USER MOD reduce.3.24.130724 H: found=0, std=0, add=575, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 579 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 87 CYS SG : rot 169:sc= 0.464 USER MOD Set 1.2: A 90 GLN : amide:sc= -0.96 K(o=-0.5,f=-1.1) USER MOD Set 2.1: A 6 SER OG : rot -16:sc= 0.514 USER MOD Set 2.2: A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 10 GLN :FLIP amide:sc= -0.102 F(o=-0.84,f=-0.1) USER MOD Single : A 12 HIS : no HE2:sc= -1.24 K(o=-1.2,f=-3.8!) USER MOD Single : A 21 THR OG1 : rot 180:sc= 0 USER MOD Single : A 29 SER OG : rot -96:sc= 0.0999 USER MOD Single : A 30 THR OG1 : rot -92:sc= 0.72 USER MOD Single : A 32 GLN :FLIP amide:sc= -0.796 F(o=-2.3!,f=-0.8) USER MOD Single : A 36 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 37 GLN : amide:sc= -0.0345 K(o=-0.034,f=-1.2!) USER MOD Single : A 38 THR OG1 : rot 76:sc= 1.24 USER MOD Single : A 40 CYS SG : rot 180:sc= 0 USER MOD Single : A 41 LYS NZ :NH3+ -153:sc= -0.151 (180deg=-0.868) USER MOD Single : A 57 TYR OH : rot 180:sc= 0 USER MOD Single : A 77 SER OG : rot 31:sc= 0.235 USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 79 GLN :FLIP amide:sc= -0.99 F(o=-1.9!,f=-0.99) USER MOD Single : A 85 GLN : amide:sc= 0.854 K(o=0.85,f=0) USER MOD Single : A 92 GLN : amide:sc= -1.81! C(o=-1.8!,f=-4.7!) USER MOD Single : A 93 SER OG : rot -38:sc= 0.0365 USER MOD Single : A 94 LYS NZ :NH3+ -170:sc= 0.479 (180deg=0.433) USER MOD Single : A 96 LYS NZ :NH3+ -163:sc= -0.0427 (180deg=-0.351) USER MOD Single : A 100 LYS NZ :NH3+ 174:sc= 1.05 (180deg=0.6) USER MOD Single : A 104 LYS NZ :NH3+ -163:sc= -0.0792 (180deg=-0.436) USER MOD Single : A 106 LYS NZ :NH3+ -172:sc= 0 (180deg=-0.0617) USER MOD ----------------------------------------------------------------- ATOM 70 N SER A 6 -220.927 76.114 59.009 1.00 0.00 N ATOM 71 CA SER A 6 -221.950 77.134 59.057 1.00 0.00 C ATOM 72 C SER A 6 -223.114 76.764 58.142 1.00 0.00 C ATOM 73 O SER A 6 -222.919 76.235 57.049 1.00 0.00 O ATOM 74 CB SER A 6 -221.346 78.486 58.676 1.00 0.00 C ATOM 75 OG SER A 6 -220.247 78.316 57.795 1.00 0.00 O ATOM 0 HA SER A 6 -222.341 77.208 60.072 1.00 0.00 H new ATOM 0 HB2 SER A 6 -222.105 79.108 58.202 1.00 0.00 H new ATOM 0 HB3 SER A 6 -221.020 79.010 59.574 1.00 0.00 H new ATOM 0 HG SER A 6 -219.951 77.382 57.817 1.00 0.00 H new ATOM 81 N PHE A 7 -224.319 77.035 58.607 1.00 0.00 N ATOM 82 CA PHE A 7 -225.524 76.675 57.891 1.00 0.00 C ATOM 83 C PHE A 7 -226.136 77.935 57.285 1.00 0.00 C ATOM 84 O PHE A 7 -225.894 79.041 57.762 1.00 0.00 O ATOM 85 CB PHE A 7 -226.495 75.955 58.849 1.00 0.00 C ATOM 86 CG PHE A 7 -227.433 76.838 59.622 1.00 0.00 C ATOM 87 CD1 PHE A 7 -227.055 77.372 60.834 1.00 0.00 C ATOM 88 CD2 PHE A 7 -228.704 77.113 59.144 1.00 0.00 C ATOM 89 CE1 PHE A 7 -227.918 78.166 61.558 1.00 0.00 C ATOM 90 CE2 PHE A 7 -229.574 77.904 59.866 1.00 0.00 C ATOM 91 CZ PHE A 7 -229.179 78.433 61.075 1.00 0.00 C ATOM 0 H PHE A 7 -224.488 77.511 59.493 1.00 0.00 H new ATOM 0 HA PHE A 7 -225.300 75.986 57.076 1.00 0.00 H new ATOM 0 HB2 PHE A 7 -227.088 75.248 58.269 1.00 0.00 H new ATOM 0 HB3 PHE A 7 -225.908 75.372 59.559 1.00 0.00 H new ATOM 0 HD1 PHE A 7 -226.069 77.166 61.222 1.00 0.00 H new ATOM 0 HD2 PHE A 7 -229.017 76.703 58.195 1.00 0.00 H new ATOM 0 HE1 PHE A 7 -227.605 78.579 62.505 1.00 0.00 H new ATOM 0 HE2 PHE A 7 -230.563 78.108 59.484 1.00 0.00 H new ATOM 0 HZ PHE A 7 -229.856 79.055 61.642 1.00 0.00 H new ATOM 101 N PHE A 8 -226.910 77.776 56.236 1.00 0.00 N ATOM 102 CA PHE A 8 -227.444 78.930 55.524 1.00 0.00 C ATOM 103 C PHE A 8 -228.801 79.347 56.085 1.00 0.00 C ATOM 104 O PHE A 8 -229.651 78.502 56.366 1.00 0.00 O ATOM 105 CB PHE A 8 -227.561 78.638 54.026 1.00 0.00 C ATOM 106 CG PHE A 8 -226.239 78.599 53.314 1.00 0.00 C ATOM 107 CD1 PHE A 8 -225.673 79.766 52.829 1.00 0.00 C ATOM 108 CD2 PHE A 8 -225.566 77.403 53.127 1.00 0.00 C ATOM 109 CE1 PHE A 8 -224.461 79.744 52.170 1.00 0.00 C ATOM 110 CE2 PHE A 8 -224.352 77.373 52.468 1.00 0.00 C ATOM 111 CZ PHE A 8 -223.799 78.545 51.988 1.00 0.00 C ATOM 0 H PHE A 8 -227.186 76.871 55.854 1.00 0.00 H new ATOM 0 HA PHE A 8 -226.747 79.756 55.667 1.00 0.00 H new ATOM 0 HB2 PHE A 8 -228.066 77.682 53.889 1.00 0.00 H new ATOM 0 HB3 PHE A 8 -228.190 79.399 53.564 1.00 0.00 H new ATOM 0 HD1 PHE A 8 -226.187 80.706 52.968 1.00 0.00 H new ATOM 0 HD2 PHE A 8 -225.995 76.485 53.500 1.00 0.00 H new ATOM 0 HE1 PHE A 8 -224.031 80.662 51.797 1.00 0.00 H new ATOM 0 HE2 PHE A 8 -223.836 76.435 52.328 1.00 0.00 H new ATOM 0 HZ PHE A 8 -222.851 78.524 51.471 1.00 0.00 H new ATOM 121 N VAL A 9 -228.990 80.651 56.244 1.00 0.00 N ATOM 122 CA VAL A 9 -230.246 81.194 56.749 1.00 0.00 C ATOM 123 C VAL A 9 -230.840 82.173 55.759 1.00 0.00 C ATOM 124 O VAL A 9 -230.123 82.948 55.129 1.00 0.00 O ATOM 125 CB VAL A 9 -230.083 81.967 58.077 1.00 0.00 C ATOM 126 CG1 VAL A 9 -231.428 82.202 58.740 1.00 0.00 C ATOM 127 CG2 VAL A 9 -229.142 81.271 59.025 1.00 0.00 C ATOM 0 H VAL A 9 -228.285 81.356 56.029 1.00 0.00 H new ATOM 0 HA VAL A 9 -230.888 80.327 56.906 1.00 0.00 H new ATOM 0 HB VAL A 9 -229.644 82.933 57.830 1.00 0.00 H new ATOM 0 HG11 VAL A 9 -231.284 82.748 59.672 1.00 0.00 H new ATOM 0 HG12 VAL A 9 -232.065 82.784 58.074 1.00 0.00 H new ATOM 0 HG13 VAL A 9 -231.902 81.243 58.950 1.00 0.00 H new ATOM 0 HG21 VAL A 9 -229.058 81.850 59.945 1.00 0.00 H new ATOM 0 HG22 VAL A 9 -229.527 80.278 59.256 1.00 0.00 H new ATOM 0 HG23 VAL A 9 -228.159 81.181 58.562 1.00 0.00 H new ATOM 137 N GLN A 10 -232.144 82.134 55.620 1.00 0.00 N ATOM 138 CA GLN A 10 -232.872 83.182 54.963 1.00 0.00 C ATOM 139 C GLN A 10 -233.706 83.899 56.020 1.00 0.00 C ATOM 140 O GLN A 10 -234.652 83.330 56.557 1.00 0.00 O ATOM 141 CB GLN A 10 -233.755 82.582 53.882 1.00 0.00 C ATOM 142 CG GLN A 10 -232.998 81.741 52.864 1.00 0.00 C ATOM 143 CD GLN A 10 -233.914 81.052 51.872 1.00 0.00 C ATOM 144 OE1 GLN A 10 -234.169 81.708 50.752 1.00 0.00 O flip ATOM 145 NE2 GLN A 10 -234.380 79.936 52.106 1.00 0.00 N flip ATOM 0 H GLN A 10 -232.727 81.370 55.962 1.00 0.00 H new ATOM 0 HA GLN A 10 -232.198 83.893 54.486 1.00 0.00 H new ATOM 0 HB2 GLN A 10 -234.520 81.964 54.353 1.00 0.00 H new ATOM 0 HB3 GLN A 10 -234.272 83.387 53.361 1.00 0.00 H new ATOM 0 HG2 GLN A 10 -232.298 82.377 52.323 1.00 0.00 H new ATOM 0 HG3 GLN A 10 -232.407 80.990 53.388 1.00 0.00 H new ATOM 0 HE21 GLN A 10 -234.158 79.464 52.983 1.00 0.00 H new ATOM 0 HE22 GLN A 10 -234.988 79.484 51.423 1.00 0.00 H new ATOM 154 N VAL A 11 -233.331 85.121 56.350 1.00 0.00 N ATOM 155 CA VAL A 11 -233.958 85.854 57.440 1.00 0.00 C ATOM 156 C VAL A 11 -234.241 87.299 57.040 1.00 0.00 C ATOM 157 O VAL A 11 -233.435 87.933 56.383 1.00 0.00 O ATOM 158 CB VAL A 11 -233.087 85.795 58.728 1.00 0.00 C ATOM 159 CG1 VAL A 11 -231.622 85.982 58.395 1.00 0.00 C ATOM 160 CG2 VAL A 11 -233.537 86.820 59.761 1.00 0.00 C ATOM 0 H VAL A 11 -232.588 85.633 55.875 1.00 0.00 H new ATOM 0 HA VAL A 11 -234.912 85.373 57.657 1.00 0.00 H new ATOM 0 HB VAL A 11 -233.220 84.806 59.166 1.00 0.00 H new ATOM 0 HG11 VAL A 11 -231.032 85.937 59.311 1.00 0.00 H new ATOM 0 HG12 VAL A 11 -231.299 85.192 57.716 1.00 0.00 H new ATOM 0 HG13 VAL A 11 -231.478 86.951 57.918 1.00 0.00 H new ATOM 0 HG21 VAL A 11 -232.904 86.747 60.646 1.00 0.00 H new ATOM 0 HG22 VAL A 11 -233.456 87.822 59.339 1.00 0.00 H new ATOM 0 HG23 VAL A 11 -234.573 86.626 60.039 1.00 0.00 H new ATOM 170 N HIS A 12 -235.409 87.807 57.408 1.00 0.00 N ATOM 171 CA HIS A 12 -235.805 89.160 57.025 1.00 0.00 C ATOM 172 C HIS A 12 -235.535 90.151 58.148 1.00 0.00 C ATOM 173 O HIS A 12 -235.246 89.763 59.280 1.00 0.00 O ATOM 174 CB HIS A 12 -237.303 89.237 56.712 1.00 0.00 C ATOM 175 CG HIS A 12 -237.770 88.392 55.579 1.00 0.00 C ATOM 176 ND1 HIS A 12 -238.072 88.903 54.338 1.00 0.00 N ATOM 177 CD2 HIS A 12 -238.048 87.071 55.520 1.00 0.00 C ATOM 178 CE1 HIS A 12 -238.517 87.931 53.564 1.00 0.00 C ATOM 179 NE2 HIS A 12 -238.514 86.808 54.257 1.00 0.00 N ATOM 0 H HIS A 12 -236.098 87.307 57.969 1.00 0.00 H new ATOM 0 HA HIS A 12 -235.218 89.410 56.141 1.00 0.00 H new ATOM 0 HB2 HIS A 12 -237.857 88.952 57.606 1.00 0.00 H new ATOM 0 HB3 HIS A 12 -237.557 90.275 56.496 1.00 0.00 H new ATOM 0 HD1 HIS A 12 -237.968 89.879 54.060 1.00 0.00 H new ATOM 0 HD2 HIS A 12 -237.926 86.355 56.319 1.00 0.00 H new ATOM 0 HE1 HIS A 12 -238.831 88.037 52.536 1.00 0.00 H new ATOM 287 N LEU A 20 -235.183 89.862 51.778 1.00 0.00 N ATOM 288 CA LEU A 20 -234.782 88.574 52.313 1.00 0.00 C ATOM 289 C LEU A 20 -233.276 88.542 52.511 1.00 0.00 C ATOM 290 O LEU A 20 -232.516 88.471 51.542 1.00 0.00 O ATOM 291 CB LEU A 20 -235.210 87.428 51.394 1.00 0.00 C ATOM 292 CG LEU A 20 -234.865 86.030 51.915 1.00 0.00 C ATOM 293 CD1 LEU A 20 -235.584 85.755 53.225 1.00 0.00 C ATOM 294 CD2 LEU A 20 -235.212 84.968 50.885 1.00 0.00 C ATOM 0 HA LEU A 20 -235.280 88.440 53.273 1.00 0.00 H new ATOM 0 HB2 LEU A 20 -236.287 87.488 51.238 1.00 0.00 H new ATOM 0 HB3 LEU A 20 -234.739 87.565 50.421 1.00 0.00 H new ATOM 0 HG LEU A 20 -233.791 85.992 52.096 1.00 0.00 H new ATOM 0 HD11 LEU A 20 -235.326 84.757 53.579 1.00 0.00 H new ATOM 0 HD12 LEU A 20 -235.282 86.493 53.968 1.00 0.00 H new ATOM 0 HD13 LEU A 20 -236.661 85.818 53.069 1.00 0.00 H new ATOM 0 HD21 LEU A 20 -234.958 83.983 51.278 1.00 0.00 H new ATOM 0 HD22 LEU A 20 -236.279 85.007 50.667 1.00 0.00 H new ATOM 0 HD23 LEU A 20 -234.648 85.150 49.970 1.00 0.00 H new ATOM 306 N THR A 21 -232.847 88.624 53.757 1.00 0.00 N ATOM 307 CA THR A 21 -231.437 88.568 54.067 1.00 0.00 C ATOM 308 C THR A 21 -230.953 87.119 54.062 1.00 0.00 C ATOM 309 O THR A 21 -231.295 86.341 54.947 1.00 0.00 O ATOM 310 CB THR A 21 -231.139 89.206 55.441 1.00 0.00 C ATOM 311 OG1 THR A 21 -231.724 90.516 55.509 1.00 0.00 O ATOM 312 CG2 THR A 21 -229.641 89.308 55.685 1.00 0.00 C ATOM 0 H THR A 21 -233.457 88.729 54.568 1.00 0.00 H new ATOM 0 HA THR A 21 -230.906 89.134 53.301 1.00 0.00 H new ATOM 0 HB THR A 21 -231.573 88.568 56.211 1.00 0.00 H new ATOM 0 HG1 THR A 21 -231.533 90.915 56.384 1.00 0.00 H new ATOM 0 HG21 THR A 21 -229.461 89.761 56.660 1.00 0.00 H new ATOM 0 HG22 THR A 21 -229.200 88.312 55.661 1.00 0.00 H new ATOM 0 HG23 THR A 21 -229.187 89.925 54.909 1.00 0.00 H new ATOM 320 N VAL A 22 -230.170 86.755 53.064 1.00 0.00 N ATOM 321 CA VAL A 22 -229.616 85.413 53.003 1.00 0.00 C ATOM 322 C VAL A 22 -228.209 85.413 53.605 1.00 0.00 C ATOM 323 O VAL A 22 -227.292 86.067 53.100 1.00 0.00 O ATOM 324 CB VAL A 22 -229.598 84.853 51.557 1.00 0.00 C ATOM 325 CG1 VAL A 22 -228.840 85.772 50.607 1.00 0.00 C ATOM 326 CG2 VAL A 22 -229.007 83.448 51.533 1.00 0.00 C ATOM 0 H VAL A 22 -229.904 87.363 52.290 1.00 0.00 H new ATOM 0 HA VAL A 22 -230.260 84.754 53.585 1.00 0.00 H new ATOM 0 HB VAL A 22 -230.630 84.803 51.211 1.00 0.00 H new ATOM 0 HG11 VAL A 22 -228.849 85.346 49.604 1.00 0.00 H new ATOM 0 HG12 VAL A 22 -229.318 86.751 50.590 1.00 0.00 H new ATOM 0 HG13 VAL A 22 -227.810 85.877 50.947 1.00 0.00 H new ATOM 0 HG21 VAL A 22 -229.003 83.072 50.510 1.00 0.00 H new ATOM 0 HG22 VAL A 22 -227.986 83.476 51.913 1.00 0.00 H new ATOM 0 HG23 VAL A 22 -229.609 82.789 52.159 1.00 0.00 H new ATOM 336 N ILE A 23 -228.053 84.709 54.708 1.00 0.00 N ATOM 337 CA ILE A 23 -226.794 84.684 55.431 1.00 0.00 C ATOM 338 C ILE A 23 -226.303 83.265 55.615 1.00 0.00 C ATOM 339 O ILE A 23 -226.991 82.306 55.274 1.00 0.00 O ATOM 340 CB ILE A 23 -226.918 85.335 56.825 1.00 0.00 C ATOM 341 CG1 ILE A 23 -228.151 84.804 57.555 1.00 0.00 C ATOM 342 CG2 ILE A 23 -226.961 86.852 56.710 1.00 0.00 C ATOM 343 CD1 ILE A 23 -228.268 85.295 58.980 1.00 0.00 C ATOM 0 H ILE A 23 -228.789 84.141 55.128 1.00 0.00 H new ATOM 0 HA ILE A 23 -226.084 85.253 54.830 1.00 0.00 H new ATOM 0 HB ILE A 23 -226.037 85.070 57.410 1.00 0.00 H new ATOM 0 HG12 ILE A 23 -229.044 85.098 57.004 1.00 0.00 H new ATOM 0 HG13 ILE A 23 -228.121 83.714 57.556 1.00 0.00 H new ATOM 0 HG21 ILE A 23 -227.049 87.290 57.704 1.00 0.00 H new ATOM 0 HG22 ILE A 23 -226.046 87.207 56.236 1.00 0.00 H new ATOM 0 HG23 ILE A 23 -227.820 87.147 56.107 1.00 0.00 H new ATOM 0 HD11 ILE A 23 -229.166 84.878 59.436 1.00 0.00 H new ATOM 0 HD12 ILE A 23 -227.393 84.978 59.547 1.00 0.00 H new ATOM 0 HD13 ILE A 23 -228.330 86.383 58.986 1.00 0.00 H new ATOM 355 N LYS A 24 -225.107 83.143 56.155 1.00 0.00 N ATOM 356 CA LYS A 24 -224.579 81.858 56.550 1.00 0.00 C ATOM 357 C LYS A 24 -224.192 81.929 58.021 1.00 0.00 C ATOM 358 O LYS A 24 -223.121 82.427 58.370 1.00 0.00 O ATOM 359 CB LYS A 24 -223.369 81.497 55.693 1.00 0.00 C ATOM 360 CG LYS A 24 -223.108 80.007 55.598 1.00 0.00 C ATOM 361 CD LYS A 24 -221.690 79.742 55.120 1.00 0.00 C ATOM 362 CE LYS A 24 -221.413 78.261 54.935 1.00 0.00 C ATOM 363 NZ LYS A 24 -220.001 78.012 54.545 1.00 0.00 N ATOM 0 H LYS A 24 -224.479 83.928 56.330 1.00 0.00 H new ATOM 0 HA LYS A 24 -225.333 81.084 56.405 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -223.515 81.895 54.689 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -222.486 81.985 56.104 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -223.262 79.542 56.572 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -223.820 79.551 54.911 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -221.524 80.261 54.176 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -220.983 80.155 55.840 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -221.634 77.731 55.861 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -222.078 77.859 54.171 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -219.848 76.990 54.427 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -219.798 78.498 53.648 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -219.367 78.374 55.286 1.00 0.00 H new ATOM 377 N ALA A 25 -225.084 81.469 58.875 1.00 0.00 N ATOM 378 CA ALA A 25 -224.898 81.554 60.308 1.00 0.00 C ATOM 379 C ALA A 25 -224.459 80.212 60.845 1.00 0.00 C ATOM 380 O ALA A 25 -224.588 79.202 60.176 1.00 0.00 O ATOM 381 CB ALA A 25 -226.193 82.023 60.966 1.00 0.00 C ATOM 0 H ALA A 25 -225.959 81.026 58.594 1.00 0.00 H new ATOM 0 HA ALA A 25 -224.119 82.280 60.539 1.00 0.00 H new ATOM 0 HB1 ALA A 25 -226.051 82.086 62.045 1.00 0.00 H new ATOM 0 HB2 ALA A 25 -226.464 83.005 60.577 1.00 0.00 H new ATOM 0 HB3 ALA A 25 -226.991 81.313 60.746 1.00 0.00 H new ATOM 387 N PRO A 26 -223.928 80.176 62.057 1.00 0.00 N ATOM 388 CA PRO A 26 -223.407 78.953 62.628 1.00 0.00 C ATOM 389 C PRO A 26 -224.507 77.972 62.965 1.00 0.00 C ATOM 390 O PRO A 26 -225.589 78.364 63.371 1.00 0.00 O ATOM 391 CB PRO A 26 -222.645 79.407 63.871 1.00 0.00 C ATOM 392 CG PRO A 26 -222.797 80.892 63.963 1.00 0.00 C ATOM 393 CD PRO A 26 -223.837 81.310 62.971 1.00 0.00 C ATOM 0 HA PRO A 26 -222.766 78.416 61.929 1.00 0.00 H new ATOM 0 HB2 PRO A 26 -223.041 78.923 64.764 1.00 0.00 H new ATOM 0 HB3 PRO A 26 -221.593 79.131 63.800 1.00 0.00 H new ATOM 0 HG2 PRO A 26 -223.092 81.184 64.971 1.00 0.00 H new ATOM 0 HG3 PRO A 26 -221.849 81.386 63.753 1.00 0.00 H new ATOM 0 HD2 PRO A 26 -224.793 81.510 63.455 1.00 0.00 H new ATOM 0 HD3 PRO A 26 -223.547 82.222 62.449 1.00 0.00 H new ATOM 401 N ARG A 27 -224.223 76.688 62.781 1.00 0.00 N ATOM 402 CA ARG A 27 -225.201 75.631 63.034 1.00 0.00 C ATOM 403 C ARG A 27 -225.635 75.634 64.504 1.00 0.00 C ATOM 404 O ARG A 27 -226.541 74.911 64.904 1.00 0.00 O ATOM 405 CB ARG A 27 -224.600 74.274 62.689 1.00 0.00 C ATOM 406 CG ARG A 27 -224.332 74.096 61.210 1.00 0.00 C ATOM 407 CD ARG A 27 -223.781 72.706 60.919 1.00 0.00 C ATOM 408 NE ARG A 27 -224.569 71.656 61.578 1.00 0.00 N ATOM 409 CZ ARG A 27 -224.418 70.348 61.365 1.00 0.00 C ATOM 410 NH1 ARG A 27 -223.648 69.905 60.379 1.00 0.00 N ATOM 411 NH2 ARG A 27 -225.076 69.482 62.125 1.00 0.00 N ATOM 0 H ARG A 27 -223.317 76.350 62.455 1.00 0.00 H new ATOM 0 HA ARG A 27 -226.074 75.816 62.408 1.00 0.00 H new ATOM 0 HB2 ARG A 27 -223.667 74.148 63.238 1.00 0.00 H new ATOM 0 HB3 ARG A 27 -225.277 73.489 63.026 1.00 0.00 H new ATOM 0 HG2 ARG A 27 -225.253 74.251 60.649 1.00 0.00 H new ATOM 0 HG3 ARG A 27 -223.622 74.851 60.872 1.00 0.00 H new ATOM 0 HD2 ARG A 27 -223.777 72.535 59.842 1.00 0.00 H new ATOM 0 HD3 ARG A 27 -222.746 72.648 61.255 1.00 0.00 H new ATOM 0 HE ARG A 27 -225.282 71.948 62.246 1.00 0.00 H new ATOM 0 HH11 ARG A 27 -223.163 70.567 59.773 1.00 0.00 H new ATOM 0 HH12 ARG A 27 -223.541 68.902 60.227 1.00 0.00 H new ATOM 0 HH21 ARG A 27 -225.692 69.818 62.865 1.00 0.00 H new ATOM 0 HH22 ARG A 27 -224.966 68.480 61.969 1.00 0.00 H new ATOM 425 N VAL A 28 -224.944 76.432 65.304 1.00 0.00 N ATOM 426 CA VAL A 28 -225.259 76.582 66.711 1.00 0.00 C ATOM 427 C VAL A 28 -225.906 77.937 66.985 1.00 0.00 C ATOM 428 O VAL A 28 -226.334 78.203 68.111 1.00 0.00 O ATOM 429 CB VAL A 28 -223.996 76.434 67.583 1.00 0.00 C ATOM 430 CG1 VAL A 28 -223.405 75.047 67.426 1.00 0.00 C ATOM 431 CG2 VAL A 28 -222.965 77.495 67.223 1.00 0.00 C ATOM 0 H VAL A 28 -224.150 76.992 64.993 1.00 0.00 H new ATOM 0 HA VAL A 28 -225.963 75.791 66.970 1.00 0.00 H new ATOM 0 HB VAL A 28 -224.281 76.575 68.626 1.00 0.00 H new ATOM 0 HG11 VAL A 28 -222.514 74.959 68.048 1.00 0.00 H new ATOM 0 HG12 VAL A 28 -224.138 74.302 67.735 1.00 0.00 H new ATOM 0 HG13 VAL A 28 -223.137 74.882 66.382 1.00 0.00 H new ATOM 0 HG21 VAL A 28 -222.082 77.372 67.850 1.00 0.00 H new ATOM 0 HG22 VAL A 28 -222.684 77.388 66.175 1.00 0.00 H new ATOM 0 HG23 VAL A 28 -223.390 78.485 67.385 1.00 0.00 H new ATOM 441 N SER A 29 -225.969 78.796 65.962 1.00 0.00 N ATOM 442 CA SER A 29 -226.600 80.105 66.114 1.00 0.00 C ATOM 443 C SER A 29 -228.029 79.965 66.600 1.00 0.00 C ATOM 444 O SER A 29 -228.830 79.214 66.040 1.00 0.00 O ATOM 445 CB SER A 29 -226.579 80.898 64.804 1.00 0.00 C ATOM 446 OG SER A 29 -227.323 80.253 63.788 1.00 0.00 O ATOM 0 H SER A 29 -225.595 78.609 65.032 1.00 0.00 H new ATOM 0 HA SER A 29 -226.021 80.653 66.858 1.00 0.00 H new ATOM 0 HB2 SER A 29 -226.986 81.895 64.976 1.00 0.00 H new ATOM 0 HB3 SER A 29 -225.548 81.027 64.474 1.00 0.00 H new ATOM 0 HG SER A 29 -226.719 79.725 63.225 1.00 0.00 H new ATOM 452 N THR A 30 -228.329 80.657 67.672 1.00 0.00 N ATOM 453 CA THR A 30 -229.685 80.766 68.130 1.00 0.00 C ATOM 454 C THR A 30 -230.195 82.164 67.839 1.00 0.00 C ATOM 455 O THR A 30 -229.475 82.965 67.245 1.00 0.00 O ATOM 456 CB THR A 30 -229.814 80.383 69.616 1.00 0.00 C ATOM 457 OG1 THR A 30 -231.120 80.689 70.118 1.00 0.00 O ATOM 458 CG2 THR A 30 -228.766 81.070 70.466 1.00 0.00 C ATOM 0 H THR A 30 -227.646 81.154 68.243 1.00 0.00 H new ATOM 0 HA THR A 30 -230.310 80.055 67.589 1.00 0.00 H new ATOM 0 HB THR A 30 -229.654 79.307 69.678 1.00 0.00 H new ATOM 0 HG1 THR A 30 -231.120 81.590 70.503 1.00 0.00 H new ATOM 0 HG21 THR A 30 -228.891 80.774 71.508 1.00 0.00 H new ATOM 0 HG22 THR A 30 -227.773 80.781 70.123 1.00 0.00 H new ATOM 0 HG23 THR A 30 -228.879 82.151 70.380 1.00 0.00 H new ATOM 466 N ALA A 31 -231.434 82.437 68.218 1.00 0.00 N ATOM 467 CA ALA A 31 -232.096 83.681 67.866 1.00 0.00 C ATOM 468 C ALA A 31 -231.218 84.877 68.130 1.00 0.00 C ATOM 469 O ALA A 31 -231.036 85.687 67.248 1.00 0.00 O ATOM 470 CB ALA A 31 -233.424 83.790 68.600 1.00 0.00 C ATOM 0 H ALA A 31 -232.006 81.804 68.776 1.00 0.00 H new ATOM 0 HA ALA A 31 -232.293 83.670 66.794 1.00 0.00 H new ATOM 0 HB1 ALA A 31 -233.913 84.726 68.330 1.00 0.00 H new ATOM 0 HB2 ALA A 31 -234.064 82.953 68.321 1.00 0.00 H new ATOM 0 HB3 ALA A 31 -233.248 83.770 69.676 1.00 0.00 H new ATOM 476 N GLN A 32 -230.628 84.962 69.300 1.00 0.00 N ATOM 477 CA GLN A 32 -229.813 86.117 69.632 1.00 0.00 C ATOM 478 C GLN A 32 -228.484 86.127 68.848 1.00 0.00 C ATOM 479 O GLN A 32 -227.927 87.196 68.592 1.00 0.00 O ATOM 480 CB GLN A 32 -229.630 86.228 71.155 1.00 0.00 C ATOM 481 CG GLN A 32 -228.797 85.124 71.788 1.00 0.00 C ATOM 482 CD GLN A 32 -227.304 85.368 71.663 1.00 0.00 C ATOM 483 OE1 GLN A 32 -226.893 86.627 71.750 1.00 0.00 O flip ATOM 484 NE2 GLN A 32 -226.526 84.429 71.531 1.00 0.00 N flip ATOM 0 H GLN A 32 -230.693 84.256 70.033 1.00 0.00 H new ATOM 0 HA GLN A 32 -230.339 87.017 69.314 1.00 0.00 H new ATOM 0 HB2 GLN A 32 -229.164 87.187 71.380 1.00 0.00 H new ATOM 0 HB3 GLN A 32 -230.614 86.233 71.624 1.00 0.00 H new ATOM 0 HG2 GLN A 32 -229.059 85.037 72.842 1.00 0.00 H new ATOM 0 HG3 GLN A 32 -229.046 84.173 71.318 1.00 0.00 H new ATOM 0 HE21 GLN A 32 -226.883 83.476 71.468 1.00 0.00 H new ATOM 0 HE22 GLN A 32 -225.522 84.601 71.484 1.00 0.00 H new ATOM 493 N ASP A 33 -227.983 84.952 68.454 1.00 0.00 N ATOM 494 CA ASP A 33 -226.758 84.884 67.648 1.00 0.00 C ATOM 495 C ASP A 33 -227.044 85.439 66.271 1.00 0.00 C ATOM 496 O ASP A 33 -226.360 86.332 65.773 1.00 0.00 O ATOM 497 CB ASP A 33 -226.266 83.442 67.485 1.00 0.00 C ATOM 498 CG ASP A 33 -225.533 82.904 68.691 1.00 0.00 C ATOM 499 OD1 ASP A 33 -224.503 83.492 69.082 1.00 0.00 O ATOM 500 OD2 ASP A 33 -225.976 81.873 69.241 1.00 0.00 O ATOM 0 H ASP A 33 -228.399 84.047 68.675 1.00 0.00 H new ATOM 0 HA ASP A 33 -225.989 85.462 68.160 1.00 0.00 H new ATOM 0 HB2 ASP A 33 -227.121 82.799 67.275 1.00 0.00 H new ATOM 0 HB3 ASP A 33 -225.607 83.389 66.618 1.00 0.00 H new ATOM 505 N VAL A 34 -228.087 84.893 65.679 1.00 0.00 N ATOM 506 CA VAL A 34 -228.551 85.296 64.371 1.00 0.00 C ATOM 507 C VAL A 34 -229.105 86.721 64.425 1.00 0.00 C ATOM 508 O VAL A 34 -229.087 87.447 63.431 1.00 0.00 O ATOM 509 CB VAL A 34 -229.579 84.283 63.848 1.00 0.00 C ATOM 510 CG1 VAL A 34 -230.956 84.523 64.421 1.00 0.00 C ATOM 511 CG2 VAL A 34 -229.576 84.270 62.342 1.00 0.00 C ATOM 0 H VAL A 34 -228.642 84.148 66.100 1.00 0.00 H new ATOM 0 HA VAL A 34 -227.718 85.305 63.668 1.00 0.00 H new ATOM 0 HB VAL A 34 -229.285 83.291 64.191 1.00 0.00 H new ATOM 0 HG11 VAL A 34 -231.650 83.783 64.023 1.00 0.00 H new ATOM 0 HG12 VAL A 34 -230.918 84.438 65.507 1.00 0.00 H new ATOM 0 HG13 VAL A 34 -231.295 85.522 64.147 1.00 0.00 H new ATOM 0 HG21 VAL A 34 -230.309 83.548 61.983 1.00 0.00 H new ATOM 0 HG22 VAL A 34 -229.831 85.262 61.969 1.00 0.00 H new ATOM 0 HG23 VAL A 34 -228.586 83.991 61.983 1.00 0.00 H new ATOM 521 N ILE A 35 -229.584 87.112 65.606 1.00 0.00 N ATOM 522 CA ILE A 35 -229.935 88.495 65.886 1.00 0.00 C ATOM 523 C ILE A 35 -228.726 89.387 65.612 1.00 0.00 C ATOM 524 O ILE A 35 -228.778 90.277 64.771 1.00 0.00 O ATOM 525 CB ILE A 35 -230.361 88.679 67.373 1.00 0.00 C ATOM 526 CG1 ILE A 35 -231.826 88.323 67.618 1.00 0.00 C ATOM 527 CG2 ILE A 35 -230.107 90.102 67.844 1.00 0.00 C ATOM 528 CD1 ILE A 35 -232.238 88.477 69.070 1.00 0.00 C ATOM 0 H ILE A 35 -229.737 86.478 66.390 1.00 0.00 H new ATOM 0 HA ILE A 35 -230.772 88.769 65.244 1.00 0.00 H new ATOM 0 HB ILE A 35 -229.746 87.986 67.947 1.00 0.00 H new ATOM 0 HG12 ILE A 35 -232.457 88.959 66.997 1.00 0.00 H new ATOM 0 HG13 ILE A 35 -232.002 87.294 67.303 1.00 0.00 H new ATOM 0 HG21 ILE A 35 -230.414 90.201 68.885 1.00 0.00 H new ATOM 0 HG22 ILE A 35 -229.045 90.330 67.755 1.00 0.00 H new ATOM 0 HG23 ILE A 35 -230.680 90.796 67.229 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -233.289 88.210 69.180 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -231.629 87.821 69.692 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -232.092 89.511 69.382 1.00 0.00 H new ATOM 540 N GLN A 36 -227.624 89.091 66.294 1.00 0.00 N ATOM 541 CA GLN A 36 -226.394 89.866 66.173 1.00 0.00 C ATOM 542 C GLN A 36 -225.808 89.740 64.766 1.00 0.00 C ATOM 543 O GLN A 36 -225.191 90.676 64.254 1.00 0.00 O ATOM 544 CB GLN A 36 -225.388 89.388 67.224 1.00 0.00 C ATOM 545 CG GLN A 36 -224.022 90.041 67.130 1.00 0.00 C ATOM 546 CD GLN A 36 -223.091 89.571 68.228 1.00 0.00 C ATOM 547 OE1 GLN A 36 -222.392 88.570 68.081 1.00 0.00 O ATOM 548 NE2 GLN A 36 -223.073 90.294 69.334 1.00 0.00 N ATOM 0 H GLN A 36 -227.558 88.309 66.945 1.00 0.00 H new ATOM 0 HA GLN A 36 -226.618 90.919 66.344 1.00 0.00 H new ATOM 0 HB2 GLN A 36 -225.800 89.577 68.215 1.00 0.00 H new ATOM 0 HB3 GLN A 36 -225.268 88.309 67.129 1.00 0.00 H new ATOM 0 HG2 GLN A 36 -223.579 89.817 66.159 1.00 0.00 H new ATOM 0 HG3 GLN A 36 -224.133 91.124 67.188 1.00 0.00 H new ATOM 0 HE21 GLN A 36 -223.669 91.118 69.415 1.00 0.00 H new ATOM 0 HE22 GLN A 36 -222.463 90.028 70.107 1.00 0.00 H new ATOM 557 N GLN A 37 -225.998 88.584 64.150 1.00 0.00 N ATOM 558 CA GLN A 37 -225.574 88.362 62.795 1.00 0.00 C ATOM 559 C GLN A 37 -226.299 89.322 61.853 1.00 0.00 C ATOM 560 O GLN A 37 -225.688 89.939 60.975 1.00 0.00 O ATOM 561 CB GLN A 37 -225.873 86.917 62.417 1.00 0.00 C ATOM 562 CG GLN A 37 -225.583 86.626 60.974 1.00 0.00 C ATOM 563 CD GLN A 37 -224.104 86.471 60.690 1.00 0.00 C ATOM 564 OE1 GLN A 37 -223.340 86.038 61.552 1.00 0.00 O ATOM 565 NE2 GLN A 37 -223.689 86.827 59.486 1.00 0.00 N ATOM 0 H GLN A 37 -226.451 87.779 64.583 1.00 0.00 H new ATOM 0 HA GLN A 37 -224.503 88.546 62.708 1.00 0.00 H new ATOM 0 HB2 GLN A 37 -225.280 86.251 63.044 1.00 0.00 H new ATOM 0 HB3 GLN A 37 -226.921 86.701 62.624 1.00 0.00 H new ATOM 0 HG2 GLN A 37 -226.102 85.713 60.681 1.00 0.00 H new ATOM 0 HG3 GLN A 37 -225.984 87.431 60.358 1.00 0.00 H new ATOM 0 HE21 GLN A 37 -224.356 87.181 58.801 1.00 0.00 H new ATOM 0 HE22 GLN A 37 -222.702 86.747 59.243 1.00 0.00 H new ATOM 574 N THR A 38 -227.604 89.452 62.049 1.00 0.00 N ATOM 575 CA THR A 38 -228.397 90.377 61.260 1.00 0.00 C ATOM 576 C THR A 38 -228.028 91.817 61.620 1.00 0.00 C ATOM 577 O THR A 38 -227.949 92.675 60.750 1.00 0.00 O ATOM 578 CB THR A 38 -229.905 90.138 61.471 1.00 0.00 C ATOM 579 OG1 THR A 38 -230.197 88.742 61.309 1.00 0.00 O ATOM 580 CG2 THR A 38 -230.730 90.945 60.476 1.00 0.00 C ATOM 0 H THR A 38 -228.133 88.929 62.747 1.00 0.00 H new ATOM 0 HA THR A 38 -228.177 90.205 60.206 1.00 0.00 H new ATOM 0 HB THR A 38 -230.166 90.460 62.479 1.00 0.00 H new ATOM 0 HG1 THR A 38 -229.910 88.253 62.108 1.00 0.00 H new ATOM 0 HG21 THR A 38 -231.790 90.758 60.646 1.00 0.00 H new ATOM 0 HG22 THR A 38 -230.523 92.007 60.608 1.00 0.00 H new ATOM 0 HG23 THR A 38 -230.468 90.648 59.461 1.00 0.00 H new ATOM 588 N LEU A 39 -227.782 92.058 62.908 1.00 0.00 N ATOM 589 CA LEU A 39 -227.243 93.330 63.387 1.00 0.00 C ATOM 590 C LEU A 39 -225.999 93.724 62.589 1.00 0.00 C ATOM 591 O LEU A 39 -225.821 94.884 62.216 1.00 0.00 O ATOM 592 CB LEU A 39 -226.865 93.203 64.870 1.00 0.00 C ATOM 593 CG LEU A 39 -227.888 93.711 65.891 1.00 0.00 C ATOM 594 CD1 LEU A 39 -229.256 93.084 65.697 1.00 0.00 C ATOM 595 CD2 LEU A 39 -227.396 93.452 67.302 1.00 0.00 C ATOM 0 H LEU A 39 -227.951 91.377 63.648 1.00 0.00 H new ATOM 0 HA LEU A 39 -228.006 94.098 63.258 1.00 0.00 H new ATOM 0 HB2 LEU A 39 -226.668 92.152 65.081 1.00 0.00 H new ATOM 0 HB3 LEU A 39 -225.930 93.741 65.029 1.00 0.00 H new ATOM 0 HG LEU A 39 -227.994 94.784 65.732 1.00 0.00 H new ATOM 0 HD11 LEU A 39 -229.945 93.476 66.445 1.00 0.00 H new ATOM 0 HD12 LEU A 39 -229.627 93.322 64.700 1.00 0.00 H new ATOM 0 HD13 LEU A 39 -229.179 92.002 65.806 1.00 0.00 H new ATOM 0 HD21 LEU A 39 -228.133 93.818 68.017 1.00 0.00 H new ATOM 0 HD22 LEU A 39 -227.251 92.381 67.446 1.00 0.00 H new ATOM 0 HD23 LEU A 39 -226.450 93.970 67.458 1.00 0.00 H new ATOM 607 N CYS A 40 -225.152 92.731 62.337 1.00 0.00 N ATOM 608 CA CYS A 40 -223.902 92.931 61.616 1.00 0.00 C ATOM 609 C CYS A 40 -224.151 93.399 60.181 1.00 0.00 C ATOM 610 O CYS A 40 -223.518 94.341 59.711 1.00 0.00 O ATOM 611 CB CYS A 40 -223.092 91.628 61.612 1.00 0.00 C ATOM 612 SG CYS A 40 -221.430 91.790 60.921 1.00 0.00 S ATOM 0 H CYS A 40 -225.314 91.766 62.627 1.00 0.00 H new ATOM 0 HA CYS A 40 -223.337 93.711 62.127 1.00 0.00 H new ATOM 0 HB2 CYS A 40 -223.014 91.259 62.635 1.00 0.00 H new ATOM 0 HB3 CYS A 40 -223.638 90.876 61.043 1.00 0.00 H new ATOM 0 HG CYS A 40 -220.828 90.639 60.964 1.00 0.00 H new ATOM 618 N LYS A 41 -225.073 92.743 59.485 1.00 0.00 N ATOM 619 CA LYS A 41 -225.361 93.097 58.094 1.00 0.00 C ATOM 620 C LYS A 41 -226.270 94.317 57.985 1.00 0.00 C ATOM 621 O LYS A 41 -226.321 94.963 56.940 1.00 0.00 O ATOM 622 CB LYS A 41 -225.977 91.918 57.343 1.00 0.00 C ATOM 623 CG LYS A 41 -224.942 91.026 56.680 1.00 0.00 C ATOM 624 CD LYS A 41 -225.581 90.049 55.713 1.00 0.00 C ATOM 625 CE LYS A 41 -224.560 89.494 54.733 1.00 0.00 C ATOM 626 NZ LYS A 41 -223.924 90.570 53.924 1.00 0.00 N ATOM 0 H LYS A 41 -225.630 91.972 59.853 1.00 0.00 H new ATOM 0 HA LYS A 41 -224.406 93.351 57.634 1.00 0.00 H new ATOM 0 HB2 LYS A 41 -226.569 91.322 58.038 1.00 0.00 H new ATOM 0 HB3 LYS A 41 -226.661 92.296 56.584 1.00 0.00 H new ATOM 0 HG2 LYS A 41 -224.217 91.643 56.149 1.00 0.00 H new ATOM 0 HG3 LYS A 41 -224.393 90.475 57.444 1.00 0.00 H new ATOM 0 HD2 LYS A 41 -226.037 89.230 56.269 1.00 0.00 H new ATOM 0 HD3 LYS A 41 -226.381 90.547 55.165 1.00 0.00 H new ATOM 0 HE2 LYS A 41 -223.791 88.949 55.280 1.00 0.00 H new ATOM 0 HE3 LYS A 41 -225.046 88.779 54.069 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 -223.612 90.180 53.012 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 -224.612 91.332 53.758 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 -223.103 90.950 54.437 1.00 0.00 H new ATOM 640 N ALA A 42 -226.984 94.629 59.055 1.00 0.00 N ATOM 641 CA ALA A 42 -227.850 95.804 59.084 1.00 0.00 C ATOM 642 C ALA A 42 -227.091 97.014 59.602 1.00 0.00 C ATOM 643 O ALA A 42 -227.686 98.051 59.910 1.00 0.00 O ATOM 644 CB ALA A 42 -229.078 95.540 59.942 1.00 0.00 C ATOM 0 H ALA A 42 -226.983 94.086 59.918 1.00 0.00 H new ATOM 0 HA ALA A 42 -228.178 96.013 58.066 1.00 0.00 H new ATOM 0 HB1 ALA A 42 -229.712 96.426 59.952 1.00 0.00 H new ATOM 0 HB2 ALA A 42 -229.636 94.699 59.530 1.00 0.00 H new ATOM 0 HB3 ALA A 42 -228.767 95.305 60.960 1.00 0.00 H new ATOM 852 N ASP A 56 -232.601 92.985 73.455 1.00 0.00 N ATOM 853 CA ASP A 56 -233.934 93.573 73.329 1.00 0.00 C ATOM 854 C ASP A 56 -234.608 93.142 72.035 1.00 0.00 C ATOM 855 O ASP A 56 -235.588 93.745 71.593 1.00 0.00 O ATOM 856 CB ASP A 56 -233.848 95.101 73.394 1.00 0.00 C ATOM 857 CG ASP A 56 -233.307 95.596 74.721 1.00 0.00 C ATOM 858 OD1 ASP A 56 -234.045 95.540 75.729 1.00 0.00 O ATOM 859 OD2 ASP A 56 -232.147 96.054 74.762 1.00 0.00 O ATOM 0 HA ASP A 56 -234.539 93.213 74.161 1.00 0.00 H new ATOM 0 HB2 ASP A 56 -233.208 95.460 72.588 1.00 0.00 H new ATOM 0 HB3 ASP A 56 -234.838 95.525 73.228 1.00 0.00 H new ATOM 864 N TYR A 57 -234.103 92.076 71.447 1.00 0.00 N ATOM 865 CA TYR A 57 -234.667 91.553 70.215 1.00 0.00 C ATOM 866 C TYR A 57 -235.224 90.153 70.432 1.00 0.00 C ATOM 867 O TYR A 57 -235.128 89.581 71.519 1.00 0.00 O ATOM 868 CB TYR A 57 -233.605 91.469 69.113 1.00 0.00 C ATOM 869 CG TYR A 57 -233.108 92.781 68.577 1.00 0.00 C ATOM 870 CD1 TYR A 57 -232.409 93.665 69.379 1.00 0.00 C ATOM 871 CD2 TYR A 57 -233.322 93.122 67.250 1.00 0.00 C ATOM 872 CE1 TYR A 57 -231.940 94.857 68.878 1.00 0.00 C ATOM 873 CE2 TYR A 57 -232.853 94.311 66.736 1.00 0.00 C ATOM 874 CZ TYR A 57 -232.163 95.179 67.554 1.00 0.00 C ATOM 875 OH TYR A 57 -231.697 96.371 67.052 1.00 0.00 O ATOM 0 H TYR A 57 -233.302 91.553 71.802 1.00 0.00 H new ATOM 0 HA TYR A 57 -235.462 92.235 69.913 1.00 0.00 H new ATOM 0 HB2 TYR A 57 -232.752 90.910 69.499 1.00 0.00 H new ATOM 0 HB3 TYR A 57 -234.015 90.892 68.284 1.00 0.00 H new ATOM 0 HD1 TYR A 57 -232.229 93.415 70.414 1.00 0.00 H new ATOM 0 HD2 TYR A 57 -233.866 92.444 66.609 1.00 0.00 H new ATOM 0 HE1 TYR A 57 -231.399 95.539 69.518 1.00 0.00 H new ATOM 0 HE2 TYR A 57 -233.025 94.561 65.699 1.00 0.00 H new ATOM 0 HH TYR A 57 -231.937 96.443 66.105 1.00 0.00 H new ATOM 885 N VAL A 58 -235.795 89.626 69.368 1.00 0.00 N ATOM 886 CA VAL A 58 -236.228 88.245 69.271 1.00 0.00 C ATOM 887 C VAL A 58 -236.078 87.811 67.824 1.00 0.00 C ATOM 888 O VAL A 58 -235.662 88.605 66.975 1.00 0.00 O ATOM 889 CB VAL A 58 -237.696 88.031 69.704 1.00 0.00 C ATOM 890 CG1 VAL A 58 -237.776 87.496 71.119 1.00 0.00 C ATOM 891 CG2 VAL A 58 -238.490 89.324 69.616 1.00 0.00 C ATOM 0 H VAL A 58 -235.977 90.163 68.520 1.00 0.00 H new ATOM 0 HA VAL A 58 -235.610 87.655 69.948 1.00 0.00 H new ATOM 0 HB VAL A 58 -238.126 87.300 69.019 1.00 0.00 H new ATOM 0 HG11 VAL A 58 -238.821 87.355 71.396 1.00 0.00 H new ATOM 0 HG12 VAL A 58 -237.253 86.541 71.177 1.00 0.00 H new ATOM 0 HG13 VAL A 58 -237.311 88.206 71.803 1.00 0.00 H new ATOM 0 HG21 VAL A 58 -239.519 89.141 69.927 1.00 0.00 H new ATOM 0 HG22 VAL A 58 -238.041 90.072 70.269 1.00 0.00 H new ATOM 0 HG23 VAL A 58 -238.481 89.687 68.588 1.00 0.00 H new ATOM 901 N LEU A 59 -236.428 86.580 67.530 1.00 0.00 N ATOM 902 CA LEU A 59 -236.282 86.057 66.188 1.00 0.00 C ATOM 903 C LEU A 59 -237.450 85.115 65.897 1.00 0.00 C ATOM 904 O LEU A 59 -237.893 84.387 66.775 1.00 0.00 O ATOM 905 CB LEU A 59 -234.916 85.357 66.085 1.00 0.00 C ATOM 906 CG LEU A 59 -234.329 85.146 64.683 1.00 0.00 C ATOM 907 CD1 LEU A 59 -235.139 84.154 63.878 1.00 0.00 C ATOM 908 CD2 LEU A 59 -234.212 86.465 63.944 1.00 0.00 C ATOM 0 H LEU A 59 -236.817 85.919 68.203 1.00 0.00 H new ATOM 0 HA LEU A 59 -236.308 86.850 65.440 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -234.198 85.935 66.666 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -235.002 84.381 66.564 1.00 0.00 H new ATOM 0 HG LEU A 59 -233.330 84.728 64.809 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -234.690 84.033 62.892 1.00 0.00 H new ATOM 0 HD12 LEU A 59 -235.152 83.193 64.392 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -236.160 84.521 63.770 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -233.794 86.291 62.953 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -235.199 86.916 63.847 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -233.559 87.137 64.500 1.00 0.00 H new ATOM 920 N LEU A 60 -237.975 85.179 64.684 1.00 0.00 N ATOM 921 CA LEU A 60 -239.128 84.375 64.291 1.00 0.00 C ATOM 922 C LEU A 60 -238.701 83.206 63.410 1.00 0.00 C ATOM 923 O LEU A 60 -238.005 83.406 62.420 1.00 0.00 O ATOM 924 CB LEU A 60 -240.140 85.231 63.500 1.00 0.00 C ATOM 925 CG LEU A 60 -240.936 86.300 64.282 1.00 0.00 C ATOM 926 CD1 LEU A 60 -241.925 85.646 65.215 1.00 0.00 C ATOM 927 CD2 LEU A 60 -240.027 87.250 65.052 1.00 0.00 C ATOM 0 H LEU A 60 -237.618 85.785 63.945 1.00 0.00 H new ATOM 0 HA LEU A 60 -239.589 83.998 65.204 1.00 0.00 H new ATOM 0 HB2 LEU A 60 -239.600 85.734 62.698 1.00 0.00 H new ATOM 0 HB3 LEU A 60 -240.855 84.557 63.029 1.00 0.00 H new ATOM 0 HG LEU A 60 -241.478 86.896 63.548 1.00 0.00 H new ATOM 0 HD11 LEU A 60 -242.476 86.414 65.757 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -242.622 85.038 64.638 1.00 0.00 H new ATOM 0 HD13 LEU A 60 -241.392 85.013 65.924 1.00 0.00 H new ATOM 0 HD21 LEU A 60 -240.634 87.982 65.585 1.00 0.00 H new ATOM 0 HD22 LEU A 60 -239.431 86.683 65.767 1.00 0.00 H new ATOM 0 HD23 LEU A 60 -239.365 87.765 64.356 1.00 0.00 H new ATOM 939 N GLU A 61 -239.108 81.995 63.766 1.00 0.00 N ATOM 940 CA GLU A 61 -238.983 80.864 62.863 1.00 0.00 C ATOM 941 C GLU A 61 -240.300 80.707 62.101 1.00 0.00 C ATOM 942 O GLU A 61 -241.231 80.027 62.527 1.00 0.00 O ATOM 943 CB GLU A 61 -238.577 79.561 63.603 1.00 0.00 C ATOM 944 CG GLU A 61 -239.664 78.926 64.470 1.00 0.00 C ATOM 945 CD GLU A 61 -239.221 77.641 65.149 1.00 0.00 C ATOM 946 OE1 GLU A 61 -239.076 76.618 64.449 1.00 0.00 O ATOM 947 OE2 GLU A 61 -239.025 77.643 66.385 1.00 0.00 O ATOM 0 H GLU A 61 -239.525 81.773 64.670 1.00 0.00 H new ATOM 0 HA GLU A 61 -238.176 81.056 62.156 1.00 0.00 H new ATOM 0 HB2 GLU A 61 -238.255 78.829 62.862 1.00 0.00 H new ATOM 0 HB3 GLU A 61 -237.715 79.777 64.234 1.00 0.00 H new ATOM 0 HG2 GLU A 61 -239.975 79.642 65.231 1.00 0.00 H new ATOM 0 HG3 GLU A 61 -240.537 78.719 63.851 1.00 0.00 H new ATOM 954 N GLU A 62 -240.414 81.428 61.009 1.00 0.00 N ATOM 955 CA GLU A 62 -241.544 81.299 60.158 1.00 0.00 C ATOM 956 C GLU A 62 -241.317 80.181 59.156 1.00 0.00 C ATOM 957 O GLU A 62 -240.332 80.179 58.431 1.00 0.00 O ATOM 958 CB GLU A 62 -241.712 82.618 59.442 1.00 0.00 C ATOM 959 CG GLU A 62 -242.986 82.741 58.678 1.00 0.00 C ATOM 960 CD GLU A 62 -242.759 83.147 57.237 1.00 0.00 C ATOM 961 OE1 GLU A 62 -242.599 82.252 56.384 1.00 0.00 O ATOM 962 OE2 GLU A 62 -242.735 84.362 56.943 1.00 0.00 O ATOM 0 H GLU A 62 -239.724 82.112 60.699 1.00 0.00 H new ATOM 0 HA GLU A 62 -242.438 81.055 60.732 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -241.661 83.425 60.173 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -240.876 82.756 58.757 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -243.516 81.789 58.705 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -243.628 83.477 59.163 1.00 0.00 H new ATOM 969 N VAL A 63 -242.217 79.225 59.140 1.00 0.00 N ATOM 970 CA VAL A 63 -242.186 78.164 58.149 1.00 0.00 C ATOM 971 C VAL A 63 -243.428 78.251 57.266 1.00 0.00 C ATOM 972 O VAL A 63 -244.557 78.158 57.752 1.00 0.00 O ATOM 973 CB VAL A 63 -242.079 76.761 58.804 1.00 0.00 C ATOM 974 CG1 VAL A 63 -242.841 76.725 60.117 1.00 0.00 C ATOM 975 CG2 VAL A 63 -242.577 75.688 57.853 1.00 0.00 C ATOM 0 H VAL A 63 -242.987 79.157 59.806 1.00 0.00 H new ATOM 0 HA VAL A 63 -241.294 78.299 57.537 1.00 0.00 H new ATOM 0 HB VAL A 63 -241.030 76.559 59.019 1.00 0.00 H new ATOM 0 HG11 VAL A 63 -242.754 75.733 60.561 1.00 0.00 H new ATOM 0 HG12 VAL A 63 -242.425 77.466 60.800 1.00 0.00 H new ATOM 0 HG13 VAL A 63 -243.892 76.950 59.934 1.00 0.00 H new ATOM 0 HG21 VAL A 63 -242.494 74.712 58.330 1.00 0.00 H new ATOM 0 HG22 VAL A 63 -243.620 75.881 57.601 1.00 0.00 H new ATOM 0 HG23 VAL A 63 -241.976 75.700 56.944 1.00 0.00 H new ATOM 985 N VAL A 64 -243.220 78.466 55.974 1.00 0.00 N ATOM 986 CA VAL A 64 -244.330 78.577 55.037 1.00 0.00 C ATOM 987 C VAL A 64 -245.025 77.237 54.862 1.00 0.00 C ATOM 988 O VAL A 64 -244.472 76.302 54.283 1.00 0.00 O ATOM 989 CB VAL A 64 -243.876 79.100 53.656 1.00 0.00 C ATOM 990 CG1 VAL A 64 -245.045 79.147 52.678 1.00 0.00 C ATOM 991 CG2 VAL A 64 -243.244 80.472 53.789 1.00 0.00 C ATOM 0 H VAL A 64 -242.297 78.567 55.552 1.00 0.00 H new ATOM 0 HA VAL A 64 -245.027 79.299 55.463 1.00 0.00 H new ATOM 0 HB VAL A 64 -243.131 78.409 53.262 1.00 0.00 H new ATOM 0 HG11 VAL A 64 -244.698 79.519 51.714 1.00 0.00 H new ATOM 0 HG12 VAL A 64 -245.456 78.145 52.554 1.00 0.00 H new ATOM 0 HG13 VAL A 64 -245.818 79.811 53.066 1.00 0.00 H new ATOM 0 HG21 VAL A 64 -242.930 80.825 52.807 1.00 0.00 H new ATOM 0 HG22 VAL A 64 -243.970 81.168 54.210 1.00 0.00 H new ATOM 0 HG23 VAL A 64 -242.377 80.411 54.447 1.00 0.00 H new ATOM 1199 N SER A 77 -247.980 81.494 55.663 1.00 0.00 N ATOM 1200 CA SER A 77 -246.794 81.309 56.481 1.00 0.00 C ATOM 1201 C SER A 77 -247.184 80.978 57.917 1.00 0.00 C ATOM 1202 O SER A 77 -248.125 81.555 58.462 1.00 0.00 O ATOM 1203 CB SER A 77 -245.949 82.581 56.439 1.00 0.00 C ATOM 1204 OG SER A 77 -245.739 82.996 55.098 1.00 0.00 O ATOM 0 HA SER A 77 -246.212 80.476 56.087 1.00 0.00 H new ATOM 0 HB2 SER A 77 -246.447 83.374 56.997 1.00 0.00 H new ATOM 0 HB3 SER A 77 -244.990 82.403 56.925 1.00 0.00 H new ATOM 0 HG SER A 77 -246.508 82.733 54.550 1.00 0.00 H new ATOM 1210 N SER A 78 -246.487 80.022 58.509 1.00 0.00 N ATOM 1211 CA SER A 78 -246.673 79.699 59.911 1.00 0.00 C ATOM 1212 C SER A 78 -245.524 80.307 60.703 1.00 0.00 C ATOM 1213 O SER A 78 -244.425 79.758 60.746 1.00 0.00 O ATOM 1214 CB SER A 78 -246.732 78.178 60.103 1.00 0.00 C ATOM 1215 OG SER A 78 -247.112 77.821 61.424 1.00 0.00 O ATOM 0 H SER A 78 -245.784 79.454 58.036 1.00 0.00 H new ATOM 0 HA SER A 78 -247.616 80.111 60.269 1.00 0.00 H new ATOM 0 HB2 SER A 78 -247.441 77.751 59.394 1.00 0.00 H new ATOM 0 HB3 SER A 78 -245.757 77.746 59.878 1.00 0.00 H new ATOM 0 HG SER A 78 -247.139 76.845 61.504 1.00 0.00 H new ATOM 1221 N GLN A 79 -245.776 81.452 61.312 1.00 0.00 N ATOM 1222 CA GLN A 79 -244.728 82.198 61.982 1.00 0.00 C ATOM 1223 C GLN A 79 -244.706 81.849 63.468 1.00 0.00 C ATOM 1224 O GLN A 79 -245.746 81.832 64.125 1.00 0.00 O ATOM 1225 CB GLN A 79 -244.967 83.696 61.797 1.00 0.00 C ATOM 1226 CG GLN A 79 -243.765 84.554 62.150 1.00 0.00 C ATOM 1227 CD GLN A 79 -244.092 86.035 62.196 1.00 0.00 C ATOM 1228 OE1 GLN A 79 -245.323 86.361 62.560 1.00 0.00 O flip ATOM 1229 NE2 GLN A 79 -243.244 86.881 61.922 1.00 0.00 N flip ATOM 0 H GLN A 79 -246.698 81.885 61.356 1.00 0.00 H new ATOM 0 HA GLN A 79 -243.764 81.933 61.547 1.00 0.00 H new ATOM 0 HB2 GLN A 79 -245.245 83.885 60.760 1.00 0.00 H new ATOM 0 HB3 GLN A 79 -245.813 83.999 62.415 1.00 0.00 H new ATOM 0 HG2 GLN A 79 -243.374 84.243 63.119 1.00 0.00 H new ATOM 0 HG3 GLN A 79 -242.975 84.384 61.418 1.00 0.00 H new ATOM 0 HE21 GLN A 79 -242.306 86.592 61.645 1.00 0.00 H new ATOM 0 HE22 GLN A 79 -243.478 87.873 61.971 1.00 0.00 H new ATOM 1238 N ARG A 80 -243.523 81.563 63.986 1.00 0.00 N ATOM 1239 CA ARG A 80 -243.352 81.217 65.382 1.00 0.00 C ATOM 1240 C ARG A 80 -242.244 82.081 65.979 1.00 0.00 C ATOM 1241 O ARG A 80 -241.290 82.399 65.289 1.00 0.00 O ATOM 1242 CB ARG A 80 -243.005 79.729 65.465 1.00 0.00 C ATOM 1243 CG ARG A 80 -243.065 79.161 66.862 1.00 0.00 C ATOM 1244 CD ARG A 80 -241.698 79.152 67.525 1.00 0.00 C ATOM 1245 NE ARG A 80 -241.768 78.712 68.915 1.00 0.00 N ATOM 1246 CZ ARG A 80 -240.746 78.180 69.584 1.00 0.00 C ATOM 1247 NH1 ARG A 80 -239.592 77.939 68.976 1.00 0.00 N ATOM 1248 NH2 ARG A 80 -240.891 77.856 70.862 1.00 0.00 N ATOM 0 H ARG A 80 -242.656 81.565 63.448 1.00 0.00 H new ATOM 0 HA ARG A 80 -244.265 81.400 65.949 1.00 0.00 H new ATOM 0 HB2 ARG A 80 -243.690 79.171 64.827 1.00 0.00 H new ATOM 0 HB3 ARG A 80 -242.002 79.578 65.065 1.00 0.00 H new ATOM 0 HG2 ARG A 80 -243.758 79.749 67.464 1.00 0.00 H new ATOM 0 HG3 ARG A 80 -243.458 78.145 66.825 1.00 0.00 H new ATOM 0 HD2 ARG A 80 -241.030 78.494 66.970 1.00 0.00 H new ATOM 0 HD3 ARG A 80 -241.268 80.153 67.483 1.00 0.00 H new ATOM 0 HE ARG A 80 -242.656 78.819 69.405 1.00 0.00 H new ATOM 0 HH11 ARG A 80 -239.481 78.161 67.987 1.00 0.00 H new ATOM 0 HH12 ARG A 80 -238.816 77.531 69.498 1.00 0.00 H new ATOM 0 HH21 ARG A 80 -241.783 78.014 71.330 1.00 0.00 H new ATOM 0 HH22 ARG A 80 -240.110 77.449 71.377 1.00 0.00 H new ATOM 1262 N VAL A 81 -242.362 82.490 67.234 1.00 0.00 N ATOM 1263 CA VAL A 81 -241.344 83.352 67.823 1.00 0.00 C ATOM 1264 C VAL A 81 -240.439 82.562 68.765 1.00 0.00 C ATOM 1265 O VAL A 81 -240.899 81.685 69.496 1.00 0.00 O ATOM 1266 CB VAL A 81 -241.950 84.547 68.588 1.00 0.00 C ATOM 1267 CG1 VAL A 81 -241.113 85.805 68.362 1.00 0.00 C ATOM 1268 CG2 VAL A 81 -243.404 84.783 68.198 1.00 0.00 C ATOM 0 H VAL A 81 -243.134 82.246 67.854 1.00 0.00 H new ATOM 0 HA VAL A 81 -240.759 83.744 66.991 1.00 0.00 H new ATOM 0 HB VAL A 81 -241.934 84.306 69.651 1.00 0.00 H new ATOM 0 HG11 VAL A 81 -241.554 86.639 68.908 1.00 0.00 H new ATOM 0 HG12 VAL A 81 -240.097 85.635 68.718 1.00 0.00 H new ATOM 0 HG13 VAL A 81 -241.090 86.040 67.298 1.00 0.00 H new ATOM 0 HG21 VAL A 81 -243.797 85.632 68.757 1.00 0.00 H new ATOM 0 HG22 VAL A 81 -243.465 84.992 67.130 1.00 0.00 H new ATOM 0 HG23 VAL A 81 -243.991 83.894 68.428 1.00 0.00 H new ATOM 1278 N LEU A 82 -239.154 82.884 68.730 1.00 0.00 N ATOM 1279 CA LEU A 82 -238.140 82.178 69.503 1.00 0.00 C ATOM 1280 C LEU A 82 -237.750 82.952 70.747 1.00 0.00 C ATOM 1281 O LEU A 82 -237.912 84.170 70.814 1.00 0.00 O ATOM 1282 CB LEU A 82 -236.882 82.007 68.657 1.00 0.00 C ATOM 1283 CG LEU A 82 -237.096 81.409 67.277 1.00 0.00 C ATOM 1284 CD1 LEU A 82 -235.991 81.863 66.353 1.00 0.00 C ATOM 1285 CD2 LEU A 82 -237.148 79.894 67.348 1.00 0.00 C ATOM 0 H LEU A 82 -238.783 83.646 68.162 1.00 0.00 H new ATOM 0 HA LEU A 82 -238.561 81.215 69.791 1.00 0.00 H new ATOM 0 HB2 LEU A 82 -236.408 82.982 68.542 1.00 0.00 H new ATOM 0 HB3 LEU A 82 -236.182 81.375 69.203 1.00 0.00 H new ATOM 0 HG LEU A 82 -238.052 81.756 66.885 1.00 0.00 H new ATOM 0 HD11 LEU A 82 -236.145 81.434 65.363 1.00 0.00 H new ATOM 0 HD12 LEU A 82 -236.000 82.951 66.282 1.00 0.00 H new ATOM 0 HD13 LEU A 82 -235.029 81.533 66.746 1.00 0.00 H new ATOM 0 HD21 LEU A 82 -237.302 79.488 66.348 1.00 0.00 H new ATOM 0 HD22 LEU A 82 -236.209 79.516 67.752 1.00 0.00 H new ATOM 0 HD23 LEU A 82 -237.971 79.588 67.994 1.00 0.00 H new ATOM 1297 N LEU A 83 -237.233 82.230 71.724 1.00 0.00 N ATOM 1298 CA LEU A 83 -236.526 82.841 72.832 1.00 0.00 C ATOM 1299 C LEU A 83 -235.072 83.023 72.417 1.00 0.00 C ATOM 1300 O LEU A 83 -234.660 82.514 71.370 1.00 0.00 O ATOM 1301 CB LEU A 83 -236.611 81.981 74.103 1.00 0.00 C ATOM 1302 CG LEU A 83 -237.999 81.873 74.752 1.00 0.00 C ATOM 1303 CD1 LEU A 83 -238.928 80.988 73.932 1.00 0.00 C ATOM 1304 CD2 LEU A 83 -237.878 81.346 76.174 1.00 0.00 C ATOM 0 H LEU A 83 -237.291 81.213 71.771 1.00 0.00 H new ATOM 0 HA LEU A 83 -236.985 83.802 73.066 1.00 0.00 H new ATOM 0 HB2 LEU A 83 -236.266 80.976 73.861 1.00 0.00 H new ATOM 0 HB3 LEU A 83 -235.918 82.387 74.840 1.00 0.00 H new ATOM 0 HG LEU A 83 -238.434 82.872 74.783 1.00 0.00 H new ATOM 0 HD11 LEU A 83 -239.902 80.933 74.419 1.00 0.00 H new ATOM 0 HD12 LEU A 83 -239.045 81.410 72.934 1.00 0.00 H new ATOM 0 HD13 LEU A 83 -238.503 79.987 73.856 1.00 0.00 H new ATOM 0 HD21 LEU A 83 -238.869 81.275 76.621 1.00 0.00 H new ATOM 0 HD22 LEU A 83 -237.415 80.359 76.158 1.00 0.00 H new ATOM 0 HD23 LEU A 83 -237.262 82.026 76.763 1.00 0.00 H new ATOM 1316 N ASP A 84 -234.295 83.719 73.233 1.00 0.00 N ATOM 1317 CA ASP A 84 -232.900 84.023 72.906 1.00 0.00 C ATOM 1318 C ASP A 84 -232.097 82.761 72.579 1.00 0.00 C ATOM 1319 O ASP A 84 -231.191 82.802 71.747 1.00 0.00 O ATOM 1320 CB ASP A 84 -232.228 84.794 74.049 1.00 0.00 C ATOM 1321 CG ASP A 84 -232.182 84.018 75.353 1.00 0.00 C ATOM 1322 OD1 ASP A 84 -233.223 83.942 76.039 1.00 0.00 O ATOM 1323 OD2 ASP A 84 -231.102 83.502 75.710 1.00 0.00 O ATOM 0 H ASP A 84 -234.604 84.088 74.132 1.00 0.00 H new ATOM 0 HA ASP A 84 -232.912 84.649 72.013 1.00 0.00 H new ATOM 0 HB2 ASP A 84 -231.212 85.055 73.754 1.00 0.00 H new ATOM 0 HB3 ASP A 84 -232.763 85.730 74.210 1.00 0.00 H new ATOM 1328 N GLN A 85 -232.449 81.641 73.198 1.00 0.00 N ATOM 1329 CA GLN A 85 -231.709 80.410 73.013 1.00 0.00 C ATOM 1330 C GLN A 85 -232.578 79.276 72.472 1.00 0.00 C ATOM 1331 O GLN A 85 -232.343 78.110 72.780 1.00 0.00 O ATOM 1332 CB GLN A 85 -231.083 80.009 74.339 1.00 0.00 C ATOM 1333 CG GLN A 85 -232.042 80.094 75.514 1.00 0.00 C ATOM 1334 CD GLN A 85 -231.338 80.008 76.851 1.00 0.00 C ATOM 1335 OE1 GLN A 85 -231.143 78.923 77.400 1.00 0.00 O ATOM 1336 NE2 GLN A 85 -230.953 81.155 77.382 1.00 0.00 N ATOM 0 H GLN A 85 -233.244 81.565 73.832 1.00 0.00 H new ATOM 0 HA GLN A 85 -230.936 80.591 72.266 1.00 0.00 H new ATOM 0 HB2 GLN A 85 -230.707 78.989 74.260 1.00 0.00 H new ATOM 0 HB3 GLN A 85 -230.224 80.651 74.535 1.00 0.00 H new ATOM 0 HG2 GLN A 85 -232.595 81.032 75.459 1.00 0.00 H new ATOM 0 HG3 GLN A 85 -232.772 79.288 75.440 1.00 0.00 H new ATOM 0 HE21 GLN A 85 -231.135 82.031 76.892 1.00 0.00 H new ATOM 0 HE22 GLN A 85 -230.473 81.165 78.282 1.00 0.00 H new ATOM 1345 N GLU A 86 -233.564 79.609 71.642 1.00 0.00 N ATOM 1346 CA GLU A 86 -234.381 78.586 70.997 1.00 0.00 C ATOM 1347 C GLU A 86 -233.609 77.850 69.900 1.00 0.00 C ATOM 1348 O GLU A 86 -234.064 76.821 69.404 1.00 0.00 O ATOM 1349 CB GLU A 86 -235.647 79.203 70.413 1.00 0.00 C ATOM 1350 CG GLU A 86 -236.851 79.079 71.325 1.00 0.00 C ATOM 1351 CD GLU A 86 -237.225 77.637 71.574 1.00 0.00 C ATOM 1352 OE1 GLU A 86 -237.787 76.998 70.660 1.00 0.00 O ATOM 1353 OE2 GLU A 86 -236.956 77.130 72.676 1.00 0.00 O ATOM 0 H GLU A 86 -233.814 80.568 71.403 1.00 0.00 H new ATOM 0 HA GLU A 86 -234.653 77.859 71.763 1.00 0.00 H new ATOM 0 HB2 GLU A 86 -235.466 80.257 70.204 1.00 0.00 H new ATOM 0 HB3 GLU A 86 -235.871 78.723 69.460 1.00 0.00 H new ATOM 0 HG2 GLU A 86 -236.638 79.568 72.276 1.00 0.00 H new ATOM 0 HG3 GLU A 86 -237.698 79.602 70.881 1.00 0.00 H new ATOM 1360 N CYS A 87 -232.445 78.388 69.535 1.00 0.00 N ATOM 1361 CA CYS A 87 -231.583 77.804 68.514 1.00 0.00 C ATOM 1362 C CYS A 87 -232.210 77.888 67.120 1.00 0.00 C ATOM 1363 O CYS A 87 -233.264 77.313 66.856 1.00 0.00 O ATOM 1364 CB CYS A 87 -231.233 76.362 68.876 1.00 0.00 C ATOM 1365 SG CYS A 87 -230.002 76.203 70.190 1.00 0.00 S ATOM 0 H CYS A 87 -232.074 79.246 69.943 1.00 0.00 H new ATOM 0 HA CYS A 87 -230.663 78.387 68.482 1.00 0.00 H new ATOM 0 HB2 CYS A 87 -232.143 75.845 69.182 1.00 0.00 H new ATOM 0 HB3 CYS A 87 -230.863 75.855 67.985 1.00 0.00 H new ATOM 0 HG CYS A 87 -229.951 74.967 70.589 1.00 0.00 H new ATOM 1371 N VAL A 88 -231.533 78.592 66.224 1.00 0.00 N ATOM 1372 CA VAL A 88 -232.048 78.849 64.892 1.00 0.00 C ATOM 1373 C VAL A 88 -231.920 77.605 64.043 1.00 0.00 C ATOM 1374 O VAL A 88 -232.802 77.284 63.253 1.00 0.00 O ATOM 1375 CB VAL A 88 -231.304 80.025 64.225 1.00 0.00 C ATOM 1376 CG1 VAL A 88 -231.757 80.232 62.793 1.00 0.00 C ATOM 1377 CG2 VAL A 88 -231.523 81.289 65.024 1.00 0.00 C ATOM 0 H VAL A 88 -230.615 78.999 66.402 1.00 0.00 H new ATOM 0 HA VAL A 88 -233.100 79.121 64.979 1.00 0.00 H new ATOM 0 HB VAL A 88 -230.241 79.783 64.206 1.00 0.00 H new ATOM 0 HG11 VAL A 88 -231.211 81.068 62.356 1.00 0.00 H new ATOM 0 HG12 VAL A 88 -231.561 79.329 62.215 1.00 0.00 H new ATOM 0 HG13 VAL A 88 -232.825 80.448 62.777 1.00 0.00 H new ATOM 0 HG21 VAL A 88 -230.996 82.116 64.549 1.00 0.00 H new ATOM 0 HG22 VAL A 88 -232.589 81.514 65.064 1.00 0.00 H new ATOM 0 HG23 VAL A 88 -231.143 81.150 66.036 1.00 0.00 H new ATOM 1387 N PHE A 89 -230.833 76.881 64.241 1.00 0.00 N ATOM 1388 CA PHE A 89 -230.618 75.655 63.481 1.00 0.00 C ATOM 1389 C PHE A 89 -231.568 74.580 63.988 1.00 0.00 C ATOM 1390 O PHE A 89 -232.123 73.803 63.211 1.00 0.00 O ATOM 1391 CB PHE A 89 -229.158 75.204 63.578 1.00 0.00 C ATOM 1392 CG PHE A 89 -228.860 73.907 62.874 1.00 0.00 C ATOM 1393 CD1 PHE A 89 -229.041 72.692 63.520 1.00 0.00 C ATOM 1394 CD2 PHE A 89 -228.395 73.905 61.570 1.00 0.00 C ATOM 1395 CE1 PHE A 89 -228.766 71.502 62.876 1.00 0.00 C ATOM 1396 CE2 PHE A 89 -228.117 72.717 60.922 1.00 0.00 C ATOM 1397 CZ PHE A 89 -228.304 71.514 61.574 1.00 0.00 C ATOM 0 H PHE A 89 -230.096 77.111 64.907 1.00 0.00 H new ATOM 0 HA PHE A 89 -230.827 75.839 62.427 1.00 0.00 H new ATOM 0 HB2 PHE A 89 -228.521 75.984 63.161 1.00 0.00 H new ATOM 0 HB3 PHE A 89 -228.891 75.102 64.630 1.00 0.00 H new ATOM 0 HD1 PHE A 89 -229.401 72.677 64.538 1.00 0.00 H new ATOM 0 HD2 PHE A 89 -228.248 74.842 61.054 1.00 0.00 H new ATOM 0 HE1 PHE A 89 -228.912 70.563 63.389 1.00 0.00 H new ATOM 0 HE2 PHE A 89 -227.753 72.729 59.905 1.00 0.00 H new ATOM 0 HZ PHE A 89 -228.090 70.585 61.067 1.00 0.00 H new ATOM 1407 N GLN A 90 -231.758 74.559 65.301 1.00 0.00 N ATOM 1408 CA GLN A 90 -232.750 73.695 65.919 1.00 0.00 C ATOM 1409 C GLN A 90 -234.136 73.998 65.362 1.00 0.00 C ATOM 1410 O GLN A 90 -234.889 73.088 65.012 1.00 0.00 O ATOM 1411 CB GLN A 90 -232.736 73.877 67.436 1.00 0.00 C ATOM 1412 CG GLN A 90 -231.677 73.052 68.143 1.00 0.00 C ATOM 1413 CD GLN A 90 -231.726 73.193 69.654 1.00 0.00 C ATOM 1414 OE1 GLN A 90 -230.701 73.101 70.329 1.00 0.00 O ATOM 1415 NE2 GLN A 90 -232.914 73.412 70.200 1.00 0.00 N ATOM 0 H GLN A 90 -231.234 75.135 65.960 1.00 0.00 H new ATOM 0 HA GLN A 90 -232.503 72.659 65.689 1.00 0.00 H new ATOM 0 HB2 GLN A 90 -232.575 74.931 67.664 1.00 0.00 H new ATOM 0 HB3 GLN A 90 -233.716 73.611 67.833 1.00 0.00 H new ATOM 0 HG2 GLN A 90 -231.804 72.003 67.877 1.00 0.00 H new ATOM 0 HG3 GLN A 90 -230.692 73.354 67.787 1.00 0.00 H new ATOM 0 HE21 GLN A 90 -233.742 73.482 69.608 1.00 0.00 H new ATOM 0 HE22 GLN A 90 -233.000 73.510 71.212 1.00 0.00 H new ATOM 1424 N ALA A 91 -234.455 75.288 65.277 1.00 0.00 N ATOM 1425 CA ALA A 91 -235.728 75.745 64.728 1.00 0.00 C ATOM 1426 C ALA A 91 -235.882 75.321 63.272 1.00 0.00 C ATOM 1427 O ALA A 91 -236.883 74.717 62.893 1.00 0.00 O ATOM 1428 CB ALA A 91 -235.834 77.258 64.853 1.00 0.00 C ATOM 0 H ALA A 91 -233.841 76.042 65.585 1.00 0.00 H new ATOM 0 HA ALA A 91 -236.533 75.282 65.299 1.00 0.00 H new ATOM 0 HB1 ALA A 91 -236.787 77.591 64.441 1.00 0.00 H new ATOM 0 HB2 ALA A 91 -235.774 77.541 65.904 1.00 0.00 H new ATOM 0 HB3 ALA A 91 -235.017 77.727 64.304 1.00 0.00 H new ATOM 1434 N GLN A 92 -234.868 75.616 62.470 1.00 0.00 N ATOM 1435 CA GLN A 92 -234.876 75.309 61.053 1.00 0.00 C ATOM 1436 C GLN A 92 -235.038 73.810 60.801 1.00 0.00 C ATOM 1437 O GLN A 92 -235.514 73.394 59.746 1.00 0.00 O ATOM 1438 CB GLN A 92 -233.580 75.804 60.418 1.00 0.00 C ATOM 1439 CG GLN A 92 -233.718 76.039 58.939 1.00 0.00 C ATOM 1440 CD GLN A 92 -232.511 76.708 58.316 1.00 0.00 C ATOM 1441 OE1 GLN A 92 -232.443 77.930 58.225 1.00 0.00 O ATOM 1442 NE2 GLN A 92 -231.544 75.913 57.896 1.00 0.00 N ATOM 0 H GLN A 92 -234.015 76.077 62.789 1.00 0.00 H new ATOM 0 HA GLN A 92 -235.729 75.815 60.602 1.00 0.00 H new ATOM 0 HB2 GLN A 92 -233.272 76.730 60.903 1.00 0.00 H new ATOM 0 HB3 GLN A 92 -232.790 75.074 60.595 1.00 0.00 H new ATOM 0 HG2 GLN A 92 -233.890 75.084 58.442 1.00 0.00 H new ATOM 0 HG3 GLN A 92 -234.598 76.656 58.758 1.00 0.00 H new ATOM 0 HE21 GLN A 92 -231.638 74.902 57.989 1.00 0.00 H new ATOM 0 HE22 GLN A 92 -230.703 76.310 57.478 1.00 0.00 H new ATOM 1451 N SER A 93 -234.642 73.004 61.773 1.00 0.00 N ATOM 1452 CA SER A 93 -234.711 71.557 61.642 1.00 0.00 C ATOM 1453 C SER A 93 -236.118 71.037 61.976 1.00 0.00 C ATOM 1454 O SER A 93 -236.427 69.864 61.756 1.00 0.00 O ATOM 1455 CB SER A 93 -233.657 70.904 62.546 1.00 0.00 C ATOM 1456 OG SER A 93 -233.410 69.563 62.164 1.00 0.00 O ATOM 0 H SER A 93 -234.268 73.329 62.665 1.00 0.00 H new ATOM 0 HA SER A 93 -234.502 71.290 60.606 1.00 0.00 H new ATOM 0 HB2 SER A 93 -232.730 71.475 62.498 1.00 0.00 H new ATOM 0 HB3 SER A 93 -233.995 70.933 63.582 1.00 0.00 H new ATOM 0 HG SER A 93 -234.251 69.140 61.892 1.00 0.00 H new ATOM 1462 N LYS A 94 -236.972 71.915 62.501 1.00 0.00 N ATOM 1463 CA LYS A 94 -238.346 71.555 62.827 1.00 0.00 C ATOM 1464 C LYS A 94 -239.244 71.725 61.613 1.00 0.00 C ATOM 1465 O LYS A 94 -240.308 71.107 61.513 1.00 0.00 O ATOM 1466 CB LYS A 94 -238.892 72.467 63.916 1.00 0.00 C ATOM 1467 CG LYS A 94 -238.027 72.595 65.151 1.00 0.00 C ATOM 1468 CD LYS A 94 -238.607 73.649 66.076 1.00 0.00 C ATOM 1469 CE LYS A 94 -237.652 74.018 67.191 1.00 0.00 C ATOM 1470 NZ LYS A 94 -238.152 75.188 67.959 1.00 0.00 N ATOM 0 H LYS A 94 -236.732 72.884 62.709 1.00 0.00 H new ATOM 0 HA LYS A 94 -238.339 70.517 63.160 1.00 0.00 H new ATOM 0 HB2 LYS A 94 -239.041 73.461 63.493 1.00 0.00 H new ATOM 0 HB3 LYS A 94 -239.873 72.098 64.217 1.00 0.00 H new ATOM 0 HG2 LYS A 94 -237.969 71.637 65.667 1.00 0.00 H new ATOM 0 HG3 LYS A 94 -237.010 72.866 64.868 1.00 0.00 H new ATOM 0 HD2 LYS A 94 -238.852 74.541 65.499 1.00 0.00 H new ATOM 0 HD3 LYS A 94 -239.539 73.281 66.505 1.00 0.00 H new ATOM 0 HE2 LYS A 94 -237.524 73.167 67.861 1.00 0.00 H new ATOM 0 HE3 LYS A 94 -236.671 74.245 66.773 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 -237.408 75.525 68.602 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 -238.412 75.950 67.301 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 -238.987 74.909 68.512 1.00 0.00 H new ATOM 1484 N TRP A 95 -238.805 72.587 60.709 1.00 0.00 N ATOM 1485 CA TRP A 95 -239.633 73.058 59.610 1.00 0.00 C ATOM 1486 C TRP A 95 -240.188 71.934 58.757 1.00 0.00 C ATOM 1487 O TRP A 95 -239.534 70.921 58.511 1.00 0.00 O ATOM 1488 CB TRP A 95 -238.862 74.037 58.732 1.00 0.00 C ATOM 1489 CG TRP A 95 -238.623 75.353 59.394 1.00 0.00 C ATOM 1490 CD1 TRP A 95 -238.907 75.695 60.685 1.00 0.00 C ATOM 1491 CD2 TRP A 95 -238.065 76.509 58.783 1.00 0.00 C ATOM 1492 NE1 TRP A 95 -238.551 77.000 60.913 1.00 0.00 N ATOM 1493 CE2 TRP A 95 -238.031 77.523 59.757 1.00 0.00 C ATOM 1494 CE3 TRP A 95 -237.588 76.782 57.502 1.00 0.00 C ATOM 1495 CZ2 TRP A 95 -237.537 78.792 59.486 1.00 0.00 C ATOM 1496 CZ3 TRP A 95 -237.099 78.040 57.234 1.00 0.00 C ATOM 1497 CH2 TRP A 95 -237.077 79.029 58.219 1.00 0.00 C ATOM 0 H TRP A 95 -237.864 72.980 60.717 1.00 0.00 H new ATOM 0 HA TRP A 95 -240.482 73.565 60.069 1.00 0.00 H new ATOM 0 HB2 TRP A 95 -237.904 73.595 58.459 1.00 0.00 H new ATOM 0 HB3 TRP A 95 -239.414 74.198 57.806 1.00 0.00 H new ATOM 0 HD1 TRP A 95 -239.347 75.035 61.418 1.00 0.00 H new ATOM 0 HE1 TRP A 95 -238.656 77.499 61.796 1.00 0.00 H new ATOM 0 HE3 TRP A 95 -237.602 76.022 56.735 1.00 0.00 H new ATOM 0 HZ2 TRP A 95 -237.517 79.561 60.244 1.00 0.00 H new ATOM 0 HZ3 TRP A 95 -236.726 78.266 56.246 1.00 0.00 H new ATOM 0 HH2 TRP A 95 -236.687 80.006 57.975 1.00 0.00 H new ATOM 1508 N LYS A 96 -241.409 72.145 58.312 1.00 0.00 N ATOM 1509 CA LYS A 96 -242.095 71.203 57.438 1.00 0.00 C ATOM 1510 C LYS A 96 -242.544 71.933 56.184 1.00 0.00 C ATOM 1511 O LYS A 96 -243.433 71.494 55.451 1.00 0.00 O ATOM 1512 CB LYS A 96 -243.281 70.569 58.167 1.00 0.00 C ATOM 1513 CG LYS A 96 -242.859 69.598 59.263 1.00 0.00 C ATOM 1514 CD LYS A 96 -244.050 69.081 60.056 1.00 0.00 C ATOM 1515 CE LYS A 96 -244.653 70.166 60.930 1.00 0.00 C ATOM 1516 NZ LYS A 96 -243.699 70.644 61.969 1.00 0.00 N ATOM 0 H LYS A 96 -241.958 72.973 58.543 1.00 0.00 H new ATOM 0 HA LYS A 96 -241.417 70.398 57.155 1.00 0.00 H new ATOM 0 HB2 LYS A 96 -243.894 71.357 58.604 1.00 0.00 H new ATOM 0 HB3 LYS A 96 -243.905 70.043 57.444 1.00 0.00 H new ATOM 0 HG2 LYS A 96 -242.328 68.757 58.817 1.00 0.00 H new ATOM 0 HG3 LYS A 96 -242.162 70.094 59.938 1.00 0.00 H new ATOM 0 HD2 LYS A 96 -244.808 68.702 59.370 1.00 0.00 H new ATOM 0 HD3 LYS A 96 -243.737 68.243 60.679 1.00 0.00 H new ATOM 0 HE2 LYS A 96 -244.959 71.006 60.306 1.00 0.00 H new ATOM 0 HE3 LYS A 96 -245.552 69.784 61.413 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 -244.220 71.156 62.709 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 -243.209 69.830 62.391 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 -243.001 71.280 61.533 1.00 0.00 H new ATOM 1530 N GLY A 97 -241.888 73.054 55.963 1.00 0.00 N ATOM 1531 CA GLY A 97 -242.152 73.910 54.834 1.00 0.00 C ATOM 1532 C GLY A 97 -241.041 74.929 54.734 1.00 0.00 C ATOM 1533 O GLY A 97 -240.382 75.211 55.737 1.00 0.00 O ATOM 0 H GLY A 97 -241.147 73.397 56.574 1.00 0.00 H new ATOM 0 HA2 GLY A 97 -242.210 73.322 53.918 1.00 0.00 H new ATOM 0 HA3 GLY A 97 -243.114 74.409 54.954 1.00 0.00 H new ATOM 1537 N ALA A 98 -240.798 75.467 53.558 1.00 0.00 N ATOM 1538 CA ALA A 98 -239.695 76.402 53.390 1.00 0.00 C ATOM 1539 C ALA A 98 -240.082 77.801 53.851 1.00 0.00 C ATOM 1540 O ALA A 98 -240.810 78.515 53.164 1.00 0.00 O ATOM 1541 CB ALA A 98 -239.222 76.421 51.943 1.00 0.00 C ATOM 0 H ALA A 98 -241.337 75.280 52.713 1.00 0.00 H new ATOM 0 HA ALA A 98 -238.870 76.062 54.016 1.00 0.00 H new ATOM 0 HB1 ALA A 98 -238.397 77.126 51.839 1.00 0.00 H new ATOM 0 HB2 ALA A 98 -238.886 75.424 51.657 1.00 0.00 H new ATOM 0 HB3 ALA A 98 -240.044 76.726 51.295 1.00 0.00 H new ATOM 1547 N GLY A 99 -239.596 78.184 55.025 1.00 0.00 N ATOM 1548 CA GLY A 99 -239.915 79.483 55.566 1.00 0.00 C ATOM 1549 C GLY A 99 -238.717 80.405 55.551 1.00 0.00 C ATOM 1550 O GLY A 99 -237.859 80.311 54.672 1.00 0.00 O ATOM 0 H GLY A 99 -238.986 77.614 55.610 1.00 0.00 H new ATOM 0 HA2 GLY A 99 -240.725 79.929 54.988 1.00 0.00 H new ATOM 0 HA3 GLY A 99 -240.276 79.373 56.588 1.00 0.00 H new ATOM 1554 N LYS A 100 -238.659 81.283 56.539 1.00 0.00 N ATOM 1555 CA LYS A 100 -237.530 82.176 56.745 1.00 0.00 C ATOM 1556 C LYS A 100 -237.524 82.566 58.201 1.00 0.00 C ATOM 1557 O LYS A 100 -238.564 82.531 58.857 1.00 0.00 O ATOM 1558 CB LYS A 100 -237.610 83.480 55.929 1.00 0.00 C ATOM 1559 CG LYS A 100 -238.374 83.404 54.639 1.00 0.00 C ATOM 1560 CD LYS A 100 -239.820 83.777 54.898 1.00 0.00 C ATOM 1561 CE LYS A 100 -240.705 83.342 53.771 1.00 0.00 C ATOM 1562 NZ LYS A 100 -242.144 83.475 54.113 1.00 0.00 N ATOM 0 H LYS A 100 -239.402 81.397 57.228 1.00 0.00 H new ATOM 0 HA LYS A 100 -236.635 81.643 56.425 1.00 0.00 H new ATOM 0 HB2 LYS A 100 -238.066 84.248 56.553 1.00 0.00 H new ATOM 0 HB3 LYS A 100 -236.595 83.810 55.708 1.00 0.00 H new ATOM 0 HG2 LYS A 100 -237.937 84.079 53.903 1.00 0.00 H new ATOM 0 HG3 LYS A 100 -238.313 82.398 54.224 1.00 0.00 H new ATOM 0 HD2 LYS A 100 -240.156 83.315 55.826 1.00 0.00 H new ATOM 0 HD3 LYS A 100 -239.901 84.856 55.031 1.00 0.00 H new ATOM 0 HE2 LYS A 100 -240.486 83.939 52.886 1.00 0.00 H new ATOM 0 HE3 LYS A 100 -240.487 82.305 53.518 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 -242.721 83.261 53.275 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 -242.382 82.810 54.876 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 -242.338 84.447 54.428 1.00 0.00 H new ATOM 1576 N PHE A 101 -236.379 82.929 58.720 1.00 0.00 N ATOM 1577 CA PHE A 101 -236.347 83.544 60.020 1.00 0.00 C ATOM 1578 C PHE A 101 -236.587 85.043 59.863 1.00 0.00 C ATOM 1579 O PHE A 101 -236.327 85.607 58.806 1.00 0.00 O ATOM 1580 CB PHE A 101 -235.024 83.223 60.705 1.00 0.00 C ATOM 1581 CG PHE A 101 -234.851 81.743 60.903 1.00 0.00 C ATOM 1582 CD1 PHE A 101 -235.348 81.116 62.034 1.00 0.00 C ATOM 1583 CD2 PHE A 101 -234.228 80.973 59.938 1.00 0.00 C ATOM 1584 CE1 PHE A 101 -235.224 79.748 62.195 1.00 0.00 C ATOM 1585 CE2 PHE A 101 -234.094 79.610 60.097 1.00 0.00 C ATOM 1586 CZ PHE A 101 -234.593 78.995 61.224 1.00 0.00 C ATOM 0 H PHE A 101 -235.471 82.812 58.271 1.00 0.00 H new ATOM 0 HA PHE A 101 -237.137 83.149 60.659 1.00 0.00 H new ATOM 0 HB2 PHE A 101 -234.200 83.610 60.106 1.00 0.00 H new ATOM 0 HB3 PHE A 101 -234.981 83.728 61.670 1.00 0.00 H new ATOM 0 HD1 PHE A 101 -235.837 81.702 62.798 1.00 0.00 H new ATOM 0 HD2 PHE A 101 -233.841 81.446 59.047 1.00 0.00 H new ATOM 0 HE1 PHE A 101 -235.620 79.269 63.078 1.00 0.00 H new ATOM 0 HE2 PHE A 101 -233.598 79.024 59.338 1.00 0.00 H new ATOM 0 HZ PHE A 101 -234.491 77.927 61.348 1.00 0.00 H new ATOM 1596 N ILE A 102 -237.154 85.678 60.868 1.00 0.00 N ATOM 1597 CA ILE A 102 -237.415 87.112 60.802 1.00 0.00 C ATOM 1598 C ILE A 102 -236.907 87.793 62.063 1.00 0.00 C ATOM 1599 O ILE A 102 -237.256 87.389 63.171 1.00 0.00 O ATOM 1600 CB ILE A 102 -238.928 87.437 60.614 1.00 0.00 C ATOM 1601 CG1 ILE A 102 -239.421 87.058 59.208 1.00 0.00 C ATOM 1602 CG2 ILE A 102 -239.200 88.914 60.875 1.00 0.00 C ATOM 1603 CD1 ILE A 102 -239.754 85.591 59.035 1.00 0.00 C ATOM 0 H ILE A 102 -237.444 85.232 61.738 1.00 0.00 H new ATOM 0 HA ILE A 102 -236.885 87.490 59.928 1.00 0.00 H new ATOM 0 HB ILE A 102 -239.478 86.838 61.340 1.00 0.00 H new ATOM 0 HG12 ILE A 102 -240.307 87.649 58.976 1.00 0.00 H new ATOM 0 HG13 ILE A 102 -238.656 87.332 58.482 1.00 0.00 H new ATOM 0 HG21 ILE A 102 -240.262 89.118 60.738 1.00 0.00 H new ATOM 0 HG22 ILE A 102 -238.912 89.162 61.896 1.00 0.00 H new ATOM 0 HG23 ILE A 102 -238.621 89.519 60.177 1.00 0.00 H new ATOM 0 HD11 ILE A 102 -240.093 85.413 58.015 1.00 0.00 H new ATOM 0 HD12 ILE A 102 -238.866 84.991 59.232 1.00 0.00 H new ATOM 0 HD13 ILE A 102 -240.543 85.312 59.734 1.00 0.00 H new ATOM 1615 N LEU A 103 -236.071 88.809 61.899 1.00 0.00 N ATOM 1616 CA LEU A 103 -235.573 89.552 63.043 1.00 0.00 C ATOM 1617 C LEU A 103 -236.615 90.564 63.494 1.00 0.00 C ATOM 1618 O LEU A 103 -237.194 91.281 62.675 1.00 0.00 O ATOM 1619 CB LEU A 103 -234.265 90.276 62.717 1.00 0.00 C ATOM 1620 CG LEU A 103 -233.561 90.882 63.932 1.00 0.00 C ATOM 1621 CD1 LEU A 103 -233.015 89.783 64.823 1.00 0.00 C ATOM 1622 CD2 LEU A 103 -232.451 91.828 63.513 1.00 0.00 C ATOM 0 H LEU A 103 -235.728 89.133 60.995 1.00 0.00 H new ATOM 0 HA LEU A 103 -235.376 88.839 63.844 1.00 0.00 H new ATOM 0 HB2 LEU A 103 -233.587 89.575 62.231 1.00 0.00 H new ATOM 0 HB3 LEU A 103 -234.472 91.069 61.999 1.00 0.00 H new ATOM 0 HG LEU A 103 -234.295 91.460 64.493 1.00 0.00 H new ATOM 0 HD11 LEU A 103 -232.516 90.227 65.684 1.00 0.00 H new ATOM 0 HD12 LEU A 103 -233.835 89.151 65.164 1.00 0.00 H new ATOM 0 HD13 LEU A 103 -232.301 89.180 64.261 1.00 0.00 H new ATOM 0 HD21 LEU A 103 -231.971 92.241 64.400 1.00 0.00 H new ATOM 0 HD22 LEU A 103 -231.714 91.285 62.921 1.00 0.00 H new ATOM 0 HD23 LEU A 103 -232.870 92.638 62.916 1.00 0.00 H new ATOM 1634 N LYS A 104 -236.854 90.616 64.790 1.00 0.00 N ATOM 1635 CA LYS A 104 -237.817 91.544 65.356 1.00 0.00 C ATOM 1636 C LYS A 104 -237.344 91.976 66.732 1.00 0.00 C ATOM 1637 O LYS A 104 -236.509 91.311 67.327 1.00 0.00 O ATOM 1638 CB LYS A 104 -239.192 90.882 65.450 1.00 0.00 C ATOM 1639 CG LYS A 104 -240.291 91.848 65.848 1.00 0.00 C ATOM 1640 CD LYS A 104 -241.660 91.220 65.735 1.00 0.00 C ATOM 1641 CE LYS A 104 -242.033 90.917 64.292 1.00 0.00 C ATOM 1642 NZ LYS A 104 -241.945 92.126 63.430 1.00 0.00 N ATOM 0 H LYS A 104 -236.391 90.021 65.477 1.00 0.00 H new ATOM 0 HA LYS A 104 -237.901 92.420 64.713 1.00 0.00 H new ATOM 0 HB2 LYS A 104 -239.440 90.435 64.487 1.00 0.00 H new ATOM 0 HB3 LYS A 104 -239.149 90.070 66.176 1.00 0.00 H new ATOM 0 HG2 LYS A 104 -240.128 92.181 66.873 1.00 0.00 H new ATOM 0 HG3 LYS A 104 -240.244 92.733 65.214 1.00 0.00 H new ATOM 0 HD2 LYS A 104 -241.685 90.298 66.317 1.00 0.00 H new ATOM 0 HD3 LYS A 104 -242.403 91.890 66.168 1.00 0.00 H new ATOM 0 HE2 LYS A 104 -241.372 90.144 63.901 1.00 0.00 H new ATOM 0 HE3 LYS A 104 -243.047 90.518 64.255 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 -242.469 91.961 62.547 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 -242.357 92.940 63.930 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 -240.948 92.323 63.210 1.00 0.00 H new ATOM 1656 N LEU A 105 -237.840 93.096 67.230 1.00 0.00 N ATOM 1657 CA LEU A 105 -237.586 93.455 68.613 1.00 0.00 C ATOM 1658 C LEU A 105 -238.586 92.725 69.484 1.00 0.00 C ATOM 1659 O LEU A 105 -239.700 92.445 69.048 1.00 0.00 O ATOM 1660 CB LEU A 105 -237.744 94.950 68.859 1.00 0.00 C ATOM 1661 CG LEU A 105 -236.496 95.689 69.345 1.00 0.00 C ATOM 1662 CD1 LEU A 105 -235.458 95.769 68.249 1.00 0.00 C ATOM 1663 CD2 LEU A 105 -236.862 97.079 69.841 1.00 0.00 C ATOM 0 H LEU A 105 -238.411 93.761 66.708 1.00 0.00 H new ATOM 0 HA LEU A 105 -236.558 93.180 68.849 1.00 0.00 H new ATOM 0 HB2 LEU A 105 -238.080 95.416 67.933 1.00 0.00 H new ATOM 0 HB3 LEU A 105 -238.536 95.095 69.594 1.00 0.00 H new ATOM 0 HG LEU A 105 -236.067 95.128 70.175 1.00 0.00 H new ATOM 0 HD11 LEU A 105 -234.580 96.299 68.618 1.00 0.00 H new ATOM 0 HD12 LEU A 105 -235.173 94.762 67.944 1.00 0.00 H new ATOM 0 HD13 LEU A 105 -235.872 96.304 67.394 1.00 0.00 H new ATOM 0 HD21 LEU A 105 -235.963 97.592 70.183 1.00 0.00 H new ATOM 0 HD22 LEU A 105 -237.317 97.647 69.029 1.00 0.00 H new ATOM 0 HD23 LEU A 105 -237.569 96.996 70.666 1.00 0.00 H new ATOM 1675 N LYS A 106 -238.211 92.424 70.708 1.00 0.00 N ATOM 1676 CA LYS A 106 -239.141 91.786 71.624 1.00 0.00 C ATOM 1677 C LYS A 106 -240.101 92.829 72.173 1.00 0.00 C ATOM 1678 O LYS A 106 -241.229 92.526 72.549 1.00 0.00 O ATOM 1679 CB LYS A 106 -238.385 91.061 72.722 1.00 0.00 C ATOM 1680 CG LYS A 106 -237.408 91.944 73.439 1.00 0.00 C ATOM 1681 CD LYS A 106 -236.427 91.145 74.275 1.00 0.00 C ATOM 1682 CE LYS A 106 -237.119 90.349 75.365 1.00 0.00 C ATOM 1683 NZ LYS A 106 -237.743 91.227 76.388 1.00 0.00 N ATOM 0 H LYS A 106 -237.283 92.606 71.091 1.00 0.00 H new ATOM 0 HA LYS A 106 -239.729 91.035 71.097 1.00 0.00 H new ATOM 0 HB2 LYS A 106 -239.098 90.657 73.441 1.00 0.00 H new ATOM 0 HB3 LYS A 106 -237.852 90.213 72.291 1.00 0.00 H new ATOM 0 HG2 LYS A 106 -236.860 92.544 72.712 1.00 0.00 H new ATOM 0 HG3 LYS A 106 -237.950 92.638 74.081 1.00 0.00 H new ATOM 0 HD2 LYS A 106 -235.871 90.466 73.629 1.00 0.00 H new ATOM 0 HD3 LYS A 106 -235.701 91.822 74.726 1.00 0.00 H new ATOM 0 HE2 LYS A 106 -237.884 89.713 74.919 1.00 0.00 H new ATOM 0 HE3 LYS A 106 -236.397 89.690 75.846 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 -238.085 90.647 77.181 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 -237.039 91.909 76.736 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 -238.542 91.740 75.964 1.00 0.00 H new