8.436 11.191 -3.846 1.00 0.00 C ATOM 631 C GLY A 265 8.498 10.042 -4.824 1.00 0.00 C ATOM 632 O GLY A 265 7.850 10.073 -5.872 1.00 0.00 O ATOM 0 H GLY A 265 8.366 10.186 -2.012 1.00 0.00 H new ATOM 0 HA2 GLY A 265 7.403 11.525 -3.747 1.00 0.00 H new ATOM 0 HA3 GLY A 265 9.006 12.032 -4.241 1.00 0.00 H new ATOM 636 N ASP A 266 9.278 9.024 -4.488 1.00 0.00 N ATOM 637 CA ASP A 266 9.388 7.846 -5.335 1.00 0.00 C ATOM 638 C ASP A 266 8.141 6.994 -5.194 1.00 0.00 C ATOM 639 O ASP A 266 7.652 6.762 -4.082 1.00 0.00 O ATOM 640 CB ASP A 266 10.627 7.023 -4.983 1.00 0.00 C ATOM 641 CG ASP A 266 11.920 7.688 -5.407 1.00 0.00 C ATOM 642 OD1 ASP A 266 12.590 8.304 -4.551 1.00 0.00 O ATOM 643 OD2 ASP A 266 12.281 7.597 -6.598 1.00 0.00 O1- ATOM 0 H ASP A 266 9.842 8.990 -3.638 1.00 0.00 H new ATOM 0 HA ASP A 266 9.487 8.178 -6.369 1.00 0.00 H new ATOM 0 HB2 ASP A 266 10.649 6.852 -3.907 1.00 0.00 H new ATOM 0 HB3 ASP A 266 10.554 6.045 -5.460 1.00 0.00 H new ATOM 648 N GLN A 267 7.616 6.536 -6.315 1.00 0.00 N ATOM 649 CA GLN A 267 6.379 5.785 -6.306 1.00 0.00 C ATOM 650 C GLN A 267 6.632 4.285 -6.350 1.00 0.00 C ATOM 651 O GLN A 267 7.633 3.811 -6.895 1.00 0.00 O ATOM 652 CB GLN A 267 5.482 6.183 -7.476 1.00 0.00 C ATOM 653 CG GLN A 267 5.160 7.667 -7.537 1.00 0.00 C ATOM 654 CD GLN A 267 4.001 7.961 -8.470 1.00 0.00 C ATOM 655 OE1 GLN A 267 4.184 8.162 -9.671 1.00 0.00 O ATOM 656 NE2 GLN A 267 2.800 8.006 -7.919 1.00 0.00 N ATOM 0 H GLN A 267 8.026 6.671 -7.239 1.00 0.00 H new ATOM 0 HA GLN A 267 5.873 6.025 -5.371 1.00 0.00 H new ATOM 0 HB2 GLN A 267 5.967 5.889 -8.407 1.00 0.00 H new ATOM 0 HB3 GLN A 267 4.549 5.623 -7.411 1.00 0.00 H new ATOM 0 HG2 GLN A 267 4.920 8.027 -6.537 1.00 0.00 H new ATOM 0 HG3 GLN A 267 6.041 8.215 -7.870 1.00 0.00 H new ATOM 0 HE21 GLN A 267 2.691 7.833 -6.920 1.00 0.00 H new ATOM 0 HE22 GLN A 267 1.983 8.213 -8.493 1.00 0.00 H new ATOM 665 N VAL A 268 5.698 3.554 -5.782 1.00 0.00 N ATOM 666 CA VAL A 268 5.729 2.103 -5.768 1.00 0.00 C ATOM 667 C VAL A 268 4.429 1.581 -6.348 1.00 0.00 C ATOM 668 O VAL A 268 3.522 2.355 -6.600 1.00 0.00 O ATOM 669 CB VAL A 268 5.883 1.535 -4.330 1.00 0.00 C ATOM 670 CG1 VAL A 268 7.337 1.555 -3.889 1.00 0.00 C ATOM 671 CG2 VAL A 268 5.035 2.332 -3.342 1.00 0.00 C ATOM 0 H VAL A 268 4.886 3.952 -5.311 1.00 0.00 H new ATOM 0 HA VAL A 268 6.589 1.783 -6.356 1.00 0.00 H new ATOM 0 HB VAL A 268 5.536 0.502 -4.344 1.00 0.00 H new ATOM 0 HG11 VAL A 268 7.417 1.152 -2.879 1.00 0.00 H new ATOM 0 HG12 VAL A 268 7.932 0.947 -4.570 1.00 0.00 H new ATOM 0 HG13 VAL A 268 7.707 2.580 -3.901 1.00 0.00 H new ATOM 0 HG21 VAL A 268 5.157 1.918 -2.341 1.00 0.00 H new ATOM 0 HG22 VAL A 268 5.355 3.374 -3.345 1.00 0.00 H new ATOM 0 HG23 VAL A 268 3.986 2.274 -3.633 1.00 0.00 H new ATOM 681 N LYS A 269 4.336 0.289 -6.560 1.00 0.00 N ATOM 682 CA LYS A 269 3.059 -0.321 -6.886 1.00 0.00 C ATOM 683 C LYS A 269 3.005 -1.706 -6.259 1.00 0.00 C ATOM 684 O LYS A 269 3.965 -2.464 -6.345 1.00 0.00 O ATOM 685 CB LYS A 269 2.797 -0.384 -8.405 1.00 0.00 C ATOM 686 CG LYS A 269 3.542 -1.477 -9.165 1.00 0.00 C ATOM 687 CD LYS A 269 4.938 -1.047 -9.578 1.00 0.00 C ATOM 688 CE LYS A 269 5.540 -2.035 -10.571 1.00 0.00 C ATOM 689 NZ LYS A 269 6.809 -1.543 -11.171 1.00 0.00 N1+ ATOM 0 H LYS A 269 5.121 -0.360 -6.514 1.00 0.00 H new ATOM 0 HA LYS A 269 2.266 0.304 -6.476 1.00 0.00 H new ATOM 0 HB2 LYS A 269 1.728 -0.522 -8.564 1.00 0.00 H new ATOM 0 HB3 LYS A 269 3.062 0.580 -8.840 1.00 0.00 H new ATOM 0 HG2 LYS A 269 3.609 -2.368 -8.541 1.00 0.00 H new ATOM 0 HG3 LYS A 269 2.972 -1.752 -10.053 1.00 0.00 H new ATOM 0 HD2 LYS A 269 4.900 -0.054 -10.025 1.00 0.00 H new ATOM 0 HD3 LYS A 269 5.576 -0.976 -8.697 1.00 0.00 H new ATOM 0 HE2 LYS A 269 5.725 -2.984 -10.067 1.00 0.00 H new ATOM 0 HE3 LYS A 269 4.819 -2.231 -11.365 1.00 0.00 H new ATOM 0 HZ1 LYS A 269 7.237 -2.297 -11.745 1.00 0.00 H new ATOM 0 HZ2 LYS A 269 6.611 -0.719 -11.773 1.00 0.00 H new ATOM 0 HZ3 LYS A 269 7.467 -1.269 -10.414 1.00 0.00 H new ATOM 703 N PHE A 270 1.908 -2.030 -5.603 1.00 0.00 N ATOM 704 CA PHE A 270 1.818 -3.288 -4.882 1.00 0.00 C ATOM 705 C PHE A 270 0.416 -3.857 -4.982 1.00 0.00 C ATOM 706 O PHE A 270 -0.512 -3.171 -5.418 1.00 0.00 O ATOM 707 CB PHE A 270 2.240 -3.116 -3.414 1.00 0.00 C ATOM 708 CG PHE A 270 1.351 -2.221 -2.591 1.00 0.00 C ATOM 709 CD1 PHE A 270 0.339 -2.760 -1.810 1.00 0.00 C ATOM 710 CD2 PHE A 270 1.540 -0.849 -2.582 1.00 0.00 C ATOM 711 CE1 PHE A 270 -0.467 -1.945 -1.037 1.00 0.00 C ATOM 712 CE2 PHE A 270 0.735 -0.031 -1.813 1.00 0.00 C ATOM 713 CZ PHE A 270 -0.268 -0.579 -1.040 1.00 0.00 C ATOM 0 H PHE A 270 1.073 -1.447 -5.553 1.00 0.00 H new ATOM 0 HA PHE A 270 2.508 -3.995 -5.343 1.00 0.00 H new ATOM 0 HB2 PHE A 270 2.273 -4.099 -2.945 1.00 0.00 H new ATOM 0 HB3 PHE A 270 3.254 -2.717 -3.389 1.00 0.00 H new ATOM 0 HD1 PHE A 270 0.179 -3.828 -1.806 1.00 0.00 H new ATOM 0 HD2 PHE A 270 2.325 -0.414 -3.183 1.00 0.00 H new ATOM 0 HE1 PHE A 270 -1.251 -2.376 -0.432 1.00 0.00 H new ATOM 0 HE2 PHE A 270 0.891 1.038 -1.817 1.00 0.00 H new ATOM 0 HZ PHE A 270 -0.897 0.060 -0.438 1.00 0.00 H new ATOM 723 N THR A 271 0.263 -5.108 -4.585 1.00 0.00 N ATOM 724 CA THR A 271 -1.009 -5.781 -4.729 1.00 0.00 C ATOM 725 C THR A 271 -1.400 -6.521 -3.452 1.00 0.00 C ATOM 726 O THR A 271 -0.640 -7.339 -2.926 1.00 0.00 O ATOM 727 CB THR A 271 -1.007 -6.747 -5.943 1.00 0.00 C ATOM 728 OG1 THR A 271 -2.323 -7.278 -6.150 1.00 0.00 O ATOM 729 CG2 THR A 271 -0.013 -7.901 -5.764 1.00 0.00 C ATOM 0 H THR A 271 1.000 -5.673 -4.163 1.00 0.00 H new ATOM 0 HA THR A 271 -1.758 -5.011 -4.913 1.00 0.00 H new ATOM 0 HB THR A 271 -0.695 -6.170 -6.814 1.00 0.00 H new ATOM 0 HG1 THR A 271 -2.313 -7.885 -6.919 1.00 0.00 H new ATOM 0 HG21 THR A 271 -0.048 -8.550 -6.639 1.00 0.00 H new ATOM 0 HG22 THR A 271 0.994 -7.499 -5.650 1.00 0.00 H new ATOM 0 HG23 THR A 271 -0.278 -8.475 -4.876 1.00 0.00 H new ATOM 737 N ASN A 272 -2.581 -6.181 -2.949 1.00 0.00 N ATOM 738 CA ASN A 272 -3.190 -6.873 -1.813 1.00 0.00 C ATOM 739 C ASN A 272 -4.009 -8.041 -2.349 1.00 0.00 C ATOM 740 O ASN A 272 -5.040 -7.845 -2.989 1.00 0.00 O ATOM 741 CB ASN A 272 -4.091 -5.894 -1.042 1.00 0.00 C ATOM 742 CG ASN A 272 -4.931 -6.545 0.051 1.00 0.00 C ATOM 743 OD1 ASN A 272 -6.082 -6.163 0.260 1.00 0.00 O ATOM 744 ND2 ASN A 272 -4.365 -7.489 0.784 1.00 0.00 N ATOM 0 H ASN A 272 -3.147 -5.416 -3.317 1.00 0.00 H new ATOM 0 HA ASN A 272 -2.423 -7.245 -1.133 1.00 0.00 H new ATOM 0 HB2 ASN A 272 -3.467 -5.121 -0.593 1.00 0.00 H new ATOM 0 HB3 ASN A 272 -4.756 -5.397 -1.748 1.00 0.00 H new ATOM 0 HD21 ASN A 272 -4.885 -7.922 1.548 1.00 0.00 H new ATOM 0 HD22 ASN A 272 -3.409 -7.784 0.586 1.00 0.00 H new ATOM 1061 N SER A 292 -3.981 -4.413 -7.810 1.00 0.00 N ATOM 1062 CA SER A 292 -2.671 -3.791 -7.754 1.00 0.00 C ATOM 1063 C SER A 292 -2.790 -2.297 -8.063 1.00 0.00 C ATOM 1064 O SER A 292 -3.550 -1.908 -8.953 1.00 0.00 O ATOM 1065 CB SER A 292 -1.726 -4.474 -8.747 1.00 0.00 C ATOM 1066 OG SER A 292 -2.324 -4.589 -10.031 1.00 0.00 O ATOM 0 HA SER A 292 -2.261 -3.906 -6.751 1.00 0.00 H new ATOM 0 HB2 SER A 292 -0.801 -3.903 -8.824 1.00 0.00 H new ATOM 0 HB3 SER A 292 -1.460 -5.464 -8.377 1.00 0.00 H new ATOM 0 HG SER A 292 -3.298 -4.526 -9.945 1.00 0.00 H new ATOM 1072 N PHE A 293 -2.062 -1.460 -7.329 1.00 0.00 N ATOM 1073 CA PHE A 293 -2.131 -0.019 -7.539 1.00 0.00 C ATOM 1074 C PHE A 293 -0.826 0.656 -7.139 1.00 0.00 C ATOM 1075 O PHE A 293 -0.029 0.097 -6.379 1.00 0.00 O ATOM 1076 CB PHE A 293 -3.311 0.590 -6.771 1.00 0.00 C ATOM 1077 CG PHE A 293 -3.314 0.318 -5.290 1.00 0.00 C ATOM 1078 CD1 PHE A 293 -3.868 -0.850 -4.786 1.00 0.00 C ATOM 1079 CD2 PHE A 293 -2.780 1.238 -4.402 1.00 0.00 C ATOM 1080 CE1 PHE A 293 -3.887 -1.094 -3.427 1.00 0.00 C ATOM 1081 CE2 PHE A 293 -2.794 0.998 -3.041 1.00 0.00 C ATOM 1082 CZ PHE A 293 -3.348 -0.170 -2.553 1.00 0.00 C ATOM 0 H PHE A 293 -1.423 -1.752 -6.590 1.00 0.00 H new ATOM 0 HA PHE A 293 -2.289 0.155 -8.603 1.00 0.00 H new ATOM 0 HB2 PHE A 293 -3.309 1.669 -6.927 1.00 0.00 H new ATOM 0 HB3 PHE A 293 -4.239 0.208 -7.197 1.00 0.00 H new ATOM 0 HD1 PHE A 293 -4.289 -1.577 -5.465 1.00 0.00 H new ATOM 0 HD2 PHE A 293 -2.348 2.154 -4.778 1.00 0.00 H new ATOM 0 HE1 PHE A 293 -4.323 -2.006 -3.048 1.00 0.00 H new ATOM 0 HE2 PHE A 293 -2.373 1.722 -2.360 1.00 0.00 H new ATOM 0 HZ PHE A 293 -3.360 -0.360 -1.490 1.00 0.00 H new ATOM 1092 N THR A 294 -0.621 1.856 -7.662 1.00 0.00 N ATOM 1093 CA THR A 294 0.611 2.598 -7.449 1.00 0.00 C ATOM 1094 C THR A 294 0.504 3.500 -6.215 1.00 0.00 C ATOM 1095 O THR A 294 -0.450 4.265 -6.075 1.00 0.00 O ATOM 1096 CB THR A 294 0.945 3.447 -8.698 1.00 0.00 C ATOM 1097 OG1 THR A 294 1.118 2.589 -9.837 1.00 0.00 O ATOM 1098 CG2 THR A 294 2.200 4.302 -8.506 1.00 0.00 C ATOM 0 H THR A 294 -1.303 2.341 -8.245 1.00 0.00 H new ATOM 0 HA THR A 294 1.413 1.880 -7.279 1.00 0.00 H new ATOM 0 HB THR A 294 0.108 4.126 -8.860 1.00 0.00 H new ATOM 0 HG1 THR A 294 1.328 3.131 -10.626 1.00 0.00 H new ATOM 0 HG21 THR A 294 2.390 4.878 -9.412 1.00 0.00 H new ATOM 0 HG22 THR A 294 2.052 4.982 -7.667 1.00 0.00 H new ATOM 0 HG23 THR A 294 3.053 3.655 -8.302 1.00 0.00 H new ATOM 1106 N ALA A 295 1.488 3.406 -5.329 1.00 0.00 N ATOM 1107 CA ALA A 295 1.498 4.187 -4.104 1.00 0.00 C ATOM 1108 C ALA A 295 2.737 5.078 -4.058 1.00 0.00 C ATOM 1109 O ALA A 295 3.529 5.083 -4.999 1.00 0.00 O ATOM 1110 CB ALA A 295 1.457 3.248 -2.918 1.00 0.00 C ATOM 0 H ALA A 295 2.294 2.791 -5.440 1.00 0.00 H new ATOM 0 HA ALA A 295 0.622 4.834 -4.071 1.00 0.00 H new ATOM 0 HB1 ALA A 295 1.464 3.827 -1.995 1.00 0.00 H new ATOM 0 HB2 ALA A 295 0.549 2.646 -2.962 1.00 0.00 H new ATOM 0 HB3 ALA A 295 2.328 2.593 -2.942 1.00 0.00 H new ATOM 1116 N THR A 296 2.913 5.842 -2.983 1.00 0.00 N ATOM 1117 CA THR A 296 4.056 6.744 -2.895 1.00 0.00 C ATOM 1118 C THR A 296 4.631 6.823 -1.482 1.00 0.00 C ATOM 1119 O THR A 296 3.913 7.063 -0.506 1.00 0.00 O ATOM 1120 CB THR A 296 3.673 8.161 -3.397 1.00 0.00 C ATOM 1121 OG1 THR A 296 3.259 8.078 -4.769 1.00 0.00 O ATOM 1122 CG2 THR A 296 4.830 9.163 -3.266 1.00 0.00 C ATOM 0 H THR A 296 2.291 5.855 -2.175 1.00 0.00 H new ATOM 0 HA THR A 296 4.833 6.332 -3.538 1.00 0.00 H new ATOM 0 HB THR A 296 2.859 8.526 -2.771 1.00 0.00 H new ATOM 0 HG1 THR A 296 3.014 8.971 -5.091 1.00 0.00 H new ATOM 0 HG21 THR A 296 4.509 10.139 -3.631 1.00 0.00 H new ATOM 0 HG22 THR A 296 5.123 9.246 -2.219 1.00 0.00 H new ATOM 0 HG23 THR A 296 5.680 8.817 -3.854 1.00 0.00 H new ATOM 1130 N VAL A 297 5.941 6.619 -1.403 1.00 0.00 N ATOM 1131 CA VAL A 297 6.660 6.659 -0.139 1.00 0.00 C ATOM 1132 C VAL A 297 7.242 8.054 0.088 1.00 0.00 C ATOM 1133 O VAL A 297 7.613 8.744 -0.864 1.00 0.00 O ATOM 1134 CB VAL A 297 7.792 5.610 -0.113 1.00 0.00 C ATOM 1135 CG1 VAL A 297 8.460 5.564 1.251 1.00 0.00 C ATOM 1136 CG2 VAL A 297 7.261 4.235 -0.496 1.00 0.00 C ATOM 0 H VAL A 297 6.531 6.422 -2.211 1.00 0.00 H new ATOM 0 HA VAL A 297 5.956 6.426 0.660 1.00 0.00 H new ATOM 0 HB VAL A 297 8.541 5.906 -0.847 1.00 0.00 H new ATOM 0 HG11 VAL A 297 9.254 4.817 1.242 1.00 0.00 H new ATOM 0 HG12 VAL A 297 8.884 6.541 1.482 1.00 0.00 H new ATOM 0 HG13 VAL A 297 7.722 5.301 2.009 1.00 0.00 H new ATOM 0 HG21 VAL A 297 8.075 3.511 -0.471 1.00 0.00 H new ATOM 0 HG22 VAL A 297 6.487 3.935 0.210 1.00 0.00 H new ATOM 0 HG23 VAL A 297 6.841 4.274 -1.501 1.00 0.00 H new ATOM 1146 N THR A 298 7.321 8.466 1.345 1.00 0.00 N ATOM 1147 CA THR A 298 7.721 9.825 1.671 1.00 0.00 C ATOM 1148 C THR A 298 9.110 9.880 2.325 1.00 0.00 C ATOM 1149 O THR A 298 9.475 10.895 2.923 1.00 0.00 O ATOM 1150 CB THR A 298 6.675 10.482 2.605 1.00 0.00 C ATOM 1151 OG1 THR A 298 6.968 11.873 2.797 1.00 0.00 O ATOM 1152 CG2 THR A 298 6.630 9.778 3.956 1.00 0.00 C ATOM 0 H THR A 298 7.114 7.880 2.153 1.00 0.00 H new ATOM 0 HA THR A 298 7.775 10.378 0.733 1.00 0.00 H new ATOM 0 HB THR A 298 5.700 10.386 2.127 1.00 0.00 H new ATOM 0 HG1 THR A 298 7.937 11.996 2.873 1.00 0.00 H new ATOM 0 HG21 THR A 298 5.887 10.259 4.593 1.00 0.00 H new ATOM 0 HG22 THR A 298 6.361 8.732 3.812 1.00 0.00 H new ATOM 0 HG23 THR A 298 7.609 9.839 4.431 1.00 0.00 H new ATOM 1160 N ALA A 299 9.897 8.814 2.195 1.00 0.00 N ATOM 1161 CA ALA A 299 11.216 8.778 2.823 1.00 0.00 C ATOM 1162 C ALA A 299 12.081 7.652 2.289 1.00 0.00 C ATOM 1163 O ALA A 299 11.647 6.858 1.455 1.00 0.00 O ATOM 1164 CB ALA A 299 11.080 8.662 4.337 1.00 0.00 C ATOM 0 H ALA A 299 9.650 7.976 1.669 1.00 0.00 H new ATOM 0 HA ALA A 299 11.714 9.715 2.573 1.00 0.00 H new ATOM 0 HB1 ALA A 299 12.071 8.636 4.790 1.00 0.00 H new ATOM 0 HB2 ALA A 299 10.528 9.521 4.720 1.00 0.00 H new ATOM 0 HB3 ALA A 299 10.544 7.746 4.585 1.00 0.00 H new ATOM 1170 N ASP A 300 13.315 7.616 2.784 1.00 0.00 N ATOM 1171 CA ASP A 300 14.297 6.621 2.397 1.00 0.00 C ATOM 1172 C ASP A 300 13.810 5.230 2.743 1.00 0.00 C ATOM 1173 O ASP A 300 13.525 4.924 3.901 1.00 0.00 O ATOM 1174 CB ASP A 300 15.633 6.886 3.099 1.00 0.00 C ATOM 1175 CG ASP A 300 16.241 8.222 2.727 1.00 0.00 C ATOM 1176 OD1 ASP A 300 17.185 8.245 1.913 1.00 0.00 O ATOM 1177 OD2 ASP A 300 15.778 9.261 3.249 1.00 0.00 O1- ATOM 0 H ASP A 300 13.660 8.286 3.472 1.00 0.00 H new ATOM 0 HA ASP A 300 14.440 6.689 1.319 1.00 0.00 H new ATOM 0 HB2 ASP A 300 15.484 6.849 4.178 1.00 0.00 H new ATOM 0 HB3 ASP A 300 16.334 6.091 2.846 1.00 0.00 H new ATOM 1182 N ALA A 301 13.703 4.403 1.732 1.00 0.00 N ATOM 1183 CA ALA A 301 13.265 3.025 1.925 1.00 0.00 C ATOM 1184 C ALA A 301 14.472 2.106 2.100 1.00 0.00 C ATOM 1185 O ALA A 301 15.271 1.928 1.188 1.00 0.00 O ATOM 1186 CB ALA A 301 12.350 2.549 0.788 1.00 0.00 C ATOM 0 H ALA A 301 13.911 4.651 0.765 1.00 0.00 H new ATOM 0 HA ALA A 301 12.670 2.986 2.837 1.00 0.00 H new ATOM 0 HB1 ALA A 301 12.047 1.518 0.972 1.00 0.00 H new ATOM 0 HB2 ALA A 301 11.465 3.184 0.743 1.00 0.00 H new ATOM 0 HB3 ALA A 301 12.887 2.606 -0.159 1.00 0.00 H new ATOM 1192 N ASN A 302 14.587 1.524 3.281 1.00 0.00 N ATOM 1193 CA ASN A 302 15.795 0.802 3.681 1.00 0.00 C ATOM 1194 C ASN A 302 15.862 -0.606 3.095 1.00 0.00 C ATOM 1195 O ASN A 302 14.894 -1.353 3.180 1.00 0.00 O ATOM 1196 CB ASN A 302 15.833 0.678 5.206 1.00 0.00 C ATOM 1197 CG ASN A 302 15.809 2.017 5.921 1.00 0.00 C ATOM 1198 OD1 ASN A 302 16.294 3.027 5.411 1.00 0.00 O ATOM 1199 ND2 ASN A 302 15.247 2.031 7.119 1.00 0.00 N ATOM 0 H ASN A 302 13.854 1.535 3.990 1.00 0.00 H new ATOM 0 HA ASN A 302 16.642 1.373 3.301 1.00 0.00 H new ATOM 0 HB2 ASN A 302 14.981 0.083 5.536 1.00 0.00 H new ATOM 0 HB3 ASN A 302 16.733 0.135 5.497 1.00 0.00 H new ATOM 0 HD21 ASN A 302 15.205 2.899 7.653 1.00 0.00 H new ATOM 0 HD22 ASN A 302 14.856 1.174 7.509 1.00 0.00 H new ATOM 1206 N SER A 303 16.989 -0.968 2.482 1.00 0.00 N ATOM 1207 CA SER A 303 17.277 -2.371 2.229 1.00 0.00 C ATOM 1208 C SER A 303 18.493 -2.796 3.053 1.00 0.00 C ATOM 1209 O SER A 303 19.636 -2.604 2.630 1.00 0.00 O ATOM 1210 CB SER A 303 17.551 -2.587 0.744 1.00 0.00 C ATOM 1211 OG SER A 303 17.746 -3.958 0.437 1.00 0.00 O ATOM 0 H SER A 303 17.704 -0.317 2.158 1.00 0.00 H new ATOM 0 HA SER A 303 16.417 -2.975 2.518 1.00 0.00 H new ATOM 0 HB2 SER A 303 16.716 -2.199 0.160 1.00 0.00 H new ATOM 0 HB3 SER A 303 18.435 -2.020 0.451 1.00 0.00 H new ATOM 0 HG SER A 303 18.611 -4.253 0.791 1.00 0.00 H new ATOM 1217 N ASP A 304 18.256 -3.363 4.229 1.00 0.00 N ATOM 1218 CA ASP A 304 19.358 -3.757 5.102 1.00 0.00 C ATOM 1219 C ASP A 304 19.485 -5.275 5.177 1.00 0.00 C ATOM 1220 O ASP A 304 18.678 -5.991 4.589 1.00 0.00 O ATOM 1221 CB ASP A 304 19.200 -3.163 6.509 1.00 0.00 C ATOM 1222 CG ASP A 304 18.171 -3.881 7.361 1.00 0.00 C ATOM 1223 OD1 ASP A 304 18.526 -4.902 7.990 1.00 0.00 O ATOM 1224 OD2 ASP A 304 17.019 -3.411 7.430 1.00 0.00 O1- ATOM 0 H ASP A 304 17.325 -3.559 4.598 1.00 0.00 H new ATOM 0 HA ASP A 304 20.274 -3.357 4.667 1.00 0.00 H new ATOM 0 HB2 ASP A 304 20.164 -3.193 7.017 1.00 0.00 H new ATOM 0 HB3 ASP A 304 18.918 -2.114 6.421 1.00 0.00 H new ATOM 1229 N SER A 305 20.483 -5.761 5.902 1.00 0.00 N ATOM 1230 CA SER A 305 20.801 -7.188 5.933 1.00 0.00 C ATOM 1231 C SER A 305 19.596 -8.041 6.323 1.00 0.00 C ATOM 1232 O SER A 305 19.429 -9.158 5.827 1.00 0.00 O ATOM 1233 CB SER A 305 21.932 -7.436 6.922 1.00 0.00 C ATOM 1234 OG SER A 305 22.424 -8.763 6.836 1.00 0.00 O ATOM 0 H SER A 305 21.093 -5.185 6.482 1.00 0.00 H new ATOM 0 HA SER A 305 21.102 -7.478 4.926 1.00 0.00 H new ATOM 0 HB2 SER A 305 22.744 -6.734 6.730 1.00 0.00 H new ATOM 0 HB3 SER A 305 21.578 -7.244 7.935 1.00 0.00 H new ATOM 0 HG SER A 305 23.149 -8.886 7.483 1.00 0.00 H new ATOM 1240 N GLY A 306 18.740 -7.504 7.180 1.00 0.00 N ATOM 1241 CA GLY A 306 17.614 -8.268 7.675 1.00 0.00 C ATOM 1242 C GLY A 306 16.494 -8.374 6.665 1.00 0.00 C ATOM 1243 O GLY A 306 15.425 -8.906 6.974 1.00 0.00 O ATOM 0 H GLY A 306 18.805 -6.552 7.541 1.00 0.00 H new ATOM 0 HA2 GLY A 306 17.950 -9.269 7.946 1.00 0.00 H new ATOM 0 HA3 GLY A 306 17.235 -7.802 8.585 1.00 0.00 H new ATOM 1247 N GLY A 307 16.739 -7.879 5.454 1.00 0.00 N ATOM 1248 CA GLY A 307 15.715 -7.880 4.432 1.00 0.00 C ATOM 1249 C GLY A 307 14.461 -7.167 4.888 1.00 0.00 C ATOM 1250 O GLY A 307 13.352 -7.621 4.622 1.00 0.00 O ATOM 0 H GLY A 307 17.631 -7.477 5.166 1.00 0.00 H new ATOM 0 HA2 GLY A 307 16.099 -7.399 3.533 1.00 0.00 H new ATOM 0 HA3 GLY A 307 15.471 -8.908 4.164 1.00 0.00 H new ATOM 1254 N ASP A 308 14.635 -6.055 5.584 1.00 0.00 N ATOM 1255 CA ASP A 308 13.509 -5.321 6.138 1.00 0.00 C ATOM 1256 C ASP A 308 13.467 -3.905 5.579 1.00 0.00 C ATOM 1257 O ASP A 308 14.443 -3.160 5.672 1.00 0.00 O ATOM 1258 CB ASP A 308 13.604 -5.286 7.660 1.00 0.00 C ATOM 1259 CG ASP A 308 12.492 -4.487 8.318 1.00 0.00 C ATOM 1260 OD1 ASP A 308 11.412 -5.056 8.562 1.00 0.00 O ATOM 1261 OD2 ASP A 308 12.709 -3.293 8.628 1.00 0.00 O1- ATOM 0 H ASP A 308 15.546 -5.641 5.779 1.00 0.00 H new ATOM 0 HA ASP A 308 12.588 -5.831 5.854 1.00 0.00 H new ATOM 0 HB2 ASP A 308 13.582 -6.307 8.041 1.00 0.00 H new ATOM 0 HB3 ASP A 308 14.565 -4.860 7.946 1.00 0.00 H new ATOM 1266 N VAL A 309 12.341 -3.549 4.992 1.00 0.00 N ATOM 1267 CA VAL A 309 12.153 -2.230 4.415 1.00 0.00 C ATOM 1268 C VAL A 309 10.910 -1.565 5.003 1.00 0.00 C ATOM 1269 O VAL A 309 9.792 -1.777 4.549 1.00 0.00 O ATOM 1270 CB VAL A 309 12.069 -2.294 2.859 1.00 0.00 C ATOM 1271 CG1 VAL A 309 11.085 -3.344 2.371 1.00 0.00 C ATOM 1272 CG2 VAL A 309 11.725 -0.945 2.242 1.00 0.00 C ATOM 0 H VAL A 309 11.532 -4.163 4.901 1.00 0.00 H new ATOM 0 HA VAL A 309 13.023 -1.624 4.669 1.00 0.00 H new ATOM 0 HB VAL A 309 13.067 -2.581 2.529 1.00 0.00 H new ATOM 0 HG11 VAL A 309 11.066 -3.346 1.281 1.00 0.00 H new ATOM 0 HG12 VAL A 309 11.393 -4.326 2.730 1.00 0.00 H new ATOM 0 HG13 VAL A 309 10.090 -3.114 2.751 1.00 0.00 H new ATOM 0 HG21 VAL A 309 11.678 -1.042 1.157 1.00 0.00 H new ATOM 0 HG22 VAL A 309 10.759 -0.609 2.618 1.00 0.00 H new ATOM 0 HG23 VAL A 309 12.491 -0.217 2.508 1.00 0.00 H new ATOM 1282 N THR A 310 11.111 -0.770 6.031 1.00 0.00 N ATOM 1283 CA THR A 310 10.002 -0.139 6.725 1.00 0.00 C ATOM 1284 C THR A 310 9.863 1.327 6.319 1.00 0.00 C ATOM 1285 O THR A 310 10.769 2.133 6.547 1.00 0.00 O ATOM 1286 CB THR A 310 10.208 -0.243 8.258 1.00 0.00 C ATOM 1287 OG1 THR A 310 10.182 -1.620 8.657 1.00 0.00 O ATOM 1288 CG2 THR A 310 9.158 0.548 9.052 1.00 0.00 C ATOM 0 H THR A 310 12.031 -0.543 6.408 1.00 0.00 H new ATOM 0 HA THR A 310 9.086 -0.660 6.446 1.00 0.00 H new ATOM 0 HB THR A 310 11.179 0.197 8.483 1.00 0.00 H new ATOM 0 HG1 THR A 310 11.086 -1.995 8.598 1.00 0.00 H new ATOM 0 HG21 THR A 310 9.351 0.439 10.119 1.00 0.00 H new ATOM 0 HG22 THR A 310 9.213 1.602 8.779 1.00 0.00 H new ATOM 0 HG23 THR A 310 8.164 0.165 8.822 1.00 0.00 H new ATOM 1296 N VAL A 311 8.728 1.660 5.711 1.00 0.00 N ATOM 1297 CA VAL A 311 8.457 3.029 5.264 1.00 0.00 C ATOM 1298 C VAL A 311 6.971 3.333 5.335 1.00 0.00 C ATOM 1299 O VAL A 311 6.135 2.431 5.373 1.00 0.00 O ATOM 1300 CB VAL A 311 8.933 3.283 3.808 1.00 0.00 C ATOM 1301 CG1 VAL A 311 10.458 3.420 3.725 1.00 0.00 C ATOM 1302 CG2 VAL A 311 8.455 2.152 2.887 1.00 0.00 C ATOM 0 H VAL A 311 7.976 0.999 5.514 1.00 0.00 H new ATOM 0 HA VAL A 311 9.015 3.682 5.935 1.00 0.00 H new ATOM 0 HB VAL A 311 8.495 4.225 3.479 1.00 0.00 H new ATOM 0 HG11 VAL A 311 10.752 3.597 2.690 1.00 0.00 H new ATOM 0 HG12 VAL A 311 10.782 4.258 4.342 1.00 0.00 H new ATOM 0 HG13 VAL A 311 10.926 2.503 4.083 1.00 0.00 H new ATOM 0 HG21 VAL A 311 8.796 2.343 1.869 1.00 0.00 H new ATOM 0 HG22 VAL A 311 8.863 1.203 3.234 1.00 0.00 H new ATOM 0 HG23 VAL A 311 7.366 2.106 2.902 1.00 0.00 H new ATOM 1312 N THR A 312 6.654 4.611 5.357 1.00 0.00 N ATOM 1313 CA THR A 312 5.277 5.052 5.390 1.00 0.00 C ATOM 1314 C THR A 312 4.896 5.704 4.065 1.00 0.00 C ATOM 1315 O THR A 312 5.699 6.417 3.454 1.00 0.00 O ATOM 1316 CB THR A 312 5.064 6.057 6.552 1.00 0.00 C ATOM 1317 OG1 THR A 312 5.194 5.381 7.803 1.00 0.00 O ATOM 1318 CG2 THR A 312 3.704 6.783 6.482 1.00 0.00 C ATOM 0 H THR A 312 7.338 5.367 5.353 1.00 0.00 H new ATOM 0 HA THR A 312 4.640 4.183 5.551 1.00 0.00 H new ATOM 0 HB THR A 312 5.833 6.824 6.456 1.00 0.00 H new ATOM 0 HG1 THR A 312 4.344 5.426 8.289 1.00 0.00 H new ATOM 0 HG21 THR A 312 3.616 7.472 7.322 1.00 0.00 H new ATOM 0 HG22 THR A 312 3.636 7.340 5.547 1.00 0.00 H new ATOM 0 HG23 THR A 312 2.898 6.051 6.527 1.00 0.00 H new ATOM 1326 N LEU A 313 3.677 5.446 3.634 1.00 0.00 N ATOM 1327 CA LEU A 313 3.165 5.984 2.395 1.00 0.00 C ATOM 1328 C LEU A 313 2.107 7.028 2.694 1.00 0.00 C ATOM 1329 O LEU A 313 1.116 6.741 3.361 1.00 0.00 O ATOM 1330 CB LEU A 313 2.596 4.860 1.539 1.00 0.00 C ATOM 1331 CG LEU A 313 3.605 3.760 1.207 1.00 0.00 C ATOM 1332 CD1 LEU A 313 3.626 2.685 2.279 1.00 0.00 C ATOM 1333 CD2 LEU A 313 3.331 3.153 -0.154 1.00 0.00 C ATOM 0 H LEU A 313 3.014 4.856 4.136 1.00 0.00 H new ATOM 0 HA LEU A 313 3.973 6.460 1.839 1.00 0.00 H new ATOM 0 HB2 LEU A 313 1.747 4.416 2.058 1.00 0.00 H new ATOM 0 HB3 LEU A 313 2.215 5.282 0.609 1.00 0.00 H new ATOM 0 HG LEU A 313 4.591 4.224 1.177 1.00 0.00 H new ATOM 0 HD11 LEU A 313 4.354 1.919 2.012 1.00 0.00 H new ATOM 0 HD12 LEU A 313 3.902 3.130 3.235 1.00 0.00 H new ATOM 0 HD13 LEU A 313 2.637 2.234 2.361 1.00 0.00 H new ATOM 0 HD21 LEU A 313 4.066 2.375 -0.360 1.00 0.00 H new ATOM 0 HD22 LEU A 313 2.331 2.720 -0.165 1.00 0.00 H new ATOM 0 HD23 LEU A 313 3.399 3.927 -0.918 1.00 0.00 H new ATOM 1345 N SER A 314 2.311 8.235 2.211 1.00 0.00 N ATOM 1346 CA SER A 314 1.457 9.338 2.609 1.00 0.00 C ATOM 1347 C SER A 314 1.214 10.308 1.467 1.00 0.00 C ATOM 1348 O SER A 314 2.035 10.438 0.555 1.00 0.00 O ATOM 1349 CB SER A 314 2.085 10.067 3.800 1.00 0.00 C ATOM 1350 OG SER A 314 3.438 10.400 3.538 1.00 0.00 O ATOM 0 H SER A 314 3.050 8.478 1.551 1.00 0.00 H new ATOM 0 HA SER A 314 0.489 8.928 2.896 1.00 0.00 H new ATOM 0 HB2 SER A 314 1.519 10.973 4.015 1.00 0.00 H new ATOM 0 HB3 SER A 314 2.027 9.437 4.688 1.00 0.00 H new ATOM 0 HG SER A 314 3.816 10.866 4.313 1.00 0.00 H new ATOM 1632 N VAL A 333 -6.589 -4.064 4.516 1.00 0.00 N ATOM 1633 CA VAL A 333 -5.182 -4.410 4.514 1.00 0.00 C ATOM 1634 C VAL A 333 -4.890 -5.700 5.262 1.00 0.00 C ATOM 1635 O VAL A 333 -5.438 -5.963 6.333 1.00 0.00 O ATOM 1636 CB VAL A 333 -4.325 -3.270 5.092 1.00 0.00 C ATOM 1637 CG1 VAL A 333 -4.370 -2.066 4.165 1.00 0.00 C ATOM 1638 CG2 VAL A 333 -4.792 -2.888 6.492 1.00 0.00 C ATOM 0 HA VAL A 333 -4.915 -4.567 3.469 1.00 0.00 H new ATOM 0 HB VAL A 333 -3.295 -3.618 5.169 1.00 0.00 H new ATOM 0 HG11 VAL A 333 -3.761 -1.263 4.581 1.00 0.00 H new ATOM 0 HG12 VAL A 333 -3.981 -2.346 3.186 1.00 0.00 H new ATOM 0 HG13 VAL A 333 -5.400 -1.724 4.062 1.00 0.00 H new ATOM 0 HG21 VAL A 333 -4.169 -2.080 6.876 1.00 0.00 H new ATOM 0 HG22 VAL A 333 -5.830 -2.558 6.452 1.00 0.00 H new ATOM 0 HG23 VAL A 333 -4.712 -3.753 7.151 1.00 0.00 H new ATOM 1648 N GLU A 334 -4.030 -6.505 4.671 1.00 0.00 N ATOM 1649 CA GLU A 334 -3.562 -7.726 5.288 1.00 0.00 C ATOM 1650 C GLU A 334 -2.075 -7.881 4.995 1.00 0.00 C ATOM 1651 O GLU A 334 -1.574 -7.345 4.008 1.00 0.00 O ATOM 1652 CB GLU A 334 -4.360 -8.925 4.765 1.00 0.00 C ATOM 1653 CG GLU A 334 -4.053 -10.222 5.492 1.00 0.00 C ATOM 1654 CD GLU A 334 -4.142 -10.072 6.996 1.00 0.00 C ATOM 1655 OE1 GLU A 334 -3.078 -9.993 7.645 1.00 0.00 O ATOM 1656 OE2 GLU A 334 -5.270 -10.014 7.534 1.00 0.00 O1- ATOM 0 H GLU A 334 -3.636 -6.329 3.747 1.00 0.00 H new ATOM 0 HA GLU A 334 -3.710 -7.681 6.367 1.00 0.00 H new ATOM 0 HB2 GLU A 334 -5.425 -8.710 4.856 1.00 0.00 H new ATOM 0 HB3 GLU A 334 -4.151 -9.055 3.703 1.00 0.00 H new ATOM 0 HG2 GLU A 334 -4.750 -10.994 5.164 1.00 0.00 H new ATOM 0 HG3 GLU A 334 -3.053 -10.560 5.221 1.00 0.00 H new ATOM 1663 N ALA A 335 -1.371 -8.587 5.861 1.00 0.00 N ATOM 1664 CA ALA A 335 0.069 -8.717 5.734 1.00 0.00 C ATOM 1665 C ALA A 335 0.439 -9.956 4.919 1.00 0.00 C ATOM 1666 O ALA A 335 -0.205 -10.998 5.046 1.00 0.00 O ATOM 1667 CB ALA A 335 0.706 -8.789 7.111 1.00 0.00 C ATOM 0 H ALA A 335 -1.773 -9.079 6.659 1.00 0.00 H new ATOM 0 HA ALA A 335 0.446 -7.840 5.208 1.00 0.00 H new ATOM 0 HB1 ALA A 335 1.787 -8.887 7.007 1.00 0.00 H new ATOM 0 HB2 ALA A 335 0.475 -7.880 7.667 1.00 0.00 H new ATOM 0 HB3 ALA A 335 0.314 -9.652 7.649 1.00 0.00 H new ATOM 1673 N GLY A 336 1.469 -9.847 4.083 1.00 0.00 N ATOM 1674 CA GLY A 336 1.948 -11.004 3.351 1.00 0.00 C ATOM 1675 C GLY A 336 1.789 -10.882 1.847 1.00 0.00 C ATOM 1676 O GLY A 336 1.978 -11.858 1.124 1.00 0.00 O ATOM 0 H GLY A 336 1.977 -8.982 3.901 1.00 0.00 H new ATOM 0 HA2 GLY A 336 3.001 -11.161 3.585 1.00 0.00 H new ATOM 0 HA3 GLY A 336 1.411 -11.888 3.694 1.00 0.00 H new ATOM 1680 N ASP A 337 1.425 -9.699 1.366 1.00 0.00 N ATOM 1681 CA ASP A 337 1.277 -9.481 -0.069 1.00 0.00 C ATOM 1682 C ASP A 337 2.589 -9.071 -0.728 1.00 0.00 C ATOM 1683 O ASP A 337 3.661 -9.146 -0.118 1.00 0.00 O ATOM 1684 CB ASP A 337 0.207 -8.434 -0.332 1.00 0.00 C ATOM 1685 CG ASP A 337 -1.171 -8.972 -0.052 1.00 0.00 C ATOM 1686 OD1 ASP A 337 -1.907 -8.349 0.728 1.00 0.00 O ATOM 1687 OD2 ASP A 337 -1.521 -10.035 -0.614 1.00 0.00 O1- ATOM 0 H ASP A 337 1.228 -8.881 1.943 1.00 0.00 H new ATOM 0 HA ASP A 337 0.974 -10.429 -0.513 1.00 0.00 H new ATOM 0 HB2 ASP A 337 0.391 -7.559 0.292 1.00 0.00 H new ATOM 0 HB3 ASP A 337 0.266 -8.104 -1.369 1.00 0.00 H new ATOM 1692 N ALA A 338 2.497 -8.638 -1.981 1.00 0.00 N ATOM 1693 CA ALA A 338 3.681 -8.336 -2.774 1.00 0.00 C ATOM 1694 C ALA A 338 3.814 -6.843 -3.036 1.00 0.00 C ATOM 1695 O ALA A 338 2.818 -6.129 -3.157 1.00 0.00 O ATOM 1696 CB ALA A 338 3.642 -9.097 -4.092 1.00 0.00 C ATOM 0 H ALA A 338 1.614 -8.489 -2.469 1.00 0.00 H new ATOM 0 HA ALA A 338 4.552 -8.654 -2.201 1.00 0.00 H new ATOM 0 HB1 ALA A 338 4.533 -8.862 -4.674 1.00 0.00 H new ATOM 0 HB2 ALA A 338 3.611 -10.168 -3.893 1.00 0.00 H new ATOM 0 HB3 ALA A 338 2.754 -8.807 -4.654 1.00 0.00 H new ATOM 1702 N VAL A 339 5.056 -6.393 -3.128 1.00 0.00 N ATOM 1703 CA VAL A 339 5.374 -4.991 -3.354 1.00 0.00 C ATOM 1704 C VAL A 339 6.254 -4.853 -4.596 1.00 0.00 C ATOM 1705 O VAL A 339 6.968 -5.783 -4.961 1.00 0.00 O ATOM 1706 CB VAL A 339 6.105 -4.399 -2.113 1.00 0.00 C ATOM 1707 CG1 VAL A 339 6.670 -3.012 -2.396 1.00 0.00 C ATOM 1708 CG2 VAL A 339 5.162 -4.330 -0.930 1.00 0.00 C ATOM 0 H VAL A 339 5.877 -6.994 -3.048 1.00 0.00 H new ATOM 0 HA VAL A 339 4.448 -4.439 -3.510 1.00 0.00 H new ATOM 0 HB VAL A 339 6.938 -5.063 -1.881 1.00 0.00 H new ATOM 0 HG11 VAL A 339 7.172 -2.635 -1.505 1.00 0.00 H new ATOM 0 HG12 VAL A 339 7.384 -3.071 -3.217 1.00 0.00 H new ATOM 0 HG13 VAL A 339 5.859 -2.337 -2.668 1.00 0.00 H new ATOM 0 HG21 VAL A 339 5.687 -3.914 -0.070 1.00 0.00 H new ATOM 0 HG22 VAL A 339 4.312 -3.694 -1.179 1.00 0.00 H new ATOM 0 HG23 VAL A 339 4.807 -5.332 -0.689 1.00 0.00 H new ATOM 1718 N SER A 340 6.167 -3.715 -5.267 1.00 0.00 N ATOM 1719 CA SER A 340 7.022 -3.422 -6.406 1.00 0.00 C ATOM 1720 C SER A 340 7.247 -1.912 -6.508 1.00 0.00 C ATOM 1721 O SER A 340 6.519 -1.134 -5.897 1.00 0.00 O ATOM 1722 CB SER A 340 6.392 -3.975 -7.689 1.00 0.00 C ATOM 1723 OG SER A 340 6.119 -5.364 -7.565 1.00 0.00 O ATOM 0 H SER A 340 5.506 -2.973 -5.039 1.00 0.00 H new ATOM 0 HA SER A 340 7.990 -3.904 -6.269 1.00 0.00 H new ATOM 0 HB2 SER A 340 5.469 -3.437 -7.906 1.00 0.00 H new ATOM 0 HB3 SER A 340 7.064 -3.807 -8.530 1.00 0.00 H new ATOM 0 HG SER A 340 5.716 -5.694 -8.395 1.00 0.00 H new ATOM 1729 N VAL A 341 8.257 -1.502 -7.263 1.00 0.00 N ATOM 1730 CA VAL A 341 8.609 -0.087 -7.365 1.00 0.00 C ATOM 1731 C VAL A 341 8.440 0.409 -8.799 1.00 0.00 C ATOM 1732 O VAL A 341 8.790 -0.290 -9.749 1.00 0.00 O ATOM 1733 CB VAL A 341 10.074 0.147 -6.916 1.00 0.00 C ATOM 1734 CG1 VAL A 341 10.439 1.625 -6.955 1.00 0.00 C ATOM 1735 CG2 VAL A 341 10.314 -0.419 -5.526 1.00 0.00 C ATOM 0 H VAL A 341 8.848 -2.125 -7.814 1.00 0.00 H new ATOM 0 HA VAL A 341 7.938 0.469 -6.710 1.00 0.00 H new ATOM 0 HB VAL A 341 10.718 -0.379 -7.621 1.00 0.00 H new ATOM 0 HG11 VAL A 341 11.473 1.753 -6.634 1.00 0.00 H new ATOM 0 HG12 VAL A 341 10.325 2.001 -7.972 1.00 0.00 H new ATOM 0 HG13 VAL A 341 9.780 2.180 -6.287 1.00 0.00 H new ATOM 0 HG21 VAL A 341 11.349 -0.242 -5.235 1.00 0.00 H new ATOM 0 HG22 VAL A 341 9.648 0.069 -4.814 1.00 0.00 H new ATOM 0 HG23 VAL A 341 10.117 -1.491 -5.531 1.00 0.00 H new ATOM 1745 N VAL A 342 7.891 1.613 -8.950 1.00 0.00 N ATOM 1746 CA VAL A 342 7.728 2.221 -10.269 1.00 0.00 C ATOM 1747 C VAL A 342 9.090 2.607 -10.836 1.00 0.00 C ATOM 1748 O VAL A 342 9.328 2.511 -12.038 1.00 0.00 O ATOM 1749 CB VAL A 342 6.807 3.465 -10.219 1.00 0.00 C ATOM 1750 CG1 VAL A 342 6.779 4.184 -11.567 1.00 0.00 C ATOM 1751 CG2 VAL A 342 5.394 3.065 -9.814 1.00 0.00 C ATOM 0 H VAL A 342 7.552 2.186 -8.177 1.00 0.00 H new ATOM 0 HA VAL A 342 7.256 1.483 -10.918 1.00 0.00 H new ATOM 0 HB VAL A 342 7.211 4.150 -9.473 1.00 0.00 H new ATOM 0 HG11 VAL A 342 6.125 5.053 -11.502 1.00 0.00 H new ATOM 0 HG12 VAL A 342 7.787 4.507 -11.828 1.00 0.00 H new ATOM 0 HG13 VAL A 342 6.406 3.505 -12.334 1.00 0.00 H new ATOM 0 HG21 VAL A 342 4.760 3.951 -9.784 1.00 0.00 H new ATOM 0 HG22 VAL A 342 4.994 2.357 -10.540 1.00 0.00 H new ATOM 0 HG23 VAL A 342 5.416 2.600 -8.828 1.00 0.00 H new