USER MOD reduce.3.24.130724 H: found=0, std=0, add=837, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 842 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 311 SER OG : rot 157:sc= 0.872 USER MOD Set 1.2: A 317 THR OG1 : rot 74:sc= 1.17 USER MOD Set 2.1: A 219 THR OG1 : rot 97:sc= 0.553 USER MOD Set 2.2: A 296 CYS SG : rot 180:sc= -0.755 USER MOD Set 2.3: A 300 HIS : no HE2:sc= -0.607 K(o=-0.81,f=-3.4) USER MOD Set 3.1: A 222 CYS SG : rot 180:sc=-0.00985 USER MOD Set 3.2: A 224 HIS : no HD1:sc= 0.853 K(o=2.1,f=-0.36) USER MOD Set 3.3: A 293 THR OG1 : rot 125:sc= 1.21 USER MOD Single : A 209 SER OG : rot 180:sc= 0 USER MOD Single : A 210 THR OG1 : rot -140:sc= 0.0225 USER MOD Single : A 213 HIS : no HD1:sc= -1.69! C(o=-1.7!,f=-5.3!) USER MOD Single : A 214 CYS SG : rot 87:sc= 0.559 USER MOD Single : A 217 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 232 GLN : amide:sc= -2.35! C(o=-2.3!,f=-2.7!) USER MOD Single : A 257 TYR OH : rot -150:sc= 0.625 USER MOD Single : A 259 SER OG : rot 180:sc= 0.0271 USER MOD Single : A 263 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 266 SER OG : rot 180:sc= -0.0265 USER MOD Single : A 267 HIS :FLIP no HE2:sc= -1.72! C(o=-3.8!,f=-1.7!) USER MOD Single : A 270 SER OG : rot 180:sc= 0 USER MOD Single : A 276 SER OG : rot 30:sc= 0.129 USER MOD Single : A 279 LYS NZ :NH3+ 169:sc= 2.09 (180deg=1.58) USER MOD Single : A 281 THR OG1 : rot 180:sc= 0 USER MOD Single : A 286 THR OG1 : rot 180:sc= 0 USER MOD Single : A 297 LYS NZ :NH3+ -174:sc=-0.00542 (180deg=-0.0707) USER MOD Single : A 303 TYR OH : rot 130:sc= 0.804 USER MOD Single : A 305 LYS NZ :NH3+ 163:sc= 0.606 (180deg=0.425) USER MOD Single : A 306 ASN :FLIP amide:sc= -0.121 F(o=-0.94,f=-0.12) USER MOD Single : A 307 LYS NZ :NH3+ -100:sc= -0.186 (180deg=-1.37!) USER MOD Single : A 310 SER OG : rot 67:sc= -0.0157 USER MOD Single : A 313 TYR OH : rot -175:sc= 0.921 USER MOD Single : A 315 SER OG : rot 180:sc= 0 USER MOD Single : A 320 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 321 HIS : no HD1:sc= 0.404 K(o=0.4,f=-3!) USER MOD Single : A 325 CYS SG : rot 58:sc= -0.119 USER MOD Single : A 326 CYS SG : rot 140:sc= 0.573 USER MOD Single : A 329 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 334 CYS SG : rot 180:sc= -1.97! USER MOD Single : A 339 HIS : no HD1:sc= 0.226 K(o=0.23,f=-8.2!) USER MOD Single : A 344 ASN :FLIP amide:sc= -0.0305 F(o=-1.1!,f=-0.031) USER MOD ----------------------------------------------------------------- ATOM 1 N PRO A 208 -8.712 -7.326 4.657 1.00 0.00 N ATOM 2 CA PRO A 208 -7.379 -6.701 4.821 1.00 0.00 C ATOM 3 C PRO A 208 -7.513 -5.199 5.041 1.00 0.00 C ATOM 4 O PRO A 208 -8.353 -4.548 4.415 1.00 0.00 O ATOM 5 CB PRO A 208 -6.567 -6.966 3.570 1.00 0.00 C ATOM 6 CG PRO A 208 -7.614 -7.223 2.549 1.00 0.00 C ATOM 7 CD PRO A 208 -8.760 -7.880 3.283 1.00 0.00 C ATOM 0 HA PRO A 208 -6.882 -7.128 5.692 1.00 0.00 H new ATOM 0 HB2 PRO A 208 -5.943 -6.113 3.304 1.00 0.00 H new ATOM 0 HB3 PRO A 208 -5.902 -7.821 3.692 1.00 0.00 H new ATOM 0 HG2 PRO A 208 -7.935 -6.294 2.077 1.00 0.00 H new ATOM 0 HG3 PRO A 208 -7.236 -7.870 1.757 1.00 0.00 H new ATOM 0 HD2 PRO A 208 -9.713 -7.659 2.803 1.00 0.00 H new ATOM 0 HD3 PRO A 208 -8.651 -8.965 3.292 1.00 0.00 H new ATOM 17 N SER A 209 -6.692 -4.649 5.925 1.00 0.00 N ATOM 18 CA SER A 209 -6.706 -3.218 6.171 1.00 0.00 C ATOM 19 C SER A 209 -5.694 -2.520 5.270 1.00 0.00 C ATOM 20 O SER A 209 -4.481 -2.589 5.500 1.00 0.00 O ATOM 21 CB SER A 209 -6.411 -2.919 7.643 1.00 0.00 C ATOM 22 OG SER A 209 -6.515 -1.530 7.913 1.00 0.00 O ATOM 0 H SER A 209 -6.013 -5.170 6.479 1.00 0.00 H new ATOM 0 HA SER A 209 -7.701 -2.837 5.940 1.00 0.00 H new ATOM 0 HB2 SER A 209 -7.108 -3.469 8.276 1.00 0.00 H new ATOM 0 HB3 SER A 209 -5.409 -3.267 7.894 1.00 0.00 H new ATOM 0 HG SER A 209 -6.324 -1.366 8.860 1.00 0.00 H new ATOM 28 N THR A 210 -6.201 -1.876 4.229 1.00 0.00 N ATOM 29 CA THR A 210 -5.365 -1.148 3.292 1.00 0.00 C ATOM 30 C THR A 210 -5.079 0.258 3.803 1.00 0.00 C ATOM 31 O THR A 210 -5.950 0.911 4.383 1.00 0.00 O ATOM 32 CB THR A 210 -6.046 -1.061 1.917 1.00 0.00 C ATOM 33 OG1 THR A 210 -7.417 -0.672 2.078 1.00 0.00 O ATOM 34 CG2 THR A 210 -5.974 -2.392 1.186 1.00 0.00 C ATOM 0 H THR A 210 -7.197 -1.844 4.013 1.00 0.00 H new ATOM 0 HA THR A 210 -4.424 -1.689 3.194 1.00 0.00 H new ATOM 0 HB THR A 210 -5.520 -0.314 1.322 1.00 0.00 H new ATOM 0 HG1 THR A 210 -7.977 -1.180 1.454 1.00 0.00 H new ATOM 0 HG21 THR A 210 -6.463 -2.301 0.216 1.00 0.00 H new ATOM 0 HG22 THR A 210 -4.930 -2.672 1.041 1.00 0.00 H new ATOM 0 HG23 THR A 210 -6.476 -3.159 1.776 1.00 0.00 H new ATOM 42 N ILE A 211 -3.854 0.720 3.587 1.00 0.00 N ATOM 43 CA ILE A 211 -3.446 2.039 4.052 1.00 0.00 C ATOM 44 C ILE A 211 -3.831 3.090 3.016 1.00 0.00 C ATOM 45 O ILE A 211 -4.340 4.162 3.350 1.00 0.00 O ATOM 46 CB ILE A 211 -1.920 2.126 4.317 1.00 0.00 C ATOM 47 CG1 ILE A 211 -1.382 0.851 4.980 1.00 0.00 C ATOM 48 CG2 ILE A 211 -1.605 3.332 5.187 1.00 0.00 C ATOM 49 CD1 ILE A 211 -2.070 0.484 6.280 1.00 0.00 C ATOM 0 H ILE A 211 -3.127 0.202 3.094 1.00 0.00 H new ATOM 0 HA ILE A 211 -3.960 2.222 4.995 1.00 0.00 H new ATOM 0 HB ILE A 211 -1.427 2.234 3.351 1.00 0.00 H new ATOM 0 HG12 ILE A 211 -1.486 0.021 4.281 1.00 0.00 H new ATOM 0 HG13 ILE A 211 -0.316 0.977 5.170 1.00 0.00 H new ATOM 0 HG21 ILE A 211 -0.531 3.381 5.365 1.00 0.00 H new ATOM 0 HG22 ILE A 211 -1.931 4.241 4.681 1.00 0.00 H new ATOM 0 HG23 ILE A 211 -2.127 3.240 6.139 1.00 0.00 H new ATOM 0 HD11 ILE A 211 -1.628 -0.429 6.680 1.00 0.00 H new ATOM 0 HD12 ILE A 211 -1.945 1.293 6.999 1.00 0.00 H new ATOM 0 HD13 ILE A 211 -3.132 0.323 6.097 1.00 0.00 H new ATOM 61 N TRP A 212 -3.593 2.756 1.757 1.00 0.00 N ATOM 62 CA TRP A 212 -3.945 3.612 0.636 1.00 0.00 C ATOM 63 C TRP A 212 -4.137 2.747 -0.605 1.00 0.00 C ATOM 64 O TRP A 212 -3.273 1.925 -0.921 1.00 0.00 O ATOM 65 CB TRP A 212 -2.848 4.656 0.388 1.00 0.00 C ATOM 66 CG TRP A 212 -3.129 5.527 -0.799 1.00 0.00 C ATOM 67 CD1 TRP A 212 -3.980 6.592 -0.855 1.00 0.00 C ATOM 68 CD2 TRP A 212 -2.563 5.396 -2.110 1.00 0.00 C ATOM 69 NE1 TRP A 212 -3.982 7.127 -2.121 1.00 0.00 N ATOM 70 CE2 TRP A 212 -3.120 6.411 -2.908 1.00 0.00 C ATOM 71 CE3 TRP A 212 -1.642 4.518 -2.685 1.00 0.00 C ATOM 72 CZ2 TRP A 212 -2.785 6.572 -4.251 1.00 0.00 C ATOM 73 CZ3 TRP A 212 -1.309 4.678 -4.017 1.00 0.00 C ATOM 74 CH2 TRP A 212 -1.879 5.695 -4.788 1.00 0.00 C ATOM 0 H TRP A 212 -3.148 1.880 1.484 1.00 0.00 H new ATOM 0 HA TRP A 212 -4.870 4.142 0.863 1.00 0.00 H new ATOM 0 HB2 TRP A 212 -2.742 5.282 1.274 1.00 0.00 H new ATOM 0 HB3 TRP A 212 -1.895 4.147 0.241 1.00 0.00 H new ATOM 0 HD1 TRP A 212 -4.566 6.961 -0.026 1.00 0.00 H new ATOM 0 HE1 TRP A 212 -4.536 7.928 -2.425 1.00 0.00 H new ATOM 0 HE3 TRP A 212 -1.197 3.727 -2.099 1.00 0.00 H new ATOM 0 HZ2 TRP A 212 -3.223 7.359 -4.847 1.00 0.00 H new ATOM 0 HZ3 TRP A 212 -0.596 4.005 -4.470 1.00 0.00 H new ATOM 0 HH2 TRP A 212 -1.600 5.792 -5.827 1.00 0.00 H new ATOM 85 N HIS A 213 -5.272 2.914 -1.288 1.00 0.00 N ATOM 86 CA HIS A 213 -5.592 2.100 -2.462 1.00 0.00 C ATOM 87 C HIS A 213 -5.580 0.619 -2.042 1.00 0.00 C ATOM 88 O HIS A 213 -5.887 0.306 -0.896 1.00 0.00 O ATOM 89 CB HIS A 213 -4.578 2.401 -3.592 1.00 0.00 C ATOM 90 CG HIS A 213 -4.927 1.852 -4.949 1.00 0.00 C ATOM 91 ND1 HIS A 213 -4.380 0.685 -5.452 1.00 0.00 N ATOM 92 CD2 HIS A 213 -5.764 2.313 -5.909 1.00 0.00 C ATOM 93 CE1 HIS A 213 -4.873 0.453 -6.656 1.00 0.00 C ATOM 94 NE2 HIS A 213 -5.713 1.424 -6.954 1.00 0.00 N ATOM 0 H HIS A 213 -5.983 3.605 -1.048 1.00 0.00 H new ATOM 0 HA HIS A 213 -6.583 2.338 -2.849 1.00 0.00 H new ATOM 0 HB2 HIS A 213 -4.467 3.482 -3.676 1.00 0.00 H new ATOM 0 HB3 HIS A 213 -3.607 2.002 -3.299 1.00 0.00 H new ATOM 0 HD2 HIS A 213 -6.360 3.212 -5.861 1.00 0.00 H new ATOM 0 HE1 HIS A 213 -4.629 -0.388 -7.288 1.00 0.00 H new ATOM 0 HE2 HIS A 213 -6.241 1.502 -7.823 1.00 0.00 H new ATOM 103 N CYS A 214 -5.238 -0.287 -2.941 1.00 0.00 N ATOM 104 CA CYS A 214 -5.103 -1.695 -2.580 1.00 0.00 C ATOM 105 C CYS A 214 -3.675 -1.990 -2.102 1.00 0.00 C ATOM 106 O CYS A 214 -3.064 -2.981 -2.496 1.00 0.00 O ATOM 107 CB CYS A 214 -5.466 -2.584 -3.775 1.00 0.00 C ATOM 108 SG CYS A 214 -5.596 -4.349 -3.395 1.00 0.00 S ATOM 0 H CYS A 214 -5.049 -0.079 -3.922 1.00 0.00 H new ATOM 0 HA CYS A 214 -5.790 -1.915 -1.763 1.00 0.00 H new ATOM 0 HB2 CYS A 214 -6.416 -2.244 -4.187 1.00 0.00 H new ATOM 0 HB3 CYS A 214 -4.714 -2.448 -4.553 1.00 0.00 H new ATOM 0 HG CYS A 214 -6.800 -4.617 -2.985 1.00 0.00 H new ATOM 114 N PHE A 215 -3.127 -1.111 -1.274 1.00 0.00 N ATOM 115 CA PHE A 215 -1.799 -1.339 -0.715 1.00 0.00 C ATOM 116 C PHE A 215 -1.861 -1.537 0.790 1.00 0.00 C ATOM 117 O PHE A 215 -2.586 -0.833 1.498 1.00 0.00 O ATOM 118 CB PHE A 215 -0.849 -0.192 -1.055 1.00 0.00 C ATOM 119 CG PHE A 215 -0.607 -0.048 -2.525 1.00 0.00 C ATOM 120 CD1 PHE A 215 0.044 -1.043 -3.234 1.00 0.00 C ATOM 121 CD2 PHE A 215 -1.039 1.077 -3.196 1.00 0.00 C ATOM 122 CE1 PHE A 215 0.257 -0.914 -4.590 1.00 0.00 C ATOM 123 CE2 PHE A 215 -0.827 1.214 -4.554 1.00 0.00 C ATOM 124 CZ PHE A 215 -0.178 0.215 -5.253 1.00 0.00 C ATOM 0 H PHE A 215 -3.574 -0.244 -0.977 1.00 0.00 H new ATOM 0 HA PHE A 215 -1.412 -2.252 -1.167 1.00 0.00 H new ATOM 0 HB2 PHE A 215 -1.260 0.740 -0.667 1.00 0.00 H new ATOM 0 HB3 PHE A 215 0.103 -0.355 -0.550 1.00 0.00 H new ATOM 0 HD1 PHE A 215 0.388 -1.928 -2.720 1.00 0.00 H new ATOM 0 HD2 PHE A 215 -1.549 1.860 -2.654 1.00 0.00 H new ATOM 0 HE1 PHE A 215 0.765 -1.697 -5.134 1.00 0.00 H new ATOM 0 HE2 PHE A 215 -1.168 2.100 -5.068 1.00 0.00 H new ATOM 0 HZ PHE A 215 -0.012 0.317 -6.315 1.00 0.00 H new ATOM 134 N LEU A 216 -1.083 -2.496 1.267 1.00 0.00 N ATOM 135 CA LEU A 216 -1.074 -2.856 2.674 1.00 0.00 C ATOM 136 C LEU A 216 0.121 -2.228 3.372 1.00 0.00 C ATOM 137 O LEU A 216 0.967 -1.599 2.729 1.00 0.00 O ATOM 138 CB LEU A 216 -1.027 -4.383 2.850 1.00 0.00 C ATOM 139 CG LEU A 216 -2.272 -5.161 2.393 1.00 0.00 C ATOM 140 CD1 LEU A 216 -3.540 -4.503 2.910 1.00 0.00 C ATOM 141 CD2 LEU A 216 -2.311 -5.309 0.879 1.00 0.00 C ATOM 0 H LEU A 216 -0.443 -3.044 0.692 1.00 0.00 H new ATOM 0 HA LEU A 216 -1.994 -2.480 3.122 1.00 0.00 H new ATOM 0 HB2 LEU A 216 -0.165 -4.764 2.302 1.00 0.00 H new ATOM 0 HB3 LEU A 216 -0.856 -4.601 3.904 1.00 0.00 H new ATOM 0 HG LEU A 216 -2.212 -6.163 2.818 1.00 0.00 H new ATOM 0 HD11 LEU A 216 -4.408 -5.071 2.574 1.00 0.00 H new ATOM 0 HD12 LEU A 216 -3.520 -4.481 4.000 1.00 0.00 H new ATOM 0 HD13 LEU A 216 -3.603 -3.484 2.528 1.00 0.00 H new ATOM 0 HD21 LEU A 216 -3.204 -5.864 0.591 1.00 0.00 H new ATOM 0 HD22 LEU A 216 -2.332 -4.322 0.417 1.00 0.00 H new ATOM 0 HD23 LEU A 216 -1.425 -5.848 0.543 1.00 0.00 H new ATOM 153 N LYS A 217 0.191 -2.420 4.677 1.00 0.00 N ATOM 154 CA LYS A 217 1.290 -1.908 5.478 1.00 0.00 C ATOM 155 C LYS A 217 2.610 -2.541 5.034 1.00 0.00 C ATOM 156 O LYS A 217 2.645 -3.719 4.668 1.00 0.00 O ATOM 157 CB LYS A 217 1.018 -2.206 6.955 1.00 0.00 C ATOM 158 CG LYS A 217 2.051 -1.632 7.905 1.00 0.00 C ATOM 159 CD LYS A 217 1.670 -1.880 9.352 1.00 0.00 C ATOM 160 CE LYS A 217 2.646 -1.214 10.306 1.00 0.00 C ATOM 161 NZ LYS A 217 2.347 -1.548 11.724 1.00 0.00 N ATOM 0 H LYS A 217 -0.510 -2.934 5.211 1.00 0.00 H new ATOM 0 HA LYS A 217 1.370 -0.830 5.340 1.00 0.00 H new ATOM 0 HB2 LYS A 217 0.038 -1.810 7.220 1.00 0.00 H new ATOM 0 HB3 LYS A 217 0.973 -3.286 7.094 1.00 0.00 H new ATOM 0 HG2 LYS A 217 3.024 -2.080 7.701 1.00 0.00 H new ATOM 0 HG3 LYS A 217 2.151 -0.560 7.732 1.00 0.00 H new ATOM 0 HD2 LYS A 217 0.665 -1.501 9.535 1.00 0.00 H new ATOM 0 HD3 LYS A 217 1.646 -2.953 9.544 1.00 0.00 H new ATOM 0 HE2 LYS A 217 3.662 -1.528 10.065 1.00 0.00 H new ATOM 0 HE3 LYS A 217 2.606 -0.133 10.171 1.00 0.00 H new ATOM 0 HZ1 LYS A 217 3.035 -1.075 12.345 1.00 0.00 H new ATOM 0 HZ2 LYS A 217 1.387 -1.226 11.962 1.00 0.00 H new ATOM 0 HZ3 LYS A 217 2.410 -2.577 11.859 1.00 0.00 H new ATOM 175 N GLY A 218 3.679 -1.755 5.029 1.00 0.00 N ATOM 176 CA GLY A 218 4.982 -2.283 4.660 1.00 0.00 C ATOM 177 C GLY A 218 5.286 -2.094 3.186 1.00 0.00 C ATOM 178 O GLY A 218 6.308 -2.562 2.685 1.00 0.00 O ATOM 0 H GLY A 218 3.669 -0.765 5.273 1.00 0.00 H new ATOM 0 HA2 GLY A 218 5.752 -1.790 5.253 1.00 0.00 H new ATOM 0 HA3 GLY A 218 5.023 -3.345 4.903 1.00 0.00 H new ATOM 182 N THR A 219 4.393 -1.410 2.494 1.00 0.00 N ATOM 183 CA THR A 219 4.577 -1.111 1.085 1.00 0.00 C ATOM 184 C THR A 219 5.208 0.276 0.923 1.00 0.00 C ATOM 185 O THR A 219 5.019 1.150 1.772 1.00 0.00 O ATOM 186 CB THR A 219 3.220 -1.180 0.350 1.00 0.00 C ATOM 187 OG1 THR A 219 2.639 -2.480 0.522 1.00 0.00 O ATOM 188 CG2 THR A 219 3.362 -0.865 -1.131 1.00 0.00 C ATOM 0 H THR A 219 3.525 -1.048 2.889 1.00 0.00 H new ATOM 0 HA THR A 219 5.247 -1.850 0.646 1.00 0.00 H new ATOM 0 HB THR A 219 2.566 -0.425 0.786 1.00 0.00 H new ATOM 0 HG1 THR A 219 1.994 -2.455 1.259 1.00 0.00 H new ATOM 0 HG21 THR A 219 2.385 -0.924 -1.611 1.00 0.00 H new ATOM 0 HG22 THR A 219 3.765 0.140 -1.252 1.00 0.00 H new ATOM 0 HG23 THR A 219 4.038 -1.585 -1.593 1.00 0.00 H new ATOM 196 N ARG A 220 5.993 0.465 -0.127 1.00 0.00 N ATOM 197 CA ARG A 220 6.601 1.760 -0.392 1.00 0.00 C ATOM 198 C ARG A 220 6.039 2.376 -1.670 1.00 0.00 C ATOM 199 O ARG A 220 5.765 1.675 -2.643 1.00 0.00 O ATOM 200 CB ARG A 220 8.127 1.648 -0.470 1.00 0.00 C ATOM 201 CG ARG A 220 8.810 1.591 0.894 1.00 0.00 C ATOM 202 CD ARG A 220 8.545 0.287 1.632 1.00 0.00 C ATOM 203 NE ARG A 220 9.106 0.307 2.983 1.00 0.00 N ATOM 204 CZ ARG A 220 8.371 0.357 4.092 1.00 0.00 C ATOM 205 NH1 ARG A 220 7.049 0.448 4.015 1.00 0.00 N ATOM 206 NH2 ARG A 220 8.956 0.335 5.282 1.00 0.00 N ATOM 0 H ARG A 220 6.223 -0.259 -0.807 1.00 0.00 H new ATOM 0 HA ARG A 220 6.354 2.419 0.440 1.00 0.00 H new ATOM 0 HB2 ARG A 220 8.388 0.753 -1.035 1.00 0.00 H new ATOM 0 HB3 ARG A 220 8.517 2.501 -1.026 1.00 0.00 H new ATOM 0 HG2 ARG A 220 9.885 1.717 0.763 1.00 0.00 H new ATOM 0 HG3 ARG A 220 8.464 2.425 1.504 1.00 0.00 H new ATOM 0 HD2 ARG A 220 7.471 0.111 1.687 1.00 0.00 H new ATOM 0 HD3 ARG A 220 8.976 -0.543 1.071 1.00 0.00 H new ATOM 0 HE ARG A 220 10.121 0.281 3.081 1.00 0.00 H new ATOM 0 HH11 ARG A 220 6.592 0.480 3.104 1.00 0.00 H new ATOM 0 HH12 ARG A 220 6.490 0.486 4.867 1.00 0.00 H new ATOM 0 HH21 ARG A 220 9.972 0.280 5.350 1.00 0.00 H new ATOM 0 HH22 ARG A 220 8.390 0.373 6.129 1.00 0.00 H new ATOM 220 N LEU A 221 5.881 3.691 -1.643 1.00 0.00 N ATOM 221 CA LEU A 221 5.246 4.437 -2.717 1.00 0.00 C ATOM 222 C LEU A 221 6.217 5.436 -3.340 1.00 0.00 C ATOM 223 O LEU A 221 7.109 5.948 -2.664 1.00 0.00 O ATOM 224 CB LEU A 221 4.026 5.189 -2.168 1.00 0.00 C ATOM 225 CG LEU A 221 2.853 4.320 -1.713 1.00 0.00 C ATOM 226 CD1 LEU A 221 1.698 5.197 -1.261 1.00 0.00 C ATOM 227 CD2 LEU A 221 2.404 3.377 -2.815 1.00 0.00 C ATOM 0 H LEU A 221 6.193 4.275 -0.867 1.00 0.00 H new ATOM 0 HA LEU A 221 4.935 3.731 -3.487 1.00 0.00 H new ATOM 0 HB2 LEU A 221 4.349 5.799 -1.325 1.00 0.00 H new ATOM 0 HB3 LEU A 221 3.669 5.873 -2.938 1.00 0.00 H new ATOM 0 HG LEU A 221 3.188 3.712 -0.872 1.00 0.00 H new ATOM 0 HD11 LEU A 221 0.868 4.568 -0.939 1.00 0.00 H new ATOM 0 HD12 LEU A 221 2.021 5.825 -0.430 1.00 0.00 H new ATOM 0 HD13 LEU A 221 1.375 5.828 -2.089 1.00 0.00 H new ATOM 0 HD21 LEU A 221 1.569 2.773 -2.460 1.00 0.00 H new ATOM 0 HD22 LEU A 221 2.090 3.956 -3.683 1.00 0.00 H new ATOM 0 HD23 LEU A 221 3.231 2.724 -3.094 1.00 0.00 H new ATOM 239 N CYS A 222 6.038 5.693 -4.631 1.00 0.00 N ATOM 240 CA CYS A 222 6.813 6.700 -5.345 1.00 0.00 C ATOM 241 C CYS A 222 6.017 7.221 -6.541 1.00 0.00 C ATOM 242 O CYS A 222 5.928 6.562 -7.582 1.00 0.00 O ATOM 243 CB CYS A 222 8.153 6.120 -5.808 1.00 0.00 C ATOM 244 SG CYS A 222 9.121 7.225 -6.860 1.00 0.00 S ATOM 0 H CYS A 222 5.352 5.210 -5.211 1.00 0.00 H new ATOM 0 HA CYS A 222 7.015 7.530 -4.668 1.00 0.00 H new ATOM 0 HB2 CYS A 222 8.746 5.862 -4.931 1.00 0.00 H new ATOM 0 HB3 CYS A 222 7.966 5.193 -6.350 1.00 0.00 H new ATOM 0 HG CYS A 222 10.234 6.642 -7.194 1.00 0.00 H new ATOM 250 N PHE A 223 5.425 8.396 -6.383 1.00 0.00 N ATOM 251 CA PHE A 223 4.601 8.984 -7.418 1.00 0.00 C ATOM 252 C PHE A 223 5.448 9.782 -8.401 1.00 0.00 C ATOM 253 O PHE A 223 5.780 10.939 -8.144 1.00 0.00 O ATOM 254 CB PHE A 223 3.522 9.903 -6.811 1.00 0.00 C ATOM 255 CG PHE A 223 2.583 9.219 -5.866 1.00 0.00 C ATOM 256 CD1 PHE A 223 2.896 9.081 -4.524 1.00 0.00 C ATOM 257 CD2 PHE A 223 1.374 8.725 -6.323 1.00 0.00 C ATOM 258 CE1 PHE A 223 2.019 8.461 -3.657 1.00 0.00 C ATOM 259 CE2 PHE A 223 0.494 8.108 -5.462 1.00 0.00 C ATOM 260 CZ PHE A 223 0.815 7.974 -4.128 1.00 0.00 C ATOM 0 H PHE A 223 5.504 8.962 -5.538 1.00 0.00 H new ATOM 0 HA PHE A 223 4.114 8.166 -7.949 1.00 0.00 H new ATOM 0 HB2 PHE A 223 4.014 10.722 -6.285 1.00 0.00 H new ATOM 0 HB3 PHE A 223 2.943 10.346 -7.621 1.00 0.00 H new ATOM 0 HD1 PHE A 223 3.836 9.462 -4.152 1.00 0.00 H new ATOM 0 HD2 PHE A 223 1.117 8.824 -7.367 1.00 0.00 H new ATOM 0 HE1 PHE A 223 2.273 8.357 -2.613 1.00 0.00 H new ATOM 0 HE2 PHE A 223 -0.447 7.729 -5.832 1.00 0.00 H new ATOM 0 HZ PHE A 223 0.126 7.489 -3.452 1.00 0.00 H new ATOM 270 N HIS A 224 5.781 9.164 -9.531 1.00 0.00 N ATOM 271 CA HIS A 224 6.458 9.871 -10.621 1.00 0.00 C ATOM 272 C HIS A 224 5.536 10.964 -11.136 1.00 0.00 C ATOM 273 O HIS A 224 5.974 11.930 -11.755 1.00 0.00 O ATOM 274 CB HIS A 224 6.799 8.935 -11.785 1.00 0.00 C ATOM 275 CG HIS A 224 7.795 7.858 -11.480 1.00 0.00 C ATOM 276 ND1 HIS A 224 8.441 7.151 -12.470 1.00 0.00 N ATOM 277 CD2 HIS A 224 8.223 7.332 -10.309 1.00 0.00 C ATOM 278 CE1 HIS A 224 9.211 6.236 -11.926 1.00 0.00 C ATOM 279 NE2 HIS A 224 9.103 6.325 -10.614 1.00 0.00 N ATOM 0 H HIS A 224 5.595 8.179 -9.718 1.00 0.00 H new ATOM 0 HA HIS A 224 7.389 10.283 -10.231 1.00 0.00 H new ATOM 0 HB2 HIS A 224 5.878 8.466 -12.132 1.00 0.00 H new ATOM 0 HB3 HIS A 224 7.181 9.535 -12.610 1.00 0.00 H new ATOM 0 HD2 HIS A 224 7.927 7.646 -9.319 1.00 0.00 H new ATOM 0 HE1 HIS A 224 9.828 5.530 -12.462 1.00 0.00 H new ATOM 0 HE2 HIS A 224 9.594 5.741 -9.937 1.00 0.00 H new ATOM 387 N TRP A 231 11.595 7.011 -2.118 1.00 0.00 N ATOM 388 CA TRP A 231 10.747 5.979 -1.539 1.00 0.00 C ATOM 389 C TRP A 231 10.176 6.402 -0.194 1.00 0.00 C ATOM 390 O TRP A 231 10.897 6.860 0.693 1.00 0.00 O ATOM 391 CB TRP A 231 11.505 4.659 -1.410 1.00 0.00 C ATOM 392 CG TRP A 231 11.660 3.963 -2.724 1.00 0.00 C ATOM 393 CD1 TRP A 231 12.823 3.665 -3.375 1.00 0.00 C ATOM 394 CD2 TRP A 231 10.599 3.492 -3.560 1.00 0.00 C ATOM 395 NE1 TRP A 231 12.544 3.028 -4.559 1.00 0.00 N ATOM 396 CE2 TRP A 231 11.188 2.914 -4.695 1.00 0.00 C ATOM 397 CE3 TRP A 231 9.208 3.501 -3.453 1.00 0.00 C ATOM 398 CZ2 TRP A 231 10.432 2.353 -5.718 1.00 0.00 C ATOM 399 CZ3 TRP A 231 8.459 2.943 -4.468 1.00 0.00 C ATOM 400 CH2 TRP A 231 9.073 2.376 -5.587 1.00 0.00 C ATOM 0 HA TRP A 231 9.908 5.833 -2.220 1.00 0.00 H new ATOM 0 HB2 TRP A 231 12.490 4.848 -0.983 1.00 0.00 H new ATOM 0 HB3 TRP A 231 10.977 4.006 -0.715 1.00 0.00 H new ATOM 0 HD1 TRP A 231 13.814 3.896 -3.013 1.00 0.00 H new ATOM 0 HE1 TRP A 231 13.237 2.694 -5.229 1.00 0.00 H new ATOM 0 HE3 TRP A 231 8.726 3.937 -2.591 1.00 0.00 H new ATOM 0 HZ2 TRP A 231 10.903 1.915 -6.585 1.00 0.00 H new ATOM 0 HZ3 TRP A 231 7.381 2.945 -4.396 1.00 0.00 H new ATOM 0 HH2 TRP A 231 8.460 1.947 -6.365 1.00 0.00 H new ATOM 411 N GLN A 232 8.870 6.237 -0.071 1.00 0.00 N ATOM 412 CA GLN A 232 8.137 6.599 1.133 1.00 0.00 C ATOM 413 C GLN A 232 7.226 5.443 1.525 1.00 0.00 C ATOM 414 O GLN A 232 6.885 4.618 0.689 1.00 0.00 O ATOM 415 CB GLN A 232 7.303 7.861 0.873 1.00 0.00 C ATOM 416 CG GLN A 232 6.175 7.664 -0.116 1.00 0.00 C ATOM 417 CD GLN A 232 5.624 8.968 -0.643 1.00 0.00 C ATOM 418 OE1 GLN A 232 6.319 9.983 -0.681 1.00 0.00 O ATOM 419 NE2 GLN A 232 4.384 8.941 -1.091 1.00 0.00 N ATOM 0 H GLN A 232 8.283 5.846 -0.808 1.00 0.00 H new ATOM 0 HA GLN A 232 8.836 6.802 1.944 1.00 0.00 H new ATOM 0 HB2 GLN A 232 6.886 8.209 1.818 1.00 0.00 H new ATOM 0 HB3 GLN A 232 7.961 8.649 0.505 1.00 0.00 H new ATOM 0 HG2 GLN A 232 6.532 7.061 -0.951 1.00 0.00 H new ATOM 0 HG3 GLN A 232 5.372 7.103 0.362 1.00 0.00 H new ATOM 0 HE21 GLN A 232 3.842 8.078 -1.041 1.00 0.00 H new ATOM 0 HE22 GLN A 232 3.967 9.783 -1.488 1.00 0.00 H new ATOM 428 N ASP A 233 6.850 5.357 2.789 1.00 0.00 N ATOM 429 CA ASP A 233 5.897 4.339 3.210 1.00 0.00 C ATOM 430 C ASP A 233 4.501 4.726 2.755 1.00 0.00 C ATOM 431 O ASP A 233 4.216 5.912 2.569 1.00 0.00 O ATOM 432 CB ASP A 233 5.869 4.177 4.733 1.00 0.00 C ATOM 433 CG ASP A 233 7.225 3.907 5.349 1.00 0.00 C ATOM 434 OD1 ASP A 233 8.089 4.808 5.311 1.00 0.00 O ATOM 435 OD2 ASP A 233 7.415 2.806 5.904 1.00 0.00 O ATOM 0 H ASP A 233 7.183 5.969 3.534 1.00 0.00 H new ATOM 0 HA ASP A 233 6.212 3.398 2.760 1.00 0.00 H new ATOM 0 HB2 ASP A 233 5.454 5.082 5.177 1.00 0.00 H new ATOM 0 HB3 ASP A 233 5.196 3.359 4.989 1.00 0.00 H new ATOM 440 N VAL A 234 3.631 3.745 2.574 1.00 0.00 N ATOM 441 CA VAL A 234 2.209 4.038 2.382 1.00 0.00 C ATOM 442 C VAL A 234 1.726 4.800 3.584 1.00 0.00 C ATOM 443 O VAL A 234 1.079 5.833 3.481 1.00 0.00 O ATOM 444 CB VAL A 234 1.333 2.789 2.312 1.00 0.00 C ATOM 445 CG1 VAL A 234 0.035 3.072 1.580 1.00 0.00 C ATOM 446 CG2 VAL A 234 2.056 1.633 1.699 1.00 0.00 C ATOM 0 H VAL A 234 3.872 2.754 2.555 1.00 0.00 H new ATOM 0 HA VAL A 234 2.128 4.581 1.441 1.00 0.00 H new ATOM 0 HB VAL A 234 1.089 2.509 3.337 1.00 0.00 H new ATOM 0 HG11 VAL A 234 -0.568 2.165 1.545 1.00 0.00 H new ATOM 0 HG12 VAL A 234 -0.515 3.854 2.104 1.00 0.00 H new ATOM 0 HG13 VAL A 234 0.254 3.401 0.564 1.00 0.00 H new ATOM 0 HG21 VAL A 234 1.396 0.766 1.669 1.00 0.00 H new ATOM 0 HG22 VAL A 234 2.362 1.891 0.685 1.00 0.00 H new ATOM 0 HG23 VAL A 234 2.938 1.398 2.295 1.00 0.00 H new ATOM 456 N GLU A 235 2.095 4.255 4.724 1.00 0.00 N ATOM 457 CA GLU A 235 1.733 4.774 6.025 1.00 0.00 C ATOM 458 C GLU A 235 2.235 6.200 6.188 1.00 0.00 C ATOM 459 O GLU A 235 1.733 6.957 7.016 1.00 0.00 O ATOM 460 CB GLU A 235 2.331 3.857 7.082 1.00 0.00 C ATOM 461 CG GLU A 235 1.931 2.411 6.886 1.00 0.00 C ATOM 462 CD GLU A 235 3.043 1.455 7.248 1.00 0.00 C ATOM 463 OE1 GLU A 235 3.425 1.399 8.432 1.00 0.00 O ATOM 464 OE2 GLU A 235 3.559 0.772 6.332 1.00 0.00 O ATOM 0 H GLU A 235 2.671 3.415 4.772 1.00 0.00 H new ATOM 0 HA GLU A 235 0.649 4.800 6.134 1.00 0.00 H new ATOM 0 HB2 GLU A 235 3.418 3.937 7.055 1.00 0.00 H new ATOM 0 HB3 GLU A 235 2.011 4.189 8.070 1.00 0.00 H new ATOM 0 HG2 GLU A 235 1.054 2.193 7.496 1.00 0.00 H new ATOM 0 HG3 GLU A 235 1.643 2.254 5.847 1.00 0.00 H new ATOM 471 N ASP A 236 3.236 6.556 5.396 1.00 0.00 N ATOM 472 CA ASP A 236 3.766 7.913 5.430 1.00 0.00 C ATOM 473 C ASP A 236 2.928 8.827 4.547 1.00 0.00 C ATOM 474 O ASP A 236 2.456 9.870 4.997 1.00 0.00 O ATOM 475 CB ASP A 236 5.224 7.956 4.983 1.00 0.00 C ATOM 476 CG ASP A 236 5.820 9.344 5.133 1.00 0.00 C ATOM 477 OD1 ASP A 236 6.063 9.769 6.285 1.00 0.00 O ATOM 478 OD2 ASP A 236 6.036 10.022 4.110 1.00 0.00 O ATOM 0 H ASP A 236 3.693 5.934 4.730 1.00 0.00 H new ATOM 0 HA ASP A 236 3.718 8.261 6.462 1.00 0.00 H new ATOM 0 HB2 ASP A 236 5.805 7.246 5.571 1.00 0.00 H new ATOM 0 HB3 ASP A 236 5.294 7.641 3.942 1.00 0.00 H new ATOM 483 N PHE A 237 2.731 8.420 3.296 1.00 0.00 N ATOM 484 CA PHE A 237 1.920 9.193 2.360 1.00 0.00 C ATOM 485 C PHE A 237 0.481 9.291 2.838 1.00 0.00 C ATOM 486 O PHE A 237 -0.094 10.366 2.857 1.00 0.00 O ATOM 487 CB PHE A 237 1.948 8.573 0.964 1.00 0.00 C ATOM 488 CG PHE A 237 0.976 9.220 0.008 1.00 0.00 C ATOM 489 CD1 PHE A 237 1.135 10.545 -0.373 1.00 0.00 C ATOM 490 CD2 PHE A 237 -0.098 8.507 -0.504 1.00 0.00 C ATOM 491 CE1 PHE A 237 0.244 11.143 -1.244 1.00 0.00 C ATOM 492 CE2 PHE A 237 -0.992 9.100 -1.375 1.00 0.00 C ATOM 493 CZ PHE A 237 -0.821 10.420 -1.745 1.00 0.00 C ATOM 0 H PHE A 237 3.121 7.561 2.908 1.00 0.00 H new ATOM 0 HA PHE A 237 2.349 10.194 2.312 1.00 0.00 H new ATOM 0 HB2 PHE A 237 2.956 8.654 0.557 1.00 0.00 H new ATOM 0 HB3 PHE A 237 1.720 7.510 1.041 1.00 0.00 H new ATOM 0 HD1 PHE A 237 1.965 11.116 0.016 1.00 0.00 H new ATOM 0 HD2 PHE A 237 -0.237 7.475 -0.218 1.00 0.00 H new ATOM 0 HE1 PHE A 237 0.380 12.175 -1.533 1.00 0.00 H new ATOM 0 HE2 PHE A 237 -1.823 8.532 -1.766 1.00 0.00 H new ATOM 0 HZ PHE A 237 -1.519 10.886 -2.425 1.00 0.00 H new ATOM 503 N ALA A 238 -0.085 8.155 3.214 1.00 0.00 N ATOM 504 CA ALA A 238 -1.459 8.096 3.709 1.00 0.00 C ATOM 505 C ALA A 238 -1.646 9.013 4.915 1.00 0.00 C ATOM 506 O ALA A 238 -2.704 9.613 5.097 1.00 0.00 O ATOM 507 CB ALA A 238 -1.832 6.670 4.078 1.00 0.00 C ATOM 0 H ALA A 238 0.388 7.252 3.187 1.00 0.00 H new ATOM 0 HA ALA A 238 -2.117 8.438 2.910 1.00 0.00 H new ATOM 0 HB1 ALA A 238 -2.858 6.646 4.444 1.00 0.00 H new ATOM 0 HB2 ALA A 238 -1.746 6.032 3.198 1.00 0.00 H new ATOM 0 HB3 ALA A 238 -1.160 6.308 4.856 1.00 0.00 H new ATOM 513 N ARG A 239 -0.603 9.114 5.730 1.00 0.00 N ATOM 514 CA ARG A 239 -0.612 9.977 6.899 1.00 0.00 C ATOM 515 C ARG A 239 -0.551 11.433 6.457 1.00 0.00 C ATOM 516 O ARG A 239 -1.301 12.281 6.942 1.00 0.00 O ATOM 517 CB ARG A 239 0.590 9.650 7.783 1.00 0.00 C ATOM 518 CG ARG A 239 0.540 10.282 9.157 1.00 0.00 C ATOM 519 CD ARG A 239 1.850 10.081 9.899 1.00 0.00 C ATOM 520 NE ARG A 239 2.348 8.708 9.784 1.00 0.00 N ATOM 521 CZ ARG A 239 3.180 8.144 10.659 1.00 0.00 C ATOM 522 NH1 ARG A 239 3.531 8.793 11.762 1.00 0.00 N ATOM 523 NH2 ARG A 239 3.644 6.921 10.440 1.00 0.00 N ATOM 0 H ARG A 239 0.269 8.601 5.598 1.00 0.00 H new ATOM 0 HA ARG A 239 -1.528 9.814 7.466 1.00 0.00 H new ATOM 0 HB2 ARG A 239 0.660 8.568 7.895 1.00 0.00 H new ATOM 0 HB3 ARG A 239 1.498 9.978 7.278 1.00 0.00 H new ATOM 0 HG2 ARG A 239 0.331 11.348 9.063 1.00 0.00 H new ATOM 0 HG3 ARG A 239 -0.278 9.847 9.732 1.00 0.00 H new ATOM 0 HD2 ARG A 239 2.597 10.770 9.506 1.00 0.00 H new ATOM 0 HD3 ARG A 239 1.711 10.328 10.951 1.00 0.00 H new ATOM 0 HE ARG A 239 2.040 8.151 8.987 1.00 0.00 H new ATOM 0 HH11 ARG A 239 3.164 9.727 11.943 1.00 0.00 H new ATOM 0 HH12 ARG A 239 4.168 8.358 12.429 1.00 0.00 H new ATOM 0 HH21 ARG A 239 3.364 6.412 9.602 1.00 0.00 H new ATOM 0 HH22 ARG A 239 4.281 6.490 11.110 1.00 0.00 H new ATOM 771 N TYR A 257 -5.818 9.633 -7.331 1.00 0.00 N ATOM 772 CA TYR A 257 -4.980 8.960 -8.309 1.00 0.00 C ATOM 773 C TYR A 257 -5.091 7.450 -8.125 1.00 0.00 C ATOM 774 O TYR A 257 -4.814 6.922 -7.048 1.00 0.00 O ATOM 775 CB TYR A 257 -3.510 9.418 -8.224 1.00 0.00 C ATOM 776 CG TYR A 257 -2.586 8.626 -9.124 1.00 0.00 C ATOM 777 CD1 TYR A 257 -2.026 7.436 -8.681 1.00 0.00 C ATOM 778 CD2 TYR A 257 -2.283 9.053 -10.414 1.00 0.00 C ATOM 779 CE1 TYR A 257 -1.192 6.694 -9.486 1.00 0.00 C ATOM 780 CE2 TYR A 257 -1.444 8.314 -11.224 1.00 0.00 C ATOM 781 CZ TYR A 257 -0.901 7.137 -10.756 1.00 0.00 C ATOM 782 OH TYR A 257 -0.074 6.398 -11.567 1.00 0.00 O ATOM 0 HA TYR A 257 -5.336 9.229 -9.303 1.00 0.00 H new ATOM 0 HB2 TYR A 257 -3.449 10.473 -8.490 1.00 0.00 H new ATOM 0 HB3 TYR A 257 -3.167 9.329 -7.193 1.00 0.00 H new ATOM 0 HD1 TYR A 257 -2.249 7.085 -7.684 1.00 0.00 H new ATOM 0 HD2 TYR A 257 -2.709 9.973 -10.785 1.00 0.00 H new ATOM 0 HE1 TYR A 257 -0.768 5.769 -9.123 1.00 0.00 H new ATOM 0 HE2 TYR A 257 -1.214 8.657 -12.222 1.00 0.00 H new ATOM 0 HH TYR A 257 0.408 6.997 -12.175 1.00 0.00 H new ATOM 792 N GLY A 258 -5.521 6.767 -9.176 1.00 0.00 N ATOM 793 CA GLY A 258 -5.660 5.329 -9.111 1.00 0.00 C ATOM 794 C GLY A 258 -7.017 4.904 -8.603 1.00 0.00 C ATOM 795 O GLY A 258 -7.213 3.745 -8.234 1.00 0.00 O ATOM 0 H GLY A 258 -5.776 7.184 -10.071 1.00 0.00 H new ATOM 0 HA2 GLY A 258 -5.497 4.906 -10.102 1.00 0.00 H new ATOM 0 HA3 GLY A 258 -4.887 4.921 -8.460 1.00 0.00 H new ATOM 799 N SER A 259 -7.960 5.836 -8.611 1.00 0.00 N ATOM 800 CA SER A 259 -9.294 5.593 -8.081 1.00 0.00 C ATOM 801 C SER A 259 -10.083 4.612 -8.946 1.00 0.00 C ATOM 802 O SER A 259 -11.099 4.066 -8.514 1.00 0.00 O ATOM 803 CB SER A 259 -10.039 6.922 -7.961 1.00 0.00 C ATOM 804 OG SER A 259 -9.904 7.683 -9.151 1.00 0.00 O ATOM 0 H SER A 259 -7.823 6.776 -8.983 1.00 0.00 H new ATOM 0 HA SER A 259 -9.193 5.137 -7.096 1.00 0.00 H new ATOM 0 HB2 SER A 259 -11.094 6.736 -7.760 1.00 0.00 H new ATOM 0 HB3 SER A 259 -9.649 7.488 -7.115 1.00 0.00 H new ATOM 0 HG SER A 259 -10.389 8.529 -9.055 1.00 0.00 H new ATOM 810 N ASP A 260 -9.607 4.376 -10.158 1.00 0.00 N ATOM 811 CA ASP A 260 -10.283 3.465 -11.066 1.00 0.00 C ATOM 812 C ASP A 260 -9.492 2.177 -11.214 1.00 0.00 C ATOM 813 O ASP A 260 -10.052 1.112 -11.471 1.00 0.00 O ATOM 814 CB ASP A 260 -10.497 4.111 -12.434 1.00 0.00 C ATOM 815 CG ASP A 260 -11.225 3.183 -13.389 1.00 0.00 C ATOM 816 OD1 ASP A 260 -12.306 2.672 -13.018 1.00 0.00 O ATOM 817 OD2 ASP A 260 -10.715 2.952 -14.508 1.00 0.00 O ATOM 0 H ASP A 260 -8.759 4.801 -10.534 1.00 0.00 H new ATOM 0 HA ASP A 260 -11.260 3.232 -10.641 1.00 0.00 H new ATOM 0 HB2 ASP A 260 -11.069 5.032 -12.316 1.00 0.00 H new ATOM 0 HB3 ASP A 260 -9.533 4.387 -12.860 1.00 0.00 H new ATOM 822 N GLY A 261 -8.190 2.270 -11.010 1.00 0.00 N ATOM 823 CA GLY A 261 -7.348 1.111 -11.171 1.00 0.00 C ATOM 824 C GLY A 261 -5.897 1.472 -11.389 1.00 0.00 C ATOM 825 O GLY A 261 -5.578 2.586 -11.802 1.00 0.00 O ATOM 0 H GLY A 261 -7.704 3.124 -10.737 1.00 0.00 H new ATOM 0 HA2 GLY A 261 -7.432 0.480 -10.287 1.00 0.00 H new ATOM 0 HA3 GLY A 261 -7.703 0.523 -12.017 1.00 0.00 H new ATOM 829 N LEU A 262 -5.032 0.527 -11.070 1.00 0.00 N ATOM 830 CA LEU A 262 -3.594 0.656 -11.287 1.00 0.00 C ATOM 831 C LEU A 262 -3.080 -0.498 -12.139 1.00 0.00 C ATOM 832 O LEU A 262 -2.856 -1.592 -11.631 1.00 0.00 O ATOM 833 CB LEU A 262 -2.871 0.635 -9.947 1.00 0.00 C ATOM 834 CG LEU A 262 -2.235 1.947 -9.509 1.00 0.00 C ATOM 835 CD1 LEU A 262 -3.265 3.055 -9.404 1.00 0.00 C ATOM 836 CD2 LEU A 262 -1.527 1.741 -8.186 1.00 0.00 C ATOM 0 H LEU A 262 -5.305 -0.361 -10.649 1.00 0.00 H new ATOM 0 HA LEU A 262 -3.405 1.598 -11.802 1.00 0.00 H new ATOM 0 HB2 LEU A 262 -3.580 0.324 -9.179 1.00 0.00 H new ATOM 0 HB3 LEU A 262 -2.092 -0.127 -9.989 1.00 0.00 H new ATOM 0 HG LEU A 262 -1.510 2.255 -10.263 1.00 0.00 H new ATOM 0 HD11 LEU A 262 -2.777 3.977 -9.089 1.00 0.00 H new ATOM 0 HD12 LEU A 262 -3.736 3.207 -10.375 1.00 0.00 H new ATOM 0 HD13 LEU A 262 -4.024 2.778 -8.672 1.00 0.00 H new ATOM 0 HD21 LEU A 262 -1.070 2.678 -7.868 1.00 0.00 H new ATOM 0 HD22 LEU A 262 -2.247 1.415 -7.435 1.00 0.00 H new ATOM 0 HD23 LEU A 262 -0.754 0.981 -8.301 1.00 0.00 H new ATOM 848 N LYS A 263 -2.885 -0.262 -13.423 1.00 0.00 N ATOM 849 CA LYS A 263 -2.482 -1.324 -14.327 1.00 0.00 C ATOM 850 C LYS A 263 -0.976 -1.516 -14.299 1.00 0.00 C ATOM 851 O LYS A 263 -0.212 -0.573 -14.491 1.00 0.00 O ATOM 852 CB LYS A 263 -2.975 -1.027 -15.739 1.00 0.00 C ATOM 853 CG LYS A 263 -2.712 -2.135 -16.742 1.00 0.00 C ATOM 854 CD LYS A 263 -3.639 -1.993 -17.931 1.00 0.00 C ATOM 855 CE LYS A 263 -3.358 -3.011 -19.022 1.00 0.00 C ATOM 856 NZ LYS A 263 -4.268 -2.822 -20.183 1.00 0.00 N ATOM 0 H LYS A 263 -2.998 0.651 -13.862 1.00 0.00 H new ATOM 0 HA LYS A 263 -2.938 -2.257 -13.995 1.00 0.00 H new ATOM 0 HB2 LYS A 263 -4.047 -0.833 -15.703 1.00 0.00 H new ATOM 0 HB3 LYS A 263 -2.498 -0.113 -16.092 1.00 0.00 H new ATOM 0 HG2 LYS A 263 -1.674 -2.097 -17.074 1.00 0.00 H new ATOM 0 HG3 LYS A 263 -2.860 -3.106 -16.270 1.00 0.00 H new ATOM 0 HD2 LYS A 263 -4.671 -2.101 -17.596 1.00 0.00 H new ATOM 0 HD3 LYS A 263 -3.542 -0.989 -18.344 1.00 0.00 H new ATOM 0 HE2 LYS A 263 -2.323 -2.920 -19.350 1.00 0.00 H new ATOM 0 HE3 LYS A 263 -3.478 -4.018 -18.623 1.00 0.00 H new ATOM 0 HZ1 LYS A 263 -4.052 -3.532 -20.912 1.00 0.00 H new ATOM 0 HZ2 LYS A 263 -5.254 -2.933 -19.873 1.00 0.00 H new ATOM 0 HZ3 LYS A 263 -4.134 -1.869 -20.577 1.00 0.00 H new ATOM 870 N LEU A 264 -0.571 -2.743 -14.014 1.00 0.00 N ATOM 871 CA LEU A 264 0.834 -3.114 -13.950 1.00 0.00 C ATOM 872 C LEU A 264 1.469 -2.986 -15.337 1.00 0.00 C ATOM 873 O LEU A 264 1.246 -3.821 -16.207 1.00 0.00 O ATOM 874 CB LEU A 264 0.922 -4.558 -13.428 1.00 0.00 C ATOM 875 CG LEU A 264 2.273 -5.035 -12.873 1.00 0.00 C ATOM 876 CD1 LEU A 264 2.166 -6.481 -12.420 1.00 0.00 C ATOM 877 CD2 LEU A 264 3.393 -4.895 -13.890 1.00 0.00 C ATOM 0 H LEU A 264 -1.210 -3.514 -13.820 1.00 0.00 H new ATOM 0 HA LEU A 264 1.379 -2.452 -13.277 1.00 0.00 H new ATOM 0 HB2 LEU A 264 0.176 -4.677 -12.642 1.00 0.00 H new ATOM 0 HB3 LEU A 264 0.638 -5.226 -14.241 1.00 0.00 H new ATOM 0 HG LEU A 264 2.520 -4.398 -12.024 1.00 0.00 H new ATOM 0 HD11 LEU A 264 3.128 -6.812 -12.028 1.00 0.00 H new ATOM 0 HD12 LEU A 264 1.409 -6.563 -11.640 1.00 0.00 H new ATOM 0 HD13 LEU A 264 1.885 -7.108 -13.266 1.00 0.00 H new ATOM 0 HD21 LEU A 264 4.328 -5.245 -13.452 1.00 0.00 H new ATOM 0 HD22 LEU A 264 3.160 -5.491 -14.772 1.00 0.00 H new ATOM 0 HD23 LEU A 264 3.496 -3.848 -14.176 1.00 0.00 H new ATOM 889 N LEU A 265 2.252 -1.939 -15.533 1.00 0.00 N ATOM 890 CA LEU A 265 2.896 -1.697 -16.816 1.00 0.00 C ATOM 891 C LEU A 265 4.149 -2.555 -16.965 1.00 0.00 C ATOM 892 O LEU A 265 4.372 -3.172 -18.006 1.00 0.00 O ATOM 893 CB LEU A 265 3.276 -0.221 -16.967 1.00 0.00 C ATOM 894 CG LEU A 265 2.139 0.794 -16.802 1.00 0.00 C ATOM 895 CD1 LEU A 265 2.681 2.198 -17.020 1.00 0.00 C ATOM 896 CD2 LEU A 265 0.988 0.498 -17.760 1.00 0.00 C ATOM 0 H LEU A 265 2.458 -1.240 -14.819 1.00 0.00 H new ATOM 0 HA LEU A 265 2.183 -1.965 -17.596 1.00 0.00 H new ATOM 0 HB2 LEU A 265 4.049 0.010 -16.234 1.00 0.00 H new ATOM 0 HB3 LEU A 265 3.719 -0.081 -17.953 1.00 0.00 H new ATOM 0 HG LEU A 265 1.743 0.716 -15.790 1.00 0.00 H new ATOM 0 HD11 LEU A 265 1.874 2.922 -16.903 1.00 0.00 H new ATOM 0 HD12 LEU A 265 3.462 2.404 -16.288 1.00 0.00 H new ATOM 0 HD13 LEU A 265 3.096 2.276 -18.025 1.00 0.00 H new ATOM 0 HD21 LEU A 265 0.198 1.235 -17.618 1.00 0.00 H new ATOM 0 HD22 LEU A 265 1.348 0.546 -18.788 1.00 0.00 H new ATOM 0 HD23 LEU A 265 0.595 -0.499 -17.559 1.00 0.00 H new ATOM 908 N SER A 266 4.968 -2.591 -15.921 1.00 0.00 N ATOM 909 CA SER A 266 6.222 -3.332 -15.967 1.00 0.00 C ATOM 910 C SER A 266 6.624 -3.803 -14.574 1.00 0.00 C ATOM 911 O SER A 266 6.110 -3.309 -13.565 1.00 0.00 O ATOM 912 CB SER A 266 7.325 -2.464 -16.584 1.00 0.00 C ATOM 913 OG SER A 266 8.521 -3.201 -16.782 1.00 0.00 O ATOM 0 H SER A 266 4.787 -2.118 -15.036 1.00 0.00 H new ATOM 0 HA SER A 266 6.081 -4.214 -16.592 1.00 0.00 H new ATOM 0 HB2 SER A 266 6.982 -2.063 -17.538 1.00 0.00 H new ATOM 0 HB3 SER A 266 7.525 -1.613 -15.934 1.00 0.00 H new ATOM 0 HG SER A 266 9.202 -2.619 -17.178 1.00 0.00 H new ATOM 919 N HIS A 267 7.560 -4.742 -14.532 1.00 0.00 N ATOM 920 CA HIS A 267 7.877 -5.470 -13.314 1.00 0.00 C ATOM 921 C HIS A 267 9.385 -5.640 -13.140 1.00 0.00 C ATOM 922 O HIS A 267 10.109 -5.902 -14.100 1.00 0.00 O ATOM 923 CB HIS A 267 7.137 -6.823 -13.368 1.00 0.00 C ATOM 924 CG HIS A 267 7.856 -8.024 -12.819 1.00 0.00 C ATOM 925 ND1 HIS A 267 7.515 -8.845 -11.812 1.00 0.00 N flip ATOM 926 CD2 HIS A 267 9.038 -8.523 -13.330 1.00 0.00 C flip ATOM 927 CE1 HIS A 267 8.480 -9.816 -11.718 1.00 0.00 C flip ATOM 928 NE2 HIS A 267 9.389 -9.598 -12.649 1.00 0.00 N flip ATOM 0 H HIS A 267 8.118 -5.019 -15.339 1.00 0.00 H new ATOM 0 HA HIS A 267 7.544 -4.909 -12.441 1.00 0.00 H new ATOM 0 HB2 HIS A 267 6.197 -6.715 -12.826 1.00 0.00 H new ATOM 0 HB3 HIS A 267 6.884 -7.028 -14.408 1.00 0.00 H new ATOM 0 HD1 HIS A 267 6.687 -8.762 -11.223 1.00 0.00 H new ATOM 0 HD2 HIS A 267 9.589 -8.100 -14.157 1.00 0.00 H new ATOM 0 HE1 HIS A 267 8.493 -10.624 -11.001 1.00 0.00 H new ATOM 937 N GLU A 268 9.838 -5.487 -11.906 1.00 0.00 N ATOM 938 CA GLU A 268 11.227 -5.735 -11.548 1.00 0.00 C ATOM 939 C GLU A 268 11.290 -6.289 -10.129 1.00 0.00 C ATOM 940 O GLU A 268 10.522 -5.876 -9.265 1.00 0.00 O ATOM 941 CB GLU A 268 12.052 -4.444 -11.646 1.00 0.00 C ATOM 942 CG GLU A 268 13.502 -4.602 -11.210 1.00 0.00 C ATOM 943 CD GLU A 268 14.211 -3.277 -11.032 1.00 0.00 C ATOM 944 OE1 GLU A 268 14.680 -2.699 -12.037 1.00 0.00 O ATOM 945 OE2 GLU A 268 14.301 -2.804 -9.885 1.00 0.00 O ATOM 0 H GLU A 268 9.255 -5.188 -11.125 1.00 0.00 H new ATOM 0 HA GLU A 268 11.648 -6.461 -12.244 1.00 0.00 H new ATOM 0 HB2 GLU A 268 12.030 -4.088 -12.676 1.00 0.00 H new ATOM 0 HB3 GLU A 268 11.580 -3.676 -11.033 1.00 0.00 H new ATOM 0 HG2 GLU A 268 13.536 -5.155 -10.271 1.00 0.00 H new ATOM 0 HG3 GLU A 268 14.036 -5.198 -11.950 1.00 0.00 H new ATOM 952 N GLU A 269 12.172 -7.245 -9.898 1.00 0.00 N ATOM 953 CA GLU A 269 12.398 -7.757 -8.557 1.00 0.00 C ATOM 954 C GLU A 269 13.748 -7.274 -8.041 1.00 0.00 C ATOM 955 O GLU A 269 14.800 -7.701 -8.518 1.00 0.00 O ATOM 956 CB GLU A 269 12.307 -9.282 -8.542 1.00 0.00 C ATOM 957 CG GLU A 269 10.897 -9.794 -8.792 1.00 0.00 C ATOM 958 CD GLU A 269 10.841 -11.293 -8.982 1.00 0.00 C ATOM 959 OE1 GLU A 269 10.870 -12.033 -7.978 1.00 0.00 O ATOM 960 OE2 GLU A 269 10.768 -11.741 -10.146 1.00 0.00 O ATOM 0 H GLU A 269 12.743 -7.683 -10.621 1.00 0.00 H new ATOM 0 HA GLU A 269 11.622 -7.377 -7.893 1.00 0.00 H new ATOM 0 HB2 GLU A 269 12.975 -9.688 -9.301 1.00 0.00 H new ATOM 0 HB3 GLU A 269 12.657 -9.652 -7.578 1.00 0.00 H new ATOM 0 HG2 GLU A 269 10.260 -9.515 -7.952 1.00 0.00 H new ATOM 0 HG3 GLU A 269 10.490 -9.305 -9.677 1.00 0.00 H new ATOM 967 N SER A 270 13.698 -6.377 -7.068 1.00 0.00 N ATOM 968 CA SER A 270 14.882 -5.680 -6.584 1.00 0.00 C ATOM 969 C SER A 270 15.034 -5.881 -5.079 1.00 0.00 C ATOM 970 O SER A 270 14.238 -6.585 -4.455 1.00 0.00 O ATOM 971 CB SER A 270 14.759 -4.185 -6.921 1.00 0.00 C ATOM 972 OG SER A 270 15.913 -3.452 -6.534 1.00 0.00 O ATOM 0 H SER A 270 12.836 -6.111 -6.591 1.00 0.00 H new ATOM 0 HA SER A 270 15.769 -6.085 -7.070 1.00 0.00 H new ATOM 0 HB2 SER A 270 14.598 -4.068 -7.993 1.00 0.00 H new ATOM 0 HB3 SER A 270 13.883 -3.772 -6.420 1.00 0.00 H new ATOM 0 HG SER A 270 15.794 -2.508 -6.767 1.00 0.00 H new ATOM 1047 N SER A 276 14.069 -8.112 -0.147 1.00 0.00 N ATOM 1048 CA SER A 276 13.657 -8.375 -1.514 1.00 0.00 C ATOM 1049 C SER A 276 12.258 -7.812 -1.732 1.00 0.00 C ATOM 1050 O SER A 276 11.351 -8.074 -0.939 1.00 0.00 O ATOM 1051 CB SER A 276 13.671 -9.877 -1.781 1.00 0.00 C ATOM 1052 OG SER A 276 14.941 -10.436 -1.480 1.00 0.00 O ATOM 0 HA SER A 276 14.350 -7.894 -2.205 1.00 0.00 H new ATOM 0 HB2 SER A 276 12.904 -10.364 -1.179 1.00 0.00 H new ATOM 0 HB3 SER A 276 13.425 -10.066 -2.826 1.00 0.00 H new ATOM 0 HG SER A 276 15.362 -9.922 -0.760 1.00 0.00 H new ATOM 1058 N VAL A 277 12.086 -7.029 -2.783 1.00 0.00 N ATOM 1059 CA VAL A 277 10.819 -6.367 -3.021 1.00 0.00 C ATOM 1060 C VAL A 277 10.337 -6.529 -4.452 1.00 0.00 C ATOM 1061 O VAL A 277 11.118 -6.751 -5.380 1.00 0.00 O ATOM 1062 CB VAL A 277 10.889 -4.857 -2.711 1.00 0.00 C ATOM 1063 CG1 VAL A 277 10.966 -4.613 -1.211 1.00 0.00 C ATOM 1064 CG2 VAL A 277 12.076 -4.229 -3.421 1.00 0.00 C ATOM 0 H VAL A 277 12.805 -6.838 -3.481 1.00 0.00 H new ATOM 0 HA VAL A 277 10.114 -6.853 -2.346 1.00 0.00 H new ATOM 0 HB VAL A 277 9.977 -4.388 -3.079 1.00 0.00 H new ATOM 0 HG11 VAL A 277 11.014 -3.541 -1.019 1.00 0.00 H new ATOM 0 HG12 VAL A 277 10.081 -5.029 -0.729 1.00 0.00 H new ATOM 0 HG13 VAL A 277 11.858 -5.094 -0.809 1.00 0.00 H new ATOM 0 HG21 VAL A 277 12.114 -3.164 -3.194 1.00 0.00 H new ATOM 0 HG22 VAL A 277 12.996 -4.705 -3.082 1.00 0.00 H new ATOM 0 HG23 VAL A 277 11.971 -4.367 -4.497 1.00 0.00 H new ATOM 1074 N LEU A 278 9.031 -6.410 -4.594 1.00 0.00 N ATOM 1075 CA LEU A 278 8.373 -6.393 -5.880 1.00 0.00 C ATOM 1076 C LEU A 278 8.232 -4.953 -6.350 1.00 0.00 C ATOM 1077 O LEU A 278 7.469 -4.182 -5.765 1.00 0.00 O ATOM 1078 CB LEU A 278 6.984 -7.028 -5.760 1.00 0.00 C ATOM 1079 CG LEU A 278 6.959 -8.506 -5.374 1.00 0.00 C ATOM 1080 CD1 LEU A 278 5.524 -8.969 -5.177 1.00 0.00 C ATOM 1081 CD2 LEU A 278 7.645 -9.346 -6.442 1.00 0.00 C ATOM 0 H LEU A 278 8.390 -6.321 -3.805 1.00 0.00 H new ATOM 0 HA LEU A 278 8.965 -6.960 -6.598 1.00 0.00 H new ATOM 0 HB2 LEU A 278 6.413 -6.469 -5.019 1.00 0.00 H new ATOM 0 HB3 LEU A 278 6.469 -6.912 -6.714 1.00 0.00 H new ATOM 0 HG LEU A 278 7.501 -8.632 -4.437 1.00 0.00 H new ATOM 0 HD11 LEU A 278 5.516 -10.024 -4.902 1.00 0.00 H new ATOM 0 HD12 LEU A 278 5.059 -8.384 -4.384 1.00 0.00 H new ATOM 0 HD13 LEU A 278 4.967 -8.832 -6.104 1.00 0.00 H new ATOM 0 HD21 LEU A 278 7.618 -10.396 -6.152 1.00 0.00 H new ATOM 0 HD22 LEU A 278 7.127 -9.219 -7.393 1.00 0.00 H new ATOM 0 HD23 LEU A 278 8.681 -9.025 -6.548 1.00 0.00 H new ATOM 1093 N LYS A 279 8.975 -4.591 -7.381 1.00 0.00 N ATOM 1094 CA LYS A 279 8.919 -3.243 -7.923 1.00 0.00 C ATOM 1095 C LYS A 279 8.000 -3.223 -9.128 1.00 0.00 C ATOM 1096 O LYS A 279 8.341 -3.740 -10.194 1.00 0.00 O ATOM 1097 CB LYS A 279 10.307 -2.735 -8.336 1.00 0.00 C ATOM 1098 CG LYS A 279 10.272 -1.306 -8.865 1.00 0.00 C ATOM 1099 CD LYS A 279 11.500 -0.945 -9.700 1.00 0.00 C ATOM 1100 CE LYS A 279 12.654 -0.355 -8.886 1.00 0.00 C ATOM 1101 NZ LYS A 279 13.287 -1.336 -7.970 1.00 0.00 N ATOM 0 H LYS A 279 9.626 -5.212 -7.861 1.00 0.00 H new ATOM 0 HA LYS A 279 8.539 -2.585 -7.142 1.00 0.00 H new ATOM 0 HB2 LYS A 279 10.979 -2.785 -7.479 1.00 0.00 H new ATOM 0 HB3 LYS A 279 10.718 -3.393 -9.102 1.00 0.00 H new ATOM 0 HG2 LYS A 279 9.376 -1.171 -9.471 1.00 0.00 H new ATOM 0 HG3 LYS A 279 10.196 -0.616 -8.025 1.00 0.00 H new ATOM 0 HD2 LYS A 279 11.852 -1.839 -10.215 1.00 0.00 H new ATOM 0 HD3 LYS A 279 11.207 -0.229 -10.468 1.00 0.00 H new ATOM 0 HE2 LYS A 279 13.409 0.034 -9.569 1.00 0.00 H new ATOM 0 HE3 LYS A 279 12.285 0.489 -8.304 1.00 0.00 H new ATOM 0 HZ1 LYS A 279 14.168 -0.937 -7.589 1.00 0.00 H new ATOM 0 HZ2 LYS A 279 12.637 -1.550 -7.187 1.00 0.00 H new ATOM 0 HZ3 LYS A 279 13.500 -2.210 -8.491 1.00 0.00 H new ATOM 1115 N LEU A 280 6.828 -2.647 -8.955 1.00 0.00 N ATOM 1116 CA LEU A 280 5.868 -2.568 -10.035 1.00 0.00 C ATOM 1117 C LEU A 280 5.641 -1.122 -10.444 1.00 0.00 C ATOM 1118 O LEU A 280 5.580 -0.228 -9.598 1.00 0.00 O ATOM 1119 CB LEU A 280 4.537 -3.198 -9.625 1.00 0.00 C ATOM 1120 CG LEU A 280 4.586 -4.674 -9.213 1.00 0.00 C ATOM 1121 CD1 LEU A 280 3.184 -5.251 -9.154 1.00 0.00 C ATOM 1122 CD2 LEU A 280 5.464 -5.477 -10.165 1.00 0.00 C ATOM 0 H LEU A 280 6.518 -2.228 -8.078 1.00 0.00 H new ATOM 0 HA LEU A 280 6.274 -3.119 -10.883 1.00 0.00 H new ATOM 0 HB2 LEU A 280 4.127 -2.624 -8.794 1.00 0.00 H new ATOM 0 HB3 LEU A 280 3.840 -3.097 -10.457 1.00 0.00 H new ATOM 0 HG LEU A 280 5.028 -4.738 -8.219 1.00 0.00 H new ATOM 0 HD11 LEU A 280 3.234 -6.299 -8.860 1.00 0.00 H new ATOM 0 HD12 LEU A 280 2.593 -4.698 -8.424 1.00 0.00 H new ATOM 0 HD13 LEU A 280 2.716 -5.171 -10.135 1.00 0.00 H new ATOM 0 HD21 LEU A 280 5.482 -6.521 -9.851 1.00 0.00 H new ATOM 0 HD22 LEU A 280 5.061 -5.409 -11.176 1.00 0.00 H new ATOM 0 HD23 LEU A 280 6.478 -5.076 -10.151 1.00 0.00 H new ATOM 1134 N THR A 281 5.543 -0.895 -11.740 1.00 0.00 N ATOM 1135 CA THR A 281 5.195 0.411 -12.258 1.00 0.00 C ATOM 1136 C THR A 281 3.740 0.388 -12.712 1.00 0.00 C ATOM 1137 O THR A 281 3.368 -0.418 -13.562 1.00 0.00 O ATOM 1138 CB THR A 281 6.112 0.799 -13.432 1.00 0.00 C ATOM 1139 OG1 THR A 281 7.475 0.503 -13.094 1.00 0.00 O ATOM 1140 CG2 THR A 281 5.984 2.278 -13.760 1.00 0.00 C ATOM 0 H THR A 281 5.701 -1.604 -12.456 1.00 0.00 H new ATOM 0 HA THR A 281 5.327 1.155 -11.472 1.00 0.00 H new ATOM 0 HB THR A 281 5.810 0.224 -14.307 1.00 0.00 H new ATOM 0 HG1 THR A 281 8.058 0.749 -13.842 1.00 0.00 H new ATOM 0 HG21 THR A 281 6.643 2.524 -14.593 1.00 0.00 H new ATOM 0 HG22 THR A 281 4.953 2.502 -14.034 1.00 0.00 H new ATOM 0 HG23 THR A 281 6.264 2.870 -12.888 1.00 0.00 H new ATOM 1148 N PHE A 282 2.923 1.247 -12.130 1.00 0.00 N ATOM 1149 CA PHE A 282 1.484 1.201 -12.334 1.00 0.00 C ATOM 1150 C PHE A 282 0.981 2.371 -13.171 1.00 0.00 C ATOM 1151 O PHE A 282 1.680 3.373 -13.349 1.00 0.00 O ATOM 1152 CB PHE A 282 0.779 1.206 -10.984 1.00 0.00 C ATOM 1153 CG PHE A 282 1.004 -0.036 -10.173 1.00 0.00 C ATOM 1154 CD1 PHE A 282 0.366 -1.220 -10.504 1.00 0.00 C ATOM 1155 CD2 PHE A 282 1.846 -0.016 -9.075 1.00 0.00 C ATOM 1156 CE1 PHE A 282 0.564 -2.362 -9.753 1.00 0.00 C ATOM 1157 CE2 PHE A 282 2.048 -1.154 -8.322 1.00 0.00 C ATOM 1158 CZ PHE A 282 1.407 -2.328 -8.660 1.00 0.00 C ATOM 0 H PHE A 282 3.234 1.992 -11.506 1.00 0.00 H new ATOM 0 HA PHE A 282 1.259 0.284 -12.879 1.00 0.00 H new ATOM 0 HB2 PHE A 282 1.120 2.068 -10.411 1.00 0.00 H new ATOM 0 HB3 PHE A 282 -0.291 1.333 -11.145 1.00 0.00 H new ATOM 0 HD1 PHE A 282 -0.294 -1.250 -11.359 1.00 0.00 H new ATOM 0 HD2 PHE A 282 2.350 0.900 -8.805 1.00 0.00 H new ATOM 0 HE1 PHE A 282 0.061 -3.279 -10.020 1.00 0.00 H new ATOM 0 HE2 PHE A 282 2.708 -1.126 -7.468 1.00 0.00 H new ATOM 0 HZ PHE A 282 1.564 -3.219 -8.071 1.00 0.00 H new ATOM 1168 N ASP A 283 -0.240 2.217 -13.675 1.00 0.00 N ATOM 1169 CA ASP A 283 -0.913 3.246 -14.461 1.00 0.00 C ATOM 1170 C ASP A 283 -2.339 3.431 -13.958 1.00 0.00 C ATOM 1171 O ASP A 283 -3.028 2.451 -13.683 1.00 0.00 O ATOM 1172 CB ASP A 283 -0.957 2.821 -15.926 1.00 0.00 C ATOM 1173 CG ASP A 283 -1.539 3.881 -16.838 1.00 0.00 C ATOM 1174 OD1 ASP A 283 -0.858 4.890 -17.099 1.00 0.00 O ATOM 1175 OD2 ASP A 283 -2.688 3.703 -17.294 1.00 0.00 O ATOM 0 H ASP A 283 -0.794 1.370 -13.549 1.00 0.00 H new ATOM 0 HA ASP A 283 -0.365 4.183 -14.362 1.00 0.00 H new ATOM 0 HB2 ASP A 283 0.053 2.580 -16.258 1.00 0.00 H new ATOM 0 HB3 ASP A 283 -1.548 1.910 -16.016 1.00 0.00 H new ATOM 1180 N PRO A 284 -2.817 4.673 -13.838 1.00 0.00 N ATOM 1181 CA PRO A 284 -4.172 4.944 -13.366 1.00 0.00 C ATOM 1182 C PRO A 284 -5.215 4.837 -14.477 1.00 0.00 C ATOM 1183 O PRO A 284 -6.378 5.202 -14.288 1.00 0.00 O ATOM 1184 CB PRO A 284 -4.070 6.380 -12.864 1.00 0.00 C ATOM 1185 CG PRO A 284 -3.024 7.014 -13.717 1.00 0.00 C ATOM 1186 CD PRO A 284 -2.079 5.913 -14.140 1.00 0.00 C ATOM 0 HA PRO A 284 -4.498 4.227 -12.612 1.00 0.00 H new ATOM 0 HB2 PRO A 284 -5.024 6.899 -12.958 1.00 0.00 H new ATOM 0 HB3 PRO A 284 -3.792 6.411 -11.810 1.00 0.00 H new ATOM 0 HG2 PRO A 284 -3.473 7.494 -14.587 1.00 0.00 H new ATOM 0 HG3 PRO A 284 -2.492 7.789 -13.165 1.00 0.00 H new ATOM 0 HD2 PRO A 284 -1.833 5.983 -15.200 1.00 0.00 H new ATOM 0 HD3 PRO A 284 -1.139 5.961 -13.591 1.00 0.00 H new ATOM 1194 N GLY A 285 -4.796 4.336 -15.634 1.00 0.00 N ATOM 1195 CA GLY A 285 -5.680 4.276 -16.782 1.00 0.00 C ATOM 1196 C GLY A 285 -5.331 5.352 -17.784 1.00 0.00 C ATOM 1197 O GLY A 285 -5.809 5.347 -18.921 1.00 0.00 O ATOM 0 H GLY A 285 -3.858 3.970 -15.797 1.00 0.00 H new ATOM 0 HA2 GLY A 285 -5.606 3.296 -17.253 1.00 0.00 H new ATOM 0 HA3 GLY A 285 -6.714 4.396 -16.458 1.00 0.00 H new ATOM 1201 N THR A 286 -4.479 6.266 -17.349 1.00 0.00 N ATOM 1202 CA THR A 286 -4.001 7.351 -18.180 1.00 0.00 C ATOM 1203 C THR A 286 -2.625 7.803 -17.696 1.00 0.00 C ATOM 1204 O THR A 286 -2.468 8.316 -16.585 1.00 0.00 O ATOM 1205 CB THR A 286 -4.991 8.545 -18.206 1.00 0.00 C ATOM 1206 OG1 THR A 286 -4.434 9.633 -18.953 1.00 0.00 O ATOM 1207 CG2 THR A 286 -5.346 9.018 -16.802 1.00 0.00 C ATOM 0 H THR A 286 -4.099 6.273 -16.402 1.00 0.00 H new ATOM 0 HA THR A 286 -3.922 6.981 -19.202 1.00 0.00 H new ATOM 0 HB THR A 286 -5.906 8.199 -18.686 1.00 0.00 H new ATOM 0 HG1 THR A 286 -5.068 10.380 -18.964 1.00 0.00 H new ATOM 0 HG21 THR A 286 -6.041 9.855 -16.865 1.00 0.00 H new ATOM 0 HG22 THR A 286 -5.811 8.201 -16.250 1.00 0.00 H new ATOM 0 HG23 THR A 286 -4.441 9.337 -16.286 1.00 0.00 H new ATOM 1215 N VAL A 287 -1.628 7.601 -18.541 1.00 0.00 N ATOM 1216 CA VAL A 287 -0.248 7.927 -18.200 1.00 0.00 C ATOM 1217 C VAL A 287 -0.043 9.444 -18.133 1.00 0.00 C ATOM 1218 O VAL A 287 0.999 9.929 -17.685 1.00 0.00 O ATOM 1219 CB VAL A 287 0.725 7.298 -19.223 1.00 0.00 C ATOM 1220 CG1 VAL A 287 0.649 8.013 -20.564 1.00 0.00 C ATOM 1221 CG2 VAL A 287 2.151 7.280 -18.691 1.00 0.00 C ATOM 0 H VAL A 287 -1.747 7.210 -19.475 1.00 0.00 H new ATOM 0 HA VAL A 287 -0.036 7.511 -17.215 1.00 0.00 H new ATOM 0 HB VAL A 287 0.417 6.264 -19.379 1.00 0.00 H new ATOM 0 HG11 VAL A 287 1.344 7.549 -21.264 1.00 0.00 H new ATOM 0 HG12 VAL A 287 -0.365 7.941 -20.958 1.00 0.00 H new ATOM 0 HG13 VAL A 287 0.913 9.062 -20.432 1.00 0.00 H new ATOM 0 HG21 VAL A 287 2.811 6.832 -19.434 1.00 0.00 H new ATOM 0 HG22 VAL A 287 2.476 8.300 -18.486 1.00 0.00 H new ATOM 0 HG23 VAL A 287 2.189 6.695 -17.772 1.00 0.00 H new ATOM 1231 N GLU A 288 -1.063 10.181 -18.561 1.00 0.00 N ATOM 1232 CA GLU A 288 -1.016 11.638 -18.596 1.00 0.00 C ATOM 1233 C GLU A 288 -0.941 12.240 -17.193 1.00 0.00 C ATOM 1234 O GLU A 288 -0.495 13.377 -17.028 1.00 0.00 O ATOM 1235 CB GLU A 288 -2.243 12.190 -19.322 1.00 0.00 C ATOM 1236 CG GLU A 288 -2.349 11.751 -20.770 1.00 0.00 C ATOM 1237 CD GLU A 288 -3.566 12.329 -21.455 1.00 0.00 C ATOM 1238 OE1 GLU A 288 -3.466 13.440 -22.021 1.00 0.00 O ATOM 1239 OE2 GLU A 288 -4.635 11.682 -21.427 1.00 0.00 O ATOM 0 H GLU A 288 -1.943 9.786 -18.892 1.00 0.00 H new ATOM 0 HA GLU A 288 -0.111 11.919 -19.134 1.00 0.00 H new ATOM 0 HB2 GLU A 288 -3.140 11.874 -18.790 1.00 0.00 H new ATOM 0 HB3 GLU A 288 -2.216 13.279 -19.284 1.00 0.00 H new ATOM 0 HG2 GLU A 288 -1.452 12.058 -21.307 1.00 0.00 H new ATOM 0 HG3 GLU A 288 -2.391 10.663 -20.816 1.00 0.00 H new ATOM 1246 N ASP A 289 -1.392 11.499 -16.182 1.00 0.00 N ATOM 1247 CA ASP A 289 -1.331 12.008 -14.814 1.00 0.00 C ATOM 1248 C ASP A 289 0.068 11.812 -14.255 1.00 0.00 C ATOM 1249 O ASP A 289 0.628 12.701 -13.615 1.00 0.00 O ATOM 1250 CB ASP A 289 -2.355 11.336 -13.890 1.00 0.00 C ATOM 1251 CG ASP A 289 -2.832 12.285 -12.811 1.00 0.00 C ATOM 1252 OD1 ASP A 289 -3.188 13.437 -13.143 1.00 0.00 O ATOM 1253 OD2 ASP A 289 -2.855 11.895 -11.631 1.00 0.00 O ATOM 0 H ASP A 289 -1.794 10.567 -16.279 1.00 0.00 H new ATOM 0 HA ASP A 289 -1.576 13.069 -14.853 1.00 0.00 H new ATOM 0 HB2 ASP A 289 -3.207 10.993 -14.477 1.00 0.00 H new ATOM 0 HB3 ASP A 289 -1.909 10.454 -13.430 1.00 0.00 H new ATOM 1258 N GLY A 290 0.632 10.642 -14.515 1.00 0.00 N ATOM 1259 CA GLY A 290 1.978 10.353 -14.085 1.00 0.00 C ATOM 1260 C GLY A 290 2.128 8.923 -13.616 1.00 0.00 C ATOM 1261 O GLY A 290 1.160 8.306 -13.170 1.00 0.00 O ATOM 0 H GLY A 290 0.174 9.884 -15.021 1.00 0.00 H new ATOM 0 HA2 GLY A 290 2.669 10.539 -14.907 1.00 0.00 H new ATOM 0 HA3 GLY A 290 2.254 11.030 -13.277 1.00 0.00 H new ATOM 1265 N LEU A 291 3.339 8.399 -13.719 1.00 0.00 N ATOM 1266 CA LEU A 291 3.627 7.027 -13.318 1.00 0.00 C ATOM 1267 C LEU A 291 3.633 6.893 -11.796 1.00 0.00 C ATOM 1268 O LEU A 291 3.865 7.863 -11.075 1.00 0.00 O ATOM 1269 CB LEU A 291 4.988 6.600 -13.878 1.00 0.00 C ATOM 1270 CG LEU A 291 5.108 6.638 -15.401 1.00 0.00 C ATOM 1271 CD1 LEU A 291 6.420 7.284 -15.817 1.00 0.00 C ATOM 1272 CD2 LEU A 291 5.020 5.232 -15.965 1.00 0.00 C ATOM 0 H LEU A 291 4.146 8.907 -14.080 1.00 0.00 H new ATOM 0 HA LEU A 291 2.846 6.381 -13.718 1.00 0.00 H new ATOM 0 HB2 LEU A 291 5.756 7.246 -13.453 1.00 0.00 H new ATOM 0 HB3 LEU A 291 5.200 5.586 -13.538 1.00 0.00 H new ATOM 0 HG LEU A 291 4.286 7.234 -15.798 1.00 0.00 H new ATOM 0 HD11 LEU A 291 6.488 7.302 -16.905 1.00 0.00 H new ATOM 0 HD12 LEU A 291 6.461 8.304 -15.434 1.00 0.00 H new ATOM 0 HD13 LEU A 291 7.253 6.710 -15.411 1.00 0.00 H new ATOM 0 HD21 LEU A 291 5.107 5.270 -17.051 1.00 0.00 H new ATOM 0 HD22 LEU A 291 5.828 4.625 -15.557 1.00 0.00 H new ATOM 0 HD23 LEU A 291 4.062 4.790 -15.692 1.00 0.00 H new ATOM 1284 N LEU A 292 3.375 5.691 -11.318 1.00 0.00 N ATOM 1285 CA LEU A 292 3.423 5.396 -9.893 1.00 0.00 C ATOM 1286 C LEU A 292 4.143 4.073 -9.691 1.00 0.00 C ATOM 1287 O LEU A 292 3.725 3.042 -10.210 1.00 0.00 O ATOM 1288 CB LEU A 292 1.990 5.377 -9.331 1.00 0.00 C ATOM 1289 CG LEU A 292 1.783 4.995 -7.848 1.00 0.00 C ATOM 1290 CD1 LEU A 292 1.648 3.495 -7.693 1.00 0.00 C ATOM 1291 CD2 LEU A 292 2.902 5.513 -6.956 1.00 0.00 C ATOM 0 H LEU A 292 3.127 4.892 -11.901 1.00 0.00 H new ATOM 0 HA LEU A 292 3.976 6.163 -9.351 1.00 0.00 H new ATOM 0 HB2 LEU A 292 1.563 6.368 -9.480 1.00 0.00 H new ATOM 0 HB3 LEU A 292 1.406 4.684 -9.936 1.00 0.00 H new ATOM 0 HG LEU A 292 0.858 5.473 -7.526 1.00 0.00 H new ATOM 0 HD11 LEU A 292 1.503 3.250 -6.641 1.00 0.00 H new ATOM 0 HD12 LEU A 292 0.791 3.145 -8.269 1.00 0.00 H new ATOM 0 HD13 LEU A 292 2.553 3.009 -8.058 1.00 0.00 H new ATOM 0 HD21 LEU A 292 2.711 5.219 -5.924 1.00 0.00 H new ATOM 0 HD22 LEU A 292 3.853 5.092 -7.283 1.00 0.00 H new ATOM 0 HD23 LEU A 292 2.945 6.600 -7.021 1.00 0.00 H new ATOM 1303 N THR A 293 5.242 4.114 -8.965 1.00 0.00 N ATOM 1304 CA THR A 293 6.056 2.939 -8.765 1.00 0.00 C ATOM 1305 C THR A 293 5.948 2.483 -7.322 1.00 0.00 C ATOM 1306 O THR A 293 5.954 3.303 -6.402 1.00 0.00 O ATOM 1307 CB THR A 293 7.524 3.223 -9.122 1.00 0.00 C ATOM 1308 OG1 THR A 293 7.588 3.853 -10.408 1.00 0.00 O ATOM 1309 CG2 THR A 293 8.338 1.939 -9.151 1.00 0.00 C ATOM 0 H THR A 293 5.591 4.954 -8.503 1.00 0.00 H new ATOM 0 HA THR A 293 5.694 2.148 -9.422 1.00 0.00 H new ATOM 0 HB THR A 293 7.942 3.880 -8.360 1.00 0.00 H new ATOM 0 HG1 THR A 293 8.082 4.696 -10.335 1.00 0.00 H new ATOM 0 HG21 THR A 293 9.372 2.170 -9.406 1.00 0.00 H new ATOM 0 HG22 THR A 293 8.303 1.464 -8.171 1.00 0.00 H new ATOM 0 HG23 THR A 293 7.923 1.262 -9.897 1.00 0.00 H new ATOM 1317 N VAL A 294 5.820 1.186 -7.128 1.00 0.00 N ATOM 1318 CA VAL A 294 5.626 0.639 -5.803 1.00 0.00 C ATOM 1319 C VAL A 294 6.587 -0.509 -5.537 1.00 0.00 C ATOM 1320 O VAL A 294 6.786 -1.370 -6.394 1.00 0.00 O ATOM 1321 CB VAL A 294 4.181 0.135 -5.627 1.00 0.00 C ATOM 1322 CG1 VAL A 294 3.995 -0.500 -4.274 1.00 0.00 C ATOM 1323 CG2 VAL A 294 3.190 1.266 -5.810 1.00 0.00 C ATOM 0 H VAL A 294 5.847 0.491 -7.874 1.00 0.00 H new ATOM 0 HA VAL A 294 5.822 1.440 -5.090 1.00 0.00 H new ATOM 0 HB VAL A 294 3.996 -0.618 -6.393 1.00 0.00 H new ATOM 0 HG11 VAL A 294 2.967 -0.848 -4.174 1.00 0.00 H new ATOM 0 HG12 VAL A 294 4.676 -1.345 -4.172 1.00 0.00 H new ATOM 0 HG13 VAL A 294 4.208 0.233 -3.496 1.00 0.00 H new ATOM 0 HG21 VAL A 294 2.176 0.886 -5.681 1.00 0.00 H new ATOM 0 HG22 VAL A 294 3.383 2.042 -5.070 1.00 0.00 H new ATOM 0 HG23 VAL A 294 3.296 1.684 -6.811 1.00 0.00 H new ATOM 1333 N GLU A 295 7.195 -0.501 -4.358 1.00 0.00 N ATOM 1334 CA GLU A 295 8.001 -1.619 -3.909 1.00 0.00 C ATOM 1335 C GLU A 295 7.401 -2.221 -2.650 1.00 0.00 C ATOM 1336 O GLU A 295 7.220 -1.540 -1.638 1.00 0.00 O ATOM 1337 CB GLU A 295 9.454 -1.205 -3.674 1.00 0.00 C ATOM 1338 CG GLU A 295 10.199 -0.945 -4.966 1.00 0.00 C ATOM 1339 CD GLU A 295 11.705 -0.962 -4.807 1.00 0.00 C ATOM 1340 OE1 GLU A 295 12.233 -0.223 -3.955 1.00 0.00 O ATOM 1341 OE2 GLU A 295 12.367 -1.711 -5.558 1.00 0.00 O ATOM 0 H GLU A 295 7.142 0.273 -3.696 1.00 0.00 H new ATOM 0 HA GLU A 295 8.002 -2.374 -4.695 1.00 0.00 H new ATOM 0 HB2 GLU A 295 9.477 -0.306 -3.058 1.00 0.00 H new ATOM 0 HB3 GLU A 295 9.966 -1.988 -3.115 1.00 0.00 H new ATOM 0 HG2 GLU A 295 9.910 -1.697 -5.701 1.00 0.00 H new ATOM 0 HG3 GLU A 295 9.894 0.023 -5.364 1.00 0.00 H new ATOM 1348 N CYS A 296 7.061 -3.492 -2.736 1.00 0.00 N ATOM 1349 CA CYS A 296 6.452 -4.203 -1.627 1.00 0.00 C ATOM 1350 C CYS A 296 7.055 -5.588 -1.484 1.00 0.00 C ATOM 1351 O CYS A 296 7.832 -6.021 -2.324 1.00 0.00 O ATOM 1352 CB CYS A 296 4.945 -4.309 -1.843 1.00 0.00 C ATOM 1353 SG CYS A 296 4.474 -4.797 -3.520 1.00 0.00 S ATOM 0 H CYS A 296 7.198 -4.060 -3.572 1.00 0.00 H new ATOM 0 HA CYS A 296 6.645 -3.646 -0.710 1.00 0.00 H new ATOM 0 HB2 CYS A 296 4.537 -5.033 -1.137 1.00 0.00 H new ATOM 0 HB3 CYS A 296 4.487 -3.347 -1.614 1.00 0.00 H new ATOM 0 HG CYS A 296 3.179 -4.872 -3.602 1.00 0.00 H new ATOM 1359 N LYS A 297 6.698 -6.275 -0.418 1.00 0.00 N ATOM 1360 CA LYS A 297 7.162 -7.637 -0.202 1.00 0.00 C ATOM 1361 C LYS A 297 6.569 -8.583 -1.244 1.00 0.00 C ATOM 1362 O LYS A 297 5.568 -8.271 -1.890 1.00 0.00 O ATOM 1363 CB LYS A 297 6.788 -8.100 1.205 1.00 0.00 C ATOM 1364 CG LYS A 297 7.356 -7.227 2.319 1.00 0.00 C ATOM 1365 CD LYS A 297 8.879 -7.172 2.292 1.00 0.00 C ATOM 1366 CE LYS A 297 9.499 -8.561 2.360 1.00 0.00 C ATOM 1367 NZ LYS A 297 9.093 -9.294 3.587 1.00 0.00 N ATOM 0 H LYS A 297 6.087 -5.915 0.315 1.00 0.00 H new ATOM 0 HA LYS A 297 8.247 -7.652 -0.305 1.00 0.00 H new ATOM 0 HB2 LYS A 297 5.702 -8.121 1.292 1.00 0.00 H new ATOM 0 HB3 LYS A 297 7.139 -9.123 1.345 1.00 0.00 H new ATOM 0 HG2 LYS A 297 6.957 -6.217 2.225 1.00 0.00 H new ATOM 0 HG3 LYS A 297 7.026 -7.612 3.284 1.00 0.00 H new ATOM 0 HD2 LYS A 297 9.208 -6.672 1.381 1.00 0.00 H new ATOM 0 HD3 LYS A 297 9.236 -6.574 3.131 1.00 0.00 H new ATOM 0 HE2 LYS A 297 9.202 -9.134 1.481 1.00 0.00 H new ATOM 0 HE3 LYS A 297 10.585 -8.475 2.332 1.00 0.00 H new ATOM 0 HZ1 LYS A 297 9.615 -10.191 3.644 1.00 0.00 H new ATOM 0 HZ2 LYS A 297 9.307 -8.715 4.424 1.00 0.00 H new ATOM 0 HZ3 LYS A 297 8.072 -9.489 3.553 1.00 0.00 H new ATOM 1381 N LEU A 298 7.199 -9.752 -1.377 1.00 0.00 N ATOM 1382 CA LEU A 298 6.874 -10.713 -2.432 1.00 0.00 C ATOM 1383 C LEU A 298 5.506 -11.344 -2.198 1.00 0.00 C ATOM 1384 O LEU A 298 4.979 -12.056 -3.053 1.00 0.00 O ATOM 1385 CB LEU A 298 7.932 -11.831 -2.500 1.00 0.00 C ATOM 1386 CG LEU A 298 9.402 -11.397 -2.640 1.00 0.00 C ATOM 1387 CD1 LEU A 298 9.565 -10.331 -3.709 1.00 0.00 C ATOM 1388 CD2 LEU A 298 9.963 -10.924 -1.307 1.00 0.00 C ATOM 0 H LEU A 298 7.948 -10.059 -0.757 1.00 0.00 H new ATOM 0 HA LEU A 298 6.861 -10.165 -3.374 1.00 0.00 H new ATOM 0 HB2 LEU A 298 7.842 -12.437 -1.598 1.00 0.00 H new ATOM 0 HB3 LEU A 298 7.688 -12.477 -3.343 1.00 0.00 H new ATOM 0 HG LEU A 298 9.974 -12.270 -2.954 1.00 0.00 H new ATOM 0 HD11 LEU A 298 10.615 -10.047 -3.782 1.00 0.00 H new ATOM 0 HD12 LEU A 298 9.227 -10.723 -4.668 1.00 0.00 H new ATOM 0 HD13 LEU A 298 8.970 -9.457 -3.445 1.00 0.00 H new ATOM 0 HD21 LEU A 298 11.003 -10.624 -1.436 1.00 0.00 H new ATOM 0 HD22 LEU A 298 9.382 -10.075 -0.948 1.00 0.00 H new ATOM 0 HD23 LEU A 298 9.907 -11.735 -0.580 1.00 0.00 H new ATOM 1400 N ASP A 299 4.947 -11.073 -1.032 1.00 0.00 N ATOM 1401 CA ASP A 299 3.686 -11.662 -0.613 1.00 0.00 C ATOM 1402 C ASP A 299 2.547 -10.658 -0.703 1.00 0.00 C ATOM 1403 O ASP A 299 1.464 -10.893 -0.163 1.00 0.00 O ATOM 1404 CB ASP A 299 3.812 -12.159 0.827 1.00 0.00 C ATOM 1405 CG ASP A 299 4.220 -11.053 1.783 1.00 0.00 C ATOM 1406 OD1 ASP A 299 5.438 -10.806 1.915 1.00 0.00 O ATOM 1407 OD2 ASP A 299 3.334 -10.421 2.393 1.00 0.00 O ATOM 0 H ASP A 299 5.355 -10.437 -0.347 1.00 0.00 H new ATOM 0 HA ASP A 299 3.460 -12.493 -1.281 1.00 0.00 H new ATOM 0 HB2 ASP A 299 2.860 -12.581 1.148 1.00 0.00 H new ATOM 0 HB3 ASP A 299 4.547 -12.962 0.869 1.00 0.00 H new ATOM 1412 N HIS A 300 2.778 -9.544 -1.388 1.00 0.00 N ATOM 1413 CA HIS A 300 1.773 -8.492 -1.457 1.00 0.00 C ATOM 1414 C HIS A 300 0.622 -8.901 -2.369 1.00 0.00 C ATOM 1415 O HIS A 300 0.810 -9.087 -3.569 1.00 0.00 O ATOM 1416 CB HIS A 300 2.383 -7.181 -1.957 1.00 0.00 C ATOM 1417 CG HIS A 300 1.453 -6.006 -1.861 1.00 0.00 C ATOM 1418 ND1 HIS A 300 0.294 -5.896 -2.597 1.00 0.00 N ATOM 1419 CD2 HIS A 300 1.518 -4.885 -1.105 1.00 0.00 C ATOM 1420 CE1 HIS A 300 -0.309 -4.762 -2.301 1.00 0.00 C ATOM 1421 NE2 HIS A 300 0.413 -4.123 -1.398 1.00 0.00 N ATOM 0 H HIS A 300 3.640 -9.348 -1.897 1.00 0.00 H new ATOM 0 HA HIS A 300 1.390 -8.338 -0.448 1.00 0.00 H new ATOM 0 HB2 HIS A 300 3.284 -6.968 -1.382 1.00 0.00 H new ATOM 0 HB3 HIS A 300 2.690 -7.306 -2.995 1.00 0.00 H new ATOM 0 HD1 HIS A 300 -0.045 -6.586 -3.268 1.00 0.00 H new ATOM 0 HD2 HIS A 300 2.297 -4.635 -0.400 1.00 0.00 H new ATOM 0 HE1 HIS A 300 -1.239 -4.413 -2.726 1.00 0.00 H new ATOM 1430 N PRO A 301 -0.587 -9.029 -1.812 1.00 0.00 N ATOM 1431 CA PRO A 301 -1.774 -9.345 -2.595 1.00 0.00 C ATOM 1432 C PRO A 301 -2.274 -8.130 -3.372 1.00 0.00 C ATOM 1433 O PRO A 301 -2.582 -7.087 -2.795 1.00 0.00 O ATOM 1434 CB PRO A 301 -2.792 -9.781 -1.539 1.00 0.00 C ATOM 1435 CG PRO A 301 -2.382 -9.075 -0.293 1.00 0.00 C ATOM 1436 CD PRO A 301 -0.889 -8.889 -0.374 1.00 0.00 C ATOM 0 HA PRO A 301 -1.587 -10.109 -3.349 1.00 0.00 H new ATOM 0 HB2 PRO A 301 -3.806 -9.508 -1.832 1.00 0.00 H new ATOM 0 HB3 PRO A 301 -2.780 -10.862 -1.402 1.00 0.00 H new ATOM 0 HG2 PRO A 301 -2.888 -8.113 -0.208 1.00 0.00 H new ATOM 0 HG3 PRO A 301 -2.653 -9.656 0.588 1.00 0.00 H new ATOM 0 HD2 PRO A 301 -0.588 -7.912 0.003 1.00 0.00 H new ATOM 0 HD3 PRO A 301 -0.361 -9.636 0.219 1.00 0.00 H new ATOM 1444 N PHE A 302 -2.298 -8.259 -4.683 1.00 0.00 N ATOM 1445 CA PHE A 302 -2.816 -7.219 -5.553 1.00 0.00 C ATOM 1446 C PHE A 302 -4.182 -7.635 -6.059 1.00 0.00 C ATOM 1447 O PHE A 302 -4.315 -8.676 -6.704 1.00 0.00 O ATOM 1448 CB PHE A 302 -1.890 -6.996 -6.753 1.00 0.00 C ATOM 1449 CG PHE A 302 -0.507 -6.550 -6.390 1.00 0.00 C ATOM 1450 CD1 PHE A 302 -0.252 -5.225 -6.082 1.00 0.00 C ATOM 1451 CD2 PHE A 302 0.539 -7.458 -6.362 1.00 0.00 C ATOM 1452 CE1 PHE A 302 1.022 -4.812 -5.749 1.00 0.00 C ATOM 1453 CE2 PHE A 302 1.816 -7.050 -6.029 1.00 0.00 C ATOM 1454 CZ PHE A 302 2.058 -5.727 -5.723 1.00 0.00 C ATOM 0 H PHE A 302 -1.960 -9.085 -5.176 1.00 0.00 H new ATOM 0 HA PHE A 302 -2.881 -6.291 -4.985 1.00 0.00 H new ATOM 0 HB2 PHE A 302 -1.822 -7.923 -7.322 1.00 0.00 H new ATOM 0 HB3 PHE A 302 -2.339 -6.251 -7.410 1.00 0.00 H new ATOM 0 HD1 PHE A 302 -1.058 -4.507 -6.102 1.00 0.00 H new ATOM 0 HD2 PHE A 302 0.354 -8.494 -6.603 1.00 0.00 H new ATOM 0 HE1 PHE A 302 1.209 -3.776 -5.509 1.00 0.00 H new ATOM 0 HE2 PHE A 302 2.624 -7.766 -6.008 1.00 0.00 H new ATOM 0 HZ PHE A 302 3.056 -5.406 -5.463 1.00 0.00 H new ATOM 1464 N TYR A 303 -5.202 -6.855 -5.755 1.00 0.00 N ATOM 1465 CA TYR A 303 -6.522 -7.161 -6.264 1.00 0.00 C ATOM 1466 C TYR A 303 -6.589 -6.814 -7.741 1.00 0.00 C ATOM 1467 O TYR A 303 -6.636 -5.646 -8.113 1.00 0.00 O ATOM 1468 CB TYR A 303 -7.612 -6.418 -5.506 1.00 0.00 C ATOM 1469 CG TYR A 303 -8.960 -7.066 -5.692 1.00 0.00 C ATOM 1470 CD1 TYR A 303 -9.698 -6.877 -6.853 1.00 0.00 C ATOM 1471 CD2 TYR A 303 -9.475 -7.901 -4.716 1.00 0.00 C ATOM 1472 CE1 TYR A 303 -10.916 -7.502 -7.030 1.00 0.00 C ATOM 1473 CE2 TYR A 303 -10.685 -8.531 -4.885 1.00 0.00 C ATOM 1474 CZ TYR A 303 -11.403 -8.331 -6.039 1.00 0.00 C ATOM 1475 OH TYR A 303 -12.611 -8.963 -6.193 1.00 0.00 O ATOM 0 H TYR A 303 -5.144 -6.021 -5.170 1.00 0.00 H new ATOM 0 HA TYR A 303 -6.696 -8.228 -6.123 1.00 0.00 H new ATOM 0 HB2 TYR A 303 -7.364 -6.391 -4.445 1.00 0.00 H new ATOM 0 HB3 TYR A 303 -7.654 -5.384 -5.849 1.00 0.00 H new ATOM 0 HD1 TYR A 303 -9.313 -6.232 -7.629 1.00 0.00 H new ATOM 0 HD2 TYR A 303 -8.916 -8.060 -3.806 1.00 0.00 H new ATOM 0 HE1 TYR A 303 -11.483 -7.344 -7.936 1.00 0.00 H new ATOM 0 HE2 TYR A 303 -11.070 -9.181 -4.113 1.00 0.00 H new ATOM 0 HH TYR A 303 -12.508 -9.918 -5.998 1.00 0.00 H new ATOM 1485 N VAL A 304 -6.587 -7.835 -8.572 1.00 0.00 N ATOM 1486 CA VAL A 304 -6.577 -7.650 -10.009 1.00 0.00 C ATOM 1487 C VAL A 304 -7.990 -7.684 -10.581 1.00 0.00 C ATOM 1488 O VAL A 304 -8.809 -8.535 -10.220 1.00 0.00 O ATOM 1489 CB VAL A 304 -5.698 -8.717 -10.694 1.00 0.00 C ATOM 1490 CG1 VAL A 304 -5.864 -8.680 -12.204 1.00 0.00 C ATOM 1491 CG2 VAL A 304 -4.244 -8.504 -10.318 1.00 0.00 C ATOM 0 H VAL A 304 -6.592 -8.810 -8.274 1.00 0.00 H new ATOM 0 HA VAL A 304 -6.152 -6.667 -10.211 1.00 0.00 H new ATOM 0 HB VAL A 304 -6.019 -9.699 -10.348 1.00 0.00 H new ATOM 0 HG11 VAL A 304 -5.232 -9.443 -12.658 1.00 0.00 H new ATOM 0 HG12 VAL A 304 -6.906 -8.872 -12.460 1.00 0.00 H new ATOM 0 HG13 VAL A 304 -5.573 -7.698 -12.578 1.00 0.00 H new ATOM 0 HG21 VAL A 304 -3.628 -9.260 -10.804 1.00 0.00 H new ATOM 0 HG22 VAL A 304 -3.926 -7.513 -10.642 1.00 0.00 H new ATOM 0 HG23 VAL A 304 -4.132 -8.585 -9.237 1.00 0.00 H new ATOM 1501 N LYS A 305 -8.266 -6.736 -11.461 1.00 0.00 N ATOM 1502 CA LYS A 305 -9.543 -6.653 -12.147 1.00 0.00 C ATOM 1503 C LYS A 305 -9.809 -7.935 -12.928 1.00 0.00 C ATOM 1504 O LYS A 305 -8.971 -8.365 -13.723 1.00 0.00 O ATOM 1505 CB LYS A 305 -9.510 -5.437 -13.077 1.00 0.00 C ATOM 1506 CG LYS A 305 -10.747 -5.218 -13.935 1.00 0.00 C ATOM 1507 CD LYS A 305 -10.515 -4.049 -14.882 1.00 0.00 C ATOM 1508 CE LYS A 305 -11.622 -3.896 -15.912 1.00 0.00 C ATOM 1509 NZ LYS A 305 -12.841 -3.244 -15.358 1.00 0.00 N ATOM 0 H LYS A 305 -7.608 -6.001 -11.720 1.00 0.00 H new ATOM 0 HA LYS A 305 -10.352 -6.537 -11.426 1.00 0.00 H new ATOM 0 HB2 LYS A 305 -9.351 -4.545 -12.471 1.00 0.00 H new ATOM 0 HB3 LYS A 305 -8.647 -5.532 -13.736 1.00 0.00 H new ATOM 0 HG2 LYS A 305 -10.971 -6.120 -14.504 1.00 0.00 H new ATOM 0 HG3 LYS A 305 -11.611 -5.019 -13.301 1.00 0.00 H new ATOM 0 HD2 LYS A 305 -10.434 -3.129 -14.303 1.00 0.00 H new ATOM 0 HD3 LYS A 305 -9.564 -4.187 -15.396 1.00 0.00 H new ATOM 0 HE2 LYS A 305 -11.251 -3.309 -16.752 1.00 0.00 H new ATOM 0 HE3 LYS A 305 -11.887 -4.879 -16.302 1.00 0.00 H new ATOM 0 HZ1 LYS A 305 -13.439 -2.906 -16.139 1.00 0.00 H new ATOM 0 HZ2 LYS A 305 -13.373 -3.931 -14.787 1.00 0.00 H new ATOM 0 HZ3 LYS A 305 -12.563 -2.439 -14.761 1.00 0.00 H new ATOM 1523 N ASN A 306 -10.963 -8.553 -12.661 1.00 0.00 N ATOM 1524 CA ASN A 306 -11.413 -9.768 -13.361 1.00 0.00 C ATOM 1525 C ASN A 306 -10.707 -11.025 -12.849 1.00 0.00 C ATOM 1526 O ASN A 306 -10.993 -12.130 -13.305 1.00 0.00 O ATOM 1527 CB ASN A 306 -11.219 -9.650 -14.881 1.00 0.00 C ATOM 1528 CG ASN A 306 -11.986 -8.489 -15.496 1.00 0.00 C ATOM 1529 OD1 ASN A 306 -13.149 -8.174 -14.941 1.00 0.00 O flip ATOM 1530 ND2 ASN A 306 -11.533 -7.884 -16.469 1.00 0.00 N flip ATOM 0 H ASN A 306 -11.617 -8.226 -11.950 1.00 0.00 H new ATOM 0 HA ASN A 306 -12.478 -9.864 -13.148 1.00 0.00 H new ATOM 0 HB2 ASN A 306 -10.157 -9.530 -15.097 1.00 0.00 H new ATOM 0 HB3 ASN A 306 -11.538 -10.579 -15.354 1.00 0.00 H new ATOM 0 HD21 ASN A 306 -10.634 -8.158 -16.866 1.00 0.00 H new ATOM 0 HD22 ASN A 306 -12.057 -7.110 -16.877 1.00 0.00 H new ATOM 1537 N LYS A 307 -9.789 -10.862 -11.909 1.00 0.00 N ATOM 1538 CA LYS A 307 -9.094 -12.006 -11.322 1.00 0.00 C ATOM 1539 C LYS A 307 -9.373 -12.118 -9.832 1.00 0.00 C ATOM 1540 O LYS A 307 -9.340 -13.208 -9.265 1.00 0.00 O ATOM 1541 CB LYS A 307 -7.586 -11.899 -11.532 1.00 0.00 C ATOM 1542 CG LYS A 307 -7.093 -12.462 -12.849 1.00 0.00 C ATOM 1543 CD LYS A 307 -5.574 -12.541 -12.871 1.00 0.00 C ATOM 1544 CE LYS A 307 -5.042 -12.880 -14.254 1.00 0.00 C ATOM 1545 NZ LYS A 307 -5.344 -11.810 -15.240 1.00 0.00 N ATOM 0 H LYS A 307 -9.506 -9.956 -11.535 1.00 0.00 H new ATOM 0 HA LYS A 307 -9.470 -12.896 -11.826 1.00 0.00 H new ATOM 0 HB2 LYS A 307 -7.297 -10.850 -11.469 1.00 0.00 H new ATOM 0 HB3 LYS A 307 -7.081 -12.418 -10.718 1.00 0.00 H new ATOM 0 HG2 LYS A 307 -7.515 -13.455 -13.005 1.00 0.00 H new ATOM 0 HG3 LYS A 307 -7.440 -11.835 -13.670 1.00 0.00 H new ATOM 0 HD2 LYS A 307 -5.157 -11.588 -12.545 1.00 0.00 H new ATOM 0 HD3 LYS A 307 -5.240 -13.295 -12.159 1.00 0.00 H new ATOM 0 HE2 LYS A 307 -3.964 -13.032 -14.201 1.00 0.00 H new ATOM 0 HE3 LYS A 307 -5.480 -13.819 -14.592 1.00 0.00 H new ATOM 0 HZ1 LYS A 307 -6.172 -12.084 -15.807 1.00 0.00 H new ATOM 0 HZ2 LYS A 307 -5.547 -10.922 -14.738 1.00 0.00 H new ATOM 0 HZ3 LYS A 307 -4.525 -11.674 -15.867 1.00 0.00 H new ATOM 1559 N GLY A 308 -9.634 -10.984 -9.204 1.00 0.00 N ATOM 1560 CA GLY A 308 -9.794 -10.961 -7.768 1.00 0.00 C ATOM 1561 C GLY A 308 -8.453 -10.811 -7.092 1.00 0.00 C ATOM 1562 O GLY A 308 -7.524 -10.251 -7.678 1.00 0.00 O ATOM 0 H GLY A 308 -9.738 -10.079 -9.663 1.00 0.00 H new ATOM 0 HA2 GLY A 308 -10.447 -10.137 -7.482 1.00 0.00 H new ATOM 0 HA3 GLY A 308 -10.276 -11.880 -7.435 1.00 0.00 H new ATOM 1566 N TRP A 309 -8.333 -11.314 -5.877 1.00 0.00 N ATOM 1567 CA TRP A 309 -7.065 -11.274 -5.166 1.00 0.00 C ATOM 1568 C TRP A 309 -6.013 -12.061 -5.930 1.00 0.00 C ATOM 1569 O TRP A 309 -6.151 -13.265 -6.130 1.00 0.00 O ATOM 1570 CB TRP A 309 -7.211 -11.843 -3.756 1.00 0.00 C ATOM 1571 CG TRP A 309 -8.106 -11.031 -2.872 1.00 0.00 C ATOM 1572 CD1 TRP A 309 -9.360 -11.362 -2.440 1.00 0.00 C ATOM 1573 CD2 TRP A 309 -7.816 -9.745 -2.314 1.00 0.00 C ATOM 1574 NE1 TRP A 309 -9.861 -10.360 -1.645 1.00 0.00 N ATOM 1575 CE2 TRP A 309 -8.933 -9.357 -1.554 1.00 0.00 C ATOM 1576 CE3 TRP A 309 -6.716 -8.883 -2.384 1.00 0.00 C ATOM 1577 CZ2 TRP A 309 -8.982 -8.145 -0.868 1.00 0.00 C ATOM 1578 CZ3 TRP A 309 -6.766 -7.682 -1.703 1.00 0.00 C ATOM 1579 CH2 TRP A 309 -7.891 -7.324 -0.954 1.00 0.00 C ATOM 0 H TRP A 309 -9.095 -11.754 -5.362 1.00 0.00 H new ATOM 0 HA TRP A 309 -6.753 -10.233 -5.088 1.00 0.00 H new ATOM 0 HB2 TRP A 309 -7.603 -12.858 -3.822 1.00 0.00 H new ATOM 0 HB3 TRP A 309 -6.225 -11.911 -3.297 1.00 0.00 H new ATOM 0 HD1 TRP A 309 -9.880 -12.276 -2.687 1.00 0.00 H new ATOM 0 HE1 TRP A 309 -10.776 -10.363 -1.195 1.00 0.00 H new ATOM 0 HE3 TRP A 309 -5.843 -9.152 -2.960 1.00 0.00 H new ATOM 0 HZ2 TRP A 309 -9.850 -7.864 -0.290 1.00 0.00 H new ATOM 0 HZ3 TRP A 309 -5.923 -7.009 -1.750 1.00 0.00 H new ATOM 0 HH2 TRP A 309 -7.899 -6.379 -0.432 1.00 0.00 H new ATOM 1590 N SER A 310 -4.979 -11.372 -6.377 1.00 0.00 N ATOM 1591 CA SER A 310 -3.921 -11.998 -7.141 1.00 0.00 C ATOM 1592 C SER A 310 -2.557 -11.658 -6.539 1.00 0.00 C ATOM 1593 O SER A 310 -2.448 -10.775 -5.694 1.00 0.00 O ATOM 1594 CB SER A 310 -4.008 -11.552 -8.598 1.00 0.00 C ATOM 1595 OG SER A 310 -5.314 -11.763 -9.109 1.00 0.00 O ATOM 0 H SER A 310 -4.851 -10.372 -6.222 1.00 0.00 H new ATOM 0 HA SER A 310 -4.040 -13.081 -7.103 1.00 0.00 H new ATOM 0 HB2 SER A 310 -3.747 -10.497 -8.677 1.00 0.00 H new ATOM 0 HB3 SER A 310 -3.284 -12.105 -9.197 1.00 0.00 H new ATOM 0 HG SER A 310 -5.944 -11.168 -8.651 1.00 0.00 H new ATOM 1601 N SER A 311 -1.533 -12.378 -6.956 1.00 0.00 N ATOM 1602 CA SER A 311 -0.194 -12.195 -6.425 1.00 0.00 C ATOM 1603 C SER A 311 0.847 -12.785 -7.374 1.00 0.00 C ATOM 1604 O SER A 311 0.503 -13.446 -8.357 1.00 0.00 O ATOM 1605 CB SER A 311 -0.078 -12.852 -5.040 1.00 0.00 C ATOM 1606 OG SER A 311 1.241 -12.753 -4.524 1.00 0.00 O ATOM 0 H SER A 311 -1.604 -13.104 -7.669 1.00 0.00 H new ATOM 0 HA SER A 311 -0.006 -11.126 -6.327 1.00 0.00 H new ATOM 0 HB2 SER A 311 -0.776 -12.376 -4.351 1.00 0.00 H new ATOM 0 HB3 SER A 311 -0.365 -13.901 -5.109 1.00 0.00 H new ATOM 0 HG SER A 311 1.216 -12.824 -3.547 1.00 0.00 H new ATOM 1612 N PHE A 312 2.113 -12.528 -7.078 1.00 0.00 N ATOM 1613 CA PHE A 312 3.220 -13.109 -7.824 1.00 0.00 C ATOM 1614 C PHE A 312 3.565 -14.474 -7.247 1.00 0.00 C ATOM 1615 O PHE A 312 3.911 -15.406 -7.973 1.00 0.00 O ATOM 1616 CB PHE A 312 4.447 -12.196 -7.765 1.00 0.00 C ATOM 1617 CG PHE A 312 4.286 -10.918 -8.538 1.00 0.00 C ATOM 1618 CD1 PHE A 312 3.535 -9.869 -8.030 1.00 0.00 C ATOM 1619 CD2 PHE A 312 4.878 -10.771 -9.782 1.00 0.00 C ATOM 1620 CE1 PHE A 312 3.381 -8.703 -8.746 1.00 0.00 C ATOM 1621 CE2 PHE A 312 4.722 -9.604 -10.504 1.00 0.00 C ATOM 1622 CZ PHE A 312 3.973 -8.571 -9.985 1.00 0.00 C ATOM 0 H PHE A 312 2.401 -11.913 -6.317 1.00 0.00 H new ATOM 0 HA PHE A 312 2.920 -13.219 -8.866 1.00 0.00 H new ATOM 0 HB2 PHE A 312 4.661 -11.956 -6.723 1.00 0.00 H new ATOM 0 HB3 PHE A 312 5.311 -12.737 -8.151 1.00 0.00 H new ATOM 0 HD1 PHE A 312 3.066 -9.968 -7.062 1.00 0.00 H new ATOM 0 HD2 PHE A 312 5.468 -11.578 -10.192 1.00 0.00 H new ATOM 0 HE1 PHE A 312 2.797 -7.892 -8.338 1.00 0.00 H new ATOM 0 HE2 PHE A 312 5.186 -9.502 -11.474 1.00 0.00 H new ATOM 0 HZ PHE A 312 3.849 -7.658 -10.548 1.00 0.00 H new ATOM 1632 N TYR A 313 3.454 -14.575 -5.930 1.00 0.00 N ATOM 1633 CA TYR A 313 3.713 -15.816 -5.221 1.00 0.00 C ATOM 1634 C TYR A 313 2.508 -16.166 -4.352 1.00 0.00 C ATOM 1635 O TYR A 313 2.523 -15.957 -3.142 1.00 0.00 O ATOM 1636 CB TYR A 313 4.979 -15.683 -4.361 1.00 0.00 C ATOM 1637 CG TYR A 313 6.211 -15.324 -5.165 1.00 0.00 C ATOM 1638 CD1 TYR A 313 6.977 -16.311 -5.767 1.00 0.00 C ATOM 1639 CD2 TYR A 313 6.594 -13.998 -5.338 1.00 0.00 C ATOM 1640 CE1 TYR A 313 8.092 -15.990 -6.517 1.00 0.00 C ATOM 1641 CE2 TYR A 313 7.706 -13.670 -6.094 1.00 0.00 C ATOM 1642 CZ TYR A 313 8.450 -14.670 -6.678 1.00 0.00 C ATOM 1643 OH TYR A 313 9.556 -14.353 -7.440 1.00 0.00 O ATOM 0 H TYR A 313 3.182 -13.800 -5.326 1.00 0.00 H new ATOM 0 HA TYR A 313 3.875 -16.617 -5.942 1.00 0.00 H new ATOM 0 HB2 TYR A 313 4.815 -14.920 -3.600 1.00 0.00 H new ATOM 0 HB3 TYR A 313 5.156 -16.623 -3.838 1.00 0.00 H new ATOM 0 HD1 TYR A 313 6.697 -17.347 -5.648 1.00 0.00 H new ATOM 0 HD2 TYR A 313 6.015 -13.212 -4.875 1.00 0.00 H new ATOM 0 HE1 TYR A 313 8.680 -16.771 -6.975 1.00 0.00 H new ATOM 0 HE2 TYR A 313 7.988 -12.636 -6.225 1.00 0.00 H new ATOM 0 HH TYR A 313 9.726 -13.389 -7.385 1.00 0.00 H new ATOM 1653 N PRO A 314 1.435 -16.693 -4.970 1.00 0.00 N ATOM 1654 CA PRO A 314 0.182 -17.008 -4.268 1.00 0.00 C ATOM 1655 C PRO A 314 0.380 -17.970 -3.101 1.00 0.00 C ATOM 1656 O PRO A 314 -0.240 -17.811 -2.048 1.00 0.00 O ATOM 1657 CB PRO A 314 -0.684 -17.654 -5.351 1.00 0.00 C ATOM 1658 CG PRO A 314 -0.124 -17.153 -6.635 1.00 0.00 C ATOM 1659 CD PRO A 314 1.352 -17.020 -6.404 1.00 0.00 C ATOM 0 HA PRO A 314 -0.260 -16.117 -3.822 1.00 0.00 H new ATOM 0 HB2 PRO A 314 -0.638 -18.742 -5.297 1.00 0.00 H new ATOM 0 HB3 PRO A 314 -1.731 -17.373 -5.240 1.00 0.00 H new ATOM 0 HG2 PRO A 314 -0.333 -17.845 -7.451 1.00 0.00 H new ATOM 0 HG3 PRO A 314 -0.566 -16.195 -6.909 1.00 0.00 H new ATOM 0 HD2 PRO A 314 1.882 -17.943 -6.639 1.00 0.00 H new ATOM 0 HD3 PRO A 314 1.788 -16.236 -7.023 1.00 0.00 H new ATOM 1667 N SER A 315 1.260 -18.949 -3.287 1.00 0.00 N ATOM 1668 CA SER A 315 1.538 -19.939 -2.254 1.00 0.00 C ATOM 1669 C SER A 315 2.207 -19.287 -1.043 1.00 0.00 C ATOM 1670 O SER A 315 2.177 -19.817 0.065 1.00 0.00 O ATOM 1671 CB SER A 315 2.427 -21.042 -2.828 1.00 0.00 C ATOM 1672 OG SER A 315 1.847 -21.597 -3.999 1.00 0.00 O ATOM 0 H SER A 315 1.794 -19.077 -4.147 1.00 0.00 H new ATOM 0 HA SER A 315 0.596 -20.376 -1.921 1.00 0.00 H new ATOM 0 HB2 SER A 315 3.412 -20.637 -3.061 1.00 0.00 H new ATOM 0 HB3 SER A 315 2.572 -21.824 -2.082 1.00 0.00 H new ATOM 0 HG SER A 315 2.432 -22.300 -4.352 1.00 0.00 H new ATOM 1678 N LEU A 316 2.807 -18.130 -1.271 1.00 0.00 N ATOM 1679 CA LEU A 316 3.430 -17.361 -0.209 1.00 0.00 C ATOM 1680 C LEU A 316 2.396 -16.444 0.449 1.00 0.00 C ATOM 1681 O LEU A 316 2.278 -16.399 1.676 1.00 0.00 O ATOM 1682 CB LEU A 316 4.591 -16.543 -0.787 1.00 0.00 C ATOM 1683 CG LEU A 316 5.398 -15.731 0.224 1.00 0.00 C ATOM 1684 CD1 LEU A 316 6.060 -16.646 1.243 1.00 0.00 C ATOM 1685 CD2 LEU A 316 6.438 -14.883 -0.492 1.00 0.00 C ATOM 0 H LEU A 316 2.875 -17.700 -2.193 1.00 0.00 H new ATOM 0 HA LEU A 316 3.820 -18.037 0.552 1.00 0.00 H new ATOM 0 HB2 LEU A 316 5.269 -17.223 -1.303 1.00 0.00 H new ATOM 0 HB3 LEU A 316 4.192 -15.861 -1.538 1.00 0.00 H new ATOM 0 HG LEU A 316 4.717 -15.068 0.757 1.00 0.00 H new ATOM 0 HD11 LEU A 316 6.630 -16.047 1.954 1.00 0.00 H new ATOM 0 HD12 LEU A 316 5.295 -17.211 1.776 1.00 0.00 H new ATOM 0 HD13 LEU A 316 6.730 -17.336 0.731 1.00 0.00 H new ATOM 0 HD21 LEU A 316 7.006 -14.309 0.240 1.00 0.00 H new ATOM 0 HD22 LEU A 316 7.114 -15.531 -1.050 1.00 0.00 H new ATOM 0 HD23 LEU A 316 5.940 -14.200 -1.180 1.00 0.00 H new ATOM 1697 N THR A 317 1.632 -15.744 -0.384 1.00 0.00 N ATOM 1698 CA THR A 317 0.608 -14.807 0.077 1.00 0.00 C ATOM 1699 C THR A 317 -0.415 -15.480 1.000 1.00 0.00 C ATOM 1700 O THR A 317 -0.814 -14.915 2.023 1.00 0.00 O ATOM 1701 CB THR A 317 -0.131 -14.189 -1.127 1.00 0.00 C ATOM 1702 OG1 THR A 317 0.814 -13.616 -2.038 1.00 0.00 O ATOM 1703 CG2 THR A 317 -1.112 -13.115 -0.682 1.00 0.00 C ATOM 0 H THR A 317 1.704 -15.809 -1.399 1.00 0.00 H new ATOM 0 HA THR A 317 1.120 -14.029 0.643 1.00 0.00 H new ATOM 0 HB THR A 317 -0.689 -14.985 -1.620 1.00 0.00 H new ATOM 0 HG1 THR A 317 1.281 -14.332 -2.518 1.00 0.00 H new ATOM 0 HG21 THR A 317 -1.617 -12.699 -1.554 1.00 0.00 H new ATOM 0 HG22 THR A 317 -1.850 -13.552 -0.010 1.00 0.00 H new ATOM 0 HG23 THR A 317 -0.573 -12.323 -0.163 1.00 0.00 H new ATOM 1711 N VAL A 318 -0.827 -16.690 0.641 1.00 0.00 N ATOM 1712 CA VAL A 318 -1.850 -17.410 1.390 1.00 0.00 C ATOM 1713 C VAL A 318 -1.339 -17.853 2.766 1.00 0.00 C ATOM 1714 O VAL A 318 -2.124 -18.112 3.675 1.00 0.00 O ATOM 1715 CB VAL A 318 -2.365 -18.627 0.589 1.00 0.00 C ATOM 1716 CG1 VAL A 318 -1.267 -19.661 0.389 1.00 0.00 C ATOM 1717 CG2 VAL A 318 -3.582 -19.245 1.261 1.00 0.00 C ATOM 0 H VAL A 318 -0.466 -17.195 -0.168 1.00 0.00 H new ATOM 0 HA VAL A 318 -2.680 -16.721 1.549 1.00 0.00 H new ATOM 0 HB VAL A 318 -2.668 -18.272 -0.396 1.00 0.00 H new ATOM 0 HG11 VAL A 318 -1.661 -20.505 -0.178 1.00 0.00 H new ATOM 0 HG12 VAL A 318 -0.439 -19.211 -0.158 1.00 0.00 H new ATOM 0 HG13 VAL A 318 -0.914 -20.009 1.360 1.00 0.00 H new ATOM 0 HG21 VAL A 318 -3.925 -20.099 0.678 1.00 0.00 H new ATOM 0 HG22 VAL A 318 -3.315 -19.575 2.265 1.00 0.00 H new ATOM 0 HG23 VAL A 318 -4.379 -18.504 1.322 1.00 0.00 H new ATOM 1727 N VAL A 319 -0.027 -17.917 2.923 1.00 0.00 N ATOM 1728 CA VAL A 319 0.567 -18.276 4.202 1.00 0.00 C ATOM 1729 C VAL A 319 0.830 -17.024 5.038 1.00 0.00 C ATOM 1730 O VAL A 319 0.539 -16.984 6.235 1.00 0.00 O ATOM 1731 CB VAL A 319 1.883 -19.061 4.006 1.00 0.00 C ATOM 1732 CG1 VAL A 319 2.527 -19.393 5.343 1.00 0.00 C ATOM 1733 CG2 VAL A 319 1.625 -20.332 3.214 1.00 0.00 C ATOM 0 H VAL A 319 0.647 -17.725 2.182 1.00 0.00 H new ATOM 0 HA VAL A 319 -0.140 -18.917 4.729 1.00 0.00 H new ATOM 0 HB VAL A 319 2.573 -18.430 3.446 1.00 0.00 H new ATOM 0 HG11 VAL A 319 3.451 -19.946 5.174 1.00 0.00 H new ATOM 0 HG12 VAL A 319 2.748 -18.470 5.879 1.00 0.00 H new ATOM 0 HG13 VAL A 319 1.843 -20.002 5.935 1.00 0.00 H new ATOM 0 HG21 VAL A 319 2.561 -20.875 3.083 1.00 0.00 H new ATOM 0 HG22 VAL A 319 0.914 -20.958 3.753 1.00 0.00 H new ATOM 0 HG23 VAL A 319 1.215 -20.075 2.237 1.00 0.00 H new ATOM 1743 N GLN A 320 1.363 -16.000 4.385 1.00 0.00 N ATOM 1744 CA GLN A 320 1.726 -14.754 5.052 1.00 0.00 C ATOM 1745 C GLN A 320 0.495 -13.936 5.453 1.00 0.00 C ATOM 1746 O GLN A 320 0.369 -13.524 6.604 1.00 0.00 O ATOM 1747 CB GLN A 320 2.639 -13.933 4.141 1.00 0.00 C ATOM 1748 CG GLN A 320 4.052 -14.485 4.035 1.00 0.00 C ATOM 1749 CD GLN A 320 4.954 -14.009 5.160 1.00 0.00 C ATOM 1750 OE1 GLN A 320 5.627 -12.986 5.037 1.00 0.00 O ATOM 1751 NE2 GLN A 320 4.967 -14.730 6.269 1.00 0.00 N ATOM 0 H GLN A 320 1.556 -16.008 3.383 1.00 0.00 H new ATOM 0 HA GLN A 320 2.255 -15.006 5.971 1.00 0.00 H new ATOM 0 HB2 GLN A 320 2.200 -13.890 3.144 1.00 0.00 H new ATOM 0 HB3 GLN A 320 2.685 -12.910 4.514 1.00 0.00 H new ATOM 0 HG2 GLN A 320 4.013 -15.574 4.042 1.00 0.00 H new ATOM 0 HG3 GLN A 320 4.483 -14.188 3.079 1.00 0.00 H new ATOM 0 HE21 GLN A 320 4.396 -15.573 6.336 1.00 0.00 H new ATOM 0 HE22 GLN A 320 5.548 -14.443 7.057 1.00 0.00 H new ATOM 1760 N HIS A 321 -0.412 -13.696 4.509 1.00 0.00 N ATOM 1761 CA HIS A 321 -1.603 -12.892 4.796 1.00 0.00 C ATOM 1762 C HIS A 321 -2.824 -13.779 5.005 1.00 0.00 C ATOM 1763 O HIS A 321 -3.816 -13.363 5.606 1.00 0.00 O ATOM 1764 CB HIS A 321 -1.890 -11.887 3.671 1.00 0.00 C ATOM 1765 CG HIS A 321 -0.850 -10.816 3.516 1.00 0.00 C ATOM 1766 ND1 HIS A 321 -0.991 -9.538 4.015 1.00 0.00 N ATOM 1767 CD2 HIS A 321 0.348 -10.840 2.894 1.00 0.00 C ATOM 1768 CE1 HIS A 321 0.077 -8.826 3.701 1.00 0.00 C ATOM 1769 NE2 HIS A 321 0.907 -9.596 3.022 1.00 0.00 N ATOM 0 H HIS A 321 -0.350 -14.040 3.551 1.00 0.00 H new ATOM 0 HA HIS A 321 -1.399 -12.340 5.713 1.00 0.00 H new ATOM 0 HB2 HIS A 321 -1.979 -12.429 2.730 1.00 0.00 H new ATOM 0 HB3 HIS A 321 -2.855 -11.415 3.859 1.00 0.00 H new ATOM 0 HD2 HIS A 321 0.786 -11.687 2.387 1.00 0.00 H new ATOM 0 HE1 HIS A 321 0.243 -7.790 3.957 1.00 0.00 H new ATOM 0 HE2 HIS A 321 1.815 -9.312 2.654 1.00 0.00 H new ATOM 1778 N GLY A 322 -2.747 -15.004 4.505 1.00 0.00 N ATOM 1779 CA GLY A 322 -3.858 -15.927 4.627 1.00 0.00 C ATOM 1780 C GLY A 322 -4.865 -15.769 3.508 1.00 0.00 C ATOM 1781 O GLY A 322 -6.034 -16.115 3.660 1.00 0.00 O ATOM 0 H GLY A 322 -1.933 -15.376 4.016 1.00 0.00 H new ATOM 0 HA2 GLY A 322 -3.479 -16.949 4.630 1.00 0.00 H new ATOM 0 HA3 GLY A 322 -4.355 -15.769 5.584 1.00 0.00 H new ATOM 1785 N ILE A 323 -4.412 -15.241 2.381 1.00 0.00 N ATOM 1786 CA ILE A 323 -5.288 -15.022 1.240 1.00 0.00 C ATOM 1787 C ILE A 323 -4.812 -15.825 0.037 1.00 0.00 C ATOM 1788 O ILE A 323 -3.731 -15.564 -0.497 1.00 0.00 O ATOM 1789 CB ILE A 323 -5.344 -13.532 0.842 1.00 0.00 C ATOM 1790 CG1 ILE A 323 -5.683 -12.664 2.057 1.00 0.00 C ATOM 1791 CG2 ILE A 323 -6.368 -13.323 -0.268 1.00 0.00 C ATOM 1792 CD1 ILE A 323 -5.691 -11.178 1.765 1.00 0.00 C ATOM 0 H ILE A 323 -3.444 -14.956 2.232 1.00 0.00 H new ATOM 0 HA ILE A 323 -6.284 -15.348 1.539 1.00 0.00 H new ATOM 0 HB ILE A 323 -4.363 -13.233 0.472 1.00 0.00 H new ATOM 0 HG12 ILE A 323 -6.662 -12.955 2.438 1.00 0.00 H new ATOM 0 HG13 ILE A 323 -4.961 -12.865 2.848 1.00 0.00 H new ATOM 0 HG21 ILE A 323 -6.399 -12.268 -0.541 1.00 0.00 H new ATOM 0 HG22 ILE A 323 -6.086 -13.915 -1.139 1.00 0.00 H new ATOM 0 HG23 ILE A 323 -7.352 -13.636 0.081 1.00 0.00 H new ATOM 0 HD11 ILE A 323 -5.939 -10.630 2.674 1.00 0.00 H new ATOM 0 HD12 ILE A 323 -4.706 -10.871 1.414 1.00 0.00 H new ATOM 0 HD13 ILE A 323 -6.434 -10.962 0.997 1.00 0.00 H new ATOM 1804 N PRO A 324 -5.597 -16.820 -0.395 1.00 0.00 N ATOM 1805 CA PRO A 324 -5.304 -17.582 -1.604 1.00 0.00 C ATOM 1806 C PRO A 324 -5.536 -16.723 -2.839 1.00 0.00 C ATOM 1807 O PRO A 324 -6.655 -16.272 -3.094 1.00 0.00 O ATOM 1808 CB PRO A 324 -6.282 -18.763 -1.558 1.00 0.00 C ATOM 1809 CG PRO A 324 -6.937 -18.702 -0.215 1.00 0.00 C ATOM 1810 CD PRO A 324 -6.837 -17.274 0.241 1.00 0.00 C ATOM 0 HA PRO A 324 -4.267 -17.914 -1.654 1.00 0.00 H new ATOM 0 HB2 PRO A 324 -7.021 -18.690 -2.356 1.00 0.00 H new ATOM 0 HB3 PRO A 324 -5.758 -19.709 -1.694 1.00 0.00 H new ATOM 0 HG2 PRO A 324 -7.978 -19.018 -0.276 1.00 0.00 H new ATOM 0 HG3 PRO A 324 -6.442 -19.370 0.489 1.00 0.00 H new ATOM 0 HD2 PRO A 324 -7.696 -16.685 -0.080 1.00 0.00 H new ATOM 0 HD3 PRO A 324 -6.787 -17.198 1.327 1.00 0.00 H new ATOM 1818 N CYS A 325 -4.478 -16.479 -3.590 1.00 0.00 N ATOM 1819 CA CYS A 325 -4.521 -15.501 -4.662 1.00 0.00 C ATOM 1820 C CYS A 325 -4.273 -16.136 -6.030 1.00 0.00 C ATOM 1821 O CYS A 325 -3.651 -17.191 -6.135 1.00 0.00 O ATOM 1822 CB CYS A 325 -3.481 -14.416 -4.388 1.00 0.00 C ATOM 1823 SG CYS A 325 -3.723 -13.545 -2.822 1.00 0.00 S ATOM 0 H CYS A 325 -3.578 -16.945 -3.478 1.00 0.00 H new ATOM 0 HA CYS A 325 -5.521 -15.067 -4.688 1.00 0.00 H new ATOM 0 HB2 CYS A 325 -2.489 -14.868 -4.391 1.00 0.00 H new ATOM 0 HB3 CYS A 325 -3.503 -13.692 -5.202 1.00 0.00 H new ATOM 0 HG CYS A 325 -3.707 -14.400 -1.843 1.00 0.00 H new ATOM 1829 N CYS A 326 -4.777 -15.473 -7.064 1.00 0.00 N ATOM 1830 CA CYS A 326 -4.522 -15.853 -8.447 1.00 0.00 C ATOM 1831 C CYS A 326 -3.144 -15.352 -8.860 1.00 0.00 C ATOM 1832 O CYS A 326 -2.560 -14.526 -8.175 1.00 0.00 O ATOM 1833 CB CYS A 326 -5.592 -15.238 -9.357 1.00 0.00 C ATOM 1834 SG CYS A 326 -7.283 -15.752 -8.969 1.00 0.00 S ATOM 0 H CYS A 326 -5.376 -14.654 -6.966 1.00 0.00 H new ATOM 0 HA CYS A 326 -4.557 -16.938 -8.540 1.00 0.00 H new ATOM 0 HB2 CYS A 326 -5.530 -14.152 -9.289 1.00 0.00 H new ATOM 0 HB3 CYS A 326 -5.371 -15.506 -10.390 1.00 0.00 H new ATOM 0 HG CYS A 326 -8.084 -14.735 -9.088 1.00 0.00 H new ATOM 1840 N GLU A 327 -2.612 -15.856 -9.958 1.00 0.00 N ATOM 1841 CA GLU A 327 -1.321 -15.387 -10.439 1.00 0.00 C ATOM 1842 C GLU A 327 -1.527 -14.254 -11.438 1.00 0.00 C ATOM 1843 O GLU A 327 -2.192 -14.436 -12.461 1.00 0.00 O ATOM 1844 CB GLU A 327 -0.536 -16.532 -11.080 1.00 0.00 C ATOM 1845 CG GLU A 327 0.890 -16.156 -11.452 1.00 0.00 C ATOM 1846 CD GLU A 327 1.643 -17.297 -12.098 1.00 0.00 C ATOM 1847 OE1 GLU A 327 2.282 -18.088 -11.366 1.00 0.00 O ATOM 1848 OE2 GLU A 327 1.601 -17.411 -13.342 1.00 0.00 O ATOM 0 H GLU A 327 -3.045 -16.581 -10.529 1.00 0.00 H new ATOM 0 HA GLU A 327 -0.743 -15.014 -9.593 1.00 0.00 H new ATOM 0 HB2 GLU A 327 -0.513 -17.376 -10.391 1.00 0.00 H new ATOM 0 HB3 GLU A 327 -1.061 -16.865 -11.975 1.00 0.00 H new ATOM 0 HG2 GLU A 327 0.871 -15.306 -12.134 1.00 0.00 H new ATOM 0 HG3 GLU A 327 1.422 -15.835 -10.557 1.00 0.00 H new ATOM 1855 N ILE A 328 -0.974 -13.079 -11.134 1.00 0.00 N ATOM 1856 CA ILE A 328 -1.140 -11.919 -12.007 1.00 0.00 C ATOM 1857 C ILE A 328 -0.360 -12.111 -13.306 1.00 0.00 C ATOM 1858 O ILE A 328 0.535 -12.954 -13.398 1.00 0.00 O ATOM 1859 CB ILE A 328 -0.685 -10.571 -11.362 1.00 0.00 C ATOM 1860 CG1 ILE A 328 0.819 -10.335 -11.545 1.00 0.00 C ATOM 1861 CG2 ILE A 328 -1.045 -10.490 -9.887 1.00 0.00 C ATOM 1862 CD1 ILE A 328 1.698 -11.371 -10.878 1.00 0.00 C ATOM 0 H ILE A 328 -0.414 -12.907 -10.299 1.00 0.00 H new ATOM 0 HA ILE A 328 -2.212 -11.853 -12.194 1.00 0.00 H new ATOM 0 HB ILE A 328 -1.228 -9.785 -11.887 1.00 0.00 H new ATOM 0 HG12 ILE A 328 1.045 -10.316 -12.611 1.00 0.00 H new ATOM 0 HG13 ILE A 328 1.071 -9.352 -11.148 1.00 0.00 H new ATOM 0 HG21 ILE A 328 -0.709 -9.535 -9.482 1.00 0.00 H new ATOM 0 HG22 ILE A 328 -2.126 -10.573 -9.771 1.00 0.00 H new ATOM 0 HG23 ILE A 328 -0.559 -11.304 -9.349 1.00 0.00 H new ATOM 0 HD11 ILE A 328 2.746 -11.129 -11.057 1.00 0.00 H new ATOM 0 HD12 ILE A 328 1.505 -11.376 -9.805 1.00 0.00 H new ATOM 0 HD13 ILE A 328 1.478 -12.355 -11.291 1.00 0.00 H new ATOM 1874 N HIS A 329 -0.712 -11.323 -14.297 1.00 0.00 N ATOM 1875 CA HIS A 329 0.031 -11.252 -15.538 1.00 0.00 C ATOM 1876 C HIS A 329 0.399 -9.800 -15.782 1.00 0.00 C ATOM 1877 O HIS A 329 -0.313 -8.902 -15.331 1.00 0.00 O ATOM 1878 CB HIS A 329 -0.801 -11.800 -16.702 1.00 0.00 C ATOM 1879 CG HIS A 329 -1.152 -13.251 -16.566 1.00 0.00 C ATOM 1880 ND1 HIS A 329 -2.395 -13.756 -16.870 1.00 0.00 N ATOM 1881 CD2 HIS A 329 -0.410 -14.308 -16.161 1.00 0.00 C ATOM 1882 CE1 HIS A 329 -2.404 -15.058 -16.656 1.00 0.00 C ATOM 1883 NE2 HIS A 329 -1.212 -15.419 -16.226 1.00 0.00 N ATOM 0 H HIS A 329 -1.526 -10.709 -14.266 1.00 0.00 H new ATOM 0 HA HIS A 329 0.932 -11.861 -15.468 1.00 0.00 H new ATOM 0 HB2 HIS A 329 -1.720 -11.220 -16.784 1.00 0.00 H new ATOM 0 HB3 HIS A 329 -0.249 -11.655 -17.631 1.00 0.00 H new ATOM 0 HD2 HIS A 329 0.622 -14.282 -15.845 1.00 0.00 H new ATOM 0 HE1 HIS A 329 -3.246 -15.717 -16.808 1.00 0.00 H new ATOM 0 HE2 HIS A 329 -0.932 -16.369 -15.982 1.00 0.00 H new ATOM 1892 N ILE A 330 1.515 -9.563 -16.455 1.00 0.00 N ATOM 1893 CA ILE A 330 1.966 -8.200 -16.708 1.00 0.00 C ATOM 1894 C ILE A 330 0.918 -7.424 -17.495 1.00 0.00 C ATOM 1895 O ILE A 330 0.643 -7.721 -18.659 1.00 0.00 O ATOM 1896 CB ILE A 330 3.319 -8.164 -17.452 1.00 0.00 C ATOM 1897 CG1 ILE A 330 4.397 -8.849 -16.612 1.00 0.00 C ATOM 1898 CG2 ILE A 330 3.725 -6.726 -17.743 1.00 0.00 C ATOM 1899 CD1 ILE A 330 4.747 -8.084 -15.361 1.00 0.00 C ATOM 0 H ILE A 330 2.122 -10.290 -16.834 1.00 0.00 H new ATOM 0 HA ILE A 330 2.109 -7.726 -15.737 1.00 0.00 H new ATOM 0 HB ILE A 330 3.211 -8.696 -18.397 1.00 0.00 H new ATOM 0 HG12 ILE A 330 4.055 -9.847 -16.337 1.00 0.00 H new ATOM 0 HG13 ILE A 330 5.295 -8.975 -17.217 1.00 0.00 H new ATOM 0 HG21 ILE A 330 4.680 -6.717 -18.268 1.00 0.00 H new ATOM 0 HG22 ILE A 330 2.965 -6.252 -18.364 1.00 0.00 H new ATOM 0 HG23 ILE A 330 3.820 -6.178 -16.806 1.00 0.00 H new ATOM 0 HD11 ILE A 330 5.517 -8.622 -14.809 1.00 0.00 H new ATOM 0 HD12 ILE A 330 5.118 -7.095 -15.631 1.00 0.00 H new ATOM 0 HD13 ILE A 330 3.859 -7.981 -14.737 1.00 0.00 H new ATOM 1911 N GLY A 331 0.340 -6.429 -16.842 1.00 0.00 N ATOM 1912 CA GLY A 331 -0.736 -5.657 -17.433 1.00 0.00 C ATOM 1913 C GLY A 331 -2.034 -5.821 -16.675 1.00 0.00 C ATOM 1914 O GLY A 331 -3.055 -5.263 -17.062 1.00 0.00 O ATOM 0 H GLY A 331 0.600 -6.138 -15.900 1.00 0.00 H new ATOM 0 HA2 GLY A 331 -0.458 -4.603 -17.452 1.00 0.00 H new ATOM 0 HA3 GLY A 331 -0.879 -5.968 -18.468 1.00 0.00 H new ATOM 1918 N ASP A 332 -2.004 -6.594 -15.601 1.00 0.00 N ATOM 1919 CA ASP A 332 -3.168 -6.729 -14.746 1.00 0.00 C ATOM 1920 C ASP A 332 -3.346 -5.485 -13.892 1.00 0.00 C ATOM 1921 O ASP A 332 -2.410 -5.022 -13.235 1.00 0.00 O ATOM 1922 CB ASP A 332 -3.062 -7.975 -13.870 1.00 0.00 C ATOM 1923 CG ASP A 332 -3.573 -9.219 -14.576 1.00 0.00 C ATOM 1924 OD1 ASP A 332 -4.451 -9.098 -15.456 1.00 0.00 O ATOM 1925 OD2 ASP A 332 -3.123 -10.328 -14.235 1.00 0.00 O ATOM 0 H ASP A 332 -1.191 -7.133 -15.304 1.00 0.00 H new ATOM 0 HA ASP A 332 -4.046 -6.840 -15.382 1.00 0.00 H new ATOM 0 HB2 ASP A 332 -2.022 -8.125 -13.580 1.00 0.00 H new ATOM 0 HB3 ASP A 332 -3.630 -7.821 -12.952 1.00 0.00 H new ATOM 1930 N VAL A 333 -4.541 -4.926 -13.945 1.00 0.00 N ATOM 1931 CA VAL A 333 -4.867 -3.707 -13.223 1.00 0.00 C ATOM 1932 C VAL A 333 -5.420 -3.987 -11.829 1.00 0.00 C ATOM 1933 O VAL A 333 -6.285 -4.839 -11.640 1.00 0.00 O ATOM 1934 CB VAL A 333 -5.847 -2.840 -14.049 1.00 0.00 C ATOM 1935 CG1 VAL A 333 -6.907 -3.697 -14.706 1.00 0.00 C ATOM 1936 CG2 VAL A 333 -6.489 -1.745 -13.212 1.00 0.00 C ATOM 0 H VAL A 333 -5.315 -5.304 -14.491 1.00 0.00 H new ATOM 0 HA VAL A 333 -3.939 -3.152 -13.083 1.00 0.00 H new ATOM 0 HB VAL A 333 -5.261 -2.353 -14.828 1.00 0.00 H new ATOM 0 HG11 VAL A 333 -7.583 -3.063 -15.280 1.00 0.00 H new ATOM 0 HG12 VAL A 333 -6.431 -4.417 -15.372 1.00 0.00 H new ATOM 0 HG13 VAL A 333 -7.471 -4.229 -13.940 1.00 0.00 H new ATOM 0 HG21 VAL A 333 -7.169 -1.163 -13.834 1.00 0.00 H new ATOM 0 HG22 VAL A 333 -7.045 -2.195 -12.390 1.00 0.00 H new ATOM 0 HG23 VAL A 333 -5.714 -1.092 -12.811 1.00 0.00 H new ATOM 1946 N CYS A 334 -4.897 -3.246 -10.867 1.00 0.00 N ATOM 1947 CA CYS A 334 -5.240 -3.416 -9.465 1.00 0.00 C ATOM 1948 C CYS A 334 -6.352 -2.458 -9.048 1.00 0.00 C ATOM 1949 O CYS A 334 -6.287 -1.255 -9.311 1.00 0.00 O ATOM 1950 CB CYS A 334 -3.995 -3.195 -8.601 1.00 0.00 C ATOM 1951 SG CYS A 334 -4.272 -3.398 -6.829 1.00 0.00 S ATOM 0 H CYS A 334 -4.218 -2.504 -11.038 1.00 0.00 H new ATOM 0 HA CYS A 334 -5.606 -4.432 -9.320 1.00 0.00 H new ATOM 0 HB2 CYS A 334 -3.219 -3.893 -8.917 1.00 0.00 H new ATOM 0 HB3 CYS A 334 -3.614 -2.190 -8.784 1.00 0.00 H new ATOM 0 HG CYS A 334 -3.159 -3.192 -6.189 1.00 0.00 H new ATOM 1957 N LEU A 335 -7.360 -3.005 -8.385 1.00 0.00 N ATOM 1958 CA LEU A 335 -8.532 -2.250 -7.965 1.00 0.00 C ATOM 1959 C LEU A 335 -8.477 -1.930 -6.481 1.00 0.00 C ATOM 1960 O LEU A 335 -8.041 -2.748 -5.674 1.00 0.00 O ATOM 1961 CB LEU A 335 -9.791 -3.055 -8.263 1.00 0.00 C ATOM 1962 CG LEU A 335 -9.941 -3.492 -9.715 1.00 0.00 C ATOM 1963 CD1 LEU A 335 -11.210 -4.298 -9.890 1.00 0.00 C ATOM 1964 CD2 LEU A 335 -9.932 -2.282 -10.636 1.00 0.00 C ATOM 0 H LEU A 335 -7.388 -3.990 -8.122 1.00 0.00 H new ATOM 0 HA LEU A 335 -8.549 -1.311 -8.518 1.00 0.00 H new ATOM 0 HB2 LEU A 335 -9.797 -3.942 -7.629 1.00 0.00 H new ATOM 0 HB3 LEU A 335 -10.661 -2.459 -7.986 1.00 0.00 H new ATOM 0 HG LEU A 335 -9.095 -4.126 -9.982 1.00 0.00 H new ATOM 0 HD11 LEU A 335 -11.306 -4.604 -10.932 1.00 0.00 H new ATOM 0 HD12 LEU A 335 -11.170 -5.182 -9.254 1.00 0.00 H new ATOM 0 HD13 LEU A 335 -12.069 -3.689 -9.611 1.00 0.00 H new ATOM 0 HD21 LEU A 335 -10.040 -2.611 -11.670 1.00 0.00 H new ATOM 0 HD22 LEU A 335 -10.759 -1.621 -10.377 1.00 0.00 H new ATOM 0 HD23 LEU A 335 -8.990 -1.745 -10.522 1.00 0.00 H new ATOM 1976 N PRO A 336 -8.906 -0.718 -6.108 1.00 0.00 N ATOM 1977 CA PRO A 336 -9.007 -0.309 -4.712 1.00 0.00 C ATOM 1978 C PRO A 336 -10.348 -0.704 -4.098 1.00 0.00 C ATOM 1979 O PRO A 336 -11.282 -1.084 -4.812 1.00 0.00 O ATOM 1980 CB PRO A 336 -8.886 1.205 -4.816 1.00 0.00 C ATOM 1981 CG PRO A 336 -9.554 1.541 -6.109 1.00 0.00 C ATOM 1982 CD PRO A 336 -9.324 0.365 -7.024 1.00 0.00 C ATOM 0 HA PRO A 336 -8.258 -0.776 -4.072 1.00 0.00 H new ATOM 0 HB2 PRO A 336 -9.372 1.701 -3.976 1.00 0.00 H new ATOM 0 HB3 PRO A 336 -7.843 1.522 -4.813 1.00 0.00 H new ATOM 0 HG2 PRO A 336 -10.620 1.716 -5.962 1.00 0.00 H new ATOM 0 HG3 PRO A 336 -9.137 2.453 -6.536 1.00 0.00 H new ATOM 0 HD2 PRO A 336 -10.229 0.100 -7.570 1.00 0.00 H new ATOM 0 HD3 PRO A 336 -8.555 0.580 -7.766 1.00 0.00 H new ATOM 1990 N PRO A 337 -10.461 -0.619 -2.765 1.00 0.00 N ATOM 1991 CA PRO A 337 -11.701 -0.943 -2.060 1.00 0.00 C ATOM 1992 C PRO A 337 -12.819 0.031 -2.425 1.00 0.00 C ATOM 1993 O PRO A 337 -12.645 1.250 -2.362 1.00 0.00 O ATOM 1994 CB PRO A 337 -11.319 -0.810 -0.580 1.00 0.00 C ATOM 1995 CG PRO A 337 -10.140 0.098 -0.570 1.00 0.00 C ATOM 1996 CD PRO A 337 -9.396 -0.188 -1.840 1.00 0.00 C ATOM 0 HA PRO A 337 -12.082 -1.932 -2.315 1.00 0.00 H new ATOM 0 HB2 PRO A 337 -12.141 -0.397 0.005 1.00 0.00 H new ATOM 0 HB3 PRO A 337 -11.075 -1.780 -0.146 1.00 0.00 H new ATOM 0 HG2 PRO A 337 -10.450 1.142 -0.525 1.00 0.00 H new ATOM 0 HG3 PRO A 337 -9.512 -0.086 0.302 1.00 0.00 H new ATOM 0 HD2 PRO A 337 -8.875 0.696 -2.209 1.00 0.00 H new ATOM 0 HD3 PRO A 337 -8.645 -0.966 -1.700 1.00 0.00 H new ATOM 2004 N GLY A 338 -13.954 -0.512 -2.840 1.00 0.00 N ATOM 2005 CA GLY A 338 -15.077 0.320 -3.221 1.00 0.00 C ATOM 2006 C GLY A 338 -15.357 0.267 -4.708 1.00 0.00 C ATOM 2007 O GLY A 338 -16.448 0.626 -5.153 1.00 0.00 O ATOM 0 H GLY A 338 -14.118 -1.516 -2.920 1.00 0.00 H new ATOM 0 HA2 GLY A 338 -15.965 -0.000 -2.675 1.00 0.00 H new ATOM 0 HA3 GLY A 338 -14.878 1.351 -2.928 1.00 0.00 H new ATOM 2011 N HIS A 339 -14.372 -0.186 -5.477 1.00 0.00 N ATOM 2012 CA HIS A 339 -14.514 -0.279 -6.927 1.00 0.00 C ATOM 2013 C HIS A 339 -15.475 -1.411 -7.282 1.00 0.00 C ATOM 2014 O HIS A 339 -15.291 -2.542 -6.842 1.00 0.00 O ATOM 2015 CB HIS A 339 -13.148 -0.522 -7.583 1.00 0.00 C ATOM 2016 CG HIS A 339 -13.080 -0.078 -9.015 1.00 0.00 C ATOM 2017 ND1 HIS A 339 -13.187 -0.935 -10.091 1.00 0.00 N ATOM 2018 CD2 HIS A 339 -12.912 1.157 -9.539 1.00 0.00 C ATOM 2019 CE1 HIS A 339 -13.086 -0.242 -11.213 1.00 0.00 C ATOM 2020 NE2 HIS A 339 -12.924 1.027 -10.907 1.00 0.00 N ATOM 0 H HIS A 339 -13.467 -0.494 -5.121 1.00 0.00 H new ATOM 0 HA HIS A 339 -14.917 0.662 -7.302 1.00 0.00 H new ATOM 0 HB2 HIS A 339 -12.382 0.003 -7.012 1.00 0.00 H new ATOM 0 HB3 HIS A 339 -12.913 -1.585 -7.530 1.00 0.00 H new ATOM 0 HD2 HIS A 339 -12.791 2.076 -8.985 1.00 0.00 H new ATOM 0 HE1 HIS A 339 -13.129 -0.649 -12.212 1.00 0.00 H new ATOM 0 HE2 HIS A 339 -12.824 1.790 -11.576 1.00 0.00 H new ATOM 2029 N PRO A 340 -16.504 -1.119 -8.100 1.00 0.00 N ATOM 2030 CA PRO A 340 -17.570 -2.081 -8.433 1.00 0.00 C ATOM 2031 C PRO A 340 -17.061 -3.325 -9.161 1.00 0.00 C ATOM 2032 O PRO A 340 -17.709 -4.372 -9.146 1.00 0.00 O ATOM 2033 CB PRO A 340 -18.510 -1.282 -9.341 1.00 0.00 C ATOM 2034 CG PRO A 340 -17.687 -0.148 -9.851 1.00 0.00 C ATOM 2035 CD PRO A 340 -16.718 0.179 -8.758 1.00 0.00 C ATOM 0 HA PRO A 340 -18.044 -2.467 -7.530 1.00 0.00 H new ATOM 0 HB2 PRO A 340 -18.884 -1.897 -10.160 1.00 0.00 H new ATOM 0 HB3 PRO A 340 -19.379 -0.922 -8.790 1.00 0.00 H new ATOM 0 HG2 PRO A 340 -17.164 -0.425 -10.766 1.00 0.00 H new ATOM 0 HG3 PRO A 340 -18.312 0.712 -10.089 1.00 0.00 H new ATOM 0 HD2 PRO A 340 -15.788 0.588 -9.153 1.00 0.00 H new ATOM 0 HD3 PRO A 340 -17.124 0.918 -8.068 1.00 0.00 H new ATOM 2043 N ASP A 341 -15.901 -3.207 -9.795 1.00 0.00 N ATOM 2044 CA ASP A 341 -15.291 -4.337 -10.490 1.00 0.00 C ATOM 2045 C ASP A 341 -14.621 -5.268 -9.490 1.00 0.00 C ATOM 2046 O ASP A 341 -14.450 -6.458 -9.749 1.00 0.00 O ATOM 2047 CB ASP A 341 -14.270 -3.861 -11.527 1.00 0.00 C ATOM 2048 CG ASP A 341 -14.909 -3.178 -12.716 1.00 0.00 C ATOM 2049 OD1 ASP A 341 -15.252 -1.987 -12.601 1.00 0.00 O ATOM 2050 OD2 ASP A 341 -15.042 -3.824 -13.776 1.00 0.00 O ATOM 0 H ASP A 341 -15.363 -2.342 -9.843 1.00 0.00 H new ATOM 0 HA ASP A 341 -16.080 -4.878 -11.012 1.00 0.00 H new ATOM 0 HB2 ASP A 341 -13.572 -3.172 -11.052 1.00 0.00 H new ATOM 0 HB3 ASP A 341 -13.689 -4.715 -11.875 1.00 0.00 H new ATOM 2055 N ALA A 342 -14.225 -4.715 -8.349 1.00 0.00 N ATOM 2056 CA ALA A 342 -13.749 -5.527 -7.244 1.00 0.00 C ATOM 2057 C ALA A 342 -14.932 -6.219 -6.573 1.00 0.00 C ATOM 2058 O ALA A 342 -15.505 -5.703 -5.615 1.00 0.00 O ATOM 2059 CB ALA A 342 -12.974 -4.680 -6.242 1.00 0.00 C ATOM 0 H ALA A 342 -14.225 -3.711 -8.169 1.00 0.00 H new ATOM 0 HA ALA A 342 -13.067 -6.286 -7.629 1.00 0.00 H new ATOM 0 HB1 ALA A 342 -12.628 -5.311 -5.423 1.00 0.00 H new ATOM 0 HB2 ALA A 342 -12.116 -4.225 -6.737 1.00 0.00 H new ATOM 0 HB3 ALA A 342 -13.623 -3.898 -5.848 1.00 0.00 H new ATOM 2065 N ILE A 343 -15.297 -7.381 -7.102 1.00 0.00 N ATOM 2066 CA ILE A 343 -16.465 -8.116 -6.632 1.00 0.00 C ATOM 2067 C ILE A 343 -16.292 -8.593 -5.193 1.00 0.00 C ATOM 2068 O ILE A 343 -17.187 -8.423 -4.365 1.00 0.00 O ATOM 2069 CB ILE A 343 -16.775 -9.324 -7.553 1.00 0.00 C ATOM 2070 CG1 ILE A 343 -17.261 -8.827 -8.919 1.00 0.00 C ATOM 2071 CG2 ILE A 343 -17.802 -10.250 -6.912 1.00 0.00 C ATOM 2072 CD1 ILE A 343 -17.538 -9.936 -9.911 1.00 0.00 C ATOM 0 H ILE A 343 -14.795 -7.838 -7.864 1.00 0.00 H new ATOM 0 HA ILE A 343 -17.307 -7.424 -6.663 1.00 0.00 H new ATOM 0 HB ILE A 343 -15.859 -9.898 -7.696 1.00 0.00 H new ATOM 0 HG12 ILE A 343 -18.170 -8.242 -8.780 1.00 0.00 H new ATOM 0 HG13 ILE A 343 -16.511 -8.156 -9.339 1.00 0.00 H new ATOM 0 HG21 ILE A 343 -18.002 -11.089 -7.579 1.00 0.00 H new ATOM 0 HG22 ILE A 343 -17.414 -10.624 -5.965 1.00 0.00 H new ATOM 0 HG23 ILE A 343 -18.726 -9.700 -6.734 1.00 0.00 H new ATOM 0 HD11 ILE A 343 -17.878 -9.505 -10.853 1.00 0.00 H new ATOM 0 HD12 ILE A 343 -16.626 -10.508 -10.082 1.00 0.00 H new ATOM 0 HD13 ILE A 343 -18.310 -10.595 -9.514 1.00 0.00 H new ATOM 2084 N ASN A 344 -15.135 -9.154 -4.888 1.00 0.00 N ATOM 2085 CA ASN A 344 -14.908 -9.748 -3.578 1.00 0.00 C ATOM 2086 C ASN A 344 -13.684 -9.129 -2.918 1.00 0.00 C ATOM 2087 O ASN A 344 -12.614 -9.733 -2.891 1.00 0.00 O ATOM 2088 CB ASN A 344 -14.723 -11.266 -3.704 1.00 0.00 C ATOM 2089 CG ASN A 344 -14.825 -11.980 -2.368 1.00 0.00 C ATOM 2090 OD1 ASN A 344 -15.757 -11.544 -1.536 1.00 0.00 O flip ATOM 2091 ND2 ASN A 344 -14.103 -12.945 -2.104 1.00 0.00 N flip ATOM 0 H ASN A 344 -14.340 -9.212 -5.525 1.00 0.00 H new ATOM 0 HA ASN A 344 -15.781 -9.550 -2.956 1.00 0.00 H new ATOM 0 HB2 ASN A 344 -15.476 -11.665 -4.383 1.00 0.00 H new ATOM 0 HB3 ASN A 344 -13.750 -11.474 -4.149 1.00 0.00 H new ATOM 0 HD21 ASN A 344 -13.396 -13.251 -2.772 1.00 0.00 H new ATOM 0 HD22 ASN A 344 -14.214 -13.437 -1.217 1.00 0.00 H new ATOM 2098 N PHE A 345 -13.836 -7.914 -2.416 1.00 0.00 N ATOM 2099 CA PHE A 345 -12.737 -7.216 -1.765 1.00 0.00 C ATOM 2100 C PHE A 345 -12.980 -7.171 -0.262 1.00 0.00 C ATOM 2101 O PHE A 345 -12.454 -8.044 0.456 1.00 0.00 O ATOM 2102 CB PHE A 345 -12.608 -5.792 -2.320 1.00 0.00 C ATOM 2103 CG PHE A 345 -11.274 -5.137 -2.057 1.00 0.00 C ATOM 2104 CD1 PHE A 345 -10.894 -4.761 -0.775 1.00 0.00 C ATOM 2105 CD2 PHE A 345 -10.402 -4.887 -3.104 1.00 0.00 C ATOM 2106 CE1 PHE A 345 -9.673 -4.152 -0.549 1.00 0.00 C ATOM 2107 CE2 PHE A 345 -9.182 -4.280 -2.882 1.00 0.00 C ATOM 2108 CZ PHE A 345 -8.817 -3.912 -1.604 1.00 0.00 C ATOM 2109 OXT PHE A 345 -13.725 -6.273 0.186 1.00 0.00 O ATOM 0 H PHE A 345 -14.710 -7.390 -2.447 1.00 0.00 H new ATOM 0 HA PHE A 345 -11.808 -7.751 -1.964 1.00 0.00 H new ATOM 0 HB2 PHE A 345 -12.780 -5.818 -3.396 1.00 0.00 H new ATOM 0 HB3 PHE A 345 -13.394 -5.174 -1.886 1.00 0.00 H new ATOM 0 HD1 PHE A 345 -11.560 -4.946 0.055 1.00 0.00 H new ATOM 0 HD2 PHE A 345 -10.680 -5.171 -4.108 1.00 0.00 H new ATOM 0 HE1 PHE A 345 -9.390 -3.864 0.453 1.00 0.00 H new ATOM 0 HE2 PHE A 345 -8.513 -4.093 -3.709 1.00 0.00 H new ATOM 0 HZ PHE A 345 -7.863 -3.437 -1.429 1.00 0.00 H new