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 272 ASN : amide:sc= 0.32! C(o=-0.032!,f=-5.5!) USER MOD Set 1.2: A 292 SER OG : rot -92:sc= -0.352! USER MOD Set 2.1: A 267 GLN : amide:sc= 0.991 K(o=1.9,f=0.18) USER MOD Set 2.2: A 296 THR OG1 : rot -174:sc= 0.866 USER MOD Set 3.1: A 248 THR OG1 : rot 180:sc= 0.44 USER MOD Set 3.2: A 312 THR OG1 : rot -117:sc= 0.339 USER MOD Set 4.1: A 232 THR OG1 : rot 180:sc= 0.957 USER MOD Set 4.2: 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+ -177:sc= 1.23 (180deg=1.22) USER MOD Single : A 233 GLN : amide:sc= -3.23! C(o=-3.2!,f=-3.8!) USER MOD Single : A 235 THR OG1 : rot 180:sc= 0 USER MOD Single : A 237 THR OG1 : rot 180:sc= 0.00392 USER MOD Single : A 238 TYR OH : rot 180:sc= 0 USER MOD Single : A 239 ASN : amide:sc= -2.92! C(o=-2.9!,f=-2.8!) 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= -0.513 USER MOD Single : A 246 GLN : amide:sc= -1.1 K(o=-1.1,f=-0.0023) USER MOD Single : A 252 THR OG1 : rot 180:sc= -1.6! USER MOD Single : A 255 THR OG1 : rot 180:sc= 0.0986 USER MOD Single : A 257 SER OG : rot -41:sc= 0.387 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+ -155:sc= -0.147 (180deg=-0.626) USER MOD Single : A 271 THR OG1 : rot 42:sc= 0.431 USER MOD Single : A 294 THR OG1 : rot 180:sc= 0 USER MOD Single : A 298 THR OG1 : rot -110:sc= -0.81 USER MOD Single : A 302 ASN : amide:sc= -3.27! K(o=-3.3!,f=-1.1) USER MOD Single : A 303 SER OG : rot -89:sc= 1.71 USER MOD Single : A 305 SER OG : rot 180:sc= 0 USER MOD Single : A 310 THR OG1 : rot 180:sc= -2.67! USER MOD Single : A 314 SER OG : rot 180:sc= 0 USER MOD Single : A 340 SER OG : rot 180:sc= -0.0246 USER MOD ----------------------------------------------------------------- ATOM 47 N GLY A 226 12.132 -3.843 -9.155 1.00 0.00 N ATOM 48 CA GLY A 226 12.516 -4.412 -7.881 1.00 0.00 C ATOM 49 C GLY A 226 11.346 -5.053 -7.169 1.00 0.00 C ATOM 50 O GLY A 226 10.334 -4.400 -6.903 1.00 0.00 O ATOM 0 HA2 GLY A 226 13.297 -5.156 -8.037 1.00 0.00 H new ATOM 0 HA3 GLY A 226 12.941 -3.632 -7.249 1.00 0.00 H new ATOM 54 N THR A 227 11.474 -6.334 -6.880 1.00 0.00 N ATOM 55 CA THR A 227 10.424 -7.067 -6.204 1.00 0.00 C ATOM 56 C THR A 227 10.685 -7.086 -4.707 1.00 0.00 C ATOM 57 O THR A 227 11.811 -7.314 -4.264 1.00 0.00 O ATOM 58 CB THR A 227 10.341 -8.506 -6.731 1.00 0.00 C ATOM 59 OG1 THR A 227 10.344 -8.492 -8.167 1.00 0.00 O ATOM 60 CG2 THR A 227 9.084 -9.211 -6.233 1.00 0.00 C ATOM 0 H THR A 227 12.299 -6.890 -7.105 1.00 0.00 H new ATOM 0 HA THR A 227 9.475 -6.567 -6.401 1.00 0.00 H new ATOM 0 HB THR A 227 11.207 -9.053 -6.359 1.00 0.00 H new ATOM 0 HG1 THR A 227 10.293 -9.411 -8.503 1.00 0.00 H new ATOM 0 HG21 THR A 227 9.057 -10.228 -6.625 1.00 0.00 H new ATOM 0 HG22 THR A 227 9.092 -9.243 -5.143 1.00 0.00 H new ATOM 0 HG23 THR A 227 8.203 -8.667 -6.574 1.00 0.00 H new ATOM 68 N LEU A 228 9.649 -6.831 -3.936 1.00 0.00 N ATOM 69 CA LEU A 228 9.762 -6.766 -2.496 1.00 0.00 C ATOM 70 C LEU A 228 8.623 -7.554 -1.860 1.00 0.00 C ATOM 71 O LEU A 228 7.756 -8.074 -2.560 1.00 0.00 O ATOM 72 CB LEU A 228 9.750 -5.300 -2.047 1.00 0.00 C ATOM 73 CG LEU A 228 10.971 -4.469 -2.526 1.00 0.00 C ATOM 74 CD1 LEU A 228 10.513 -3.344 -3.443 1.00 0.00 C ATOM 75 CD2 LEU A 228 11.772 -3.889 -1.362 1.00 0.00 C ATOM 0 H LEU A 228 8.707 -6.663 -4.290 1.00 0.00 H new ATOM 0 HA LEU A 228 10.703 -7.211 -2.173 1.00 0.00 H new ATOM 0 HB2 LEU A 228 8.839 -4.828 -2.415 1.00 0.00 H new ATOM 0 HB3 LEU A 228 9.709 -5.267 -0.958 1.00 0.00 H new ATOM 0 HG LEU A 228 11.626 -5.149 -3.071 1.00 0.00 H new ATOM 0 HD11 LEU A 228 11.378 -2.768 -3.772 1.00 0.00 H new ATOM 0 HD12 LEU A 228 10.006 -3.766 -4.311 1.00 0.00 H new ATOM 0 HD13 LEU A 228 9.827 -2.691 -2.903 1.00 0.00 H new ATOM 0 HD21 LEU A 228 12.615 -3.317 -1.750 1.00 0.00 H new ATOM 0 HD22 LEU A 228 11.132 -3.236 -0.769 1.00 0.00 H new ATOM 0 HD23 LEU A 228 12.142 -4.700 -0.735 1.00 0.00 H new ATOM 87 N THR A 229 8.633 -7.657 -0.549 1.00 0.00 N ATOM 88 CA THR A 229 7.657 -8.462 0.160 1.00 0.00 C ATOM 89 C THR A 229 6.885 -7.611 1.172 1.00 0.00 C ATOM 90 O THR A 229 7.379 -6.583 1.634 1.00 0.00 O ATOM 91 CB THR A 229 8.386 -9.615 0.871 1.00 0.00 C ATOM 92 OG1 THR A 229 9.184 -10.332 -0.083 1.00 0.00 O ATOM 93 CG2 THR A 229 7.424 -10.582 1.556 1.00 0.00 C ATOM 0 H THR A 229 9.311 -7.190 0.053 1.00 0.00 H new ATOM 0 HA THR A 229 6.937 -8.867 -0.551 1.00 0.00 H new ATOM 0 HB THR A 229 9.013 -9.176 1.647 1.00 0.00 H new ATOM 0 HG1 THR A 229 9.651 -11.066 0.367 1.00 0.00 H new ATOM 0 HG21 THR A 229 7.991 -11.376 2.042 1.00 0.00 H new ATOM 0 HG22 THR A 229 6.838 -10.045 2.302 1.00 0.00 H new ATOM 0 HG23 THR A 229 6.755 -11.016 0.813 1.00 0.00 H new ATOM 101 N VAL A 230 5.675 -8.042 1.499 1.00 0.00 N ATOM 102 CA VAL A 230 4.801 -7.301 2.402 1.00 0.00 C ATOM 103 C VAL A 230 4.878 -7.854 3.819 1.00 0.00 C ATOM 104 O VAL A 230 4.829 -9.068 4.025 1.00 0.00 O ATOM 105 CB VAL A 230 3.329 -7.361 1.930 1.00 0.00 C ATOM 106 CG1 VAL A 230 2.405 -6.659 2.923 1.00 0.00 C ATOM 107 CG2 VAL A 230 3.185 -6.736 0.550 1.00 0.00 C ATOM 0 H VAL A 230 5.271 -8.911 1.149 1.00 0.00 H new ATOM 0 HA VAL A 230 5.144 -6.266 2.395 1.00 0.00 H new ATOM 0 HB VAL A 230 3.038 -8.410 1.874 1.00 0.00 H new ATOM 0 HG11 VAL A 230 1.377 -6.716 2.566 1.00 0.00 H new ATOM 0 HG12 VAL A 230 2.479 -7.145 3.896 1.00 0.00 H new ATOM 0 HG13 VAL A 230 2.699 -5.614 3.017 1.00 0.00 H new ATOM 0 HG21 VAL A 230 2.143 -6.787 0.234 1.00 0.00 H new ATOM 0 HG22 VAL A 230 3.502 -5.694 0.588 1.00 0.00 H new ATOM 0 HG23 VAL A 230 3.807 -7.279 -0.162 1.00 0.00 H new ATOM 117 N LYS A 231 5.018 -6.964 4.792 1.00 0.00 N ATOM 118 CA LYS A 231 4.917 -7.347 6.190 1.00 0.00 C ATOM 119 C LYS A 231 3.628 -6.785 6.772 1.00 0.00 C ATOM 120 O LYS A 231 2.972 -7.432 7.581 1.00 0.00 O ATOM 121 CB LYS A 231 6.116 -6.856 7.001 1.00 0.00 C ATOM 122 CG LYS A 231 7.458 -7.184 6.372 1.00 0.00 C ATOM 123 CD LYS A 231 8.599 -6.973 7.352 1.00 0.00 C ATOM 124 CE LYS A 231 8.731 -8.147 8.304 1.00 0.00 C ATOM 125 NZ LYS A 231 9.856 -7.969 9.256 1.00 0.00 N1+ ATOM 0 H LYS A 231 5.202 -5.973 4.637 1.00 0.00 H new ATOM 0 HA LYS A 231 4.909 -8.436 6.246 1.00 0.00 H new ATOM 0 HB2 LYS A 231 6.039 -5.776 7.128 1.00 0.00 H new ATOM 0 HB3 LYS A 231 6.074 -7.298 7.997 1.00 0.00 H new ATOM 0 HG2 LYS A 231 7.457 -8.219 6.030 1.00 0.00 H new ATOM 0 HG3 LYS A 231 7.612 -6.558 5.493 1.00 0.00 H new ATOM 0 HD2 LYS A 231 9.532 -6.839 6.804 1.00 0.00 H new ATOM 0 HD3 LYS A 231 8.429 -6.058 7.920 1.00 0.00 H new ATOM 0 HE2 LYS A 231 7.802 -8.269 8.860 1.00 0.00 H new ATOM 0 HE3 LYS A 231 8.882 -9.062 7.732 1.00 0.00 H new ATOM 0 HZ1 LYS A 231 9.942 -8.816 9.854 1.00 0.00 H new ATOM 0 HZ2 LYS A 231 10.740 -7.828 8.726 1.00 0.00 H new ATOM 0 HZ3 LYS A 231 9.675 -7.139 9.856 1.00 0.00 H new ATOM 139 N THR A 232 3.279 -5.567 6.359 1.00 0.00 N ATOM 140 CA THR A 232 1.994 -4.970 6.705 1.00 0.00 C ATOM 141 C THR A 232 1.448 -4.199 5.504 1.00 0.00 C ATOM 142 O THR A 232 2.190 -3.864 4.591 1.00 0.00 O ATOM 143 CB THR A 232 2.078 -4.024 7.929 1.00 0.00 C ATOM 144 OG1 THR A 232 3.023 -2.979 7.696 1.00 0.00 O ATOM 145 CG2 THR A 232 2.464 -4.778 9.192 1.00 0.00 C ATOM 0 H THR A 232 3.874 -4.973 5.781 1.00 0.00 H new ATOM 0 HA THR A 232 1.325 -5.787 6.975 1.00 0.00 H new ATOM 0 HB THR A 232 1.087 -3.593 8.070 1.00 0.00 H new ATOM 0 HG1 THR A 232 3.061 -2.391 8.479 1.00 0.00 H new ATOM 0 HG21 THR A 232 2.513 -4.083 10.030 1.00 0.00 H new ATOM 0 HG22 THR A 232 1.718 -5.545 9.400 1.00 0.00 H new ATOM 0 HG23 THR A 232 3.438 -5.247 9.052 1.00 0.00 H new ATOM 153 N GLN A 233 0.155 -3.943 5.523 1.00 0.00 N ATOM 154 CA GLN A 233 -0.548 -3.294 4.428 1.00 0.00 C ATOM 155 C GLN A 233 -1.107 -1.948 4.888 1.00 0.00 C ATOM 156 O GLN A 233 -1.194 -1.703 6.095 1.00 0.00 O ATOM 157 CB GLN A 233 -1.653 -4.216 3.905 1.00 0.00 C ATOM 158 CG GLN A 233 -1.211 -5.120 2.761 1.00 0.00 C ATOM 159 CD GLN A 233 -1.092 -4.392 1.439 1.00 0.00 C ATOM 160 OE1 GLN A 233 -0.048 -3.830 1.106 1.00 0.00 O ATOM 161 NE2 GLN A 233 -2.171 -4.401 0.677 1.00 0.00 N ATOM 0 H GLN A 233 -0.448 -4.183 6.310 1.00 0.00 H new ATOM 0 HA GLN A 233 0.146 -3.101 3.610 1.00 0.00 H new ATOM 0 HB2 GLN A 233 -2.015 -4.835 4.726 1.00 0.00 H new ATOM 0 HB3 GLN A 233 -2.493 -3.607 3.571 1.00 0.00 H new ATOM 0 HG2 GLN A 233 -0.249 -5.567 3.010 1.00 0.00 H new ATOM 0 HG3 GLN A 233 -1.924 -5.937 2.656 1.00 0.00 H new ATOM 0 HE21 GLN A 233 -3.015 -4.879 0.993 1.00 0.00 H new ATOM 0 HE22 GLN A 233 -2.161 -3.930 -0.227 1.00 0.00 H new ATOM 170 N PRO A 234 -1.489 -1.071 3.935 1.00 0.00 N ATOM 171 CA PRO A 234 -1.970 0.292 4.194 1.00 0.00 C ATOM 172 C PRO A 234 -2.863 0.442 5.425 1.00 0.00 C ATOM 173 O PRO A 234 -4.007 -0.006 5.431 1.00 0.00 O ATOM 174 CB PRO A 234 -2.786 0.626 2.930 1.00 0.00 C ATOM 175 CG PRO A 234 -2.667 -0.558 2.023 1.00 0.00 C ATOM 176 CD PRO A 234 -1.474 -1.326 2.495 1.00 0.00 C ATOM 0 HA PRO A 234 -1.126 0.950 4.399 1.00 0.00 H new ATOM 0 HB2 PRO A 234 -3.829 0.819 3.181 1.00 0.00 H new ATOM 0 HB3 PRO A 234 -2.403 1.525 2.447 1.00 0.00 H new ATOM 0 HG2 PRO A 234 -3.567 -1.172 2.064 1.00 0.00 H new ATOM 0 HG3 PRO A 234 -2.543 -0.244 0.987 1.00 0.00 H new ATOM 0 HD2 PRO A 234 -1.559 -2.389 2.269 1.00 0.00 H new ATOM 0 HD3 PRO A 234 -0.553 -0.974 2.029 1.00 0.00 H new ATOM 184 N THR A 235 -2.337 1.081 6.464 1.00 0.00 N ATOM 185 CA THR A 235 -3.143 1.408 7.627 1.00 0.00 C ATOM 186 C THR A 235 -2.568 2.618 8.395 1.00 0.00 C ATOM 187 O THR A 235 -1.657 2.485 9.208 1.00 0.00 O ATOM 188 CB THR A 235 -3.316 0.170 8.551 1.00 0.00 C ATOM 189 OG1 THR A 235 -4.157 0.497 9.664 1.00 0.00 O ATOM 190 CG2 THR A 235 -1.974 -0.369 9.050 1.00 0.00 C ATOM 0 H THR A 235 -1.363 1.380 6.522 1.00 0.00 H new ATOM 0 HA THR A 235 -4.133 1.697 7.274 1.00 0.00 H new ATOM 0 HB THR A 235 -3.785 -0.615 7.957 1.00 0.00 H new ATOM 0 HG1 THR A 235 -4.260 -0.290 10.238 1.00 0.00 H new ATOM 0 HG21 THR A 235 -2.145 -1.233 9.692 1.00 0.00 H new ATOM 0 HG22 THR A 235 -1.361 -0.665 8.198 1.00 0.00 H new ATOM 0 HG23 THR A 235 -1.458 0.407 9.616 1.00 0.00 H new ATOM 198 N VAL A 236 -3.054 3.811 8.049 1.00 0.00 N ATOM 199 CA VAL A 236 -2.752 5.046 8.785 1.00 0.00 C ATOM 200 C VAL A 236 -3.847 6.103 8.515 1.00 0.00 C ATOM 201 O VAL A 236 -4.766 5.835 7.739 1.00 0.00 O ATOM 202 CB VAL A 236 -1.275 5.542 8.545 1.00 0.00 C ATOM 203 CG1 VAL A 236 -1.137 7.040 8.307 1.00 0.00 C ATOM 204 CG2 VAL A 236 -0.423 5.171 9.746 1.00 0.00 C ATOM 0 H VAL A 236 -3.670 3.951 7.248 1.00 0.00 H new ATOM 0 HA VAL A 236 -2.782 4.842 9.855 1.00 0.00 H new ATOM 0 HB VAL A 236 -0.944 5.049 7.631 1.00 0.00 H new ATOM 0 HG11 VAL A 236 -0.087 7.289 8.152 1.00 0.00 H new ATOM 0 HG12 VAL A 236 -1.711 7.323 7.425 1.00 0.00 H new ATOM 0 HG13 VAL A 236 -1.514 7.582 9.174 1.00 0.00 H new ATOM 0 HG21 VAL A 236 0.600 5.512 9.586 1.00 0.00 H new ATOM 0 HG22 VAL A 236 -0.828 5.646 10.640 1.00 0.00 H new ATOM 0 HG23 VAL A 236 -0.429 4.089 9.876 1.00 0.00 H new ATOM 214 N THR A 237 -3.767 7.250 9.193 1.00 0.00 N ATOM 215 CA THR A 237 -4.797 8.288 9.202 1.00 0.00 C ATOM 216 C THR A 237 -5.497 8.486 7.854 1.00 0.00 C ATOM 217 O THR A 237 -4.872 8.832 6.847 1.00 0.00 O ATOM 218 CB THR A 237 -4.171 9.626 9.640 1.00 0.00 C ATOM 219 OG1 THR A 237 -3.538 9.466 10.919 1.00 0.00 O ATOM 220 CG2 THR A 237 -5.219 10.729 9.723 1.00 0.00 C ATOM 0 H THR A 237 -2.959 7.488 9.768 1.00 0.00 H new ATOM 0 HA THR A 237 -5.560 7.952 9.904 1.00 0.00 H new ATOM 0 HB THR A 237 -3.432 9.915 8.893 1.00 0.00 H new ATOM 0 HG1 THR A 237 -3.139 10.317 11.195 1.00 0.00 H new ATOM 0 HG21 THR A 237 -4.744 11.659 10.035 1.00 0.00 H new ATOM 0 HG22 THR A 237 -5.680 10.867 8.745 1.00 0.00 H new ATOM 0 HG23 THR A 237 -5.983 10.451 10.449 1.00 0.00 H new ATOM 228 N TYR A 238 -6.804 8.265 7.858 1.00 0.00 N ATOM 229 CA TYR A 238 -7.631 8.519 6.691 1.00 0.00 C ATOM 230 C TYR A 238 -8.487 9.754 6.962 1.00 0.00 C ATOM 231 O TYR A 238 -9.639 9.640 7.382 1.00 0.00 O ATOM 232 CB TYR A 238 -8.551 7.307 6.411 1.00 0.00 C ATOM 233 CG TYR A 238 -8.997 7.174 4.980 1.00 0.00 C ATOM 234 CD1 TYR A 238 -8.165 6.613 4.028 1.00 0.00 C ATOM 235 CD2 TYR A 238 -10.257 7.599 4.587 1.00 0.00 C ATOM 236 CE1 TYR A 238 -8.572 6.482 2.717 1.00 0.00 C ATOM 237 CE2 TYR A 238 -10.673 7.470 3.280 1.00 0.00 C ATOM 238 CZ TYR A 238 -9.826 6.912 2.347 1.00 0.00 C ATOM 239 OH TYR A 238 -10.235 6.783 1.041 1.00 0.00 O ATOM 0 H TYR A 238 -7.316 7.907 8.664 1.00 0.00 H new ATOM 0 HA TYR A 238 -6.994 8.681 5.822 1.00 0.00 H new ATOM 0 HB2 TYR A 238 -8.027 6.396 6.700 1.00 0.00 H new ATOM 0 HB3 TYR A 238 -9.433 7.383 7.047 1.00 0.00 H new ATOM 0 HD1 TYR A 238 -7.181 6.272 4.316 1.00 0.00 H new ATOM 0 HD2 TYR A 238 -10.922 8.038 5.316 1.00 0.00 H new ATOM 0 HE1 TYR A 238 -7.910 6.044 1.984 1.00 0.00 H new ATOM 0 HE2 TYR A 238 -11.658 7.804 2.988 1.00 0.00 H new ATOM 0 HH TYR A 238 -11.145 7.134 0.947 1.00 0.00 H new ATOM 249 N ASN A 239 -7.922 10.929 6.731 1.00 0.00 N ATOM 250 CA ASN A 239 -8.604 12.176 7.043 1.00 0.00 C ATOM 251 C ASN A 239 -9.270 12.688 5.776 1.00 0.00 C ATOM 252 O ASN A 239 -8.599 13.009 4.804 1.00 0.00 O ATOM 253 CB ASN A 239 -7.597 13.194 7.587 1.00 0.00 C ATOM 254 CG ASN A 239 -8.085 13.928 8.823 1.00 0.00 C ATOM 255 OD1 ASN A 239 -7.694 15.067 9.069 1.00 0.00 O ATOM 256 ND2 ASN A 239 -8.908 13.277 9.632 1.00 0.00 N ATOM 0 H ASN A 239 -6.992 11.045 6.328 1.00 0.00 H new ATOM 0 HA ASN A 239 -9.364 12.016 7.808 1.00 0.00 H new ATOM 0 HB2 ASN A 239 -6.665 12.680 7.823 1.00 0.00 H new ATOM 0 HB3 ASN A 239 -7.371 13.922 6.808 1.00 0.00 H new ATOM 0 HD21 ASN A 239 -9.237 13.720 10.490 1.00 0.00 H new ATOM 0 HD22 ASN A 239 -9.213 12.332 9.397 1.00 0.00 H new ATOM 263 N ALA A 240 -10.584 12.755 5.775 1.00 0.00 N ATOM 264 CA ALA A 240 -11.322 12.950 4.535 1.00 0.00 C ATOM 265 C ALA A 240 -11.780 14.386 4.354 1.00 0.00 C ATOM 266 O ALA A 240 -11.675 14.940 3.262 1.00 0.00 O ATOM 267 CB ALA A 240 -12.500 12.002 4.474 1.00 0.00 C ATOM 0 H ALA A 240 -11.165 12.679 6.610 1.00 0.00 H new ATOM 0 HA ALA A 240 -10.641 12.730 3.713 1.00 0.00 H new ATOM 0 HB1 ALA A 240 -13.044 12.157 3.542 1.00 0.00 H new ATOM 0 HB2 ALA A 240 -12.142 10.973 4.518 1.00 0.00 H new ATOM 0 HB3 ALA A 240 -13.164 12.192 5.318 1.00 0.00 H new ATOM 273 N VAL A 241 -12.277 14.991 5.421 1.00 0.00 N ATOM 274 CA VAL A 241 -12.709 16.384 5.371 1.00 0.00 C ATOM 275 C VAL A 241 -11.497 17.283 5.135 1.00 0.00 C ATOM 276 O VAL A 241 -11.608 18.392 4.613 1.00 0.00 O ATOM 277 CB VAL A 241 -13.425 16.800 6.682 1.00 0.00 C ATOM 278 CG1 VAL A 241 -13.967 18.225 6.595 1.00 0.00 C ATOM 279 CG2 VAL A 241 -14.544 15.823 7.021 1.00 0.00 C ATOM 0 H VAL A 241 -12.392 14.544 6.330 1.00 0.00 H new ATOM 0 HA VAL A 241 -13.419 16.494 4.551 1.00 0.00 H new ATOM 0 HB VAL A 241 -12.686 16.772 7.483 1.00 0.00 H new ATOM 0 HG11 VAL A 241 -14.463 18.484 7.531 1.00 0.00 H new ATOM 0 HG12 VAL A 241 -13.144 18.917 6.417 1.00 0.00 H new ATOM 0 HG13 VAL A 241 -14.682 18.293 5.775 1.00 0.00 H new ATOM 0 HG21 VAL A 241 -15.032 16.135 7.944 1.00 0.00 H new ATOM 0 HG22 VAL A 241 -15.274 15.810 6.211 1.00 0.00 H new ATOM 0 HG23 VAL A 241 -14.128 14.824 7.150 1.00 0.00 H new ATOM 289 N LYS A 242 -10.336 16.773 5.513 1.00 0.00 N ATOM 290 CA LYS A 242 -9.082 17.493 5.354 1.00 0.00 C ATOM 291 C LYS A 242 -8.345 17.036 4.103 1.00 0.00 C ATOM 292 O LYS A 242 -7.343 17.627 3.703 1.00 0.00 O ATOM 293 CB LYS A 242 -8.206 17.253 6.576 1.00 0.00 C ATOM 294 CG LYS A 242 -8.932 17.497 7.886 1.00 0.00 C ATOM 295 CD LYS A 242 -9.277 18.962 8.081 1.00 0.00 C ATOM 296 CE LYS A 242 -8.042 19.842 8.016 1.00 0.00 C ATOM 297 NZ LYS A 242 -8.358 21.268 8.283 1.00 0.00 N1+ ATOM 0 H LYS A 242 -10.236 15.851 5.938 1.00 0.00 H new ATOM 0 HA LYS A 242 -9.302 18.556 5.254 1.00 0.00 H new ATOM 0 HB2 LYS A 242 -7.839 16.227 6.557 1.00 0.00 H new ATOM 0 HB3 LYS A 242 -7.334 17.905 6.524 1.00 0.00 H new ATOM 0 HG2 LYS A 242 -9.846 16.903 7.910 1.00 0.00 H new ATOM 0 HG3 LYS A 242 -8.310 17.158 8.714 1.00 0.00 H new ATOM 0 HD2 LYS A 242 -9.987 19.274 7.315 1.00 0.00 H new ATOM 0 HD3 LYS A 242 -9.769 19.095 9.045 1.00 0.00 H new ATOM 0 HE2 LYS A 242 -7.309 19.491 8.742 1.00 0.00 H new ATOM 0 HE3 LYS A 242 -7.584 19.751 7.031 1.00 0.00 H new ATOM 0 HZ1 LYS A 242 -7.486 21.833 8.229 1.00 0.00 H new ATOM 0 HZ2 LYS A 242 -9.038 21.611 7.575 1.00 0.00 H new ATOM 0 HZ3 LYS A 242 -8.771 21.360 9.233 1.00 0.00 H new ATOM 311 N ASP A 243 -8.864 15.967 3.504 1.00 0.00 N ATOM 312 CA ASP A 243 -8.249 15.314 2.345 1.00 0.00 C ATOM 313 C ASP A 243 -6.794 14.970 2.638 1.00 0.00 C ATOM 314 O ASP A 243 -5.873 15.388 1.939 1.00 0.00 O ATOM 315 CB ASP A 243 -8.357 16.190 1.091 1.00 0.00 C ATOM 316 CG ASP A 243 -8.040 15.427 -0.184 1.00 0.00 C ATOM 317 OD1 ASP A 243 -8.898 14.641 -0.638 1.00 0.00 O ATOM 318 OD2 ASP A 243 -6.945 15.621 -0.753 1.00 0.00 O1- ATOM 0 H ASP A 243 -9.730 15.524 3.810 1.00 0.00 H new ATOM 0 HA ASP A 243 -8.793 14.389 2.152 1.00 0.00 H new ATOM 0 HB2 ASP A 243 -9.365 16.599 1.024 1.00 0.00 H new ATOM 0 HB3 ASP A 243 -7.675 17.035 1.183 1.00 0.00 H new ATOM 323 N SER A 244 -6.602 14.203 3.689 1.00 0.00 N ATOM 324 CA SER A 244 -5.278 13.792 4.110 1.00 0.00 C ATOM 325 C SER A 244 -5.264 12.286 4.306 1.00 0.00 C ATOM 326 O SER A 244 -5.675 11.778 5.349 1.00 0.00 O ATOM 327 CB SER A 244 -4.888 14.511 5.402 1.00 0.00 C ATOM 328 OG SER A 244 -5.063 15.914 5.270 1.00 0.00 O ATOM 0 H SER A 244 -7.357 13.847 4.275 1.00 0.00 H new ATOM 0 HA SER A 244 -4.550 14.058 3.344 1.00 0.00 H new ATOM 0 HB2 SER A 244 -5.495 14.140 6.228 1.00 0.00 H new ATOM 0 HB3 SER A 244 -3.849 14.291 5.647 1.00 0.00 H new ATOM 0 HG SER A 244 -4.810 16.355 6.107 1.00 0.00 H new ATOM 334 N TYR A 245 -4.808 11.574 3.295 1.00 0.00 N ATOM 335 CA TYR A 245 -4.880 10.129 3.299 1.00 0.00 C ATOM 336 C TYR A 245 -3.483 9.550 3.299 1.00 0.00 C ATOM 337 O TYR A 245 -2.755 9.658 2.308 1.00 0.00 O ATOM 338 CB TYR A 245 -5.660 9.630 2.080 1.00 0.00 C ATOM 339 CG TYR A 245 -7.057 10.210 1.951 1.00 0.00 C ATOM 340 CD1 TYR A 245 -7.401 11.006 0.865 1.00 0.00 C ATOM 341 CD2 TYR A 245 -8.031 9.969 2.916 1.00 0.00 C ATOM 342 CE1 TYR A 245 -8.667 11.542 0.744 1.00 0.00 C ATOM 343 CE2 TYR A 245 -9.296 10.499 2.800 1.00 0.00 C ATOM 344 CZ TYR A 245 -9.611 11.285 1.712 1.00 0.00 C ATOM 345 OH TYR A 245 -10.873 11.819 1.592 1.00 0.00 O ATOM 0 H TYR A 245 -4.383 11.975 2.459 1.00 0.00 H new ATOM 0 HA TYR A 245 -5.402 9.803 4.198 1.00 0.00 H new ATOM 0 HB2 TYR A 245 -5.095 9.870 1.179 1.00 0.00 H new ATOM 0 HB3 TYR A 245 -5.734 8.544 2.130 1.00 0.00 H new ATOM 0 HD1 TYR A 245 -6.664 11.209 0.102 1.00 0.00 H new ATOM 0 HD2 TYR A 245 -7.790 9.355 3.771 1.00 0.00 H new ATOM 0 HE1 TYR A 245 -8.916 12.160 -0.106 1.00 0.00 H new ATOM 0 HE2 TYR A 245 -10.039 10.300 3.558 1.00 0.00 H new ATOM 0 HH TYR A 245 -11.523 11.223 2.020 1.00 0.00 H new ATOM 355 N GLN A 246 -3.091 8.969 4.417 1.00 0.00 N ATOM 356 CA GLN A 246 -1.786 8.366 4.521 1.00 0.00 C ATOM 357 C GLN A 246 -1.943 6.942 5.002 1.00 0.00 C ATOM 358 O GLN A 246 -2.924 6.618 5.662 1.00 0.00 O ATOM 359 CB GLN A 246 -0.911 9.158 5.495 1.00 0.00 C ATOM 360 CG GLN A 246 -0.834 10.644 5.190 1.00 0.00 C ATOM 361 CD GLN A 246 0.059 11.394 6.158 1.00 0.00 C ATOM 362 OE1 GLN A 246 -0.180 12.562 6.463 1.00 0.00 O ATOM 363 NE2 GLN A 246 1.097 10.731 6.643 1.00 0.00 N ATOM 0 H GLN A 246 -3.660 8.904 5.261 1.00 0.00 H new ATOM 0 HA GLN A 246 -1.302 8.373 3.544 1.00 0.00 H new ATOM 0 HB2 GLN A 246 -1.298 9.025 6.505 1.00 0.00 H new ATOM 0 HB3 GLN A 246 0.097 8.742 5.482 1.00 0.00 H new ATOM 0 HG2 GLN A 246 -0.461 10.784 4.175 1.00 0.00 H new ATOM 0 HG3 GLN A 246 -1.837 11.070 5.223 1.00 0.00 H new ATOM 0 HE21 GLN A 246 1.259 9.763 6.364 1.00 0.00 H new ATOM 0 HE22 GLN A 246 1.734 11.188 7.295 1.00 0.00 H new ATOM 372 N PHE A 247 -1.004 6.086 4.665 1.00 0.00 N ATOM 373 CA PHE A 247 -1.022 4.733 5.181 1.00 0.00 C ATOM 374 C PHE A 247 0.390 4.189 5.348 1.00 0.00 C ATOM 375 O PHE A 247 1.252 4.449 4.521 1.00 0.00 O ATOM 376 CB PHE A 247 -1.867 3.810 4.308 1.00 0.00 C ATOM 377 CG PHE A 247 -1.531 3.790 2.842 1.00 0.00 C ATOM 378 CD1 PHE A 247 -2.228 4.583 1.952 1.00 0.00 C ATOM 379 CD2 PHE A 247 -0.562 2.933 2.347 1.00 0.00 C ATOM 380 CE1 PHE A 247 -1.969 4.521 0.599 1.00 0.00 C ATOM 381 CE2 PHE A 247 -0.296 2.872 0.998 1.00 0.00 C ATOM 382 CZ PHE A 247 -1.004 3.663 0.121 1.00 0.00 C ATOM 0 H PHE A 247 -0.225 6.298 4.042 1.00 0.00 H new ATOM 0 HA PHE A 247 -1.487 4.767 6.166 1.00 0.00 H new ATOM 0 HB2 PHE A 247 -1.775 2.795 4.694 1.00 0.00 H new ATOM 0 HB3 PHE A 247 -2.912 4.099 4.416 1.00 0.00 H new ATOM 0 HD1 PHE A 247 -2.985 5.260 2.320 1.00 0.00 H new ATOM 0 HD2 PHE A 247 -0.008 2.304 3.028 1.00 0.00 H new ATOM 0 HE1 PHE A 247 -2.523 5.146 -0.086 1.00 0.00 H new ATOM 0 HE2 PHE A 247 0.468 2.204 0.628 1.00 0.00 H new ATOM 0 HZ PHE A 247 -0.803 3.611 -0.939 1.00 0.00 H new ATOM 392 N THR A 248 0.640 3.447 6.422 1.00 0.00 N ATOM 393 CA THR A 248 1.969 2.915 6.670 1.00 0.00 C ATOM 394 C THR A 248 2.056 1.483 6.199 1.00 0.00 C ATOM 395 O THR A 248 1.086 0.730 6.312 1.00 0.00 O ATOM 396 CB THR A 248 2.322 2.974 8.174 1.00 0.00 C ATOM 397 OG1 THR A 248 2.345 4.333 8.624 1.00 0.00 O ATOM 398 CG2 THR A 248 3.666 2.316 8.462 1.00 0.00 C ATOM 0 H THR A 248 -0.056 3.204 7.127 1.00 0.00 H new ATOM 0 HA THR A 248 2.679 3.529 6.116 1.00 0.00 H new ATOM 0 HB THR A 248 1.552 2.423 8.714 1.00 0.00 H new ATOM 0 HG1 THR A 248 2.568 4.358 9.578 1.00 0.00 H new ATOM 0 HG21 THR A 248 3.880 2.377 9.529 1.00 0.00 H new ATOM 0 HG22 THR A 248 3.631 1.270 8.158 1.00 0.00 H new ATOM 0 HG23 THR A 248 4.449 2.830 7.905 1.00 0.00 H new ATOM 406 N VAL A 249 3.210 1.107 5.668 1.00 0.00 N ATOM 407 CA VAL A 249 3.406 -0.265 5.225 1.00 0.00 C ATOM 408 C VAL A 249 4.816 -0.752 5.567 1.00 0.00 C ATOM 409 O VAL A 249 5.806 -0.115 5.217 1.00 0.00 O ATOM 410 CB VAL A 249 3.159 -0.423 3.703 1.00 0.00 C ATOM 411 CG1 VAL A 249 3.663 -1.759 3.182 1.00 0.00 C ATOM 412 CG2 VAL A 249 1.689 -0.251 3.368 1.00 0.00 C ATOM 0 H VAL A 249 4.013 1.721 5.535 1.00 0.00 H new ATOM 0 HA VAL A 249 2.674 -0.875 5.755 1.00 0.00 H new ATOM 0 HB VAL A 249 3.726 0.365 3.207 1.00 0.00 H new ATOM 0 HG11 VAL A 249 3.470 -1.828 2.111 1.00 0.00 H new ATOM 0 HG12 VAL A 249 4.735 -1.839 3.363 1.00 0.00 H new ATOM 0 HG13 VAL A 249 3.146 -2.569 3.697 1.00 0.00 H new ATOM 0 HG21 VAL A 249 1.545 -0.367 2.294 1.00 0.00 H new ATOM 0 HG22 VAL A 249 1.105 -1.005 3.896 1.00 0.00 H new ATOM 0 HG23 VAL A 249 1.360 0.742 3.673 1.00 0.00 H new ATOM 422 N THR A 250 4.907 -1.864 6.273 1.00 0.00 N ATOM 423 CA THR A 250 6.186 -2.487 6.539 1.00 0.00 C ATOM 424 C THR A 250 6.488 -3.492 5.436 1.00 0.00 C ATOM 425 O THR A 250 5.641 -4.322 5.099 1.00 0.00 O ATOM 426 CB THR A 250 6.187 -3.197 7.905 1.00 0.00 C ATOM 427 OG1 THR A 250 5.793 -2.278 8.935 1.00 0.00 O ATOM 428 CG2 THR A 250 7.563 -3.751 8.223 1.00 0.00 C ATOM 0 H THR A 250 4.107 -2.354 6.673 1.00 0.00 H new ATOM 0 HA THR A 250 6.953 -1.713 6.563 1.00 0.00 H new ATOM 0 HB THR A 250 5.478 -4.023 7.860 1.00 0.00 H new ATOM 0 HG1 THR A 250 5.794 -2.737 9.801 1.00 0.00 H new ATOM 0 HG21 THR A 250 7.540 -4.248 9.193 1.00 0.00 H new ATOM 0 HG22 THR A 250 7.853 -4.468 7.455 1.00 0.00 H new ATOM 0 HG23 THR A 250 8.286 -2.936 8.251 1.00 0.00 H new ATOM 436 N LEU A 251 7.673 -3.409 4.858 1.00 0.00 N ATOM 437 CA LEU A 251 8.035 -4.263 3.748 1.00 0.00 C ATOM 438 C LEU A 251 9.256 -5.098 4.097 1.00 0.00 C ATOM 439 O LEU A 251 9.959 -4.836 5.074 1.00 0.00 O ATOM 440 CB LEU A 251 8.353 -3.440 2.488 1.00 0.00 C ATOM 441 CG LEU A 251 7.257 -2.509 1.963 1.00 0.00 C ATOM 442 CD1 LEU A 251 7.197 -1.222 2.767 1.00 0.00 C ATOM 443 CD2 LEU A 251 7.510 -2.190 0.506 1.00 0.00 C ATOM 0 H LEU A 251 8.402 -2.755 5.143 1.00 0.00 H new ATOM 0 HA LEU A 251 7.181 -4.910 3.548 1.00 0.00 H new ATOM 0 HB2 LEU A 251 9.238 -2.837 2.693 1.00 0.00 H new ATOM 0 HB3 LEU A 251 8.618 -4.134 1.690 1.00 0.00 H new ATOM 0 HG LEU A 251 6.300 -3.020 2.066 1.00 0.00 H new ATOM 0 HD11 LEU A 251 6.409 -0.582 2.370 1.00 0.00 H new ATOM 0 HD12 LEU A 251 6.985 -1.454 3.811 1.00 0.00 H new ATOM 0 HD13 LEU A 251 8.154 -0.705 2.698 1.00 0.00 H new ATOM 0 HD21 LEU A 251 6.727 -1.527 0.137 1.00 0.00 H new ATOM 0 HD22 LEU A 251 8.478 -1.700 0.404 1.00 0.00 H new ATOM 0 HD23 LEU A 251 7.507 -3.113 -0.074 1.00 0.00 H new ATOM 455 N THR A 252 9.492 -6.106 3.299 1.00 0.00 N ATOM 456 CA THR A 252 10.718 -6.859 3.354 1.00 0.00 C ATOM 457 C THR A 252 11.415 -6.775 1.994 1.00 0.00 C ATOM 458 O THR A 252 10.762 -6.874 0.953 1.00 0.00 O ATOM 459 CB THR A 252 10.442 -8.323 3.707 1.00 0.00 C ATOM 460 OG1 THR A 252 9.023 -8.569 3.688 1.00 0.00 O ATOM 461 CG2 THR A 252 11.018 -8.686 5.077 1.00 0.00 C ATOM 0 H THR A 252 8.836 -6.430 2.589 1.00 0.00 H new ATOM 0 HA THR A 252 11.359 -6.438 4.129 1.00 0.00 H new ATOM 0 HB THR A 252 10.932 -8.950 2.962 1.00 0.00 H new ATOM 0 HG1 THR A 252 8.851 -9.507 3.913 1.00 0.00 H new ATOM 0 HG21 THR A 252 10.804 -9.732 5.296 1.00 0.00 H new ATOM 0 HG22 THR A 252 12.097 -8.530 5.071 1.00 0.00 H new ATOM 0 HG23 THR A 252 10.564 -8.055 5.841 1.00 0.00 H new ATOM 469 N GLY A 253 12.721 -6.577 1.996 1.00 0.00 N ATOM 470 CA GLY A 253 13.449 -6.414 0.761 1.00 0.00 C ATOM 471 C GLY A 253 14.626 -7.354 0.670 1.00 0.00 C ATOM 472 O GLY A 253 14.555 -8.494 1.135 1.00 0.00 O ATOM 0 H GLY A 253 13.293 -6.526 2.839 1.00 0.00 H new ATOM 0 HA2 GLY A 253 12.779 -6.590 -0.081 1.00 0.00 H new ATOM 0 HA3 GLY A 253 13.800 -5.385 0.680 1.00 0.00 H new ATOM 476 N ALA A 254 15.711 -6.879 0.084 1.00 0.00 N ATOM 477 CA ALA A 254 16.884 -7.711 -0.119 1.00 0.00 C ATOM 478 C ALA A 254 18.075 -7.254 0.714 1.00 0.00 C ATOM 479 O ALA A 254 17.956 -6.361 1.553 1.00 0.00 O ATOM 480 CB ALA A 254 17.240 -7.764 -1.595 1.00 0.00 C ATOM 0 H ALA A 254 15.804 -5.923 -0.259 1.00 0.00 H new ATOM 0 HA ALA A 254 16.634 -8.715 0.223 1.00 0.00 H new ATOM 0 HB1 ALA A 254 18.121 -8.391 -1.735 1.00 0.00 H new ATOM 0 HB2 ALA A 254 16.404 -8.183 -2.156 1.00 0.00 H new ATOM 0 HB3 ALA A 254 17.450 -6.757 -1.955 1.00 0.00 H new ATOM 486 N THR A 255 19.213 -7.895 0.459 1.00 0.00 N ATOM 487 CA THR A 255 20.428 -7.752 1.254 1.00 0.00 C ATOM 488 C THR A 255 20.922 -6.298 1.368 1.00 0.00 C ATOM 489 O THR A 255 20.456 -5.400 0.659 1.00 0.00 O ATOM 490 CB THR A 255 21.540 -8.627 0.630 1.00 0.00 C ATOM 491 OG1 THR A 255 20.945 -9.820 0.095 1.00 0.00 O ATOM 492 CG2 THR A 255 22.607 -9.025 1.662 1.00 0.00 C ATOM 0 H THR A 255 19.317 -8.542 -0.323 1.00 0.00 H new ATOM 0 HA THR A 255 20.188 -8.077 2.266 1.00 0.00 H new ATOM 0 HB THR A 255 22.028 -8.045 -0.151 1.00 0.00 H new ATOM 0 HG1 THR A 255 21.641 -10.382 -0.305 1.00 0.00 H new ATOM 0 HG21 THR A 255 23.368 -9.639 1.180 1.00 0.00 H new ATOM 0 HG22 THR A 255 23.070 -8.127 2.071 1.00 0.00 H new ATOM 0 HG23 THR A 255 22.140 -9.592 2.468 1.00 0.00 H new ATOM 500 N ALA A 256 21.882 -6.099 2.267 1.00 0.00 N ATOM 501 CA ALA A 256 22.473 -4.795 2.540 1.00 0.00 C ATOM 502 C ALA A 256 23.271 -4.257 1.347 1.00 0.00 C ATOM 503 O ALA A 256 23.299 -4.873 0.276 1.00 0.00 O ATOM 504 CB ALA A 256 23.358 -4.890 3.776 1.00 0.00 C ATOM 0 H ALA A 256 22.276 -6.850 2.833 1.00 0.00 H new ATOM 0 HA ALA A 256 21.662 -4.089 2.720 1.00 0.00 H new ATOM 0 HB1 ALA A 256 23.801 -3.916 3.982 1.00 0.00 H new ATOM 0 HB2 ALA A 256 22.758 -5.204 4.630 1.00 0.00 H new ATOM 0 HB3 ALA A 256 24.149 -5.619 3.602 1.00 0.00 H new ATOM 510 N SER A 257 23.896 -3.093 1.556 1.00 0.00 N ATOM 511 CA SER A 257 24.687 -2.399 0.540 1.00 0.00 C ATOM 512 C SER A 257 23.782 -1.633 -0.433 1.00 0.00 C ATOM 513 O SER A 257 24.208 -1.237 -1.519 1.00 0.00 O ATOM 514 CB SER A 257 25.620 -3.372 -0.202 1.00 0.00 C ATOM 515 OG SER A 257 26.577 -2.687 -0.997 1.00 0.00 O ATOM 0 H SER A 257 23.865 -2.602 2.449 1.00 0.00 H new ATOM 0 HA SER A 257 25.318 -1.669 1.047 1.00 0.00 H new ATOM 0 HB2 SER A 257 26.135 -4.004 0.522 1.00 0.00 H new ATOM 0 HB3 SER A 257 25.027 -4.031 -0.836 1.00 0.00 H new ATOM 0 HG SER A 257 26.148 -1.928 -1.444 1.00 0.00 H new ATOM 521 N VAL A 258 22.531 -1.424 -0.030 1.00 0.00 N ATOM 522 CA VAL A 258 21.611 -0.577 -0.773 1.00 0.00 C ATOM 523 C VAL A 258 20.990 0.439 0.184 1.00 0.00 C ATOM 524 O VAL A 258 19.951 0.180 0.817 1.00 0.00 O ATOM 525 CB VAL A 258 20.501 -1.394 -1.476 1.00 0.00 C ATOM 526 CG1 VAL A 258 19.612 -0.488 -2.317 1.00 0.00 C ATOM 527 CG2 VAL A 258 21.102 -2.496 -2.337 1.00 0.00 C ATOM 0 H VAL A 258 22.132 -1.835 0.814 1.00 0.00 H new ATOM 0 HA VAL A 258 22.174 -0.067 -1.555 1.00 0.00 H new ATOM 0 HB VAL A 258 19.887 -1.858 -0.704 1.00 0.00 H new ATOM 0 HG11 VAL A 258 18.839 -1.085 -2.802 1.00 0.00 H new ATOM 0 HG12 VAL A 258 19.145 0.260 -1.676 1.00 0.00 H new ATOM 0 HG13 VAL A 258 20.215 0.010 -3.076 1.00 0.00 H new ATOM 0 HG21 VAL A 258 20.302 -3.057 -2.821 1.00 0.00 H new ATOM 0 HG22 VAL A 258 21.746 -2.054 -3.097 1.00 0.00 H new ATOM 0 HG23 VAL A 258 21.689 -3.168 -1.711 1.00 0.00 H new ATOM 537 N THR A 259 21.648 1.586 0.299 1.00 0.00 N ATOM 538 CA THR A 259 21.257 2.609 1.255 1.00 0.00 C ATOM 539 C THR A 259 19.990 3.328 0.804 1.00 0.00 C ATOM 540 O THR A 259 20.038 4.267 0.006 1.00 0.00 O ATOM 541 CB THR A 259 22.388 3.632 1.466 1.00 0.00 C ATOM 542 OG1 THR A 259 23.616 2.946 1.749 1.00 0.00 O ATOM 543 CG2 THR A 259 22.061 4.573 2.617 1.00 0.00 C ATOM 0 H THR A 259 22.462 1.830 -0.265 1.00 0.00 H new ATOM 0 HA THR A 259 21.057 2.108 2.202 1.00 0.00 H new ATOM 0 HB THR A 259 22.493 4.218 0.553 1.00 0.00 H new ATOM 0 HG1 THR A 259 24.333 3.600 1.881 1.00 0.00 H new ATOM 0 HG21 THR A 259 22.875 5.286 2.746 1.00 0.00 H new ATOM 0 HG22 THR A 259 21.139 5.111 2.397 1.00 0.00 H new ATOM 0 HG23 THR A 259 21.935 3.997 3.533 1.00 0.00 H new ATOM 551 N GLY A 260 18.864 2.867 1.319 1.00 0.00 N ATOM 552 CA GLY A 260 17.586 3.448 0.983 1.00 0.00 C ATOM 553 C GLY A 260 17.101 3.057 -0.397 1.00 0.00 C ATOM 554 O GLY A 260 17.471 3.691 -1.386 1.00 0.00 O ATOM 0 H GLY A 260 18.814 2.087 1.975 1.00 0.00 H new ATOM 0 HA2 GLY A 260 16.847 3.139 1.722 1.00 0.00 H new ATOM 0 HA3 GLY A 260 17.660 4.534 1.041 1.00 0.00 H new ATOM 558 N PHE A 261 16.293 1.999 -0.463 1.00 0.00 N ATOM 559 CA PHE A 261 15.609 1.618 -1.703 1.00 0.00 C ATOM 560 C PHE A 261 15.038 2.839 -2.435 1.00 0.00 C ATOM 561 O PHE A 261 15.355 3.076 -3.601 1.00 0.00 O ATOM 562 CB PHE A 261 14.435 0.662 -1.411 1.00 0.00 C ATOM 563 CG PHE A 261 14.793 -0.795 -1.374 1.00 0.00 C ATOM 564 CD1 PHE A 261 15.333 -1.415 -2.488 1.00 0.00 C ATOM 565 CD2 PHE A 261 14.553 -1.552 -0.239 1.00 0.00 C ATOM 566 CE1 PHE A 261 15.628 -2.763 -2.472 1.00 0.00 C ATOM 567 CE2 PHE A 261 14.852 -2.901 -0.215 1.00 0.00 C ATOM 568 CZ PHE A 261 15.389 -3.507 -1.335 1.00 0.00 C ATOM 0 H PHE A 261 16.094 1.388 0.329 1.00 0.00 H new ATOM 0 HA PHE A 261 16.357 1.130 -2.328 1.00 0.00 H new ATOM 0 HB2 PHE A 261 13.994 0.936 -0.453 1.00 0.00 H new ATOM 0 HB3 PHE A 261 13.667 0.812 -2.170 1.00 0.00 H new ATOM 0 HD1 PHE A 261 15.526 -0.837 -3.380 1.00 0.00 H new ATOM 0 HD2 PHE A 261 14.128 -1.083 0.636 1.00 0.00 H new ATOM 0 HE1 PHE A 261 16.046 -3.235 -3.349 1.00 0.00 H new ATOM 0 HE2 PHE A 261 14.666 -3.481 0.677 1.00 0.00 H new ATOM 0 HZ PHE A 261 15.621 -4.562 -1.320 1.00 0.00 H new ATOM 578 N LEU A 262 14.202 3.611 -1.742 1.00 0.00 N ATOM 579 CA LEU A 262 13.528 4.752 -2.349 1.00 0.00 C ATOM 580 C LEU A 262 13.015 5.690 -1.262 1.00 0.00 C ATOM 581 O LEU A 262 12.962 5.312 -0.092 1.00 0.00 O ATOM 582 CB LEU A 262 12.371 4.292 -3.257 1.00 0.00 C ATOM 583 CG LEU A 262 11.116 3.738 -2.560 1.00 0.00 C ATOM 584 CD1 LEU A 262 10.013 3.510 -3.581 1.00 0.00 C ATOM 585 CD2 LEU A 262 11.407 2.438 -1.824 1.00 0.00 C ATOM 0 H LEU A 262 13.977 3.465 -0.758 1.00 0.00 H new ATOM 0 HA LEU A 262 14.246 5.288 -2.970 1.00 0.00 H new ATOM 0 HB2 LEU A 262 12.070 5.137 -3.877 1.00 0.00 H new ATOM 0 HB3 LEU A 262 12.753 3.524 -3.929 1.00 0.00 H new ATOM 0 HG LEU A 262 10.794 4.476 -1.825 1.00 0.00 H new ATOM 0 HD11 LEU A 262 9.128 3.118 -3.079 1.00 0.00 H new ATOM 0 HD12 LEU A 262 9.766 4.454 -4.067 1.00 0.00 H new ATOM 0 HD13 LEU A 262 10.353 2.794 -4.330 1.00 0.00 H new ATOM 0 HD21 LEU A 262 10.496 2.079 -1.345 1.00 0.00 H new ATOM 0 HD22 LEU A 262 11.763 1.690 -2.533 1.00 0.00 H new ATOM 0 HD23 LEU A 262 12.171 2.612 -1.066 1.00 0.00 H new ATOM 597 N LYS A 263 12.659 6.910 -1.642 1.00 0.00 N ATOM 598 CA LYS A 263 12.210 7.911 -0.686 1.00 0.00 C ATOM 599 C LYS A 263 11.046 8.725 -1.228 1.00 0.00 C ATOM 600 O LYS A 263 10.434 8.354 -2.231 1.00 0.00 O ATOM 601 CB LYS A 263 13.364 8.838 -0.318 1.00 0.00 C ATOM 602 CG LYS A 263 14.419 8.155 0.515 1.00 0.00 C ATOM 603 CD LYS A 263 15.507 9.126 0.941 1.00 0.00 C ATOM 604 CE LYS A 263 16.589 8.433 1.750 1.00 0.00 C ATOM 605 NZ LYS A 263 17.740 9.335 2.022 1.00 0.00 N1+ ATOM 0 H LYS A 263 12.673 7.230 -2.610 1.00 0.00 H new ATOM 0 HA LYS A 263 11.865 7.386 0.205 1.00 0.00 H new ATOM 0 HB2 LYS A 263 13.820 9.222 -1.230 1.00 0.00 H new ATOM 0 HB3 LYS A 263 12.974 9.696 0.230 1.00 0.00 H new ATOM 0 HG2 LYS A 263 13.957 7.714 1.398 1.00 0.00 H new ATOM 0 HG3 LYS A 263 14.862 7.338 -0.055 1.00 0.00 H new ATOM 0 HD2 LYS A 263 15.951 9.586 0.058 1.00 0.00 H new ATOM 0 HD3 LYS A 263 15.068 9.929 1.533 1.00 0.00 H new ATOM 0 HE2 LYS A 263 16.170 8.084 2.694 1.00 0.00 H new ATOM 0 HE3 LYS A 263 16.937 7.552 1.211 1.00 0.00 H new ATOM 0 HZ1 LYS A 263 18.457 8.825 2.576 1.00 0.00 H new ATOM 0 HZ2 LYS A 263 18.156 9.648 1.122 1.00 0.00 H new ATOM 0 HZ3 LYS A 263 17.412 10.164 2.558 1.00 0.00 H new ATOM 619 N ALA A 264 10.744 9.829 -0.549 1.00 0.00 N ATOM 620 CA ALA A 264 9.648 10.704 -0.916 1.00 0.00 C ATOM 621 C ALA A 264 9.694 11.083 -2.382 1.00 0.00 C ATOM 622 O ALA A 264 10.692 11.603 -2.887 1.00 0.00 O ATOM 623 CB ALA A 264 9.646 11.949 -0.046 1.00 0.00 C ATOM 0 H ALA A 264 11.259 10.138 0.275 1.00 0.00 H new ATOM 0 HA ALA A 264 8.722 10.154 -0.749 1.00 0.00 H new ATOM 0 HB1 ALA A 264 8.817 12.594 -0.336 1.00 0.00 H new ATOM 0 HB2 ALA A 264 9.534 11.662 1.000 1.00 0.00 H new ATOM 0 HB3 ALA A 264 10.586 12.486 -0.177 1.00 0.00 H new ATOM 629 N GLY A 265 8.606 10.786 -3.058 1.00 0.00 N ATOM 630 CA GLY A 265 8.489 11.088 -4.466 1.00 0.00 C ATOM 631 C GLY A 265 8.523 9.837 -5.311 1.00 0.00 C ATOM 632 O GLY A 265 8.036 9.826 -6.441 1.00 0.00 O ATOM 0 H GLY A 265 7.787 10.334 -2.652 1.00 0.00 H new ATOM 0 HA2 GLY A 265 7.557 11.624 -4.647 1.00 0.00 H new ATOM 0 HA3 GLY A 265 9.301 11.751 -4.765 1.00 0.00 H new ATOM 636 N ASP A 266 9.086 8.772 -4.755 1.00 0.00 N ATOM 637 CA ASP A 266 9.194 7.511 -5.476 1.00 0.00 C ATOM 638 C ASP A 266 7.939 6.682 -5.271 1.00 0.00 C ATOM 639 O ASP A 266 7.389 6.628 -4.168 1.00 0.00 O ATOM 640 CB ASP A 266 10.426 6.719 -5.029 1.00 0.00 C ATOM 641 CG ASP A 266 11.729 7.344 -5.480 1.00 0.00 C ATOM 642 OD1 ASP A 266 12.507 7.812 -4.620 1.00 0.00 O ATOM 643 OD2 ASP A 266 11.989 7.370 -6.703 1.00 0.00 O1- ATOM 0 H ASP A 266 9.473 8.756 -3.811 1.00 0.00 H new ATOM 0 HA ASP A 266 9.305 7.738 -6.536 1.00 0.00 H new ATOM 0 HB2 ASP A 266 10.425 6.640 -3.942 1.00 0.00 H new ATOM 0 HB3 ASP A 266 10.361 5.705 -5.423 1.00 0.00 H new ATOM 648 N GLN A 267 7.482 6.038 -6.332 1.00 0.00 N ATOM 649 CA GLN A 267 6.240 5.290 -6.276 1.00 0.00 C ATOM 650 C GLN A 267 6.493 3.794 -6.392 1.00 0.00 C ATOM 651 O GLN A 267 7.373 3.351 -7.135 1.00 0.00 O ATOM 652 CB GLN A 267 5.289 5.726 -7.391 1.00 0.00 C ATOM 653 CG GLN A 267 5.048 7.225 -7.460 1.00 0.00 C ATOM 654 CD GLN A 267 3.781 7.563 -8.216 1.00 0.00 C ATOM 655 OE1 GLN A 267 3.801 7.755 -9.433 1.00 0.00 O ATOM 656 NE2 GLN A 267 2.670 7.628 -7.499 1.00 0.00 N ATOM 0 H GLN A 267 7.951 6.019 -7.238 1.00 0.00 H new ATOM 0 HA GLN A 267 5.782 5.499 -5.309 1.00 0.00 H new ATOM 0 HB2 GLN A 267 5.691 5.391 -8.347 1.00 0.00 H new ATOM 0 HB3 GLN A 267 4.332 5.222 -7.253 1.00 0.00 H new ATOM 0 HG2 GLN A 267 4.985 7.629 -6.449 1.00 0.00 H new ATOM 0 HG3 GLN A 267 5.898 7.707 -7.944 1.00 0.00 H new ATOM 0 HE21 GLN A 267 2.702 7.461 -6.493 1.00 0.00 H new ATOM 0 HE22 GLN A 267 1.782 7.845 -7.952 1.00 0.00 H new ATOM 665 N VAL A 268 5.705 3.024 -5.661 1.00 0.00 N ATOM 666 CA VAL A 268 5.755 1.574 -5.750 1.00 0.00 C ATOM 667 C VAL A 268 4.443 1.036 -6.269 1.00 0.00 C ATOM 668 O VAL A 268 3.509 1.784 -6.529 1.00 0.00 O ATOM 669 CB VAL A 268 6.043 0.874 -4.395 1.00 0.00 C ATOM 670 CG1 VAL A 268 7.540 0.766 -4.161 1.00 0.00 C ATOM 671 CG2 VAL A 268 5.386 1.622 -3.238 1.00 0.00 C ATOM 0 H VAL A 268 5.019 3.381 -4.996 1.00 0.00 H new ATOM 0 HA VAL A 268 6.580 1.355 -6.428 1.00 0.00 H new ATOM 0 HB VAL A 268 5.617 -0.128 -4.440 1.00 0.00 H new ATOM 0 HG11 VAL A 268 7.724 0.273 -3.207 1.00 0.00 H new ATOM 0 HG12 VAL A 268 7.993 0.184 -4.964 1.00 0.00 H new ATOM 0 HG13 VAL A 268 7.979 1.764 -4.145 1.00 0.00 H new ATOM 0 HG21 VAL A 268 5.605 1.109 -2.302 1.00 0.00 H new ATOM 0 HG22 VAL A 268 5.776 2.639 -3.194 1.00 0.00 H new ATOM 0 HG23 VAL A 268 4.307 1.653 -3.391 1.00 0.00 H new ATOM 681 N LYS A 269 4.387 -0.264 -6.394 1.00 0.00 N ATOM 682 CA LYS A 269 3.200 -0.955 -6.828 1.00 0.00 C ATOM 683 C LYS A 269 3.046 -2.202 -5.964 1.00 0.00 C ATOM 684 O LYS A 269 3.993 -2.970 -5.830 1.00 0.00 O ATOM 685 CB LYS A 269 3.344 -1.313 -8.318 1.00 0.00 C ATOM 686 CG LYS A 269 2.216 -2.159 -8.883 1.00 0.00 C ATOM 687 CD LYS A 269 2.387 -3.631 -8.541 1.00 0.00 C ATOM 688 CE LYS A 269 3.263 -4.351 -9.554 1.00 0.00 C ATOM 689 NZ LYS A 269 2.663 -4.347 -10.913 1.00 0.00 N1+ ATOM 0 H LYS A 269 5.174 -0.881 -6.195 1.00 0.00 H new ATOM 0 HA LYS A 269 2.311 -0.334 -6.719 1.00 0.00 H new ATOM 0 HB2 LYS A 269 3.410 -0.390 -8.894 1.00 0.00 H new ATOM 0 HB3 LYS A 269 4.284 -1.845 -8.460 1.00 0.00 H new ATOM 0 HG2 LYS A 269 1.263 -1.803 -8.491 1.00 0.00 H new ATOM 0 HG3 LYS A 269 2.179 -2.039 -9.966 1.00 0.00 H new ATOM 0 HD2 LYS A 269 2.828 -3.724 -7.549 1.00 0.00 H new ATOM 0 HD3 LYS A 269 1.409 -4.110 -8.501 1.00 0.00 H new ATOM 0 HE2 LYS A 269 4.243 -3.875 -9.589 1.00 0.00 H new ATOM 0 HE3 LYS A 269 3.420 -5.380 -9.230 1.00 0.00 H new ATOM 0 HZ1 LYS A 269 3.026 -5.157 -11.455 1.00 0.00 H new ATOM 0 HZ2 LYS A 269 1.628 -4.418 -10.836 1.00 0.00 H new ATOM 0 HZ3 LYS A 269 2.914 -3.463 -11.401 1.00 0.00 H new ATOM 703 N PHE A 270 1.886 -2.419 -5.371 1.00 0.00 N ATOM 704 CA PHE A 270 1.718 -3.589 -4.521 1.00 0.00 C ATOM 705 C PHE A 270 0.671 -4.527 -5.096 1.00 0.00 C ATOM 706 O PHE A 270 -0.157 -4.118 -5.908 1.00 0.00 O ATOM 707 CB PHE A 270 1.381 -3.196 -3.073 1.00 0.00 C ATOM 708 CG PHE A 270 0.178 -2.304 -2.914 1.00 0.00 C ATOM 709 CD1 PHE A 270 0.308 -0.928 -2.998 1.00 0.00 C ATOM 710 CD2 PHE A 270 -1.073 -2.840 -2.656 1.00 0.00 C ATOM 711 CE1 PHE A 270 -0.788 -0.101 -2.832 1.00 0.00 C ATOM 712 CE2 PHE A 270 -2.172 -2.019 -2.492 1.00 0.00 C ATOM 713 CZ PHE A 270 -2.030 -0.648 -2.580 1.00 0.00 C ATOM 0 H PHE A 270 1.065 -1.820 -5.456 1.00 0.00 H new ATOM 0 HA PHE A 270 2.670 -4.119 -4.496 1.00 0.00 H new ATOM 0 HB2 PHE A 270 1.218 -4.106 -2.495 1.00 0.00 H new ATOM 0 HB3 PHE A 270 2.246 -2.694 -2.639 1.00 0.00 H new ATOM 0 HD1 PHE A 270 1.278 -0.495 -3.196 1.00 0.00 H new ATOM 0 HD2 PHE A 270 -1.190 -3.911 -2.582 1.00 0.00 H new ATOM 0 HE1 PHE A 270 -0.672 0.971 -2.899 1.00 0.00 H new ATOM 0 HE2 PHE A 270 -3.143 -2.450 -2.295 1.00 0.00 H new ATOM 0 HZ PHE A 270 -2.889 -0.006 -2.452 1.00 0.00 H new ATOM 723 N THR A 271 0.747 -5.789 -4.702 1.00 0.00 N ATOM 724 CA THR A 271 -0.211 -6.795 -5.128 1.00 0.00 C ATOM 725 C THR A 271 -0.600 -7.660 -3.941 1.00 0.00 C ATOM 726 O THR A 271 0.116 -8.592 -3.568 1.00 0.00 O ATOM 727 CB THR A 271 0.353 -7.680 -6.273 1.00 0.00 C ATOM 728 OG1 THR A 271 1.607 -8.246 -5.870 1.00 0.00 O ATOM 729 CG2 THR A 271 0.561 -6.887 -7.579 1.00 0.00 C ATOM 0 H THR A 271 1.473 -6.143 -4.079 1.00 0.00 H new ATOM 0 HA THR A 271 -1.091 -6.282 -5.515 1.00 0.00 H new ATOM 0 HB THR A 271 -0.381 -8.462 -6.467 1.00 0.00 H new ATOM 0 HG1 THR A 271 1.546 -8.547 -4.939 1.00 0.00 H new ATOM 0 HG21 THR A 271 0.957 -7.550 -8.348 1.00 0.00 H new ATOM 0 HG22 THR A 271 -0.392 -6.475 -7.910 1.00 0.00 H new ATOM 0 HG23 THR A 271 1.266 -6.074 -7.403 1.00 0.00 H new ATOM 737 N ASN A 272 -1.737 -7.328 -3.356 1.00 0.00 N ATOM 738 CA ASN A 272 -2.193 -7.963 -2.125 1.00 0.00 C ATOM 739 C ASN A 272 -3.071 -9.173 -2.405 1.00 0.00 C ATOM 740 O ASN A 272 -3.575 -9.359 -3.512 1.00 0.00 O ATOM 741 CB ASN A 272 -2.962 -6.960 -1.258 1.00 0.00 C ATOM 742 CG ASN A 272 -4.225 -6.427 -1.917 1.00 0.00 C ATOM 743 OD1 ASN A 272 -4.276 -6.219 -3.130 1.00 0.00 O ATOM 744 ND2 ASN A 272 -5.263 -6.217 -1.125 1.00 0.00 N ATOM 0 H ASN A 272 -2.370 -6.614 -3.716 1.00 0.00 H new ATOM 0 HA ASN A 272 -1.307 -8.303 -1.590 1.00 0.00 H new ATOM 0 HB2 ASN A 272 -3.228 -7.437 -0.315 1.00 0.00 H new ATOM 0 HB3 ASN A 272 -2.307 -6.123 -1.018 1.00 0.00 H new ATOM 0 HD21 ASN A 272 -6.140 -5.872 -1.515 1.00 0.00 H new ATOM 0 HD22 ASN A 272 -5.186 -6.400 -0.124 1.00 0.00 H new ATOM 1061 N SER A 292 -3.397 -5.199 -7.394 1.00 0.00 N ATOM 1062 CA SER A 292 -3.525 -3.873 -6.816 1.00 0.00 C ATOM 1063 C SER A 292 -2.680 -2.898 -7.630 1.00 0.00 C ATOM 1064 O SER A 292 -2.306 -3.209 -8.764 1.00 0.00 O ATOM 1065 CB SER A 292 -3.097 -3.892 -5.351 1.00 0.00 C ATOM 1066 OG SER A 292 -2.757 -5.204 -4.943 1.00 0.00 O ATOM 0 HA SER A 292 -4.566 -3.550 -6.848 1.00 0.00 H new ATOM 0 HB2 SER A 292 -2.243 -3.229 -5.208 1.00 0.00 H new ATOM 0 HB3 SER A 292 -3.905 -3.510 -4.727 1.00 0.00 H new ATOM 0 HG SER A 292 -3.545 -5.641 -4.557 1.00 0.00 H new ATOM 1072 N PHE A 293 -2.372 -1.731 -7.079 1.00 0.00 N ATOM 1073 CA PHE A 293 -1.710 -0.702 -7.863 1.00 0.00 C ATOM 1074 C PHE A 293 -0.675 0.090 -7.054 1.00 0.00 C ATOM 1075 O PHE A 293 -0.070 -0.436 -6.120 1.00 0.00 O ATOM 1076 CB PHE A 293 -2.757 0.224 -8.493 1.00 0.00 C ATOM 1077 CG PHE A 293 -3.813 0.720 -7.544 1.00 0.00 C ATOM 1078 CD1 PHE A 293 -3.610 1.864 -6.789 1.00 0.00 C ATOM 1079 CD2 PHE A 293 -5.016 0.043 -7.417 1.00 0.00 C ATOM 1080 CE1 PHE A 293 -4.585 2.322 -5.926 1.00 0.00 C ATOM 1081 CE2 PHE A 293 -5.994 0.495 -6.555 1.00 0.00 C ATOM 1082 CZ PHE A 293 -5.778 1.635 -5.809 1.00 0.00 C ATOM 0 H PHE A 293 -2.566 -1.478 -6.110 1.00 0.00 H new ATOM 0 HA PHE A 293 -1.150 -1.200 -8.655 1.00 0.00 H new ATOM 0 HB2 PHE A 293 -2.247 1.083 -8.928 1.00 0.00 H new ATOM 0 HB3 PHE A 293 -3.244 -0.305 -9.312 1.00 0.00 H new ATOM 0 HD1 PHE A 293 -2.678 2.403 -6.877 1.00 0.00 H new ATOM 0 HD2 PHE A 293 -5.190 -0.849 -8.000 1.00 0.00 H new ATOM 0 HE1 PHE A 293 -4.416 3.216 -5.343 1.00 0.00 H new ATOM 0 HE2 PHE A 293 -6.926 -0.042 -6.465 1.00 0.00 H new ATOM 0 HZ PHE A 293 -6.542 1.991 -5.133 1.00 0.00 H new ATOM 1092 N THR A 294 -0.485 1.346 -7.435 1.00 0.00 N ATOM 1093 CA THR A 294 0.613 2.169 -6.954 1.00 0.00 C ATOM 1094 C THR A 294 0.422 2.667 -5.517 1.00 0.00 C ATOM 1095 O THR A 294 -0.695 2.946 -5.080 1.00 0.00 O ATOM 1096 CB THR A 294 0.759 3.396 -7.884 1.00 0.00 C ATOM 1097 OG1 THR A 294 0.885 2.961 -9.242 1.00 0.00 O ATOM 1098 CG2 THR A 294 1.950 4.284 -7.518 1.00 0.00 C ATOM 0 H THR A 294 -1.097 1.826 -8.095 1.00 0.00 H new ATOM 0 HA THR A 294 1.505 1.542 -6.960 1.00 0.00 H new ATOM 0 HB THR A 294 -0.141 3.998 -7.758 1.00 0.00 H new ATOM 0 HG1 THR A 294 0.976 3.741 -9.828 1.00 0.00 H new ATOM 0 HG21 THR A 294 2.000 5.128 -8.206 1.00 0.00 H new ATOM 0 HG22 THR A 294 1.829 4.653 -6.499 1.00 0.00 H new ATOM 0 HG23 THR A 294 2.871 3.705 -7.587 1.00 0.00 H new ATOM 1106 N ALA A 295 1.533 2.757 -4.791 1.00 0.00 N ATOM 1107 CA ALA A 295 1.592 3.496 -3.537 1.00 0.00 C ATOM 1108 C ALA A 295 2.745 4.484 -3.612 1.00 0.00 C ATOM 1109 O ALA A 295 3.656 4.302 -4.418 1.00 0.00 O ATOM 1110 CB ALA A 295 1.775 2.563 -2.357 1.00 0.00 C ATOM 0 H ALA A 295 2.416 2.320 -5.056 1.00 0.00 H new ATOM 0 HA ALA A 295 0.651 4.027 -3.390 1.00 0.00 H new ATOM 0 HB1 ALA A 295 1.815 3.145 -1.436 1.00 0.00 H new ATOM 0 HB2 ALA A 295 0.937 1.867 -2.310 1.00 0.00 H new ATOM 0 HB3 ALA A 295 2.704 2.005 -2.475 1.00 0.00 H new ATOM 1116 N THR A 296 2.732 5.520 -2.790 1.00 0.00 N ATOM 1117 CA THR A 296 3.765 6.535 -2.892 1.00 0.00 C ATOM 1118 C THR A 296 4.527 6.721 -1.585 1.00 0.00 C ATOM 1119 O THR A 296 3.953 7.082 -0.554 1.00 0.00 O ATOM 1120 CB THR A 296 3.175 7.882 -3.378 1.00 0.00 C ATOM 1121 OG1 THR A 296 2.571 7.701 -4.669 1.00 0.00 O ATOM 1122 CG2 THR A 296 4.234 8.992 -3.458 1.00 0.00 C ATOM 0 H THR A 296 2.036 5.679 -2.062 1.00 0.00 H new ATOM 0 HA THR A 296 4.481 6.181 -3.634 1.00 0.00 H new ATOM 0 HB THR A 296 2.429 8.195 -2.647 1.00 0.00 H new ATOM 0 HG1 THR A 296 2.281 8.569 -5.019 1.00 0.00 H new ATOM 0 HG21 THR A 296 3.768 9.915 -3.804 1.00 0.00 H new ATOM 0 HG22 THR A 296 4.668 9.152 -2.471 1.00 0.00 H new ATOM 0 HG23 THR A 296 5.018 8.698 -4.156 1.00 0.00 H new ATOM 1130 N VAL A 297 5.831 6.475 -1.657 1.00 0.00 N ATOM 1131 CA VAL A 297 6.705 6.547 -0.498 1.00 0.00 C ATOM 1132 C VAL A 297 7.051 7.991 -0.178 1.00 0.00 C ATOM 1133 O VAL A 297 7.379 8.774 -1.069 1.00 0.00 O ATOM 1134 CB VAL A 297 8.001 5.739 -0.730 1.00 0.00 C ATOM 1135 CG1 VAL A 297 8.922 5.815 0.478 1.00 0.00 C ATOM 1136 CG2 VAL A 297 7.671 4.291 -1.056 1.00 0.00 C ATOM 0 H VAL A 297 6.309 6.220 -2.521 1.00 0.00 H new ATOM 0 HA VAL A 297 6.171 6.113 0.348 1.00 0.00 H new ATOM 0 HB VAL A 297 8.524 6.180 -1.578 1.00 0.00 H new ATOM 0 HG11 VAL A 297 9.825 5.237 0.284 1.00 0.00 H new ATOM 0 HG12 VAL A 297 9.190 6.855 0.666 1.00 0.00 H new ATOM 0 HG13 VAL A 297 8.411 5.408 1.351 1.00 0.00 H new ATOM 0 HG21 VAL A 297 8.594 3.735 -1.217 1.00 0.00 H new ATOM 0 HG22 VAL A 297 7.120 3.848 -0.226 1.00 0.00 H new ATOM 0 HG23 VAL A 297 7.062 4.251 -1.959 1.00 0.00 H new ATOM 1146 N THR A 298 6.959 8.340 1.096 1.00 0.00 N ATOM 1147 CA THR A 298 7.247 9.690 1.540 1.00 0.00 C ATOM 1148 C THR A 298 8.231 9.665 2.715 1.00 0.00 C ATOM 1149 O THR A 298 8.282 10.593 3.527 1.00 0.00 O ATOM 1150 CB THR A 298 5.943 10.410 1.947 1.00 0.00 C ATOM 1151 OG1 THR A 298 4.907 10.086 1.008 1.00 0.00 O ATOM 1152 CG2 THR A 298 6.128 11.921 1.979 1.00 0.00 C ATOM 0 H THR A 298 6.685 7.701 1.842 1.00 0.00 H new ATOM 0 HA THR A 298 7.704 10.238 0.716 1.00 0.00 H new ATOM 0 HB THR A 298 5.671 10.075 2.948 1.00 0.00 H new ATOM 0 HG1 THR A 298 4.693 10.877 0.471 1.00 0.00 H new ATOM 0 HG21 THR A 298 5.191 12.396 2.269 1.00 0.00 H new ATOM 0 HG22 THR A 298 6.904 12.177 2.701 1.00 0.00 H new ATOM 0 HG23 THR A 298 6.422 12.273 0.990 1.00 0.00 H new ATOM 1160 N ALA A 299 9.018 8.596 2.801 1.00 0.00 N ATOM 1161 CA ALA A 299 9.927 8.415 3.926 1.00 0.00 C ATOM 1162 C ALA A 299 11.157 7.611 3.544 1.00 0.00 C ATOM 1163 O ALA A 299 11.211 6.995 2.480 1.00 0.00 O ATOM 1164 CB ALA A 299 9.195 7.749 5.082 1.00 0.00 C ATOM 0 H ALA A 299 9.044 7.847 2.109 1.00 0.00 H new ATOM 0 HA ALA A 299 10.272 9.402 4.235 1.00 0.00 H new ATOM 0 HB1 ALA A 299 9.881 7.617 5.919 1.00 0.00 H new ATOM 0 HB2 ALA A 299 8.359 8.376 5.393 1.00 0.00 H new ATOM 0 HB3 ALA A 299 8.820 6.776 4.763 1.00 0.00 H new ATOM 1170 N ASP A 300 12.143 7.642 4.433 1.00 0.00 N ATOM 1171 CA ASP A 300 13.399 6.939 4.241 1.00 0.00 C ATOM 1172 C ASP A 300 13.168 5.444 4.245 1.00 0.00 C ATOM 1173 O ASP A 300 12.749 4.874 5.254 1.00 0.00 O ATOM 1174 CB ASP A 300 14.397 7.280 5.353 1.00 0.00 C ATOM 1175 CG ASP A 300 14.661 8.762 5.493 1.00 0.00 C ATOM 1176 OD1 ASP A 300 13.869 9.448 6.177 1.00 0.00 O ATOM 1177 OD2 ASP A 300 15.678 9.243 4.950 1.00 0.00 O1- ATOM 0 H ASP A 300 12.090 8.159 5.311 1.00 0.00 H new ATOM 0 HA ASP A 300 13.808 7.253 3.281 1.00 0.00 H new ATOM 0 HB2 ASP A 300 14.019 6.895 6.300 1.00 0.00 H new ATOM 0 HB3 ASP A 300 15.339 6.768 5.154 1.00 0.00 H new ATOM 1182 N ALA A 301 13.433 4.817 3.123 1.00 0.00 N ATOM 1183 CA ALA A 301 13.350 3.363 3.050 1.00 0.00 C ATOM 1184 C ALA A 301 14.720 2.758 3.325 1.00 0.00 C ATOM 1185 O ALA A 301 15.716 3.480 3.391 1.00 0.00 O ATOM 1186 CB ALA A 301 12.779 2.876 1.715 1.00 0.00 C ATOM 0 H ALA A 301 13.705 5.277 2.254 1.00 0.00 H new ATOM 0 HA ALA A 301 12.652 3.026 3.816 1.00 0.00 H new ATOM 0 HB1 ALA A 301 12.738 1.787 1.712 1.00 0.00 H new ATOM 0 HB2 ALA A 301 11.774 3.277 1.581 1.00 0.00 H new ATOM 0 HB3 ALA A 301 13.417 3.217 0.900 1.00 0.00 H new ATOM 1192 N ASN A 302 14.782 1.445 3.493 1.00 0.00 N ATOM 1193 CA ASN A 302 16.011 0.804 3.947 1.00 0.00 C ATOM 1194 C ASN A 302 16.151 -0.606 3.381 1.00 0.00 C ATOM 1195 O ASN A 302 15.203 -1.380 3.425 1.00 0.00 O ATOM 1196 CB ASN A 302 15.992 0.728 5.475 1.00 0.00 C ATOM 1197 CG ASN A 302 17.314 0.276 6.063 1.00 0.00 C ATOM 1198 OD1 ASN A 302 18.217 1.084 6.285 1.00 0.00 O ATOM 1199 ND2 ASN A 302 17.434 -1.009 6.342 1.00 0.00 N ATOM 0 H ASN A 302 14.005 0.806 3.324 1.00 0.00 H new ATOM 0 HA ASN A 302 16.857 1.396 3.596 1.00 0.00 H new ATOM 0 HB2 ASN A 302 15.737 1.708 5.879 1.00 0.00 H new ATOM 0 HB3 ASN A 302 15.207 0.040 5.789 1.00 0.00 H new ATOM 0 HD21 ASN A 302 18.297 -1.363 6.756 1.00 0.00 H new ATOM 0 HD22 ASN A 302 16.664 -1.648 6.144 1.00 0.00 H new ATOM 1206 N SER A 303 17.313 -0.943 2.831 1.00 0.00 N ATOM 1207 CA SER A 303 17.599 -2.322 2.480 1.00 0.00 C ATOM 1208 C SER A 303 18.732 -2.845 3.358 1.00 0.00 C ATOM 1209 O SER A 303 19.904 -2.625 3.054 1.00 0.00 O ATOM 1210 CB SER A 303 18.017 -2.396 1.016 1.00 0.00 C ATOM 1211 OG SER A 303 17.584 -1.245 0.309 1.00 0.00 O ATOM 0 H SER A 303 18.063 -0.284 2.622 1.00 0.00 H new ATOM 0 HA SER A 303 16.708 -2.930 2.636 1.00 0.00 H new ATOM 0 HB2 SER A 303 19.101 -2.484 0.947 1.00 0.00 H new ATOM 0 HB3 SER A 303 17.595 -3.290 0.557 1.00 0.00 H new ATOM 0 HG SER A 303 16.681 -1.396 -0.040 1.00 0.00 H new ATOM 1217 N ASP A 304 18.398 -3.518 4.449 1.00 0.00 N ATOM 1218 CA ASP A 304 19.429 -3.983 5.371 1.00 0.00 C ATOM 1219 C ASP A 304 19.800 -5.434 5.089 1.00 0.00 C ATOM 1220 O ASP A 304 19.226 -6.064 4.204 1.00 0.00 O ATOM 1221 CB ASP A 304 18.987 -3.822 6.831 1.00 0.00 C ATOM 1222 CG ASP A 304 18.157 -4.981 7.337 1.00 0.00 C ATOM 1223 OD1 ASP A 304 16.956 -5.040 7.026 1.00 0.00 O ATOM 1224 OD2 ASP A 304 18.706 -5.830 8.066 1.00 0.00 O1- ATOM 0 H ASP A 304 17.442 -3.752 4.716 1.00 0.00 H new ATOM 0 HA ASP A 304 20.311 -3.363 5.213 1.00 0.00 H new ATOM 0 HB2 ASP A 304 19.870 -3.715 7.461 1.00 0.00 H new ATOM 0 HB3 ASP A 304 18.411 -2.902 6.930 1.00 0.00 H new ATOM 1229 N SER A 305 20.750 -5.960 5.844 1.00 0.00 N ATOM 1230 CA SER A 305 21.233 -7.320 5.642 1.00 0.00 C ATOM 1231 C SER A 305 20.106 -8.336 5.805 1.00 0.00 C ATOM 1232 O SER A 305 20.048 -9.338 5.090 1.00 0.00 O ATOM 1233 CB SER A 305 22.334 -7.608 6.653 1.00 0.00 C ATOM 1234 OG SER A 305 22.966 -8.854 6.410 1.00 0.00 O ATOM 0 H SER A 305 21.206 -5.463 6.609 1.00 0.00 H new ATOM 0 HA SER A 305 21.620 -7.407 4.627 1.00 0.00 H new ATOM 0 HB2 SER A 305 23.077 -6.811 6.616 1.00 0.00 H new ATOM 0 HB3 SER A 305 21.913 -7.605 7.658 1.00 0.00 H new ATOM 0 HG SER A 305 23.667 -9.001 7.079 1.00 0.00 H new ATOM 1240 N GLY A 306 19.184 -8.042 6.710 1.00 0.00 N ATOM 1241 CA GLY A 306 18.080 -8.940 6.964 1.00 0.00 C ATOM 1242 C GLY A 306 16.952 -8.735 5.983 1.00 0.00 C ATOM 1243 O GLY A 306 15.904 -9.368 6.094 1.00 0.00 O ATOM 0 H GLY A 306 19.183 -7.193 7.275 1.00 0.00 H new ATOM 0 HA2 GLY A 306 18.429 -9.971 6.905 1.00 0.00 H new ATOM 0 HA3 GLY A 306 17.712 -8.785 7.978 1.00 0.00 H new ATOM 1247 N GLY A 307 17.171 -7.850 5.015 1.00 0.00 N ATOM 1248 CA GLY A 307 16.174 -7.606 3.998 1.00 0.00 C ATOM 1249 C GLY A 307 14.886 -7.007 4.534 1.00 0.00 C ATOM 1250 O GLY A 307 13.807 -7.450 4.162 1.00 0.00 O ATOM 0 H GLY A 307 18.024 -7.299 4.920 1.00 0.00 H new ATOM 0 HA2 GLY A 307 16.591 -6.935 3.247 1.00 0.00 H new ATOM 0 HA3 GLY A 307 15.945 -8.545 3.494 1.00 0.00 H new ATOM 1254 N ASP A 308 14.975 -6.034 5.431 1.00 0.00 N ATOM 1255 CA ASP A 308 13.775 -5.370 5.941 1.00 0.00 C ATOM 1256 C ASP A 308 13.709 -3.907 5.499 1.00 0.00 C ATOM 1257 O ASP A 308 14.696 -3.173 5.590 1.00 0.00 O ATOM 1258 CB ASP A 308 13.713 -5.438 7.465 1.00 0.00 C ATOM 1259 CG ASP A 308 13.191 -6.761 7.986 1.00 0.00 C ATOM 1260 OD1 ASP A 308 11.961 -6.896 8.140 1.00 0.00 O ATOM 1261 OD2 ASP A 308 14.006 -7.664 8.275 1.00 0.00 O1- ATOM 0 H ASP A 308 15.852 -5.688 5.819 1.00 0.00 H new ATOM 0 HA ASP A 308 12.920 -5.902 5.522 1.00 0.00 H new ATOM 0 HB2 ASP A 308 14.710 -5.264 7.870 1.00 0.00 H new ATOM 0 HB3 ASP A 308 13.075 -4.634 7.832 1.00 0.00 H new ATOM 1266 N VAL A 309 12.535 -3.495 5.028 1.00 0.00 N ATOM 1267 CA VAL A 309 12.293 -2.116 4.590 1.00 0.00 C ATOM 1268 C VAL A 309 10.927 -1.618 5.073 1.00 0.00 C ATOM 1269 O VAL A 309 9.911 -2.174 4.721 1.00 0.00 O ATOM 1270 CB VAL A 309 12.385 -1.989 3.034 1.00 0.00 C ATOM 1271 CG1 VAL A 309 12.012 -3.288 2.333 1.00 0.00 C ATOM 1272 CG2 VAL A 309 11.512 -0.858 2.497 1.00 0.00 C ATOM 0 H VAL A 309 11.722 -4.105 4.938 1.00 0.00 H new ATOM 0 HA VAL A 309 13.071 -1.494 5.034 1.00 0.00 H new ATOM 0 HB VAL A 309 13.428 -1.759 2.816 1.00 0.00 H new ATOM 0 HG11 VAL A 309 12.090 -3.154 1.254 1.00 0.00 H new ATOM 0 HG12 VAL A 309 12.690 -4.080 2.650 1.00 0.00 H new ATOM 0 HG13 VAL A 309 10.989 -3.561 2.592 1.00 0.00 H new ATOM 0 HG21 VAL A 309 11.608 -0.808 1.412 1.00 0.00 H new ATOM 0 HG22 VAL A 309 10.471 -1.045 2.761 1.00 0.00 H new ATOM 0 HG23 VAL A 309 11.833 0.088 2.934 1.00 0.00 H new ATOM 1282 N THR A 310 10.894 -0.563 5.868 1.00 0.00 N ATOM 1283 CA THR A 310 9.619 -0.064 6.383 1.00 0.00 C ATOM 1284 C THR A 310 9.383 1.385 5.951 1.00 0.00 C ATOM 1285 O THR A 310 10.227 2.252 6.185 1.00 0.00 O ATOM 1286 CB THR A 310 9.586 -0.143 7.935 1.00 0.00 C ATOM 1287 OG1 THR A 310 9.681 -1.508 8.361 1.00 0.00 O ATOM 1288 CG2 THR A 310 8.320 0.495 8.532 1.00 0.00 C ATOM 0 H THR A 310 11.716 -0.039 6.170 1.00 0.00 H new ATOM 0 HA THR A 310 8.830 -0.693 5.970 1.00 0.00 H new ATOM 0 HB THR A 310 10.443 0.424 8.300 1.00 0.00 H new ATOM 0 HG1 THR A 310 9.661 -1.547 9.340 1.00 0.00 H new ATOM 0 HG21 THR A 310 8.349 0.412 9.618 1.00 0.00 H new ATOM 0 HG22 THR A 310 8.275 1.547 8.249 1.00 0.00 H new ATOM 0 HG23 THR A 310 7.438 -0.021 8.152 1.00 0.00 H new ATOM 1296 N VAL A 311 8.239 1.652 5.327 1.00 0.00 N ATOM 1297 CA VAL A 311 7.918 3.013 4.883 1.00 0.00 C ATOM 1298 C VAL A 311 6.466 3.360 5.159 1.00 0.00 C ATOM 1299 O VAL A 311 5.636 2.495 5.420 1.00 0.00 O ATOM 1300 CB VAL A 311 8.183 3.221 3.367 1.00 0.00 C ATOM 1301 CG1 VAL A 311 9.665 3.048 3.033 1.00 0.00 C ATOM 1302 CG2 VAL A 311 7.338 2.251 2.533 1.00 0.00 C ATOM 0 H VAL A 311 7.524 0.956 5.117 1.00 0.00 H new ATOM 0 HA VAL A 311 8.576 3.669 5.454 1.00 0.00 H new ATOM 0 HB VAL A 311 7.896 4.243 3.119 1.00 0.00 H new ATOM 0 HG11 VAL A 311 9.817 3.200 1.964 1.00 0.00 H new ATOM 0 HG12 VAL A 311 10.251 3.778 3.591 1.00 0.00 H new ATOM 0 HG13 VAL A 311 9.984 2.042 3.306 1.00 0.00 H new ATOM 0 HG21 VAL A 311 7.538 2.413 1.474 1.00 0.00 H new ATOM 0 HG22 VAL A 311 7.594 1.225 2.798 1.00 0.00 H new ATOM 0 HG23 VAL A 311 6.281 2.425 2.733 1.00 0.00 H new ATOM 1312 N THR A 312 6.173 4.640 5.114 1.00 0.00 N ATOM 1313 CA THR A 312 4.813 5.105 5.217 1.00 0.00 C ATOM 1314 C THR A 312 4.480 5.940 3.995 1.00 0.00 C ATOM 1315 O THR A 312 5.298 6.733 3.521 1.00 0.00 O ATOM 1316 CB THR A 312 4.609 5.919 6.518 1.00 0.00 C ATOM 1317 OG1 THR A 312 4.725 5.057 7.652 1.00 0.00 O ATOM 1318 CG2 THR A 312 3.260 6.667 6.560 1.00 0.00 C ATOM 0 H THR A 312 6.866 5.381 5.006 1.00 0.00 H new ATOM 0 HA THR A 312 4.140 4.249 5.259 1.00 0.00 H new ATOM 0 HB THR A 312 5.390 6.679 6.541 1.00 0.00 H new ATOM 0 HG1 THR A 312 3.873 5.036 8.135 1.00 0.00 H new ATOM 0 HG21 THR A 312 3.179 7.218 7.497 1.00 0.00 H new ATOM 0 HG22 THR A 312 3.204 7.363 5.723 1.00 0.00 H new ATOM 0 HG23 THR A 312 2.443 5.949 6.489 1.00 0.00 H new ATOM 1326 N LEU A 313 3.286 5.736 3.488 1.00 0.00 N ATOM 1327 CA LEU A 313 2.888 6.280 2.215 1.00 0.00 C ATOM 1328 C LEU A 313 1.916 7.432 2.422 1.00 0.00 C ATOM 1329 O LEU A 313 0.893 7.277 3.087 1.00 0.00 O ATOM 1330 CB LEU A 313 2.282 5.161 1.361 1.00 0.00 C ATOM 1331 CG LEU A 313 3.175 3.912 1.191 1.00 0.00 C ATOM 1332 CD1 LEU A 313 4.619 4.287 0.922 1.00 0.00 C ATOM 1333 CD2 LEU A 313 3.081 2.983 2.392 1.00 0.00 C ATOM 0 H LEU A 313 2.562 5.186 3.951 1.00 0.00 H new ATOM 0 HA LEU A 313 3.753 6.680 1.687 1.00 0.00 H new ATOM 0 HB2 LEU A 313 1.336 4.855 1.808 1.00 0.00 H new ATOM 0 HB3 LEU A 313 2.052 5.562 0.374 1.00 0.00 H new ATOM 0 HG LEU A 313 2.798 3.375 0.320 1.00 0.00 H new ATOM 0 HD11 LEU A 313 5.215 3.381 0.808 1.00 0.00 H new ATOM 0 HD12 LEU A 313 4.677 4.877 0.007 1.00 0.00 H new ATOM 0 HD13 LEU A 313 5.004 4.873 1.757 1.00 0.00 H new ATOM 0 HD21 LEU A 313 3.724 2.117 2.233 1.00 0.00 H new ATOM 0 HD22 LEU A 313 3.402 3.514 3.288 1.00 0.00 H new ATOM 0 HD23 LEU A 313 2.050 2.652 2.516 1.00 0.00 H new ATOM 1345 N SER A 314 2.246 8.591 1.872 1.00 0.00 N ATOM 1346 CA SER A 314 1.489 9.803 2.151 1.00 0.00 C ATOM 1347 C SER A 314 0.899 10.407 0.882 1.00 0.00 C ATOM 1348 O SER A 314 1.504 10.353 -0.191 1.00 0.00 O ATOM 1349 CB SER A 314 2.391 10.824 2.856 1.00 0.00 C ATOM 1350 OG SER A 314 1.700 12.031 3.134 1.00 0.00 O ATOM 0 H SER A 314 3.030 8.718 1.232 1.00 0.00 H new ATOM 0 HA SER A 314 0.657 9.538 2.803 1.00 0.00 H new ATOM 0 HB2 SER A 314 2.766 10.397 3.786 1.00 0.00 H new ATOM 0 HB3 SER A 314 3.258 11.037 2.230 1.00 0.00 H new ATOM 0 HG SER A 314 2.304 12.657 3.585 1.00 0.00 H new ATOM 1632 N VAL A 333 -6.625 -5.395 6.153 1.00 0.00 N ATOM 1633 CA VAL A 333 -5.419 -5.335 5.337 1.00 0.00 C ATOM 1634 C VAL A 333 -4.540 -6.563 5.593 1.00 0.00 C ATOM 1635 O VAL A 333 -4.475 -7.069 6.721 1.00 0.00 O ATOM 1636 CB VAL A 333 -4.631 -4.036 5.593 1.00 0.00 C ATOM 1637 CG1 VAL A 333 -5.380 -2.845 5.015 1.00 0.00 C ATOM 1638 CG2 VAL A 333 -4.381 -3.831 7.078 1.00 0.00 C ATOM 0 HA VAL A 333 -5.721 -5.335 4.290 1.00 0.00 H new ATOM 0 HB VAL A 333 -3.664 -4.122 5.097 1.00 0.00 H new ATOM 0 HG11 VAL A 333 -4.813 -1.933 5.202 1.00 0.00 H new ATOM 0 HG12 VAL A 333 -5.505 -2.980 3.941 1.00 0.00 H new ATOM 0 HG13 VAL A 333 -6.359 -2.767 5.487 1.00 0.00 H new ATOM 0 HG21 VAL A 333 -3.823 -2.907 7.229 1.00 0.00 H new ATOM 0 HG22 VAL A 333 -5.335 -3.769 7.602 1.00 0.00 H new ATOM 0 HG23 VAL A 333 -3.806 -4.670 7.469 1.00 0.00 H new ATOM 1648 N GLU A 334 -3.859 -7.026 4.558 1.00 0.00 N ATOM 1649 CA GLU A 334 -3.283 -8.369 4.553 1.00 0.00 C ATOM 1650 C GLU A 334 -1.754 -8.364 4.657 1.00 0.00 C ATOM 1651 O GLU A 334 -1.070 -7.662 3.933 1.00 0.00 O ATOM 1652 CB GLU A 334 -3.731 -9.124 3.293 1.00 0.00 C ATOM 1653 CG GLU A 334 -3.494 -8.378 1.982 1.00 0.00 C ATOM 1654 CD GLU A 334 -4.442 -7.207 1.776 1.00 0.00 C ATOM 1655 OE1 GLU A 334 -5.599 -7.438 1.383 1.00 0.00 O ATOM 1656 OE2 GLU A 334 -4.025 -6.048 1.997 1.00 0.00 O1- ATOM 0 H GLU A 334 -3.689 -6.493 3.705 1.00 0.00 H new ATOM 0 HA GLU A 334 -3.653 -8.880 5.442 1.00 0.00 H new ATOM 0 HB2 GLU A 334 -3.206 -10.078 3.252 1.00 0.00 H new ATOM 0 HB3 GLU A 334 -4.794 -9.349 3.380 1.00 0.00 H new ATOM 0 HG2 GLU A 334 -2.467 -8.013 1.960 1.00 0.00 H new ATOM 0 HG3 GLU A 334 -3.602 -9.075 1.151 1.00 0.00 H new ATOM 1663 N ALA A 335 -1.222 -9.148 5.578 1.00 0.00 N ATOM 1664 CA ALA A 335 0.218 -9.219 5.777 1.00 0.00 C ATOM 1665 C ALA A 335 0.830 -10.459 5.109 1.00 0.00 C ATOM 1666 O ALA A 335 0.516 -11.583 5.504 1.00 0.00 O ATOM 1667 CB ALA A 335 0.522 -9.233 7.264 1.00 0.00 C ATOM 0 H ALA A 335 -1.765 -9.746 6.201 1.00 0.00 H new ATOM 0 HA ALA A 335 0.665 -8.341 5.310 1.00 0.00 H new ATOM 0 HB1 ALA A 335 1.600 -9.286 7.414 1.00 0.00 H new ATOM 0 HB2 ALA A 335 0.136 -8.323 7.723 1.00 0.00 H new ATOM 0 HB3 ALA A 335 0.048 -10.100 7.724 1.00 0.00 H new ATOM 1673 N GLY A 336 1.697 -10.276 4.109 1.00 0.00 N ATOM 1674 CA GLY A 336 2.458 -11.410 3.601 1.00 0.00 C ATOM 1675 C GLY A 336 2.406 -11.589 2.092 1.00 0.00 C ATOM 1676 O GLY A 336 2.819 -12.633 1.580 1.00 0.00 O ATOM 0 H GLY A 336 1.883 -9.384 3.651 1.00 0.00 H new ATOM 0 HA2 GLY A 336 3.499 -11.296 3.903 1.00 0.00 H new ATOM 0 HA3 GLY A 336 2.087 -12.319 4.074 1.00 0.00 H new ATOM 1680 N ASP A 337 1.905 -10.598 1.376 1.00 0.00 N ATOM 1681 CA ASP A 337 1.834 -10.675 -0.083 1.00 0.00 C ATOM 1682 C ASP A 337 3.076 -10.052 -0.736 1.00 0.00 C ATOM 1683 O ASP A 337 4.172 -10.099 -0.166 1.00 0.00 O ATOM 1684 CB ASP A 337 0.545 -10.020 -0.585 1.00 0.00 C ATOM 1685 CG ASP A 337 0.299 -8.671 0.043 1.00 0.00 C ATOM 1686 OD1 ASP A 337 -0.090 -8.642 1.229 1.00 0.00 O ATOM 1687 OD2 ASP A 337 0.491 -7.655 -0.645 1.00 0.00 O1- ATOM 0 H ASP A 337 1.541 -9.732 1.773 1.00 0.00 H new ATOM 0 HA ASP A 337 1.816 -11.726 -0.372 1.00 0.00 H new ATOM 0 HB2 ASP A 337 0.596 -9.909 -1.668 1.00 0.00 H new ATOM 0 HB3 ASP A 337 -0.299 -10.676 -0.371 1.00 0.00 H new ATOM 1692 N ALA A 338 2.923 -9.474 -1.927 1.00 0.00 N ATOM 1693 CA ALA A 338 4.078 -9.088 -2.736 1.00 0.00 C ATOM 1694 C ALA A 338 4.101 -7.595 -3.064 1.00 0.00 C ATOM 1695 O ALA A 338 3.060 -6.964 -3.250 1.00 0.00 O ATOM 1696 CB ALA A 338 4.104 -9.906 -4.020 1.00 0.00 C ATOM 0 H ALA A 338 2.019 -9.264 -2.350 1.00 0.00 H new ATOM 0 HA ALA A 338 4.969 -9.294 -2.143 1.00 0.00 H new ATOM 0 HB1 ALA A 338 4.966 -9.615 -4.620 1.00 0.00 H new ATOM 0 HB2 ALA A 338 4.174 -10.966 -3.775 1.00 0.00 H new ATOM 0 HB3 ALA A 338 3.190 -9.724 -4.586 1.00 0.00 H new ATOM 1702 N VAL A 339 5.313 -7.055 -3.160 1.00 0.00 N ATOM 1703 CA VAL A 339 5.533 -5.647 -3.467 1.00 0.00 C ATOM 1704 C VAL A 339 6.385 -5.510 -4.731 1.00 0.00 C ATOM 1705 O VAL A 339 7.207 -6.375 -5.032 1.00 0.00 O ATOM 1706 CB VAL A 339 6.253 -4.926 -2.290 1.00 0.00 C ATOM 1707 CG1 VAL A 339 6.669 -3.513 -2.684 1.00 0.00 C ATOM 1708 CG2 VAL A 339 5.359 -4.874 -1.066 1.00 0.00 C ATOM 0 H VAL A 339 6.174 -7.586 -3.026 1.00 0.00 H new ATOM 0 HA VAL A 339 4.559 -5.184 -3.625 1.00 0.00 H new ATOM 0 HB VAL A 339 7.149 -5.499 -2.051 1.00 0.00 H new ATOM 0 HG11 VAL A 339 7.169 -3.033 -1.843 1.00 0.00 H new ATOM 0 HG12 VAL A 339 7.350 -3.558 -3.534 1.00 0.00 H new ATOM 0 HG13 VAL A 339 5.785 -2.936 -2.957 1.00 0.00 H new ATOM 0 HG21 VAL A 339 5.881 -4.366 -0.255 1.00 0.00 H new ATOM 0 HG22 VAL A 339 4.445 -4.330 -1.306 1.00 0.00 H new ATOM 0 HG23 VAL A 339 5.107 -5.888 -0.756 1.00 0.00 H new ATOM 1718 N SER A 340 6.169 -4.436 -5.476 1.00 0.00 N ATOM 1719 CA SER A 340 6.969 -4.131 -6.651 1.00 0.00 C ATOM 1720 C SER A 340 7.094 -2.615 -6.821 1.00 0.00 C ATOM 1721 O SER A 340 6.549 -1.849 -6.029 1.00 0.00 O ATOM 1722 CB SER A 340 6.329 -4.767 -7.888 1.00 0.00 C ATOM 1723 OG SER A 340 6.152 -6.161 -7.707 1.00 0.00 O ATOM 0 H SER A 340 5.436 -3.753 -5.283 1.00 0.00 H new ATOM 0 HA SER A 340 7.970 -4.543 -6.526 1.00 0.00 H new ATOM 0 HB2 SER A 340 5.366 -4.297 -8.086 1.00 0.00 H new ATOM 0 HB3 SER A 340 6.957 -4.587 -8.760 1.00 0.00 H new ATOM 0 HG SER A 340 5.740 -6.545 -8.509 1.00 0.00 H new ATOM 1729 N VAL A 341 7.824 -2.187 -7.841 1.00 0.00 N ATOM 1730 CA VAL A 341 8.044 -0.768 -8.096 1.00 0.00 C ATOM 1731 C VAL A 341 7.334 -0.368 -9.388 1.00 0.00 C ATOM 1732 O VAL A 341 7.126 -1.218 -10.255 1.00 0.00 O ATOM 1733 CB VAL A 341 9.562 -0.453 -8.204 1.00 0.00 C ATOM 1734 CG1 VAL A 341 9.821 1.036 -8.389 1.00 0.00 C ATOM 1735 CG2 VAL A 341 10.304 -0.971 -6.978 1.00 0.00 C ATOM 0 H VAL A 341 8.278 -2.807 -8.511 1.00 0.00 H new ATOM 0 HA VAL A 341 7.637 -0.196 -7.262 1.00 0.00 H new ATOM 0 HB VAL A 341 9.938 -0.965 -9.090 1.00 0.00 H new ATOM 0 HG11 VAL A 341 10.894 1.213 -8.460 1.00 0.00 H new ATOM 0 HG12 VAL A 341 9.336 1.379 -9.303 1.00 0.00 H new ATOM 0 HG13 VAL A 341 9.419 1.584 -7.537 1.00 0.00 H new ATOM 0 HG21 VAL A 341 11.365 -0.741 -7.071 1.00 0.00 H new ATOM 0 HG22 VAL A 341 9.906 -0.492 -6.083 1.00 0.00 H new ATOM 0 HG23 VAL A 341 10.172 -2.050 -6.902 1.00 0.00 H new ATOM 1745 N VAL A 342 6.950 0.896 -9.523 1.00 0.00 N ATOM 1746 CA VAL A 342 6.266 1.345 -10.732 1.00 0.00 C ATOM 1747 C VAL A 342 7.220 1.327 -11.925 1.00 0.00 C ATOM 1748 O VAL A 342 7.024 0.557 -12.869 1.00 0.00 O ATOM 1749 CB VAL A 342 5.661 2.759 -10.567 1.00 0.00 C ATOM 1750 CG1 VAL A 342 5.105 3.270 -11.894 1.00 0.00 C ATOM 1751 CG2 VAL A 342 4.562 2.745 -9.517 1.00 0.00 C ATOM 0 H VAL A 342 7.098 1.621 -8.821 1.00 0.00 H new ATOM 0 HA VAL A 342 5.446 0.650 -10.912 1.00 0.00 H new ATOM 0 HB VAL A 342 6.455 3.431 -10.242 1.00 0.00 H new ATOM 0 HG11 VAL A 342 4.685 4.266 -11.753 1.00 0.00 H new ATOM 0 HG12 VAL A 342 5.907 3.315 -12.631 1.00 0.00 H new ATOM 0 HG13 VAL A 342 4.326 2.594 -12.246 1.00 0.00 H new ATOM 0 HG21 VAL A 342 4.146 3.747 -9.412 1.00 0.00 H new ATOM 0 HG22 VAL A 342 3.775 2.056 -9.823 1.00 0.00 H new ATOM 0 HG23 VAL A 342 4.976 2.422 -8.562 1.00 0.00 H new