USER MOD reduce.3.24.130724 H: found=0, std=0, add=398, rem=0, adj=6 USER MOD reduce.3.24.130724 removed 400 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 171 ASN : amide:sc= -3.32! C(o=-5.3!,f=-8.6!) USER MOD Set 1.2: A 181 MET CE :methyl -117:sc= -2.02! (180deg=-3.45!) USER MOD Single : A 136 TYR OH : rot 180:sc= 0 USER MOD Single : A 154 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 155 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 164 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 168 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 175 SER OG : rot -4:sc= 0.109 USER MOD Single : A 178 LYS NZ :NH3+ -179:sc=-0.00825 (180deg=-0.0123) USER MOD Single : A 186 TYR OH : rot 180:sc= 0 USER MOD Single : A 189 LYS NZ :NH3+ -150:sc= -0.362 (180deg=-1.9!) USER MOD ----------------------------------------------------------------- ATOM 26 N TYR A 136 5.032 4.032 -0.214 1.00 0.00 N ATOM 27 CA TYR A 136 6.236 4.342 0.537 1.00 0.00 C ATOM 28 C TYR A 136 6.658 3.158 1.409 1.00 0.00 C ATOM 29 O TYR A 136 5.826 2.546 2.078 1.00 0.00 O ATOM 30 CB TYR A 136 5.878 5.523 1.441 1.00 0.00 C ATOM 31 CG TYR A 136 6.505 6.850 1.010 1.00 0.00 C ATOM 32 CD1 TYR A 136 6.174 7.406 -0.209 1.00 0.00 C ATOM 33 CD2 TYR A 136 7.401 7.492 1.840 1.00 0.00 C ATOM 34 CE1 TYR A 136 6.764 8.654 -0.615 1.00 0.00 C ATOM 35 CE2 TYR A 136 7.992 8.740 1.434 1.00 0.00 C ATOM 36 CZ TYR A 136 7.644 9.261 0.226 1.00 0.00 C ATOM 37 OH TYR A 136 8.201 10.441 -0.157 1.00 0.00 O ATOM 0 HA TYR A 136 7.061 4.568 -0.138 1.00 0.00 H new ATOM 0 HB2 TYR A 136 4.794 5.635 1.462 1.00 0.00 H new ATOM 0 HB3 TYR A 136 6.195 5.297 2.459 1.00 0.00 H new ATOM 0 HD1 TYR A 136 5.472 6.904 -0.858 1.00 0.00 H new ATOM 0 HD2 TYR A 136 7.659 7.058 2.795 1.00 0.00 H new ATOM 0 HE1 TYR A 136 6.514 9.099 -1.567 1.00 0.00 H new ATOM 0 HE2 TYR A 136 8.696 9.252 2.074 1.00 0.00 H new ATOM 0 HH TYR A 136 8.809 10.758 0.543 1.00 0.00 H new ATOM 47 N VAL A 137 7.952 2.869 1.375 1.00 0.00 N ATOM 48 CA VAL A 137 8.495 1.769 2.152 1.00 0.00 C ATOM 49 C VAL A 137 9.673 2.274 2.988 1.00 0.00 C ATOM 50 O VAL A 137 10.261 3.309 2.676 1.00 0.00 O ATOM 51 CB VAL A 137 8.870 0.609 1.228 1.00 0.00 C ATOM 52 CG1 VAL A 137 7.657 -0.279 0.942 1.00 0.00 C ATOM 53 CG2 VAL A 137 9.492 1.123 -0.071 1.00 0.00 C ATOM 0 H VAL A 137 8.640 3.379 0.820 1.00 0.00 H new ATOM 0 HA VAL A 137 7.746 1.384 2.844 1.00 0.00 H new ATOM 0 HB VAL A 137 9.616 0.001 1.739 1.00 0.00 H new ATOM 0 HG11 VAL A 137 7.951 -1.096 0.283 1.00 0.00 H new ATOM 0 HG12 VAL A 137 7.276 -0.687 1.878 1.00 0.00 H new ATOM 0 HG13 VAL A 137 6.878 0.313 0.461 1.00 0.00 H new ATOM 0 HG21 VAL A 137 9.750 0.278 -0.710 1.00 0.00 H new ATOM 0 HG22 VAL A 137 8.778 1.764 -0.587 1.00 0.00 H new ATOM 0 HG23 VAL A 137 10.393 1.693 0.157 1.00 0.00 H new ATOM 63 N ARG A 138 9.983 1.520 4.032 1.00 0.00 N ATOM 64 CA ARG A 138 11.081 1.878 4.914 1.00 0.00 C ATOM 65 C ARG A 138 12.074 0.719 5.023 1.00 0.00 C ATOM 66 O ARG A 138 11.729 -0.354 5.516 1.00 0.00 O ATOM 67 CB ARG A 138 10.570 2.237 6.310 1.00 0.00 C ATOM 68 CG ARG A 138 11.733 2.545 7.257 1.00 0.00 C ATOM 69 CD ARG A 138 12.381 3.887 6.911 1.00 0.00 C ATOM 70 NE ARG A 138 11.367 4.808 6.349 1.00 0.00 N ATOM 71 CZ ARG A 138 10.819 5.826 7.027 1.00 0.00 C ATOM 72 NH1 ARG A 138 11.184 6.060 8.295 1.00 0.00 N ATOM 73 NH2 ARG A 138 9.907 6.610 6.438 1.00 0.00 N ATOM 0 H ARG A 138 9.493 0.663 4.287 1.00 0.00 H new ATOM 0 HA ARG A 138 11.580 2.748 4.487 1.00 0.00 H new ATOM 0 HB2 ARG A 138 9.908 3.101 6.248 1.00 0.00 H new ATOM 0 HB3 ARG A 138 9.980 1.412 6.709 1.00 0.00 H new ATOM 0 HG2 ARG A 138 11.373 2.565 8.286 1.00 0.00 H new ATOM 0 HG3 ARG A 138 12.477 1.751 7.195 1.00 0.00 H new ATOM 0 HD2 ARG A 138 12.828 4.325 7.803 1.00 0.00 H new ATOM 0 HD3 ARG A 138 13.186 3.737 6.192 1.00 0.00 H new ATOM 0 HE ARG A 138 11.067 4.658 5.386 1.00 0.00 H new ATOM 0 HH11 ARG A 138 11.879 5.463 8.744 1.00 0.00 H new ATOM 0 HH12 ARG A 138 10.767 6.835 8.811 1.00 0.00 H new ATOM 0 HH21 ARG A 138 9.629 6.433 5.473 1.00 0.00 H new ATOM 0 HH22 ARG A 138 9.490 7.385 6.955 1.00 0.00 H new ATOM 87 N ALA A 139 13.287 0.974 4.555 1.00 0.00 N ATOM 88 CA ALA A 139 14.331 -0.035 4.593 1.00 0.00 C ATOM 89 C ALA A 139 15.033 0.015 5.952 1.00 0.00 C ATOM 90 O ALA A 139 15.680 1.008 6.284 1.00 0.00 O ATOM 91 CB ALA A 139 15.299 0.187 3.429 1.00 0.00 C ATOM 0 H ALA A 139 13.570 1.865 4.147 1.00 0.00 H new ATOM 0 HA ALA A 139 13.905 -1.032 4.478 1.00 0.00 H new ATOM 0 HB1 ALA A 139 16.082 -0.570 3.458 1.00 0.00 H new ATOM 0 HB2 ALA A 139 14.757 0.113 2.486 1.00 0.00 H new ATOM 0 HB3 ALA A 139 15.748 1.177 3.513 1.00 0.00 H new ATOM 97 N LEU A 140 14.881 -1.066 6.701 1.00 0.00 N ATOM 98 CA LEU A 140 15.492 -1.158 8.016 1.00 0.00 C ATOM 99 C LEU A 140 16.327 -2.437 8.097 1.00 0.00 C ATOM 100 O LEU A 140 16.495 -3.005 9.175 1.00 0.00 O ATOM 101 CB LEU A 140 14.428 -1.048 9.110 1.00 0.00 C ATOM 102 CG LEU A 140 12.981 -0.924 8.628 1.00 0.00 C ATOM 103 CD1 LEU A 140 12.448 -2.272 8.139 1.00 0.00 C ATOM 104 CD2 LEU A 140 12.092 -0.314 9.714 1.00 0.00 C ATOM 0 H LEU A 140 14.343 -1.887 6.422 1.00 0.00 H new ATOM 0 HA LEU A 140 16.172 -0.322 8.180 1.00 0.00 H new ATOM 0 HB2 LEU A 140 14.502 -1.926 9.751 1.00 0.00 H new ATOM 0 HB3 LEU A 140 14.660 -0.181 9.729 1.00 0.00 H new ATOM 0 HG LEU A 140 12.961 -0.244 7.777 1.00 0.00 H new ATOM 0 HD11 LEU A 140 11.418 -2.155 7.802 1.00 0.00 H new ATOM 0 HD12 LEU A 140 13.062 -2.628 7.312 1.00 0.00 H new ATOM 0 HD13 LEU A 140 12.484 -2.995 8.954 1.00 0.00 H new ATOM 0 HD21 LEU A 140 11.069 -0.237 9.346 1.00 0.00 H new ATOM 0 HD22 LEU A 140 12.112 -0.949 10.600 1.00 0.00 H new ATOM 0 HD23 LEU A 140 12.461 0.679 9.971 1.00 0.00 H new ATOM 116 N PHE A 141 16.830 -2.853 6.944 1.00 0.00 N ATOM 117 CA PHE A 141 17.644 -4.053 6.871 1.00 0.00 C ATOM 118 C PHE A 141 18.825 -3.858 5.918 1.00 0.00 C ATOM 119 O PHE A 141 19.698 -4.720 5.822 1.00 0.00 O ATOM 120 CB PHE A 141 16.748 -5.169 6.331 1.00 0.00 C ATOM 121 CG PHE A 141 16.959 -6.522 7.015 1.00 0.00 C ATOM 122 CD1 PHE A 141 18.043 -7.280 6.702 1.00 0.00 C ATOM 123 CD2 PHE A 141 16.060 -6.966 7.935 1.00 0.00 C ATOM 124 CE1 PHE A 141 18.239 -8.536 7.336 1.00 0.00 C ATOM 125 CE2 PHE A 141 16.257 -8.221 8.569 1.00 0.00 C ATOM 126 CZ PHE A 141 17.341 -8.979 8.256 1.00 0.00 C ATOM 0 H PHE A 141 16.689 -2.379 6.052 1.00 0.00 H new ATOM 0 HA PHE A 141 18.043 -4.292 7.857 1.00 0.00 H new ATOM 0 HB2 PHE A 141 15.706 -4.873 6.448 1.00 0.00 H new ATOM 0 HB3 PHE A 141 16.929 -5.282 5.262 1.00 0.00 H new ATOM 0 HD1 PHE A 141 18.756 -6.927 5.971 1.00 0.00 H new ATOM 0 HD2 PHE A 141 15.198 -6.365 8.183 1.00 0.00 H new ATOM 0 HE1 PHE A 141 19.100 -9.138 7.088 1.00 0.00 H new ATOM 0 HE2 PHE A 141 15.545 -8.574 9.301 1.00 0.00 H new ATOM 0 HZ PHE A 141 17.489 -9.934 8.738 1.00 0.00 H new ATOM 136 N ASP A 142 18.815 -2.721 5.239 1.00 0.00 N ATOM 137 CA ASP A 142 19.875 -2.402 4.297 1.00 0.00 C ATOM 138 C ASP A 142 20.079 -3.583 3.346 1.00 0.00 C ATOM 139 O ASP A 142 19.598 -4.685 3.608 1.00 0.00 O ATOM 140 CB ASP A 142 21.196 -2.144 5.022 1.00 0.00 C ATOM 141 CG ASP A 142 21.059 -1.672 6.471 1.00 0.00 C ATOM 142 OD1 ASP A 142 20.475 -2.441 7.265 1.00 0.00 O ATOM 143 OD2 ASP A 142 21.539 -0.553 6.751 1.00 0.00 O ATOM 0 H ASP A 142 18.090 -2.009 5.322 1.00 0.00 H new ATOM 0 HA ASP A 142 19.583 -1.505 3.751 1.00 0.00 H new ATOM 0 HB2 ASP A 142 21.785 -3.061 5.009 1.00 0.00 H new ATOM 0 HB3 ASP A 142 21.759 -1.396 4.464 1.00 0.00 H new ATOM 148 N PHE A 143 20.792 -3.313 2.263 1.00 0.00 N ATOM 149 CA PHE A 143 21.067 -4.341 1.273 1.00 0.00 C ATOM 150 C PHE A 143 22.284 -3.972 0.423 1.00 0.00 C ATOM 151 O PHE A 143 23.146 -4.813 0.169 1.00 0.00 O ATOM 152 CB PHE A 143 19.836 -4.429 0.367 1.00 0.00 C ATOM 153 CG PHE A 143 20.163 -4.691 -1.104 1.00 0.00 C ATOM 154 CD1 PHE A 143 21.048 -5.669 -1.440 1.00 0.00 C ATOM 155 CD2 PHE A 143 19.570 -3.948 -2.076 1.00 0.00 C ATOM 156 CE1 PHE A 143 21.352 -5.913 -2.805 1.00 0.00 C ATOM 157 CE2 PHE A 143 19.874 -4.191 -3.442 1.00 0.00 C ATOM 158 CZ PHE A 143 20.759 -5.169 -3.777 1.00 0.00 C ATOM 0 H PHE A 143 21.188 -2.398 2.049 1.00 0.00 H new ATOM 0 HA PHE A 143 21.277 -5.289 1.769 1.00 0.00 H new ATOM 0 HB2 PHE A 143 19.186 -5.224 0.731 1.00 0.00 H new ATOM 0 HB3 PHE A 143 19.274 -3.498 0.443 1.00 0.00 H new ATOM 0 HD1 PHE A 143 21.519 -6.259 -0.668 1.00 0.00 H new ATOM 0 HD2 PHE A 143 18.867 -3.172 -1.809 1.00 0.00 H new ATOM 0 HE1 PHE A 143 22.054 -6.689 -3.072 1.00 0.00 H new ATOM 0 HE2 PHE A 143 19.403 -3.600 -4.214 1.00 0.00 H new ATOM 0 HZ PHE A 143 20.991 -5.355 -4.815 1.00 0.00 H new ATOM 245 N ASP A 150 18.525 -4.979 -8.428 1.00 0.00 N ATOM 246 CA ASP A 150 17.649 -4.584 -7.338 1.00 0.00 C ATOM 247 C ASP A 150 17.977 -3.151 -6.917 1.00 0.00 C ATOM 248 O ASP A 150 18.854 -2.515 -7.500 1.00 0.00 O ATOM 249 CB ASP A 150 17.841 -5.490 -6.121 1.00 0.00 C ATOM 250 CG ASP A 150 18.020 -6.976 -6.442 1.00 0.00 C ATOM 251 OD1 ASP A 150 18.697 -7.260 -7.453 1.00 0.00 O ATOM 252 OD2 ASP A 150 17.475 -7.793 -5.668 1.00 0.00 O ATOM 0 HA ASP A 150 16.620 -4.664 -7.688 1.00 0.00 H new ATOM 0 HB2 ASP A 150 18.713 -5.146 -5.565 1.00 0.00 H new ATOM 0 HB3 ASP A 150 16.979 -5.377 -5.463 1.00 0.00 H new ATOM 257 N LEU A 151 17.256 -2.684 -5.908 1.00 0.00 N ATOM 258 CA LEU A 151 17.460 -1.337 -5.402 1.00 0.00 C ATOM 259 C LEU A 151 18.170 -1.407 -4.050 1.00 0.00 C ATOM 260 O LEU A 151 17.625 -1.941 -3.085 1.00 0.00 O ATOM 261 CB LEU A 151 16.134 -0.574 -5.363 1.00 0.00 C ATOM 262 CG LEU A 151 15.979 0.441 -4.228 1.00 0.00 C ATOM 263 CD1 LEU A 151 17.194 1.368 -4.152 1.00 0.00 C ATOM 264 CD2 LEU A 151 14.670 1.221 -4.366 1.00 0.00 C ATOM 0 H LEU A 151 16.530 -3.215 -5.427 1.00 0.00 H new ATOM 0 HA LEU A 151 18.107 -0.771 -6.072 1.00 0.00 H new ATOM 0 HB2 LEU A 151 16.010 -0.051 -6.311 1.00 0.00 H new ATOM 0 HB3 LEU A 151 15.323 -1.298 -5.290 1.00 0.00 H new ATOM 0 HG LEU A 151 15.931 -0.104 -3.285 1.00 0.00 H new ATOM 0 HD11 LEU A 151 17.058 2.079 -3.337 1.00 0.00 H new ATOM 0 HD12 LEU A 151 18.092 0.777 -3.972 1.00 0.00 H new ATOM 0 HD13 LEU A 151 17.298 1.909 -5.093 1.00 0.00 H new ATOM 0 HD21 LEU A 151 14.584 1.935 -3.547 1.00 0.00 H new ATOM 0 HD22 LEU A 151 14.663 1.755 -5.316 1.00 0.00 H new ATOM 0 HD23 LEU A 151 13.829 0.529 -4.333 1.00 0.00 H new ATOM 276 N PRO A 152 19.408 -0.845 -4.021 1.00 0.00 N ATOM 277 CA PRO A 152 20.199 -0.839 -2.802 1.00 0.00 C ATOM 278 C PRO A 152 19.668 0.197 -1.810 1.00 0.00 C ATOM 279 O PRO A 152 19.606 1.386 -2.121 1.00 0.00 O ATOM 280 CB PRO A 152 21.621 -0.552 -3.257 1.00 0.00 C ATOM 281 CG PRO A 152 21.500 0.050 -4.648 1.00 0.00 C ATOM 282 CD PRO A 152 20.086 -0.204 -5.144 1.00 0.00 C ATOM 0 HA PRO A 152 20.151 -1.786 -2.264 1.00 0.00 H new ATOM 0 HB2 PRO A 152 22.118 0.138 -2.575 1.00 0.00 H new ATOM 0 HB3 PRO A 152 22.216 -1.465 -3.277 1.00 0.00 H new ATOM 0 HG2 PRO A 152 21.709 1.119 -4.621 1.00 0.00 H new ATOM 0 HG3 PRO A 152 22.228 -0.400 -5.323 1.00 0.00 H new ATOM 0 HD2 PRO A 152 19.592 0.726 -5.426 1.00 0.00 H new ATOM 0 HD3 PRO A 152 20.085 -0.845 -6.025 1.00 0.00 H new ATOM 290 N PHE A 153 19.299 -0.290 -0.634 1.00 0.00 N ATOM 291 CA PHE A 153 18.776 0.578 0.406 1.00 0.00 C ATOM 292 C PHE A 153 19.655 0.527 1.657 1.00 0.00 C ATOM 293 O PHE A 153 20.697 -0.128 1.662 1.00 0.00 O ATOM 294 CB PHE A 153 17.378 0.064 0.757 1.00 0.00 C ATOM 295 CG PHE A 153 17.304 -1.452 0.951 1.00 0.00 C ATOM 296 CD1 PHE A 153 17.041 -2.262 -0.110 1.00 0.00 C ATOM 297 CD2 PHE A 153 17.501 -1.991 2.185 1.00 0.00 C ATOM 298 CE1 PHE A 153 16.973 -3.668 0.069 1.00 0.00 C ATOM 299 CE2 PHE A 153 17.432 -3.398 2.364 1.00 0.00 C ATOM 300 CZ PHE A 153 17.169 -4.207 1.303 1.00 0.00 C ATOM 0 H PHE A 153 19.352 -1.276 -0.379 1.00 0.00 H new ATOM 0 HA PHE A 153 18.753 1.609 0.053 1.00 0.00 H new ATOM 0 HB2 PHE A 153 17.040 0.554 1.670 1.00 0.00 H new ATOM 0 HB3 PHE A 153 16.686 0.353 -0.034 1.00 0.00 H new ATOM 0 HD1 PHE A 153 16.884 -1.835 -1.089 1.00 0.00 H new ATOM 0 HD2 PHE A 153 17.710 -1.349 3.028 1.00 0.00 H new ATOM 0 HE1 PHE A 153 16.766 -4.310 -0.774 1.00 0.00 H new ATOM 0 HE2 PHE A 153 17.588 -3.826 3.343 1.00 0.00 H new ATOM 0 HZ PHE A 153 17.116 -5.277 1.440 1.00 0.00 H new ATOM 310 N LYS A 154 19.203 1.225 2.688 1.00 0.00 N ATOM 311 CA LYS A 154 19.935 1.268 3.943 1.00 0.00 C ATOM 312 C LYS A 154 18.946 1.213 5.108 1.00 0.00 C ATOM 313 O LYS A 154 17.751 1.436 4.923 1.00 0.00 O ATOM 314 CB LYS A 154 20.863 2.484 3.980 1.00 0.00 C ATOM 315 CG LYS A 154 22.021 2.261 4.954 1.00 0.00 C ATOM 316 CD LYS A 154 21.952 3.245 6.124 1.00 0.00 C ATOM 317 CE LYS A 154 22.842 2.786 7.281 1.00 0.00 C ATOM 318 NZ LYS A 154 22.886 3.817 8.341 1.00 0.00 N ATOM 0 H LYS A 154 18.338 1.766 2.680 1.00 0.00 H new ATOM 0 HA LYS A 154 20.584 0.397 4.035 1.00 0.00 H new ATOM 0 HB2 LYS A 154 21.255 2.677 2.981 1.00 0.00 H new ATOM 0 HB3 LYS A 154 20.298 3.368 4.277 1.00 0.00 H new ATOM 0 HG2 LYS A 154 21.991 1.239 5.332 1.00 0.00 H new ATOM 0 HG3 LYS A 154 22.969 2.380 4.430 1.00 0.00 H new ATOM 0 HD2 LYS A 154 22.265 4.234 5.790 1.00 0.00 H new ATOM 0 HD3 LYS A 154 20.921 3.335 6.467 1.00 0.00 H new ATOM 0 HE2 LYS A 154 22.462 1.850 7.691 1.00 0.00 H new ATOM 0 HE3 LYS A 154 23.850 2.588 6.916 1.00 0.00 H new ATOM 0 HZ1 LYS A 154 23.494 3.490 9.119 1.00 0.00 H new ATOM 0 HZ2 LYS A 154 23.270 4.701 7.950 1.00 0.00 H new ATOM 0 HZ3 LYS A 154 21.925 3.986 8.701 1.00 0.00 H new ATOM 332 N LYS A 155 19.480 0.914 6.283 1.00 0.00 N ATOM 333 CA LYS A 155 18.659 0.827 7.479 1.00 0.00 C ATOM 334 C LYS A 155 18.094 2.211 7.806 1.00 0.00 C ATOM 335 O LYS A 155 18.715 2.983 8.534 1.00 0.00 O ATOM 336 CB LYS A 155 19.450 0.198 8.627 1.00 0.00 C ATOM 337 CG LYS A 155 18.517 -0.264 9.747 1.00 0.00 C ATOM 338 CD LYS A 155 18.654 0.632 10.980 1.00 0.00 C ATOM 339 CE LYS A 155 17.788 1.887 10.843 1.00 0.00 C ATOM 340 NZ LYS A 155 16.971 2.088 12.061 1.00 0.00 N ATOM 0 H LYS A 155 20.472 0.729 6.433 1.00 0.00 H new ATOM 0 HA LYS A 155 17.808 0.167 7.310 1.00 0.00 H new ATOM 0 HB2 LYS A 155 20.025 -0.650 8.255 1.00 0.00 H new ATOM 0 HB3 LYS A 155 20.165 0.921 9.020 1.00 0.00 H new ATOM 0 HG2 LYS A 155 17.485 -0.249 9.395 1.00 0.00 H new ATOM 0 HG3 LYS A 155 18.747 -1.295 10.015 1.00 0.00 H new ATOM 0 HD2 LYS A 155 18.360 0.078 11.871 1.00 0.00 H new ATOM 0 HD3 LYS A 155 19.697 0.918 11.112 1.00 0.00 H new ATOM 0 HE2 LYS A 155 18.422 2.757 10.676 1.00 0.00 H new ATOM 0 HE3 LYS A 155 17.138 1.794 9.973 1.00 0.00 H new ATOM 0 HZ1 LYS A 155 16.390 2.943 11.952 1.00 0.00 H new ATOM 0 HZ2 LYS A 155 16.352 1.264 12.204 1.00 0.00 H new ATOM 0 HZ3 LYS A 155 17.597 2.198 12.884 1.00 0.00 H new ATOM 354 N GLY A 156 16.921 2.482 7.252 1.00 0.00 N ATOM 355 CA GLY A 156 16.265 3.759 7.476 1.00 0.00 C ATOM 356 C GLY A 156 16.074 4.514 6.160 1.00 0.00 C ATOM 357 O GLY A 156 15.883 5.730 6.160 1.00 0.00 O ATOM 0 H GLY A 156 16.408 1.839 6.649 1.00 0.00 H new ATOM 0 HA2 GLY A 156 15.297 3.597 7.950 1.00 0.00 H new ATOM 0 HA3 GLY A 156 16.859 4.362 8.163 1.00 0.00 H new ATOM 361 N ASP A 157 16.131 3.764 5.070 1.00 0.00 N ATOM 362 CA ASP A 157 15.966 4.349 3.749 1.00 0.00 C ATOM 363 C ASP A 157 14.475 4.459 3.428 1.00 0.00 C ATOM 364 O ASP A 157 13.683 3.610 3.836 1.00 0.00 O ATOM 365 CB ASP A 157 16.617 3.476 2.675 1.00 0.00 C ATOM 366 CG ASP A 157 16.376 3.934 1.235 1.00 0.00 C ATOM 367 OD1 ASP A 157 16.079 5.136 1.065 1.00 0.00 O ATOM 368 OD2 ASP A 157 16.496 3.072 0.338 1.00 0.00 O ATOM 0 H ASP A 157 16.289 2.756 5.074 1.00 0.00 H new ATOM 0 HA ASP A 157 16.441 5.330 3.753 1.00 0.00 H new ATOM 0 HB2 ASP A 157 17.692 3.445 2.855 1.00 0.00 H new ATOM 0 HB3 ASP A 157 16.246 2.457 2.783 1.00 0.00 H new ATOM 373 N ILE A 158 14.135 5.512 2.699 1.00 0.00 N ATOM 374 CA ILE A 158 12.752 5.745 2.318 1.00 0.00 C ATOM 375 C ILE A 158 12.606 5.559 0.807 1.00 0.00 C ATOM 376 O ILE A 158 13.310 6.199 0.027 1.00 0.00 O ATOM 377 CB ILE A 158 12.282 7.113 2.818 1.00 0.00 C ATOM 378 CG1 ILE A 158 12.068 7.099 4.333 1.00 0.00 C ATOM 379 CG2 ILE A 158 11.030 7.570 2.066 1.00 0.00 C ATOM 380 CD1 ILE A 158 13.370 6.773 5.067 1.00 0.00 C ATOM 0 H ILE A 158 14.794 6.214 2.362 1.00 0.00 H new ATOM 0 HA ILE A 158 12.097 5.015 2.794 1.00 0.00 H new ATOM 0 HB ILE A 158 13.066 7.841 2.611 1.00 0.00 H new ATOM 0 HG12 ILE A 158 11.695 8.069 4.660 1.00 0.00 H new ATOM 0 HG13 ILE A 158 11.307 6.362 4.590 1.00 0.00 H new ATOM 0 HG21 ILE A 158 10.716 8.545 2.440 1.00 0.00 H new ATOM 0 HG22 ILE A 158 11.252 7.644 1.001 1.00 0.00 H new ATOM 0 HG23 ILE A 158 10.229 6.847 2.220 1.00 0.00 H new ATOM 0 HD11 ILE A 158 13.190 6.769 6.142 1.00 0.00 H new ATOM 0 HD12 ILE A 158 13.727 5.792 4.755 1.00 0.00 H new ATOM 0 HD13 ILE A 158 14.121 7.526 4.827 1.00 0.00 H new ATOM 392 N LEU A 159 11.687 4.678 0.438 1.00 0.00 N ATOM 393 CA LEU A 159 11.439 4.400 -0.967 1.00 0.00 C ATOM 394 C LEU A 159 9.934 4.457 -1.236 1.00 0.00 C ATOM 395 O LEU A 159 9.153 4.797 -0.347 1.00 0.00 O ATOM 396 CB LEU A 159 12.086 3.074 -1.373 1.00 0.00 C ATOM 397 CG LEU A 159 13.279 2.623 -0.526 1.00 0.00 C ATOM 398 CD1 LEU A 159 12.852 1.590 0.518 1.00 0.00 C ATOM 399 CD2 LEU A 159 14.416 2.108 -1.411 1.00 0.00 C ATOM 0 H LEU A 159 11.106 4.148 1.087 1.00 0.00 H new ATOM 0 HA LEU A 159 11.904 5.161 -1.594 1.00 0.00 H new ATOM 0 HB2 LEU A 159 11.325 2.295 -1.337 1.00 0.00 H new ATOM 0 HB3 LEU A 159 12.411 3.154 -2.410 1.00 0.00 H new ATOM 0 HG LEU A 159 13.660 3.489 0.016 1.00 0.00 H new ATOM 0 HD11 LEU A 159 13.719 1.287 1.106 1.00 0.00 H new ATOM 0 HD12 LEU A 159 12.102 2.027 1.177 1.00 0.00 H new ATOM 0 HD13 LEU A 159 12.431 0.719 0.017 1.00 0.00 H new ATOM 0 HD21 LEU A 159 15.251 1.794 -0.785 1.00 0.00 H new ATOM 0 HD22 LEU A 159 14.064 1.260 -1.999 1.00 0.00 H new ATOM 0 HD23 LEU A 159 14.744 2.903 -2.081 1.00 0.00 H new ATOM 411 N ARG A 160 9.572 4.117 -2.463 1.00 0.00 N ATOM 412 CA ARG A 160 8.174 4.126 -2.861 1.00 0.00 C ATOM 413 C ARG A 160 7.849 2.879 -3.687 1.00 0.00 C ATOM 414 O ARG A 160 8.701 2.373 -4.416 1.00 0.00 O ATOM 415 CB ARG A 160 7.841 5.374 -3.682 1.00 0.00 C ATOM 416 CG ARG A 160 6.733 5.084 -4.696 1.00 0.00 C ATOM 417 CD ARG A 160 6.116 6.382 -5.220 1.00 0.00 C ATOM 418 NE ARG A 160 6.166 6.405 -6.699 1.00 0.00 N ATOM 419 CZ ARG A 160 5.536 7.312 -7.458 1.00 0.00 C ATOM 420 NH1 ARG A 160 4.804 8.276 -6.881 1.00 0.00 N ATOM 421 NH2 ARG A 160 5.637 7.256 -8.793 1.00 0.00 N ATOM 0 H ARG A 160 10.222 3.833 -3.196 1.00 0.00 H new ATOM 0 HA ARG A 160 7.572 4.132 -1.953 1.00 0.00 H new ATOM 0 HB2 ARG A 160 7.528 6.179 -3.016 1.00 0.00 H new ATOM 0 HB3 ARG A 160 8.734 5.720 -4.203 1.00 0.00 H new ATOM 0 HG2 ARG A 160 7.138 4.508 -5.528 1.00 0.00 H new ATOM 0 HG3 ARG A 160 5.960 4.472 -4.231 1.00 0.00 H new ATOM 0 HD2 ARG A 160 5.083 6.466 -4.881 1.00 0.00 H new ATOM 0 HD3 ARG A 160 6.655 7.239 -4.816 1.00 0.00 H new ATOM 0 HE ARG A 160 6.714 5.685 -7.170 1.00 0.00 H new ATOM 0 HH11 ARG A 160 4.727 8.319 -5.865 1.00 0.00 H new ATOM 0 HH12 ARG A 160 4.324 8.967 -7.458 1.00 0.00 H new ATOM 0 HH21 ARG A 160 6.194 6.523 -9.232 1.00 0.00 H new ATOM 0 HH22 ARG A 160 5.157 7.947 -9.370 1.00 0.00 H new ATOM 435 N ILE A 161 6.614 2.420 -3.545 1.00 0.00 N ATOM 436 CA ILE A 161 6.167 1.241 -4.269 1.00 0.00 C ATOM 437 C ILE A 161 5.659 1.660 -5.650 1.00 0.00 C ATOM 438 O ILE A 161 4.704 2.428 -5.759 1.00 0.00 O ATOM 439 CB ILE A 161 5.137 0.465 -3.445 1.00 0.00 C ATOM 440 CG1 ILE A 161 5.729 -0.847 -2.925 1.00 0.00 C ATOM 441 CG2 ILE A 161 3.853 0.239 -4.244 1.00 0.00 C ATOM 442 CD1 ILE A 161 7.130 -0.628 -2.351 1.00 0.00 C ATOM 0 H ILE A 161 5.910 2.842 -2.940 1.00 0.00 H new ATOM 0 HA ILE A 161 6.998 0.553 -4.428 1.00 0.00 H new ATOM 0 HB ILE A 161 4.871 1.066 -2.575 1.00 0.00 H new ATOM 0 HG12 ILE A 161 5.078 -1.264 -2.156 1.00 0.00 H new ATOM 0 HG13 ILE A 161 5.774 -1.576 -3.734 1.00 0.00 H new ATOM 0 HG21 ILE A 161 3.138 -0.315 -3.635 1.00 0.00 H new ATOM 0 HG22 ILE A 161 3.424 1.201 -4.523 1.00 0.00 H new ATOM 0 HG23 ILE A 161 4.081 -0.331 -5.145 1.00 0.00 H new ATOM 0 HD11 ILE A 161 7.527 -1.576 -1.989 1.00 0.00 H new ATOM 0 HD12 ILE A 161 7.784 -0.234 -3.129 1.00 0.00 H new ATOM 0 HD13 ILE A 161 7.078 0.083 -1.526 1.00 0.00 H new ATOM 454 N ARG A 162 6.321 1.136 -6.671 1.00 0.00 N ATOM 455 CA ARG A 162 5.948 1.446 -8.042 1.00 0.00 C ATOM 456 C ARG A 162 5.185 0.274 -8.663 1.00 0.00 C ATOM 457 O ARG A 162 4.137 0.467 -9.276 1.00 0.00 O ATOM 458 CB ARG A 162 7.184 1.748 -8.893 1.00 0.00 C ATOM 459 CG ARG A 162 6.808 1.906 -10.368 1.00 0.00 C ATOM 460 CD ARG A 162 7.641 0.972 -11.248 1.00 0.00 C ATOM 461 NE ARG A 162 7.552 1.397 -12.664 1.00 0.00 N ATOM 462 CZ ARG A 162 7.783 0.589 -13.707 1.00 0.00 C ATOM 463 NH1 ARG A 162 8.119 -0.691 -13.501 1.00 0.00 N ATOM 464 NH2 ARG A 162 7.679 1.062 -14.956 1.00 0.00 N ATOM 0 H ARG A 162 7.113 0.500 -6.577 1.00 0.00 H new ATOM 0 HA ARG A 162 5.309 2.329 -8.020 1.00 0.00 H new ATOM 0 HB2 ARG A 162 7.662 2.660 -8.536 1.00 0.00 H new ATOM 0 HB3 ARG A 162 7.911 0.943 -8.783 1.00 0.00 H new ATOM 0 HG2 ARG A 162 5.748 1.689 -10.502 1.00 0.00 H new ATOM 0 HG3 ARG A 162 6.964 2.939 -10.678 1.00 0.00 H new ATOM 0 HD2 ARG A 162 8.681 0.982 -10.921 1.00 0.00 H new ATOM 0 HD3 ARG A 162 7.285 -0.053 -11.144 1.00 0.00 H new ATOM 0 HE ARG A 162 7.299 2.366 -12.857 1.00 0.00 H new ATOM 0 HH11 ARG A 162 8.199 -1.051 -12.550 1.00 0.00 H new ATOM 0 HH12 ARG A 162 8.295 -1.306 -14.295 1.00 0.00 H new ATOM 0 HH21 ARG A 162 7.424 2.037 -15.112 1.00 0.00 H new ATOM 0 HH22 ARG A 162 7.855 0.447 -15.751 1.00 0.00 H new ATOM 478 N ASP A 163 5.740 -0.915 -8.480 1.00 0.00 N ATOM 479 CA ASP A 163 5.125 -2.118 -9.014 1.00 0.00 C ATOM 480 C ASP A 163 5.440 -3.299 -8.093 1.00 0.00 C ATOM 481 O ASP A 163 6.405 -3.256 -7.332 1.00 0.00 O ATOM 482 CB ASP A 163 5.669 -2.445 -10.406 1.00 0.00 C ATOM 483 CG ASP A 163 5.120 -1.572 -11.536 1.00 0.00 C ATOM 484 OD1 ASP A 163 3.904 -1.286 -11.493 1.00 0.00 O ATOM 485 OD2 ASP A 163 5.928 -1.211 -12.418 1.00 0.00 O ATOM 0 H ASP A 163 6.609 -1.071 -7.969 1.00 0.00 H new ATOM 0 HA ASP A 163 4.051 -1.946 -9.079 1.00 0.00 H new ATOM 0 HB2 ASP A 163 6.755 -2.349 -10.387 1.00 0.00 H new ATOM 0 HB3 ASP A 163 5.445 -3.488 -10.631 1.00 0.00 H new ATOM 490 N LYS A 164 4.609 -4.325 -8.194 1.00 0.00 N ATOM 491 CA LYS A 164 4.788 -5.516 -7.381 1.00 0.00 C ATOM 492 C LYS A 164 4.800 -6.750 -8.286 1.00 0.00 C ATOM 493 O LYS A 164 3.768 -7.389 -8.483 1.00 0.00 O ATOM 494 CB LYS A 164 3.730 -5.574 -6.277 1.00 0.00 C ATOM 495 CG LYS A 164 3.873 -4.390 -5.318 1.00 0.00 C ATOM 496 CD LYS A 164 2.674 -4.304 -4.371 1.00 0.00 C ATOM 497 CE LYS A 164 1.432 -3.793 -5.104 1.00 0.00 C ATOM 498 NZ LYS A 164 0.779 -2.716 -4.327 1.00 0.00 N ATOM 0 H LYS A 164 3.809 -4.357 -8.827 1.00 0.00 H new ATOM 0 HA LYS A 164 5.750 -5.487 -6.869 1.00 0.00 H new ATOM 0 HB2 LYS A 164 2.735 -5.568 -6.721 1.00 0.00 H new ATOM 0 HB3 LYS A 164 3.827 -6.508 -5.724 1.00 0.00 H new ATOM 0 HG2 LYS A 164 4.791 -4.495 -4.740 1.00 0.00 H new ATOM 0 HG3 LYS A 164 3.959 -3.464 -5.887 1.00 0.00 H new ATOM 0 HD2 LYS A 164 2.471 -5.287 -3.945 1.00 0.00 H new ATOM 0 HD3 LYS A 164 2.909 -3.639 -3.540 1.00 0.00 H new ATOM 0 HE2 LYS A 164 1.711 -3.421 -6.090 1.00 0.00 H new ATOM 0 HE3 LYS A 164 0.731 -4.613 -5.260 1.00 0.00 H new ATOM 0 HZ1 LYS A 164 -0.062 -2.380 -4.838 1.00 0.00 H new ATOM 0 HZ2 LYS A 164 0.495 -3.083 -3.396 1.00 0.00 H new ATOM 0 HZ3 LYS A 164 1.445 -1.927 -4.200 1.00 0.00 H new ATOM 512 N PRO A 165 6.010 -7.055 -8.826 1.00 0.00 N ATOM 513 CA PRO A 165 6.170 -8.200 -9.705 1.00 0.00 C ATOM 514 C PRO A 165 6.157 -9.507 -8.910 1.00 0.00 C ATOM 515 O PRO A 165 5.506 -10.473 -9.306 1.00 0.00 O ATOM 516 CB PRO A 165 7.484 -7.959 -10.430 1.00 0.00 C ATOM 517 CG PRO A 165 8.236 -6.931 -9.600 1.00 0.00 C ATOM 518 CD PRO A 165 7.254 -6.319 -8.615 1.00 0.00 C ATOM 0 HA PRO A 165 5.351 -8.302 -10.417 1.00 0.00 H new ATOM 0 HB2 PRO A 165 8.056 -8.883 -10.519 1.00 0.00 H new ATOM 0 HB3 PRO A 165 7.310 -7.593 -11.442 1.00 0.00 H new ATOM 0 HG2 PRO A 165 9.065 -7.400 -9.071 1.00 0.00 H new ATOM 0 HG3 PRO A 165 8.663 -6.161 -10.242 1.00 0.00 H new ATOM 0 HD2 PRO A 165 7.606 -6.423 -7.589 1.00 0.00 H new ATOM 0 HD3 PRO A 165 7.120 -5.253 -8.800 1.00 0.00 H new ATOM 526 N GLU A 166 6.885 -9.496 -7.803 1.00 0.00 N ATOM 527 CA GLU A 166 6.965 -10.669 -6.949 1.00 0.00 C ATOM 528 C GLU A 166 6.208 -10.427 -5.642 1.00 0.00 C ATOM 529 O GLU A 166 5.419 -9.488 -5.542 1.00 0.00 O ATOM 530 CB GLU A 166 8.421 -11.050 -6.676 1.00 0.00 C ATOM 531 CG GLU A 166 9.236 -11.069 -7.971 1.00 0.00 C ATOM 532 CD GLU A 166 9.194 -12.452 -8.624 1.00 0.00 C ATOM 533 OE1 GLU A 166 8.104 -13.064 -8.590 1.00 0.00 O ATOM 534 OE2 GLU A 166 10.252 -12.867 -9.143 1.00 0.00 O ATOM 0 H GLU A 166 7.425 -8.694 -7.478 1.00 0.00 H new ATOM 0 HA GLU A 166 6.496 -11.505 -7.468 1.00 0.00 H new ATOM 0 HB2 GLU A 166 8.861 -10.340 -5.976 1.00 0.00 H new ATOM 0 HB3 GLU A 166 8.461 -12.031 -6.203 1.00 0.00 H new ATOM 0 HG2 GLU A 166 8.844 -10.324 -8.663 1.00 0.00 H new ATOM 0 HG3 GLU A 166 10.269 -10.794 -7.759 1.00 0.00 H new ATOM 541 N GLU A 167 6.474 -11.290 -4.672 1.00 0.00 N ATOM 542 CA GLU A 167 5.827 -11.181 -3.375 1.00 0.00 C ATOM 543 C GLU A 167 6.811 -10.640 -2.335 1.00 0.00 C ATOM 544 O GLU A 167 6.537 -9.635 -1.681 1.00 0.00 O ATOM 545 CB GLU A 167 5.251 -12.529 -2.936 1.00 0.00 C ATOM 546 CG GLU A 167 4.129 -12.337 -1.913 1.00 0.00 C ATOM 547 CD GLU A 167 3.469 -13.673 -1.567 1.00 0.00 C ATOM 548 OE1 GLU A 167 3.377 -14.516 -2.486 1.00 0.00 O ATOM 549 OE2 GLU A 167 3.071 -13.823 -0.391 1.00 0.00 O ATOM 0 H GLU A 167 7.129 -12.068 -4.758 1.00 0.00 H new ATOM 0 HA GLU A 167 4.998 -10.479 -3.461 1.00 0.00 H new ATOM 0 HB2 GLU A 167 4.869 -13.066 -3.804 1.00 0.00 H new ATOM 0 HB3 GLU A 167 6.041 -13.143 -2.504 1.00 0.00 H new ATOM 0 HG2 GLU A 167 4.531 -11.881 -1.008 1.00 0.00 H new ATOM 0 HG3 GLU A 167 3.382 -11.651 -2.312 1.00 0.00 H new ATOM 556 N GLN A 168 7.935 -11.331 -2.215 1.00 0.00 N ATOM 557 CA GLN A 168 8.960 -10.932 -1.267 1.00 0.00 C ATOM 558 C GLN A 168 9.764 -9.753 -1.817 1.00 0.00 C ATOM 559 O GLN A 168 10.319 -8.965 -1.053 1.00 0.00 O ATOM 560 CB GLN A 168 9.878 -12.109 -0.924 1.00 0.00 C ATOM 561 CG GLN A 168 10.656 -12.572 -2.156 1.00 0.00 C ATOM 562 CD GLN A 168 11.453 -13.844 -1.855 1.00 0.00 C ATOM 563 OE1 GLN A 168 11.189 -14.912 -2.382 1.00 0.00 O ATOM 564 NE2 GLN A 168 12.439 -13.670 -0.980 1.00 0.00 N ATOM 0 H GLN A 168 8.158 -12.165 -2.759 1.00 0.00 H new ATOM 0 HA GLN A 168 8.471 -10.614 -0.346 1.00 0.00 H new ATOM 0 HB2 GLN A 168 10.574 -11.815 -0.139 1.00 0.00 H new ATOM 0 HB3 GLN A 168 9.285 -12.935 -0.532 1.00 0.00 H new ATOM 0 HG2 GLN A 168 9.965 -12.757 -2.978 1.00 0.00 H new ATOM 0 HG3 GLN A 168 11.333 -11.782 -2.481 1.00 0.00 H new ATOM 0 HE21 GLN A 168 12.606 -12.748 -0.576 1.00 0.00 H new ATOM 0 HE22 GLN A 168 13.029 -14.458 -0.713 1.00 0.00 H new ATOM 573 N TRP A 169 9.799 -9.667 -3.139 1.00 0.00 N ATOM 574 CA TRP A 169 10.525 -8.596 -3.801 1.00 0.00 C ATOM 575 C TRP A 169 9.502 -7.615 -4.373 1.00 0.00 C ATOM 576 O TRP A 169 8.531 -8.024 -5.007 1.00 0.00 O ATOM 577 CB TRP A 169 11.477 -9.154 -4.862 1.00 0.00 C ATOM 578 CG TRP A 169 12.798 -9.683 -4.298 1.00 0.00 C ATOM 579 CD1 TRP A 169 13.124 -10.950 -4.013 1.00 0.00 C ATOM 580 CD2 TRP A 169 13.962 -8.901 -3.958 1.00 0.00 C ATOM 581 NE1 TRP A 169 14.408 -11.043 -3.518 1.00 0.00 N ATOM 582 CE2 TRP A 169 14.935 -9.756 -3.484 1.00 0.00 C ATOM 583 CE3 TRP A 169 14.186 -7.516 -4.050 1.00 0.00 C ATOM 584 CZ2 TRP A 169 16.197 -9.324 -3.063 1.00 0.00 C ATOM 585 CZ3 TRP A 169 15.453 -7.099 -3.626 1.00 0.00 C ATOM 586 CH2 TRP A 169 16.444 -7.948 -3.145 1.00 0.00 C ATOM 0 H TRP A 169 9.336 -10.322 -3.770 1.00 0.00 H new ATOM 0 HA TRP A 169 11.159 -8.063 -3.092 1.00 0.00 H new ATOM 0 HB2 TRP A 169 10.975 -9.959 -5.398 1.00 0.00 H new ATOM 0 HB3 TRP A 169 11.692 -8.372 -5.590 1.00 0.00 H new ATOM 0 HD1 TRP A 169 12.464 -11.793 -4.153 1.00 0.00 H new ATOM 0 HE1 TRP A 169 14.884 -11.898 -3.230 1.00 0.00 H new ATOM 0 HE3 TRP A 169 13.439 -6.828 -4.419 1.00 0.00 H new ATOM 0 HZ2 TRP A 169 16.941 -10.015 -2.694 1.00 0.00 H new ATOM 0 HZ3 TRP A 169 15.677 -6.044 -3.676 1.00 0.00 H new ATOM 0 HH2 TRP A 169 17.399 -7.548 -2.836 1.00 0.00 H new ATOM 597 N TRP A 170 9.753 -6.337 -4.127 1.00 0.00 N ATOM 598 CA TRP A 170 8.866 -5.293 -4.610 1.00 0.00 C ATOM 599 C TRP A 170 9.703 -4.294 -5.412 1.00 0.00 C ATOM 600 O TRP A 170 10.838 -3.993 -5.044 1.00 0.00 O ATOM 601 CB TRP A 170 8.104 -4.642 -3.453 1.00 0.00 C ATOM 602 CG TRP A 170 6.781 -5.330 -3.114 1.00 0.00 C ATOM 603 CD1 TRP A 170 6.208 -6.370 -3.737 1.00 0.00 C ATOM 604 CD2 TRP A 170 5.882 -4.984 -2.039 1.00 0.00 C ATOM 605 NE1 TRP A 170 5.011 -6.717 -3.143 1.00 0.00 N ATOM 606 CE2 TRP A 170 4.807 -5.847 -2.079 1.00 0.00 C ATOM 607 CE3 TRP A 170 5.975 -3.974 -1.065 1.00 0.00 C ATOM 608 CZ2 TRP A 170 3.742 -5.789 -1.171 1.00 0.00 C ATOM 609 CZ3 TRP A 170 4.903 -3.928 -0.166 1.00 0.00 C ATOM 610 CH2 TRP A 170 3.814 -4.790 -0.192 1.00 0.00 C ATOM 0 H TRP A 170 10.559 -6.001 -3.599 1.00 0.00 H new ATOM 0 HA TRP A 170 8.101 -5.710 -5.265 1.00 0.00 H new ATOM 0 HB2 TRP A 170 8.739 -4.642 -2.567 1.00 0.00 H new ATOM 0 HB3 TRP A 170 7.906 -3.600 -3.703 1.00 0.00 H new ATOM 0 HD1 TRP A 170 6.630 -6.873 -4.595 1.00 0.00 H new ATOM 0 HE1 TRP A 170 4.390 -7.473 -3.432 1.00 0.00 H new ATOM 0 HE3 TRP A 170 6.808 -3.288 -1.015 1.00 0.00 H new ATOM 0 HZ2 TRP A 170 2.911 -6.477 -1.223 1.00 0.00 H new ATOM 0 HZ3 TRP A 170 4.924 -3.169 0.602 1.00 0.00 H new ATOM 0 HH2 TRP A 170 3.026 -4.690 0.540 1.00 0.00 H new ATOM 621 N ASN A 171 9.110 -3.807 -6.492 1.00 0.00 N ATOM 622 CA ASN A 171 9.787 -2.848 -7.349 1.00 0.00 C ATOM 623 C ASN A 171 9.444 -1.430 -6.891 1.00 0.00 C ATOM 624 O ASN A 171 8.495 -0.826 -7.388 1.00 0.00 O ATOM 625 CB ASN A 171 9.338 -2.997 -8.805 1.00 0.00 C ATOM 626 CG ASN A 171 9.852 -1.836 -9.658 1.00 0.00 C ATOM 627 OD1 ASN A 171 9.360 -0.722 -9.599 1.00 0.00 O ATOM 628 ND2 ASN A 171 10.868 -2.159 -10.454 1.00 0.00 N ATOM 0 H ASN A 171 8.168 -4.058 -6.793 1.00 0.00 H new ATOM 0 HA ASN A 171 10.859 -3.034 -7.282 1.00 0.00 H new ATOM 0 HB2 ASN A 171 9.706 -3.940 -9.208 1.00 0.00 H new ATOM 0 HB3 ASN A 171 8.250 -3.034 -8.852 1.00 0.00 H new ATOM 0 HD21 ASN A 171 11.282 -1.454 -11.064 1.00 0.00 H new ATOM 0 HD22 ASN A 171 11.233 -3.112 -10.454 1.00 0.00 H new ATOM 635 N ALA A 172 10.235 -0.939 -5.948 1.00 0.00 N ATOM 636 CA ALA A 172 10.026 0.397 -5.416 1.00 0.00 C ATOM 637 C ALA A 172 11.077 1.342 -6.001 1.00 0.00 C ATOM 638 O ALA A 172 12.082 0.896 -6.552 1.00 0.00 O ATOM 639 CB ALA A 172 10.068 0.352 -3.888 1.00 0.00 C ATOM 0 H ALA A 172 11.022 -1.443 -5.539 1.00 0.00 H new ATOM 0 HA ALA A 172 9.045 0.775 -5.703 1.00 0.00 H new ATOM 0 HB1 ALA A 172 9.911 1.355 -3.490 1.00 0.00 H new ATOM 0 HB2 ALA A 172 9.284 -0.311 -3.522 1.00 0.00 H new ATOM 0 HB3 ALA A 172 11.039 -0.020 -3.562 1.00 0.00 H new ATOM 645 N GLU A 173 10.810 2.633 -5.861 1.00 0.00 N ATOM 646 CA GLU A 173 11.720 3.646 -6.367 1.00 0.00 C ATOM 647 C GLU A 173 12.477 4.305 -5.212 1.00 0.00 C ATOM 648 O GLU A 173 11.892 4.602 -4.172 1.00 0.00 O ATOM 649 CB GLU A 173 10.971 4.690 -7.198 1.00 0.00 C ATOM 650 CG GLU A 173 11.211 4.476 -8.694 1.00 0.00 C ATOM 651 CD GLU A 173 10.259 5.332 -9.531 1.00 0.00 C ATOM 652 OE1 GLU A 173 9.125 5.549 -9.055 1.00 0.00 O ATOM 653 OE2 GLU A 173 10.689 5.753 -10.627 1.00 0.00 O ATOM 0 H GLU A 173 9.975 3.000 -5.404 1.00 0.00 H new ATOM 0 HA GLU A 173 12.445 3.161 -7.021 1.00 0.00 H new ATOM 0 HB2 GLU A 173 9.904 4.631 -6.985 1.00 0.00 H new ATOM 0 HB3 GLU A 173 11.298 5.690 -6.913 1.00 0.00 H new ATOM 0 HG2 GLU A 173 12.243 4.727 -8.940 1.00 0.00 H new ATOM 0 HG3 GLU A 173 11.072 3.424 -8.941 1.00 0.00 H new ATOM 660 N ASP A 174 13.767 4.512 -5.435 1.00 0.00 N ATOM 661 CA ASP A 174 14.610 5.130 -4.425 1.00 0.00 C ATOM 662 C ASP A 174 14.358 6.640 -4.412 1.00 0.00 C ATOM 663 O ASP A 174 13.720 7.174 -5.317 1.00 0.00 O ATOM 664 CB ASP A 174 16.092 4.901 -4.730 1.00 0.00 C ATOM 665 CG ASP A 174 17.041 5.161 -3.559 1.00 0.00 C ATOM 666 OD1 ASP A 174 17.180 4.240 -2.726 1.00 0.00 O ATOM 667 OD2 ASP A 174 17.605 6.275 -3.523 1.00 0.00 O ATOM 0 H ASP A 174 14.248 4.263 -6.299 1.00 0.00 H new ATOM 0 HA ASP A 174 14.366 4.682 -3.461 1.00 0.00 H new ATOM 0 HB2 ASP A 174 16.224 3.872 -5.063 1.00 0.00 H new ATOM 0 HB3 ASP A 174 16.380 5.545 -5.561 1.00 0.00 H new ATOM 672 N SER A 175 14.874 7.284 -3.375 1.00 0.00 N ATOM 673 CA SER A 175 14.713 8.720 -3.231 1.00 0.00 C ATOM 674 C SER A 175 15.288 9.436 -4.454 1.00 0.00 C ATOM 675 O SER A 175 15.004 10.611 -4.681 1.00 0.00 O ATOM 676 CB SER A 175 15.389 9.225 -1.955 1.00 0.00 C ATOM 677 OG SER A 175 14.967 8.498 -0.804 1.00 0.00 O ATOM 0 H SER A 175 15.404 6.837 -2.627 1.00 0.00 H new ATOM 0 HA SER A 175 13.648 8.939 -3.157 1.00 0.00 H new ATOM 0 HB2 SER A 175 16.471 9.141 -2.060 1.00 0.00 H new ATOM 0 HB3 SER A 175 15.163 10.283 -1.819 1.00 0.00 H new ATOM 0 HG SER A 175 14.267 7.860 -1.058 1.00 0.00 H new ATOM 683 N GLU A 176 16.087 8.698 -5.212 1.00 0.00 N ATOM 684 CA GLU A 176 16.704 9.247 -6.407 1.00 0.00 C ATOM 685 C GLU A 176 15.746 9.143 -7.595 1.00 0.00 C ATOM 686 O GLU A 176 15.881 9.878 -8.572 1.00 0.00 O ATOM 687 CB GLU A 176 18.030 8.548 -6.710 1.00 0.00 C ATOM 688 CG GLU A 176 19.021 8.729 -5.558 1.00 0.00 C ATOM 689 CD GLU A 176 20.292 9.436 -6.033 1.00 0.00 C ATOM 690 OE1 GLU A 176 20.184 10.637 -6.364 1.00 0.00 O ATOM 691 OE2 GLU A 176 21.343 8.760 -6.054 1.00 0.00 O ATOM 0 H GLU A 176 16.321 7.724 -5.021 1.00 0.00 H new ATOM 0 HA GLU A 176 16.919 10.301 -6.229 1.00 0.00 H new ATOM 0 HB2 GLU A 176 17.855 7.486 -6.880 1.00 0.00 H new ATOM 0 HB3 GLU A 176 18.457 8.952 -7.628 1.00 0.00 H new ATOM 0 HG2 GLU A 176 18.555 9.308 -4.761 1.00 0.00 H new ATOM 0 HG3 GLU A 176 19.277 7.756 -5.138 1.00 0.00 H new ATOM 698 N GLY A 177 14.799 8.225 -7.472 1.00 0.00 N ATOM 699 CA GLY A 177 13.818 8.015 -8.524 1.00 0.00 C ATOM 700 C GLY A 177 14.197 6.817 -9.395 1.00 0.00 C ATOM 701 O GLY A 177 13.851 6.768 -10.575 1.00 0.00 O ATOM 0 H GLY A 177 14.690 7.618 -6.660 1.00 0.00 H new ATOM 0 HA2 GLY A 177 12.835 7.852 -8.082 1.00 0.00 H new ATOM 0 HA3 GLY A 177 13.745 8.910 -9.142 1.00 0.00 H new ATOM 705 N LYS A 178 14.903 5.879 -8.781 1.00 0.00 N ATOM 706 CA LYS A 178 15.333 4.683 -9.487 1.00 0.00 C ATOM 707 C LYS A 178 14.424 3.514 -9.101 1.00 0.00 C ATOM 708 O LYS A 178 14.315 3.169 -7.925 1.00 0.00 O ATOM 709 CB LYS A 178 16.819 4.416 -9.234 1.00 0.00 C ATOM 710 CG LYS A 178 17.034 3.764 -7.867 1.00 0.00 C ATOM 711 CD LYS A 178 16.850 2.248 -7.949 1.00 0.00 C ATOM 712 CE LYS A 178 18.202 1.535 -8.028 1.00 0.00 C ATOM 713 NZ LYS A 178 18.046 0.191 -8.629 1.00 0.00 N ATOM 0 H LYS A 178 15.188 5.923 -7.803 1.00 0.00 H new ATOM 0 HA LYS A 178 15.236 4.821 -10.564 1.00 0.00 H new ATOM 0 HB2 LYS A 178 17.214 3.768 -10.016 1.00 0.00 H new ATOM 0 HB3 LYS A 178 17.374 5.353 -9.286 1.00 0.00 H new ATOM 0 HG2 LYS A 178 18.036 3.993 -7.504 1.00 0.00 H new ATOM 0 HG3 LYS A 178 16.331 4.181 -7.146 1.00 0.00 H new ATOM 0 HD2 LYS A 178 16.300 1.897 -7.076 1.00 0.00 H new ATOM 0 HD3 LYS A 178 16.251 1.998 -8.825 1.00 0.00 H new ATOM 0 HE2 LYS A 178 18.898 2.127 -8.623 1.00 0.00 H new ATOM 0 HE3 LYS A 178 18.631 1.446 -7.030 1.00 0.00 H new ATOM 0 HZ1 LYS A 178 18.970 -0.285 -8.659 1.00 0.00 H new ATOM 0 HZ2 LYS A 178 17.385 -0.371 -8.055 1.00 0.00 H new ATOM 0 HZ3 LYS A 178 17.673 0.284 -9.595 1.00 0.00 H new ATOM 727 N ARG A 179 13.796 2.935 -10.114 1.00 0.00 N ATOM 728 CA ARG A 179 12.900 1.812 -9.895 1.00 0.00 C ATOM 729 C ARG A 179 13.691 0.502 -9.859 1.00 0.00 C ATOM 730 O ARG A 179 14.270 0.095 -10.864 1.00 0.00 O ATOM 731 CB ARG A 179 11.841 1.731 -10.996 1.00 0.00 C ATOM 732 CG ARG A 179 11.651 3.087 -11.676 1.00 0.00 C ATOM 733 CD ARG A 179 10.268 3.188 -12.322 1.00 0.00 C ATOM 734 NE ARG A 179 10.383 3.043 -13.790 1.00 0.00 N ATOM 735 CZ ARG A 179 10.924 3.966 -14.596 1.00 0.00 C ATOM 736 NH1 ARG A 179 11.403 5.107 -14.082 1.00 0.00 N ATOM 737 NH2 ARG A 179 10.987 3.749 -15.918 1.00 0.00 N ATOM 0 H ARG A 179 13.890 3.222 -11.088 1.00 0.00 H new ATOM 0 HA ARG A 179 12.402 1.966 -8.938 1.00 0.00 H new ATOM 0 HB2 ARG A 179 12.137 0.988 -11.736 1.00 0.00 H new ATOM 0 HB3 ARG A 179 10.894 1.398 -10.571 1.00 0.00 H new ATOM 0 HG2 ARG A 179 11.773 3.885 -10.944 1.00 0.00 H new ATOM 0 HG3 ARG A 179 12.421 3.229 -12.434 1.00 0.00 H new ATOM 0 HD2 ARG A 179 9.613 2.414 -11.922 1.00 0.00 H new ATOM 0 HD3 ARG A 179 9.813 4.148 -12.078 1.00 0.00 H new ATOM 0 HE ARG A 179 10.028 2.186 -14.215 1.00 0.00 H new ATOM 0 HH11 ARG A 179 11.356 5.273 -13.077 1.00 0.00 H new ATOM 0 HH12 ARG A 179 11.815 5.810 -14.696 1.00 0.00 H new ATOM 0 HH21 ARG A 179 10.623 2.881 -16.310 1.00 0.00 H new ATOM 0 HH22 ARG A 179 11.399 4.452 -16.531 1.00 0.00 H new ATOM 751 N GLY A 180 13.688 -0.121 -8.690 1.00 0.00 N ATOM 752 CA GLY A 180 14.397 -1.376 -8.510 1.00 0.00 C ATOM 753 C GLY A 180 13.655 -2.291 -7.534 1.00 0.00 C ATOM 754 O GLY A 180 12.654 -1.890 -6.940 1.00 0.00 O ATOM 0 H GLY A 180 13.206 0.220 -7.858 1.00 0.00 H new ATOM 0 HA2 GLY A 180 14.506 -1.877 -9.472 1.00 0.00 H new ATOM 0 HA3 GLY A 180 15.402 -1.179 -8.137 1.00 0.00 H new ATOM 758 N MET A 181 14.172 -3.503 -7.398 1.00 0.00 N ATOM 759 CA MET A 181 13.570 -4.478 -6.505 1.00 0.00 C ATOM 760 C MET A 181 14.108 -4.322 -5.081 1.00 0.00 C ATOM 761 O MET A 181 15.268 -3.964 -4.887 1.00 0.00 O ATOM 762 CB MET A 181 13.870 -5.889 -7.012 1.00 0.00 C ATOM 763 CG MET A 181 12.639 -6.504 -7.681 1.00 0.00 C ATOM 764 SD MET A 181 12.923 -6.686 -9.434 1.00 0.00 S ATOM 765 CE MET A 181 11.493 -5.827 -10.071 1.00 0.00 C ATOM 0 H MET A 181 15.002 -3.832 -7.892 1.00 0.00 H new ATOM 0 HA MET A 181 12.493 -4.310 -6.487 1.00 0.00 H new ATOM 0 HB2 MET A 181 14.696 -5.856 -7.722 1.00 0.00 H new ATOM 0 HB3 MET A 181 14.189 -6.518 -6.181 1.00 0.00 H new ATOM 0 HG2 MET A 181 12.421 -7.475 -7.237 1.00 0.00 H new ATOM 0 HG3 MET A 181 11.768 -5.872 -7.509 1.00 0.00 H new ATOM 0 HE1 MET A 181 10.870 -6.524 -10.632 1.00 0.00 H new ATOM 0 HE2 MET A 181 10.919 -5.412 -9.243 1.00 0.00 H new ATOM 0 HE3 MET A 181 11.816 -5.020 -10.728 1.00 0.00 H new ATOM 775 N ILE A 182 13.239 -4.599 -4.120 1.00 0.00 N ATOM 776 CA ILE A 182 13.612 -4.495 -2.719 1.00 0.00 C ATOM 777 C ILE A 182 12.827 -5.528 -1.908 1.00 0.00 C ATOM 778 O ILE A 182 11.674 -5.820 -2.219 1.00 0.00 O ATOM 779 CB ILE A 182 13.434 -3.059 -2.223 1.00 0.00 C ATOM 780 CG1 ILE A 182 12.053 -2.864 -1.594 1.00 0.00 C ATOM 781 CG2 ILE A 182 13.699 -2.054 -3.346 1.00 0.00 C ATOM 782 CD1 ILE A 182 10.952 -2.933 -2.654 1.00 0.00 C ATOM 0 H ILE A 182 12.277 -4.896 -4.284 1.00 0.00 H new ATOM 0 HA ILE A 182 14.670 -4.724 -2.588 1.00 0.00 H new ATOM 0 HB ILE A 182 14.173 -2.873 -1.443 1.00 0.00 H new ATOM 0 HG12 ILE A 182 11.883 -3.630 -0.838 1.00 0.00 H new ATOM 0 HG13 ILE A 182 12.014 -1.900 -1.086 1.00 0.00 H new ATOM 0 HG21 ILE A 182 13.566 -1.041 -2.967 1.00 0.00 H new ATOM 0 HG22 ILE A 182 14.720 -2.174 -3.708 1.00 0.00 H new ATOM 0 HG23 ILE A 182 13.000 -2.230 -4.164 1.00 0.00 H new ATOM 0 HD11 ILE A 182 9.981 -2.791 -2.180 1.00 0.00 H new ATOM 0 HD12 ILE A 182 11.111 -2.150 -3.396 1.00 0.00 H new ATOM 0 HD13 ILE A 182 10.978 -3.907 -3.143 1.00 0.00 H new ATOM 794 N PRO A 183 13.502 -6.066 -0.856 1.00 0.00 N ATOM 795 CA PRO A 183 12.880 -7.060 0.001 1.00 0.00 C ATOM 796 C PRO A 183 11.861 -6.413 0.942 1.00 0.00 C ATOM 797 O PRO A 183 12.162 -5.418 1.599 1.00 0.00 O ATOM 798 CB PRO A 183 14.033 -7.720 0.739 1.00 0.00 C ATOM 799 CG PRO A 183 15.208 -6.763 0.616 1.00 0.00 C ATOM 800 CD PRO A 183 14.868 -5.743 -0.459 1.00 0.00 C ATOM 0 HA PRO A 183 12.308 -7.799 -0.560 1.00 0.00 H new ATOM 0 HB2 PRO A 183 13.779 -7.894 1.785 1.00 0.00 H new ATOM 0 HB3 PRO A 183 14.272 -8.690 0.303 1.00 0.00 H new ATOM 0 HG2 PRO A 183 15.397 -6.266 1.568 1.00 0.00 H new ATOM 0 HG3 PRO A 183 16.116 -7.305 0.354 1.00 0.00 H new ATOM 0 HD2 PRO A 183 14.939 -4.725 -0.076 1.00 0.00 H new ATOM 0 HD3 PRO A 183 15.553 -5.814 -1.304 1.00 0.00 H new ATOM 808 N VAL A 184 10.675 -7.004 0.975 1.00 0.00 N ATOM 809 CA VAL A 184 9.610 -6.496 1.823 1.00 0.00 C ATOM 810 C VAL A 184 9.910 -6.855 3.279 1.00 0.00 C ATOM 811 O VAL A 184 9.500 -6.143 4.195 1.00 0.00 O ATOM 812 CB VAL A 184 8.259 -7.031 1.343 1.00 0.00 C ATOM 813 CG1 VAL A 184 8.036 -6.707 -0.136 1.00 0.00 C ATOM 814 CG2 VAL A 184 8.141 -8.534 1.598 1.00 0.00 C ATOM 0 H VAL A 184 10.429 -7.829 0.428 1.00 0.00 H new ATOM 0 HA VAL A 184 9.556 -5.409 1.759 1.00 0.00 H new ATOM 0 HB VAL A 184 7.479 -6.532 1.918 1.00 0.00 H new ATOM 0 HG11 VAL A 184 7.069 -7.098 -0.452 1.00 0.00 H new ATOM 0 HG12 VAL A 184 8.055 -5.627 -0.279 1.00 0.00 H new ATOM 0 HG13 VAL A 184 8.825 -7.165 -0.732 1.00 0.00 H new ATOM 0 HG21 VAL A 184 7.171 -8.888 1.247 1.00 0.00 H new ATOM 0 HG22 VAL A 184 8.933 -9.057 1.063 1.00 0.00 H new ATOM 0 HG23 VAL A 184 8.234 -8.730 2.666 1.00 0.00 H new ATOM 824 N PRO A 185 10.643 -7.987 3.454 1.00 0.00 N ATOM 825 CA PRO A 185 11.003 -8.449 4.784 1.00 0.00 C ATOM 826 C PRO A 185 12.122 -7.591 5.378 1.00 0.00 C ATOM 827 O PRO A 185 12.390 -7.657 6.576 1.00 0.00 O ATOM 828 CB PRO A 185 11.403 -9.904 4.600 1.00 0.00 C ATOM 829 CG PRO A 185 11.698 -10.071 3.119 1.00 0.00 C ATOM 830 CD PRO A 185 11.147 -8.855 2.393 1.00 0.00 C ATOM 0 HA PRO A 185 10.182 -8.363 5.496 1.00 0.00 H new ATOM 0 HB2 PRO A 185 12.278 -10.148 5.202 1.00 0.00 H new ATOM 0 HB3 PRO A 185 10.602 -10.572 4.916 1.00 0.00 H new ATOM 0 HG2 PRO A 185 12.771 -10.161 2.952 1.00 0.00 H new ATOM 0 HG3 PRO A 185 11.238 -10.983 2.739 1.00 0.00 H new ATOM 0 HD2 PRO A 185 11.921 -8.358 1.809 1.00 0.00 H new ATOM 0 HD3 PRO A 185 10.354 -9.134 1.699 1.00 0.00 H new ATOM 838 N TYR A 186 12.746 -6.807 4.511 1.00 0.00 N ATOM 839 CA TYR A 186 13.831 -5.937 4.934 1.00 0.00 C ATOM 840 C TYR A 186 13.323 -4.519 5.206 1.00 0.00 C ATOM 841 O TYR A 186 13.797 -3.852 6.124 1.00 0.00 O ATOM 842 CB TYR A 186 14.819 -5.897 3.767 1.00 0.00 C ATOM 843 CG TYR A 186 15.831 -7.045 3.769 1.00 0.00 C ATOM 844 CD1 TYR A 186 15.415 -8.330 4.050 1.00 0.00 C ATOM 845 CD2 TYR A 186 17.158 -6.794 3.488 1.00 0.00 C ATOM 846 CE1 TYR A 186 16.367 -9.410 4.052 1.00 0.00 C ATOM 847 CE2 TYR A 186 18.110 -7.874 3.490 1.00 0.00 C ATOM 848 CZ TYR A 186 17.668 -9.129 3.772 1.00 0.00 C ATOM 849 OH TYR A 186 18.567 -10.150 3.773 1.00 0.00 O ATOM 0 H TYR A 186 12.521 -6.756 3.517 1.00 0.00 H new ATOM 0 HA TYR A 186 14.284 -6.308 5.853 1.00 0.00 H new ATOM 0 HB2 TYR A 186 14.261 -5.920 2.831 1.00 0.00 H new ATOM 0 HB3 TYR A 186 15.359 -4.950 3.793 1.00 0.00 H new ATOM 0 HD1 TYR A 186 14.376 -8.526 4.268 1.00 0.00 H new ATOM 0 HD2 TYR A 186 17.483 -5.788 3.267 1.00 0.00 H new ATOM 0 HE1 TYR A 186 16.055 -10.421 4.271 1.00 0.00 H new ATOM 0 HE2 TYR A 186 19.152 -7.692 3.272 1.00 0.00 H new ATOM 0 HH TYR A 186 19.457 -9.802 3.555 1.00 0.00 H new ATOM 859 N VAL A 187 12.365 -4.101 4.390 1.00 0.00 N ATOM 860 CA VAL A 187 11.788 -2.776 4.532 1.00 0.00 C ATOM 861 C VAL A 187 10.362 -2.900 5.071 1.00 0.00 C ATOM 862 O VAL A 187 9.833 -4.004 5.191 1.00 0.00 O ATOM 863 CB VAL A 187 11.860 -2.030 3.199 1.00 0.00 C ATOM 864 CG1 VAL A 187 13.217 -2.241 2.524 1.00 0.00 C ATOM 865 CG2 VAL A 187 10.717 -2.447 2.273 1.00 0.00 C ATOM 0 H VAL A 187 11.975 -4.657 3.629 1.00 0.00 H new ATOM 0 HA VAL A 187 12.357 -2.187 5.251 1.00 0.00 H new ATOM 0 HB VAL A 187 11.751 -0.966 3.406 1.00 0.00 H new ATOM 0 HG11 VAL A 187 13.241 -1.700 1.578 1.00 0.00 H new ATOM 0 HG12 VAL A 187 14.009 -1.870 3.175 1.00 0.00 H new ATOM 0 HG13 VAL A 187 13.369 -3.304 2.338 1.00 0.00 H new ATOM 0 HG21 VAL A 187 10.793 -1.901 1.333 1.00 0.00 H new ATOM 0 HG22 VAL A 187 10.779 -3.517 2.077 1.00 0.00 H new ATOM 0 HG23 VAL A 187 9.763 -2.220 2.748 1.00 0.00 H new ATOM 875 N GLU A 188 9.778 -1.751 5.381 1.00 0.00 N ATOM 876 CA GLU A 188 8.423 -1.717 5.904 1.00 0.00 C ATOM 877 C GLU A 188 7.545 -0.805 5.046 1.00 0.00 C ATOM 878 O GLU A 188 7.875 -0.524 3.895 1.00 0.00 O ATOM 879 CB GLU A 188 8.411 -1.271 7.368 1.00 0.00 C ATOM 880 CG GLU A 188 9.715 -1.659 8.070 1.00 0.00 C ATOM 881 CD GLU A 188 9.505 -1.799 9.578 1.00 0.00 C ATOM 882 OE1 GLU A 188 9.407 -0.742 10.238 1.00 0.00 O ATOM 883 OE2 GLU A 188 9.445 -2.960 10.038 1.00 0.00 O ATOM 0 H GLU A 188 10.219 -0.837 5.280 1.00 0.00 H new ATOM 0 HA GLU A 188 8.013 -2.726 5.862 1.00 0.00 H new ATOM 0 HB2 GLU A 188 8.272 -0.191 7.422 1.00 0.00 H new ATOM 0 HB3 GLU A 188 7.566 -1.727 7.884 1.00 0.00 H new ATOM 0 HG2 GLU A 188 10.086 -2.599 7.662 1.00 0.00 H new ATOM 0 HG3 GLU A 188 10.476 -0.904 7.874 1.00 0.00 H new ATOM 890 N LYS A 189 6.444 -0.367 5.639 1.00 0.00 N ATOM 891 CA LYS A 189 5.516 0.508 4.943 1.00 0.00 C ATOM 892 C LYS A 189 5.351 1.805 5.738 1.00 0.00 C ATOM 893 O LYS A 189 5.019 1.774 6.922 1.00 0.00 O ATOM 894 CB LYS A 189 4.198 -0.217 4.670 1.00 0.00 C ATOM 895 CG LYS A 189 4.402 -1.379 3.696 1.00 0.00 C ATOM 896 CD LYS A 189 3.794 -1.062 2.329 1.00 0.00 C ATOM 897 CE LYS A 189 2.386 -1.647 2.205 1.00 0.00 C ATOM 898 NZ LYS A 189 2.401 -3.098 2.490 1.00 0.00 N ATOM 0 H LYS A 189 6.174 -0.602 6.594 1.00 0.00 H new ATOM 0 HA LYS A 189 5.911 0.781 3.965 1.00 0.00 H new ATOM 0 HB2 LYS A 189 3.784 -0.591 5.606 1.00 0.00 H new ATOM 0 HB3 LYS A 189 3.472 0.484 4.258 1.00 0.00 H new ATOM 0 HG2 LYS A 189 5.467 -1.583 3.586 1.00 0.00 H new ATOM 0 HG3 LYS A 189 3.945 -2.282 4.101 1.00 0.00 H new ATOM 0 HD2 LYS A 189 3.757 0.018 2.185 1.00 0.00 H new ATOM 0 HD3 LYS A 189 4.430 -1.466 1.542 1.00 0.00 H new ATOM 0 HE2 LYS A 189 1.713 -1.141 2.898 1.00 0.00 H new ATOM 0 HE3 LYS A 189 2.000 -1.472 1.201 1.00 0.00 H new ATOM 0 HZ1 LYS A 189 1.647 -3.566 1.948 1.00 0.00 H new ATOM 0 HZ2 LYS A 189 3.322 -3.496 2.217 1.00 0.00 H new ATOM 0 HZ3 LYS A 189 2.244 -3.254 3.506 1.00 0.00 H new