USER MOD reduce.3.24.130724 H: found=0, std=0, add=395, rem=0, adj=12 USER MOD reduce.3.24.130724 removed 397 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 Single : A 8 TYR OH : rot 180:sc= 0 USER MOD Single : A 9 TYR OH : rot 130:sc= 0 USER MOD Single : A 10 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 17 ASN : amide:sc=-0.00848 K(o=-0.0085,f=-0.75) USER MOD Single : A 19 SER OG : rot 180:sc= 0 USER MOD Single : A 20 GLN :FLIP amide:sc= -0.581 F(o=-3,f=-0.58) USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 LYS NZ :NH3+ 167:sc=-0.00271 (180deg=-0.0984) USER MOD Single : A 27 TYR OH : rot 180:sc= -0.0298 USER MOD Single : A 28 TYR OH : rot 180:sc= 0 USER MOD Single : A 29 GLN : amide:sc= -0.602 K(o=-0.6,f=-1.2) USER MOD Single : A 32 LYS NZ :NH3+ -152:sc= 0.0225 (180deg=0) USER MOD Single : A 33 LYS NZ :NH3+ 155:sc= -0.0627 (180deg=-0.511) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 SER OG : rot 180:sc= 0 USER MOD Single : A 51 GLN : amide:sc= -0.496 K(o=-0.5,f=-2) USER MOD Single : A 56 TYR OH : rot 180:sc= 0 USER MOD Single : A 60 SER OG : rot 180:sc= 0 USER MOD Single : A 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 66 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 101 N ASP A 7 -9.503 -8.106 -11.135 1.00 15.21 N ATOM 102 CA ASP A 7 -10.407 -9.052 -11.779 1.00 22.42 C ATOM 103 C ASP A 7 -10.041 -9.239 -13.248 1.00 53.01 C ATOM 104 O ASP A 7 -9.519 -8.326 -13.889 1.00 74.51 O ATOM 105 CB ASP A 7 -11.854 -8.572 -11.657 1.00 60.44 C ATOM 106 CG ASP A 7 -12.145 -7.948 -10.307 1.00 53.52 C ATOM 107 OD1 ASP A 7 -12.488 -8.696 -9.368 1.00 72.20 O ATOM 108 OD2 ASP A 7 -12.030 -6.710 -10.189 1.00 44.14 O ATOM 0 HA ASP A 7 -10.308 -10.013 -11.274 1.00 22.42 H new ATOM 0 HB2 ASP A 7 -12.060 -7.845 -12.442 1.00 60.44 H new ATOM 0 HB3 ASP A 7 -12.528 -9.414 -11.818 1.00 60.44 H new ATOM 113 N TYR A 8 -10.318 -10.427 -13.775 1.00 2.41 N ATOM 114 CA TYR A 8 -10.015 -10.734 -15.168 1.00 20.24 C ATOM 115 C TYR A 8 -10.752 -9.785 -16.108 1.00 32.52 C ATOM 116 O TYR A 8 -10.296 -9.516 -17.219 1.00 73.24 O ATOM 117 CB TYR A 8 -10.393 -12.182 -15.486 1.00 12.31 C ATOM 118 CG TYR A 8 -9.837 -13.184 -14.500 1.00 44.11 C ATOM 119 CD1 TYR A 8 -10.616 -14.235 -14.033 1.00 14.21 C ATOM 120 CD2 TYR A 8 -8.532 -13.079 -14.035 1.00 24.51 C ATOM 121 CE1 TYR A 8 -10.113 -15.153 -13.132 1.00 5.54 C ATOM 122 CE2 TYR A 8 -8.019 -13.993 -13.135 1.00 21.42 C ATOM 123 CZ TYR A 8 -8.813 -15.028 -12.686 1.00 12.10 C ATOM 124 OH TYR A 8 -8.307 -15.939 -11.788 1.00 65.42 O ATOM 0 H TYR A 8 -10.752 -11.193 -13.259 1.00 2.41 H new ATOM 0 HA TYR A 8 -8.943 -10.604 -15.318 1.00 20.24 H new ATOM 0 HB2 TYR A 8 -11.479 -12.269 -15.506 1.00 12.31 H new ATOM 0 HB3 TYR A 8 -10.035 -12.431 -16.485 1.00 12.31 H new ATOM 0 HD1 TYR A 8 -11.633 -14.336 -14.381 1.00 14.21 H new ATOM 0 HD2 TYR A 8 -7.908 -12.269 -14.383 1.00 24.51 H new ATOM 0 HE1 TYR A 8 -10.733 -15.964 -12.779 1.00 5.54 H new ATOM 0 HE2 TYR A 8 -7.002 -13.898 -12.785 1.00 21.42 H new ATOM 0 HH TYR A 8 -7.378 -15.709 -11.577 1.00 65.42 H new ATOM 134 N TYR A 9 -11.894 -9.282 -15.653 1.00 41.40 N ATOM 135 CA TYR A 9 -12.697 -8.364 -16.453 1.00 23.02 C ATOM 136 C TYR A 9 -11.849 -7.204 -16.966 1.00 11.23 C ATOM 137 O TYR A 9 -11.958 -6.808 -18.126 1.00 11.53 O ATOM 138 CB TYR A 9 -13.869 -7.829 -15.629 1.00 53.44 C ATOM 139 CG TYR A 9 -14.776 -8.912 -15.091 1.00 21.20 C ATOM 140 CD1 TYR A 9 -14.710 -9.303 -13.759 1.00 52.53 C ATOM 141 CD2 TYR A 9 -15.699 -9.545 -15.914 1.00 73.13 C ATOM 142 CE1 TYR A 9 -15.536 -10.293 -13.264 1.00 11.35 C ATOM 143 CE2 TYR A 9 -16.530 -10.535 -15.427 1.00 33.23 C ATOM 144 CZ TYR A 9 -16.445 -10.906 -14.101 1.00 5.21 C ATOM 145 OH TYR A 9 -17.270 -11.892 -13.611 1.00 0.54 O ATOM 0 H TYR A 9 -12.285 -9.494 -14.735 1.00 41.40 H new ATOM 0 HA TYR A 9 -13.085 -8.913 -17.311 1.00 23.02 H new ATOM 0 HB2 TYR A 9 -13.479 -7.246 -14.795 1.00 53.44 H new ATOM 0 HB3 TYR A 9 -14.456 -7.149 -16.247 1.00 53.44 H new ATOM 0 HD1 TYR A 9 -14.001 -8.825 -13.100 1.00 52.53 H new ATOM 0 HD2 TYR A 9 -15.768 -9.258 -16.953 1.00 73.13 H new ATOM 0 HE1 TYR A 9 -15.471 -10.586 -12.227 1.00 11.35 H new ATOM 0 HE2 TYR A 9 -17.242 -11.016 -16.081 1.00 33.23 H new ATOM 0 HH TYR A 9 -18.197 -11.698 -13.862 1.00 0.54 H new ATOM 155 N GLN A 10 -11.005 -6.665 -16.092 1.00 63.02 N ATOM 156 CA GLN A 10 -10.138 -5.550 -16.456 1.00 31.30 C ATOM 157 C GLN A 10 -8.981 -6.023 -17.330 1.00 53.13 C ATOM 158 O GLN A 10 -8.616 -5.363 -18.303 1.00 52.54 O ATOM 159 CB GLN A 10 -9.597 -4.866 -15.199 1.00 62.43 C ATOM 160 CG GLN A 10 -10.684 -4.388 -14.251 1.00 31.34 C ATOM 161 CD GLN A 10 -11.254 -3.041 -14.648 1.00 12.02 C ATOM 162 OE1 GLN A 10 -10.576 -2.017 -14.561 1.00 0.11 O ATOM 163 NE2 GLN A 10 -12.507 -3.034 -15.087 1.00 72.44 N ATOM 0 H GLN A 10 -10.903 -6.982 -15.128 1.00 63.02 H new ATOM 0 HA GLN A 10 -10.730 -4.833 -17.025 1.00 31.30 H new ATOM 0 HB2 GLN A 10 -8.945 -5.561 -14.670 1.00 62.43 H new ATOM 0 HB3 GLN A 10 -8.984 -4.015 -15.494 1.00 62.43 H new ATOM 0 HG2 GLN A 10 -11.487 -5.124 -14.224 1.00 31.34 H new ATOM 0 HG3 GLN A 10 -10.278 -4.323 -13.242 1.00 31.34 H new ATOM 0 HE21 GLN A 10 -13.033 -3.906 -15.143 1.00 72.44 H new ATOM 0 HE22 GLN A 10 -12.944 -2.156 -15.368 1.00 72.44 H new ATOM 172 N ILE A 11 -8.409 -7.169 -16.977 1.00 2.31 N ATOM 173 CA ILE A 11 -7.294 -7.729 -17.730 1.00 60.32 C ATOM 174 C ILE A 11 -7.676 -7.959 -19.189 1.00 10.34 C ATOM 175 O ILE A 11 -6.813 -8.024 -20.065 1.00 50.11 O ATOM 176 CB ILE A 11 -6.816 -9.061 -17.121 1.00 43.50 C ATOM 177 CG1 ILE A 11 -6.413 -8.862 -15.658 1.00 42.44 C ATOM 178 CG2 ILE A 11 -5.653 -9.623 -17.925 1.00 21.24 C ATOM 179 CD1 ILE A 11 -6.299 -10.155 -14.882 1.00 5.30 C ATOM 0 H ILE A 11 -8.699 -7.728 -16.174 1.00 2.31 H new ATOM 0 HA ILE A 11 -6.483 -7.003 -17.679 1.00 60.32 H new ATOM 0 HB ILE A 11 -7.637 -9.777 -17.158 1.00 43.50 H new ATOM 0 HG12 ILE A 11 -5.457 -8.340 -15.621 1.00 42.44 H new ATOM 0 HG13 ILE A 11 -7.147 -8.219 -15.172 1.00 42.44 H new ATOM 0 HG21 ILE A 11 -5.326 -10.564 -17.483 1.00 21.24 H new ATOM 0 HG22 ILE A 11 -5.971 -9.796 -18.953 1.00 21.24 H new ATOM 0 HG23 ILE A 11 -4.827 -8.912 -17.916 1.00 21.24 H new ATOM 0 HD11 ILE A 11 -6.010 -9.938 -13.854 1.00 5.30 H new ATOM 0 HD12 ILE A 11 -7.260 -10.669 -14.888 1.00 5.30 H new ATOM 0 HD13 ILE A 11 -5.544 -10.791 -15.344 1.00 5.30 H new ATOM 191 N LEU A 12 -8.974 -8.079 -19.442 1.00 54.33 N ATOM 192 CA LEU A 12 -9.472 -8.299 -20.796 1.00 14.13 C ATOM 193 C LEU A 12 -10.167 -7.051 -21.330 1.00 52.40 C ATOM 194 O LEU A 12 -10.387 -6.917 -22.533 1.00 41.11 O ATOM 195 CB LEU A 12 -10.440 -9.484 -20.818 1.00 5.20 C ATOM 196 CG LEU A 12 -9.813 -10.857 -21.061 1.00 22.32 C ATOM 197 CD1 LEU A 12 -10.826 -11.960 -20.798 1.00 30.42 C ATOM 198 CD2 LEU A 12 -9.273 -10.954 -22.480 1.00 50.34 C ATOM 0 H LEU A 12 -9.701 -8.028 -18.728 1.00 54.33 H new ATOM 0 HA LEU A 12 -8.620 -8.521 -21.438 1.00 14.13 H new ATOM 0 HB2 LEU A 12 -10.970 -9.512 -19.866 1.00 5.20 H new ATOM 0 HB3 LEU A 12 -11.185 -9.305 -21.593 1.00 5.20 H new ATOM 0 HG LEU A 12 -8.981 -10.983 -20.368 1.00 22.32 H new ATOM 0 HD11 LEU A 12 -10.362 -12.930 -20.976 1.00 30.42 H new ATOM 0 HD12 LEU A 12 -11.164 -11.904 -19.763 1.00 30.42 H new ATOM 0 HD13 LEU A 12 -11.679 -11.838 -21.466 1.00 30.42 H new ATOM 0 HD21 LEU A 12 -8.831 -11.938 -22.634 1.00 50.34 H new ATOM 0 HD22 LEU A 12 -10.087 -10.807 -23.190 1.00 50.34 H new ATOM 0 HD23 LEU A 12 -8.514 -10.187 -22.634 1.00 50.34 H new ATOM 210 N GLY A 13 -10.509 -6.137 -20.426 1.00 72.04 N ATOM 211 CA GLY A 13 -11.174 -4.910 -20.826 1.00 64.44 C ATOM 212 C GLY A 13 -12.650 -5.114 -21.104 1.00 64.54 C ATOM 213 O GLY A 13 -13.257 -4.356 -21.860 1.00 14.34 O ATOM 0 H GLY A 13 -10.337 -6.224 -19.424 1.00 72.04 H new ATOM 0 HA2 GLY A 13 -11.055 -4.164 -20.041 1.00 64.44 H new ATOM 0 HA3 GLY A 13 -10.691 -4.513 -21.719 1.00 64.44 H new ATOM 217 N VAL A 14 -13.228 -6.144 -20.494 1.00 15.32 N ATOM 218 CA VAL A 14 -14.643 -6.446 -20.680 1.00 24.11 C ATOM 219 C VAL A 14 -15.436 -6.167 -19.409 1.00 12.25 C ATOM 220 O VAL A 14 -14.915 -6.229 -18.295 1.00 65.30 O ATOM 221 CB VAL A 14 -14.853 -7.916 -21.091 1.00 1.43 C ATOM 222 CG1 VAL A 14 -14.076 -8.232 -22.359 1.00 42.15 C ATOM 223 CG2 VAL A 14 -14.446 -8.848 -19.960 1.00 22.11 C ATOM 0 H VAL A 14 -12.739 -6.783 -19.867 1.00 15.32 H new ATOM 0 HA VAL A 14 -15.003 -5.798 -21.479 1.00 24.11 H new ATOM 0 HB VAL A 14 -15.912 -8.071 -21.295 1.00 1.43 H new ATOM 0 HG11 VAL A 14 -14.237 -9.275 -22.634 1.00 42.15 H new ATOM 0 HG12 VAL A 14 -14.420 -7.587 -23.167 1.00 42.15 H new ATOM 0 HG13 VAL A 14 -13.013 -8.062 -22.186 1.00 42.15 H new ATOM 0 HG21 VAL A 14 -14.601 -9.882 -20.267 1.00 22.11 H new ATOM 0 HG22 VAL A 14 -13.393 -8.694 -19.722 1.00 22.11 H new ATOM 0 HG23 VAL A 14 -15.052 -8.637 -19.079 1.00 22.11 H new ATOM 233 N PRO A 15 -16.729 -5.851 -19.575 1.00 71.24 N ATOM 234 CA PRO A 15 -17.624 -5.557 -18.452 1.00 5.21 C ATOM 235 C PRO A 15 -17.932 -6.795 -17.617 1.00 12.21 C ATOM 236 O PRO A 15 -17.518 -7.903 -17.956 1.00 65.23 O ATOM 237 CB PRO A 15 -18.893 -5.042 -19.135 1.00 31.12 C ATOM 238 CG PRO A 15 -18.868 -5.655 -20.492 1.00 74.42 C ATOM 239 CD PRO A 15 -17.418 -5.758 -20.874 1.00 25.12 C ATOM 0 HA PRO A 15 -17.182 -4.847 -17.753 1.00 5.21 H new ATOM 0 HB2 PRO A 15 -19.786 -5.336 -18.584 1.00 31.12 H new ATOM 0 HB3 PRO A 15 -18.898 -3.954 -19.192 1.00 31.12 H new ATOM 0 HG2 PRO A 15 -19.340 -6.637 -20.485 1.00 74.42 H new ATOM 0 HG3 PRO A 15 -19.417 -5.042 -21.207 1.00 74.42 H new ATOM 0 HD2 PRO A 15 -17.227 -6.634 -21.494 1.00 25.12 H new ATOM 0 HD3 PRO A 15 -17.089 -4.888 -21.442 1.00 25.12 H new ATOM 247 N ARG A 16 -18.663 -6.599 -16.524 1.00 43.31 N ATOM 248 CA ARG A 16 -19.026 -7.700 -15.640 1.00 51.23 C ATOM 249 C ARG A 16 -20.192 -8.498 -16.217 1.00 64.13 C ATOM 250 O ARG A 16 -20.543 -9.560 -15.705 1.00 61.14 O ATOM 251 CB ARG A 16 -19.395 -7.169 -14.254 1.00 4.31 C ATOM 252 CG ARG A 16 -18.263 -6.423 -13.567 1.00 4.33 C ATOM 253 CD ARG A 16 -18.263 -4.947 -13.936 1.00 21.45 C ATOM 254 NE ARG A 16 -17.598 -4.130 -12.924 1.00 71.21 N ATOM 255 CZ ARG A 16 -17.298 -2.848 -13.096 1.00 42.25 C ATOM 256 NH1 ARG A 16 -17.602 -2.239 -14.235 1.00 21.54 N ATOM 257 NH2 ARG A 16 -16.692 -2.171 -12.129 1.00 34.01 N ATOM 0 H ARG A 16 -19.015 -5.688 -16.230 1.00 43.31 H new ATOM 0 HA ARG A 16 -18.164 -8.361 -15.551 1.00 51.23 H new ATOM 0 HB2 ARG A 16 -20.254 -6.504 -14.346 1.00 4.31 H new ATOM 0 HB3 ARG A 16 -19.704 -8.004 -13.625 1.00 4.31 H new ATOM 0 HG2 ARG A 16 -18.359 -6.529 -12.486 1.00 4.33 H new ATOM 0 HG3 ARG A 16 -17.309 -6.869 -13.847 1.00 4.33 H new ATOM 0 HD2 ARG A 16 -17.764 -4.813 -14.896 1.00 21.45 H new ATOM 0 HD3 ARG A 16 -19.290 -4.604 -14.061 1.00 21.45 H new ATOM 0 HE ARG A 16 -17.351 -4.568 -12.037 1.00 71.21 H new ATOM 0 HH11 ARG A 16 -18.067 -2.756 -14.981 1.00 21.54 H new ATOM 0 HH12 ARG A 16 -17.370 -1.254 -14.364 1.00 21.54 H new ATOM 0 HH21 ARG A 16 -16.456 -2.635 -11.252 1.00 34.01 H new ATOM 0 HH22 ARG A 16 -16.462 -1.186 -12.263 1.00 34.01 H new ATOM 271 N ASN A 17 -20.787 -7.978 -17.286 1.00 21.02 N ATOM 272 CA ASN A 17 -21.914 -8.642 -17.932 1.00 5.42 C ATOM 273 C ASN A 17 -21.541 -9.100 -19.338 1.00 71.15 C ATOM 274 O ASN A 17 -22.386 -9.592 -20.086 1.00 22.32 O ATOM 275 CB ASN A 17 -23.119 -7.702 -17.992 1.00 54.21 C ATOM 276 CG ASN A 17 -23.764 -7.500 -16.634 1.00 62.22 C ATOM 277 OD1 ASN A 17 -23.840 -8.427 -15.827 1.00 51.22 O ATOM 278 ND2 ASN A 17 -24.232 -6.284 -16.376 1.00 64.52 N ATOM 0 H ASN A 17 -20.508 -7.100 -17.723 1.00 21.02 H new ATOM 0 HA ASN A 17 -22.175 -9.520 -17.341 1.00 5.42 H new ATOM 0 HB2 ASN A 17 -22.804 -6.737 -18.389 1.00 54.21 H new ATOM 0 HB3 ASN A 17 -23.857 -8.106 -18.685 1.00 54.21 H new ATOM 0 HD21 ASN A 17 -24.676 -6.088 -15.479 1.00 64.52 H new ATOM 0 HD22 ASN A 17 -24.147 -5.546 -17.075 1.00 64.52 H new ATOM 285 N ALA A 18 -20.271 -8.935 -19.692 1.00 25.13 N ATOM 286 CA ALA A 18 -19.785 -9.334 -21.007 1.00 33.21 C ATOM 287 C ALA A 18 -20.136 -10.788 -21.303 1.00 63.53 C ATOM 288 O ALA A 18 -20.405 -11.570 -20.391 1.00 61.34 O ATOM 289 CB ALA A 18 -18.282 -9.122 -21.102 1.00 3.34 C ATOM 0 H ALA A 18 -19.559 -8.527 -19.086 1.00 25.13 H new ATOM 0 HA ALA A 18 -20.276 -8.709 -21.753 1.00 33.21 H new ATOM 0 HB1 ALA A 18 -17.934 -9.424 -22.090 1.00 3.34 H new ATOM 0 HB2 ALA A 18 -18.052 -8.068 -20.943 1.00 3.34 H new ATOM 0 HB3 ALA A 18 -17.781 -9.721 -20.341 1.00 3.34 H new ATOM 295 N SER A 19 -20.131 -11.144 -22.584 1.00 21.41 N ATOM 296 CA SER A 19 -20.453 -12.504 -23.001 1.00 22.24 C ATOM 297 C SER A 19 -19.200 -13.241 -23.466 1.00 54.53 C ATOM 298 O SER A 19 -18.175 -12.623 -23.752 1.00 11.42 O ATOM 299 CB SER A 19 -21.493 -12.484 -24.122 1.00 41.33 C ATOM 300 OG SER A 19 -22.642 -11.749 -23.739 1.00 12.22 O ATOM 0 H SER A 19 -19.908 -10.510 -23.351 1.00 21.41 H new ATOM 0 HA SER A 19 -20.866 -13.033 -22.142 1.00 22.24 H new ATOM 0 HB2 SER A 19 -21.057 -12.043 -25.018 1.00 41.33 H new ATOM 0 HB3 SER A 19 -21.778 -13.505 -24.376 1.00 41.33 H new ATOM 0 HG SER A 19 -23.291 -11.750 -24.474 1.00 12.22 H new ATOM 306 N GLN A 20 -19.293 -14.564 -23.540 1.00 21.31 N ATOM 307 CA GLN A 20 -18.167 -15.386 -23.970 1.00 54.51 C ATOM 308 C GLN A 20 -17.725 -15.007 -25.380 1.00 4.14 C ATOM 309 O GLN A 20 -16.560 -15.176 -25.743 1.00 14.23 O ATOM 310 CB GLN A 20 -18.542 -16.868 -23.921 1.00 53.35 C ATOM 311 CG GLN A 20 -19.233 -17.278 -22.631 1.00 71.51 C ATOM 312 CD GLN A 20 -18.532 -16.744 -21.398 1.00 22.20 C ATOM 313 OE1 GLN A 20 -17.492 -17.444 -20.958 1.00 42.14 O flip ATOM 314 NE2 GLN A 20 -18.920 -15.714 -20.846 1.00 14.31 N flip ATOM 0 H GLN A 20 -20.135 -15.090 -23.308 1.00 21.31 H new ATOM 0 HA GLN A 20 -17.336 -15.207 -23.287 1.00 54.51 H new ATOM 0 HB2 GLN A 20 -19.196 -17.097 -24.762 1.00 53.35 H new ATOM 0 HB3 GLN A 20 -17.640 -17.467 -24.046 1.00 53.35 H new ATOM 0 HG2 GLN A 20 -20.262 -16.918 -22.644 1.00 71.51 H new ATOM 0 HG3 GLN A 20 -19.277 -18.366 -22.577 1.00 71.51 H new ATOM 0 HE21 GLN A 20 -19.723 -15.208 -21.218 1.00 14.31 H new ATOM 0 HE22 GLN A 20 -18.438 -15.367 -20.017 1.00 14.31 H new ATOM 323 N LYS A 21 -18.661 -14.494 -26.171 1.00 21.12 N ATOM 324 CA LYS A 21 -18.368 -14.090 -27.541 1.00 33.11 C ATOM 325 C LYS A 21 -17.655 -12.742 -27.570 1.00 55.11 C ATOM 326 O LYS A 21 -16.724 -12.540 -28.348 1.00 4.33 O ATOM 327 CB LYS A 21 -19.660 -14.014 -28.359 1.00 25.22 C ATOM 328 CG LYS A 21 -20.678 -13.037 -27.798 1.00 41.43 C ATOM 329 CD LYS A 21 -22.100 -13.501 -28.062 1.00 35.02 C ATOM 330 CE LYS A 21 -22.468 -13.364 -29.531 1.00 55.32 C ATOM 331 NZ LYS A 21 -23.920 -13.603 -29.764 1.00 43.33 N ATOM 0 H LYS A 21 -19.630 -14.348 -25.887 1.00 21.12 H new ATOM 0 HA LYS A 21 -17.710 -14.839 -27.982 1.00 33.11 H new ATOM 0 HB2 LYS A 21 -19.416 -13.725 -29.381 1.00 25.22 H new ATOM 0 HB3 LYS A 21 -20.109 -15.006 -28.407 1.00 25.22 H new ATOM 0 HG2 LYS A 21 -20.524 -12.926 -26.725 1.00 41.43 H new ATOM 0 HG3 LYS A 21 -20.526 -12.055 -28.245 1.00 41.43 H new ATOM 0 HD2 LYS A 21 -22.207 -14.541 -27.755 1.00 35.02 H new ATOM 0 HD3 LYS A 21 -22.793 -12.917 -27.456 1.00 35.02 H new ATOM 0 HE2 LYS A 21 -22.204 -12.366 -29.880 1.00 55.32 H new ATOM 0 HE3 LYS A 21 -21.884 -14.072 -30.119 1.00 55.32 H new ATOM 0 HZ1 LYS A 21 -24.130 -13.500 -30.777 1.00 43.33 H new ATOM 0 HZ2 LYS A 21 -24.168 -14.565 -29.455 1.00 43.33 H new ATOM 0 HZ3 LYS A 21 -24.477 -12.911 -29.223 1.00 43.33 H new ATOM 345 N GLU A 22 -18.100 -11.824 -26.717 1.00 64.11 N ATOM 346 CA GLU A 22 -17.502 -10.496 -26.646 1.00 54.32 C ATOM 347 C GLU A 22 -16.089 -10.564 -26.075 1.00 62.34 C ATOM 348 O GLU A 22 -15.215 -9.785 -26.458 1.00 33.31 O ATOM 349 CB GLU A 22 -18.366 -9.569 -25.788 1.00 72.00 C ATOM 350 CG GLU A 22 -17.824 -8.153 -25.685 1.00 62.42 C ATOM 351 CD GLU A 22 -17.490 -7.557 -27.039 1.00 2.02 C ATOM 352 OE1 GLU A 22 -18.427 -7.307 -27.825 1.00 41.40 O ATOM 353 OE2 GLU A 22 -16.290 -7.340 -27.311 1.00 73.42 O ATOM 0 H GLU A 22 -18.871 -11.975 -26.067 1.00 64.11 H new ATOM 0 HA GLU A 22 -17.447 -10.097 -27.659 1.00 54.32 H new ATOM 0 HB2 GLU A 22 -19.372 -9.534 -26.206 1.00 72.00 H new ATOM 0 HB3 GLU A 22 -18.451 -9.990 -24.786 1.00 72.00 H new ATOM 0 HG2 GLU A 22 -18.559 -7.522 -25.186 1.00 62.42 H new ATOM 0 HG3 GLU A 22 -16.930 -8.155 -25.062 1.00 62.42 H new ATOM 360 N ILE A 23 -15.872 -11.501 -25.158 1.00 74.02 N ATOM 361 CA ILE A 23 -14.566 -11.672 -24.535 1.00 41.01 C ATOM 362 C ILE A 23 -13.522 -12.109 -25.557 1.00 52.25 C ATOM 363 O ILE A 23 -12.348 -11.754 -25.453 1.00 41.23 O ATOM 364 CB ILE A 23 -14.617 -12.707 -23.396 1.00 4.13 C ATOM 365 CG1 ILE A 23 -15.599 -12.257 -22.312 1.00 71.34 C ATOM 366 CG2 ILE A 23 -13.229 -12.915 -22.807 1.00 12.21 C ATOM 367 CD1 ILE A 23 -16.299 -13.404 -21.618 1.00 21.44 C ATOM 0 H ILE A 23 -16.584 -12.153 -24.830 1.00 74.02 H new ATOM 0 HA ILE A 23 -14.284 -10.703 -24.123 1.00 41.01 H new ATOM 0 HB ILE A 23 -14.964 -13.657 -23.803 1.00 4.13 H new ATOM 0 HG12 ILE A 23 -15.062 -11.667 -21.569 1.00 71.34 H new ATOM 0 HG13 ILE A 23 -16.347 -11.603 -22.760 1.00 71.34 H new ATOM 0 HG21 ILE A 23 -13.281 -13.649 -22.003 1.00 12.21 H new ATOM 0 HG22 ILE A 23 -12.554 -13.275 -23.584 1.00 12.21 H new ATOM 0 HG23 ILE A 23 -12.856 -11.970 -22.412 1.00 12.21 H new ATOM 0 HD11 ILE A 23 -16.979 -13.011 -20.862 1.00 21.44 H new ATOM 0 HD12 ILE A 23 -16.864 -13.982 -22.350 1.00 21.44 H new ATOM 0 HD13 ILE A 23 -15.559 -14.047 -21.141 1.00 21.44 H new ATOM 379 N LYS A 24 -13.958 -12.880 -26.547 1.00 74.33 N ATOM 380 CA LYS A 24 -13.064 -13.364 -27.592 1.00 62.21 C ATOM 381 C LYS A 24 -12.482 -12.203 -28.391 1.00 51.53 C ATOM 382 O LYS A 24 -11.302 -12.207 -28.744 1.00 55.10 O ATOM 383 CB LYS A 24 -13.809 -14.319 -28.528 1.00 44.21 C ATOM 384 CG LYS A 24 -13.778 -15.767 -28.070 1.00 55.40 C ATOM 385 CD LYS A 24 -14.991 -16.535 -28.569 1.00 1.30 C ATOM 386 CE LYS A 24 -14.738 -17.148 -29.938 1.00 24.14 C ATOM 387 NZ LYS A 24 -15.159 -16.239 -31.039 1.00 70.24 N ATOM 0 H LYS A 24 -14.927 -13.184 -26.648 1.00 74.33 H new ATOM 0 HA LYS A 24 -12.244 -13.900 -27.114 1.00 62.21 H new ATOM 0 HB2 LYS A 24 -14.846 -13.996 -28.613 1.00 44.21 H new ATOM 0 HB3 LYS A 24 -13.372 -14.252 -29.524 1.00 44.21 H new ATOM 0 HG2 LYS A 24 -12.868 -16.245 -28.433 1.00 55.40 H new ATOM 0 HG3 LYS A 24 -13.745 -15.805 -26.981 1.00 55.40 H new ATOM 0 HD2 LYS A 24 -15.243 -17.322 -27.858 1.00 1.30 H new ATOM 0 HD3 LYS A 24 -15.850 -15.866 -28.622 1.00 1.30 H new ATOM 0 HE2 LYS A 24 -13.678 -17.378 -30.042 1.00 24.14 H new ATOM 0 HE3 LYS A 24 -15.278 -18.091 -30.019 1.00 24.14 H new ATOM 0 HZ1 LYS A 24 -14.970 -16.693 -31.955 1.00 70.24 H new ATOM 0 HZ2 LYS A 24 -16.176 -16.039 -30.955 1.00 70.24 H new ATOM 0 HZ3 LYS A 24 -14.625 -15.349 -30.977 1.00 70.24 H new ATOM 401 N LYS A 25 -13.316 -11.208 -28.673 1.00 55.40 N ATOM 402 CA LYS A 25 -12.885 -10.037 -29.428 1.00 72.21 C ATOM 403 C LYS A 25 -11.938 -9.174 -28.600 1.00 73.22 C ATOM 404 O LYS A 25 -10.881 -8.764 -29.077 1.00 44.10 O ATOM 405 CB LYS A 25 -14.097 -9.210 -29.863 1.00 32.20 C ATOM 406 CG LYS A 25 -14.894 -9.845 -30.989 1.00 72.23 C ATOM 407 CD LYS A 25 -16.333 -9.358 -30.997 1.00 55.05 C ATOM 408 CE LYS A 25 -16.445 -7.959 -31.584 1.00 11.14 C ATOM 409 NZ LYS A 25 -16.257 -7.960 -33.061 1.00 11.21 N ATOM 0 H LYS A 25 -14.296 -11.189 -28.390 1.00 55.40 H new ATOM 0 HA LYS A 25 -12.352 -10.383 -30.314 1.00 72.21 H new ATOM 0 HB2 LYS A 25 -14.752 -9.061 -29.004 1.00 32.20 H new ATOM 0 HB3 LYS A 25 -13.758 -8.224 -30.180 1.00 32.20 H new ATOM 0 HG2 LYS A 25 -14.425 -9.612 -31.945 1.00 72.23 H new ATOM 0 HG3 LYS A 25 -14.877 -10.930 -30.882 1.00 72.23 H new ATOM 0 HD2 LYS A 25 -16.948 -10.047 -31.576 1.00 55.05 H new ATOM 0 HD3 LYS A 25 -16.724 -9.359 -29.980 1.00 55.05 H new ATOM 0 HE2 LYS A 25 -17.422 -7.541 -31.343 1.00 11.14 H new ATOM 0 HE3 LYS A 25 -15.699 -7.311 -31.123 1.00 11.14 H new ATOM 0 HZ1 LYS A 25 -16.554 -7.042 -33.449 1.00 11.21 H new ATOM 0 HZ2 LYS A 25 -15.254 -8.121 -33.283 1.00 11.21 H new ATOM 0 HZ3 LYS A 25 -16.831 -8.717 -33.484 1.00 11.21 H new ATOM 423 N ALA A 26 -12.325 -8.904 -27.358 1.00 21.02 N ATOM 424 CA ALA A 26 -11.509 -8.093 -26.463 1.00 65.10 C ATOM 425 C ALA A 26 -10.177 -8.774 -26.166 1.00 62.24 C ATOM 426 O ALA A 26 -9.164 -8.110 -25.946 1.00 12.44 O ATOM 427 CB ALA A 26 -12.260 -7.814 -25.170 1.00 34.20 C ATOM 0 H ALA A 26 -13.199 -9.235 -26.949 1.00 21.02 H new ATOM 0 HA ALA A 26 -11.301 -7.146 -26.961 1.00 65.10 H new ATOM 0 HB1 ALA A 26 -11.638 -7.207 -24.512 1.00 34.20 H new ATOM 0 HB2 ALA A 26 -13.182 -7.278 -25.393 1.00 34.20 H new ATOM 0 HB3 ALA A 26 -12.498 -8.756 -24.677 1.00 34.20 H new ATOM 433 N TYR A 27 -10.185 -10.103 -26.162 1.00 52.52 N ATOM 434 CA TYR A 27 -8.978 -10.874 -25.889 1.00 52.44 C ATOM 435 C TYR A 27 -8.011 -10.807 -27.067 1.00 40.44 C ATOM 436 O TYR A 27 -6.793 -10.795 -26.886 1.00 33.52 O ATOM 437 CB TYR A 27 -9.335 -12.331 -25.591 1.00 12.45 C ATOM 438 CG TYR A 27 -8.133 -13.245 -25.513 1.00 14.23 C ATOM 439 CD1 TYR A 27 -7.069 -12.956 -24.668 1.00 11.42 C ATOM 440 CD2 TYR A 27 -8.063 -14.399 -26.284 1.00 2.32 C ATOM 441 CE1 TYR A 27 -5.969 -13.788 -24.594 1.00 41.34 C ATOM 442 CE2 TYR A 27 -6.967 -15.237 -26.216 1.00 32.43 C ATOM 443 CZ TYR A 27 -5.923 -14.927 -25.370 1.00 24.41 C ATOM 444 OH TYR A 27 -4.829 -15.760 -25.298 1.00 51.45 O ATOM 0 H TYR A 27 -11.014 -10.668 -26.345 1.00 52.52 H new ATOM 0 HA TYR A 27 -8.490 -10.440 -25.016 1.00 52.44 H new ATOM 0 HB2 TYR A 27 -9.878 -12.377 -24.647 1.00 12.45 H new ATOM 0 HB3 TYR A 27 -10.009 -12.697 -26.365 1.00 12.45 H new ATOM 0 HD1 TYR A 27 -7.102 -12.065 -24.058 1.00 11.42 H new ATOM 0 HD2 TYR A 27 -8.879 -14.645 -26.947 1.00 2.32 H new ATOM 0 HE1 TYR A 27 -5.150 -13.548 -23.932 1.00 41.34 H new ATOM 0 HE2 TYR A 27 -6.928 -16.130 -26.822 1.00 32.43 H new ATOM 0 HH TYR A 27 -4.954 -16.518 -25.907 1.00 51.45 H new ATOM 454 N TYR A 28 -8.562 -10.762 -28.275 1.00 15.50 N ATOM 455 CA TYR A 28 -7.750 -10.697 -29.484 1.00 73.32 C ATOM 456 C TYR A 28 -7.160 -9.303 -29.670 1.00 43.04 C ATOM 457 O TYR A 28 -5.966 -9.153 -29.932 1.00 35.05 O ATOM 458 CB TYR A 28 -8.588 -11.076 -30.707 1.00 24.11 C ATOM 459 CG TYR A 28 -7.838 -10.959 -32.014 1.00 44.35 C ATOM 460 CD1 TYR A 28 -8.299 -10.132 -33.031 1.00 50.12 C ATOM 461 CD2 TYR A 28 -6.666 -11.674 -32.233 1.00 35.14 C ATOM 462 CE1 TYR A 28 -7.617 -10.022 -34.228 1.00 32.34 C ATOM 463 CE2 TYR A 28 -5.977 -11.570 -33.425 1.00 53.54 C ATOM 464 CZ TYR A 28 -6.457 -10.743 -34.420 1.00 1.11 C ATOM 465 OH TYR A 28 -5.774 -10.635 -35.610 1.00 30.43 O ATOM 0 H TYR A 28 -9.568 -10.769 -28.443 1.00 15.50 H new ATOM 0 HA TYR A 28 -6.930 -11.407 -29.379 1.00 73.32 H new ATOM 0 HB2 TYR A 28 -8.942 -12.100 -30.591 1.00 24.11 H new ATOM 0 HB3 TYR A 28 -9.470 -10.436 -30.745 1.00 24.11 H new ATOM 0 HD1 TYR A 28 -9.206 -9.565 -32.883 1.00 50.12 H new ATOM 0 HD2 TYR A 28 -6.288 -12.323 -31.457 1.00 35.14 H new ATOM 0 HE1 TYR A 28 -7.990 -9.375 -35.008 1.00 32.34 H new ATOM 0 HE2 TYR A 28 -5.068 -12.133 -33.578 1.00 53.54 H new ATOM 0 HH TYR A 28 -4.978 -11.206 -35.583 1.00 30.43 H new ATOM 475 N GLN A 29 -8.005 -8.286 -29.533 1.00 62.41 N ATOM 476 CA GLN A 29 -7.567 -6.904 -29.686 1.00 53.11 C ATOM 477 C GLN A 29 -6.477 -6.563 -28.675 1.00 54.13 C ATOM 478 O GLN A 29 -5.567 -5.785 -28.966 1.00 75.22 O ATOM 479 CB GLN A 29 -8.752 -5.950 -29.518 1.00 64.51 C ATOM 480 CG GLN A 29 -9.185 -5.767 -28.073 1.00 22.25 C ATOM 481 CD GLN A 29 -10.308 -4.761 -27.923 1.00 55.42 C ATOM 482 OE1 GLN A 29 -10.641 -4.040 -28.865 1.00 32.04 O ATOM 483 NE2 GLN A 29 -10.901 -4.706 -26.736 1.00 3.11 N ATOM 0 H GLN A 29 -8.996 -8.393 -29.317 1.00 62.41 H new ATOM 0 HA GLN A 29 -7.156 -6.788 -30.689 1.00 53.11 H new ATOM 0 HB2 GLN A 29 -8.488 -4.978 -29.935 1.00 64.51 H new ATOM 0 HB3 GLN A 29 -9.596 -6.326 -30.097 1.00 64.51 H new ATOM 0 HG2 GLN A 29 -9.506 -6.727 -27.670 1.00 22.25 H new ATOM 0 HG3 GLN A 29 -8.330 -5.442 -27.480 1.00 22.25 H new ATOM 0 HE21 GLN A 29 -10.593 -5.322 -25.983 1.00 3.11 H new ATOM 0 HE22 GLN A 29 -11.664 -4.048 -26.577 1.00 3.11 H new ATOM 492 N LEU A 30 -6.575 -7.149 -27.487 1.00 53.31 N ATOM 493 CA LEU A 30 -5.597 -6.907 -26.432 1.00 14.21 C ATOM 494 C LEU A 30 -4.275 -7.598 -26.746 1.00 63.23 C ATOM 495 O LEU A 30 -3.202 -7.033 -26.536 1.00 51.21 O ATOM 496 CB LEU A 30 -6.136 -7.399 -25.088 1.00 13.05 C ATOM 497 CG LEU A 30 -6.477 -6.316 -24.064 1.00 10.53 C ATOM 498 CD1 LEU A 30 -7.376 -5.258 -24.685 1.00 12.01 C ATOM 499 CD2 LEU A 30 -7.139 -6.929 -22.839 1.00 14.34 C ATOM 0 H LEU A 30 -7.321 -7.795 -27.230 1.00 53.31 H new ATOM 0 HA LEU A 30 -5.419 -5.833 -26.374 1.00 14.21 H new ATOM 0 HB2 LEU A 30 -7.033 -7.991 -25.273 1.00 13.05 H new ATOM 0 HB3 LEU A 30 -5.398 -8.069 -24.647 1.00 13.05 H new ATOM 0 HG LEU A 30 -5.550 -5.836 -23.749 1.00 10.53 H new ATOM 0 HD11 LEU A 30 -7.608 -4.496 -23.941 1.00 12.01 H new ATOM 0 HD12 LEU A 30 -6.865 -4.797 -25.530 1.00 12.01 H new ATOM 0 HD13 LEU A 30 -8.300 -5.722 -25.029 1.00 12.01 H new ATOM 0 HD21 LEU A 30 -7.374 -6.143 -22.121 1.00 14.34 H new ATOM 0 HD22 LEU A 30 -8.057 -7.436 -23.137 1.00 14.34 H new ATOM 0 HD23 LEU A 30 -6.460 -7.648 -22.380 1.00 14.34 H new ATOM 511 N ALA A 31 -4.359 -8.824 -27.253 1.00 54.21 N ATOM 512 CA ALA A 31 -3.169 -9.591 -27.601 1.00 15.42 C ATOM 513 C ALA A 31 -2.307 -8.839 -28.609 1.00 52.11 C ATOM 514 O ALA A 31 -1.079 -8.846 -28.519 1.00 53.21 O ATOM 515 CB ALA A 31 -3.562 -10.954 -28.152 1.00 12.54 C ATOM 0 H ALA A 31 -5.239 -9.307 -27.432 1.00 54.21 H new ATOM 0 HA ALA A 31 -2.581 -9.734 -26.695 1.00 15.42 H new ATOM 0 HB1 ALA A 31 -2.664 -11.516 -28.408 1.00 12.54 H new ATOM 0 HB2 ALA A 31 -4.130 -11.501 -27.399 1.00 12.54 H new ATOM 0 HB3 ALA A 31 -4.174 -10.823 -29.044 1.00 12.54 H new ATOM 521 N LYS A 32 -2.957 -8.191 -29.570 1.00 73.31 N ATOM 522 CA LYS A 32 -2.251 -7.434 -30.596 1.00 42.31 C ATOM 523 C LYS A 32 -1.441 -6.300 -29.975 1.00 21.33 C ATOM 524 O LYS A 32 -0.480 -5.811 -30.570 1.00 15.24 O ATOM 525 CB LYS A 32 -3.243 -6.867 -31.615 1.00 24.15 C ATOM 526 CG LYS A 32 -3.804 -7.912 -32.563 1.00 33.11 C ATOM 527 CD LYS A 32 -5.256 -7.627 -32.911 1.00 3.12 C ATOM 528 CE LYS A 32 -5.372 -6.550 -33.978 1.00 43.34 C ATOM 529 NZ LYS A 32 -6.755 -6.455 -34.523 1.00 5.13 N ATOM 0 H LYS A 32 -3.973 -8.175 -29.659 1.00 73.31 H new ATOM 0 HA LYS A 32 -1.565 -8.112 -31.104 1.00 42.31 H new ATOM 0 HB2 LYS A 32 -4.067 -6.392 -31.082 1.00 24.15 H new ATOM 0 HB3 LYS A 32 -2.749 -6.089 -32.197 1.00 24.15 H new ATOM 0 HG2 LYS A 32 -3.208 -7.934 -33.475 1.00 33.11 H new ATOM 0 HG3 LYS A 32 -3.725 -8.899 -32.106 1.00 33.11 H new ATOM 0 HD2 LYS A 32 -5.733 -8.542 -33.262 1.00 3.12 H new ATOM 0 HD3 LYS A 32 -5.791 -7.312 -32.015 1.00 3.12 H new ATOM 0 HE2 LYS A 32 -5.081 -5.588 -33.556 1.00 43.34 H new ATOM 0 HE3 LYS A 32 -4.676 -6.766 -34.789 1.00 43.34 H new ATOM 0 HZ1 LYS A 32 -6.719 -6.104 -35.501 1.00 5.13 H new ATOM 0 HZ2 LYS A 32 -7.199 -7.395 -34.509 1.00 5.13 H new ATOM 0 HZ3 LYS A 32 -7.314 -5.800 -33.940 1.00 5.13 H new ATOM 543 N LYS A 33 -1.833 -5.888 -28.774 1.00 32.20 N ATOM 544 CA LYS A 33 -1.143 -4.814 -28.070 1.00 25.43 C ATOM 545 C LYS A 33 0.136 -5.327 -27.415 1.00 61.41 C ATOM 546 O LYS A 33 1.142 -4.620 -27.357 1.00 1.11 O ATOM 547 CB LYS A 33 -2.059 -4.199 -27.010 1.00 34.41 C ATOM 548 CG LYS A 33 -3.470 -3.935 -27.506 1.00 13.50 C ATOM 549 CD LYS A 33 -4.150 -2.842 -26.697 1.00 61.41 C ATOM 550 CE LYS A 33 -4.033 -1.488 -27.380 1.00 75.53 C ATOM 551 NZ LYS A 33 -4.770 -1.455 -28.674 1.00 63.03 N ATOM 0 H LYS A 33 -2.626 -6.282 -28.268 1.00 32.20 H new ATOM 0 HA LYS A 33 -0.876 -4.049 -28.799 1.00 25.43 H new ATOM 0 HB2 LYS A 33 -2.104 -4.866 -26.149 1.00 34.41 H new ATOM 0 HB3 LYS A 33 -1.623 -3.262 -26.664 1.00 34.41 H new ATOM 0 HG2 LYS A 33 -3.439 -3.646 -28.556 1.00 13.50 H new ATOM 0 HG3 LYS A 33 -4.056 -4.852 -27.445 1.00 13.50 H new ATOM 0 HD2 LYS A 33 -5.202 -3.091 -26.559 1.00 61.41 H new ATOM 0 HD3 LYS A 33 -3.702 -2.790 -25.705 1.00 61.41 H new ATOM 0 HE2 LYS A 33 -4.423 -0.713 -26.720 1.00 75.53 H new ATOM 0 HE3 LYS A 33 -2.982 -1.259 -27.555 1.00 75.53 H new ATOM 0 HZ1 LYS A 33 -5.033 -0.474 -28.899 1.00 63.03 H new ATOM 0 HZ2 LYS A 33 -4.163 -1.833 -29.429 1.00 63.03 H new ATOM 0 HZ3 LYS A 33 -5.630 -2.035 -28.599 1.00 63.03 H new ATOM 786 N LYS A 48 3.225 -9.528 -19.741 1.00 50.22 N ATOM 787 CA LYS A 48 1.870 -8.997 -19.645 1.00 23.21 C ATOM 788 C LYS A 48 0.927 -9.739 -20.587 1.00 43.20 C ATOM 789 O LYS A 48 -0.248 -9.937 -20.276 1.00 45.35 O ATOM 790 CB LYS A 48 1.862 -7.502 -19.971 1.00 12.15 C ATOM 791 CG LYS A 48 2.895 -6.704 -19.193 1.00 74.33 C ATOM 792 CD LYS A 48 2.594 -6.705 -17.704 1.00 25.33 C ATOM 793 CE LYS A 48 3.745 -6.114 -16.903 1.00 33.40 C ATOM 794 NZ LYS A 48 3.371 -5.889 -15.479 1.00 62.21 N ATOM 0 HA LYS A 48 1.521 -9.141 -18.622 1.00 23.21 H new ATOM 0 HB2 LYS A 48 2.042 -7.370 -21.038 1.00 12.15 H new ATOM 0 HB3 LYS A 48 0.871 -7.099 -19.763 1.00 12.15 H new ATOM 0 HG2 LYS A 48 3.886 -7.124 -19.365 1.00 74.33 H new ATOM 0 HG3 LYS A 48 2.916 -5.678 -19.560 1.00 74.33 H new ATOM 0 HD2 LYS A 48 1.686 -6.133 -17.515 1.00 25.33 H new ATOM 0 HD3 LYS A 48 2.403 -7.725 -17.371 1.00 25.33 H new ATOM 0 HE2 LYS A 48 4.603 -6.784 -16.952 1.00 33.40 H new ATOM 0 HE3 LYS A 48 4.052 -5.169 -17.352 1.00 33.40 H new ATOM 0 HZ1 LYS A 48 4.181 -5.486 -14.967 1.00 62.21 H new ATOM 0 HZ2 LYS A 48 2.568 -5.230 -15.431 1.00 62.21 H new ATOM 0 HZ3 LYS A 48 3.102 -6.794 -15.044 1.00 62.21 H new ATOM 808 N PHE A 49 1.450 -10.148 -21.738 1.00 54.14 N ATOM 809 CA PHE A 49 0.654 -10.868 -22.726 1.00 21.44 C ATOM 810 C PHE A 49 0.129 -12.180 -22.149 1.00 11.23 C ATOM 811 O PHE A 49 -0.955 -12.638 -22.508 1.00 74.52 O ATOM 812 CB PHE A 49 1.487 -11.147 -23.978 1.00 42.25 C ATOM 813 CG PHE A 49 0.805 -12.054 -24.963 1.00 2.44 C ATOM 814 CD1 PHE A 49 0.028 -11.531 -25.983 1.00 41.44 C ATOM 815 CD2 PHE A 49 0.941 -13.429 -24.866 1.00 70.24 C ATOM 816 CE1 PHE A 49 -0.601 -12.362 -26.891 1.00 64.30 C ATOM 817 CE2 PHE A 49 0.315 -14.266 -25.771 1.00 41.32 C ATOM 818 CZ PHE A 49 -0.458 -13.732 -26.784 1.00 4.20 C ATOM 0 H PHE A 49 2.421 -9.993 -22.010 1.00 54.14 H new ATOM 0 HA PHE A 49 -0.197 -10.243 -22.996 1.00 21.44 H new ATOM 0 HB2 PHE A 49 1.720 -10.201 -24.468 1.00 42.25 H new ATOM 0 HB3 PHE A 49 2.436 -11.594 -23.681 1.00 42.25 H new ATOM 0 HD1 PHE A 49 -0.088 -10.461 -26.070 1.00 41.44 H new ATOM 0 HD2 PHE A 49 1.543 -13.852 -24.075 1.00 70.24 H new ATOM 0 HE1 PHE A 49 -1.203 -11.941 -27.683 1.00 64.30 H new ATOM 0 HE2 PHE A 49 0.430 -15.336 -25.686 1.00 41.32 H new ATOM 0 HZ PHE A 49 -0.949 -14.384 -27.491 1.00 4.20 H new ATOM 828 N SER A 50 0.906 -12.778 -21.252 1.00 64.41 N ATOM 829 CA SER A 50 0.523 -14.039 -20.628 1.00 32.20 C ATOM 830 C SER A 50 -0.712 -13.858 -19.751 1.00 12.42 C ATOM 831 O SER A 50 -1.538 -14.762 -19.630 1.00 54.40 O ATOM 832 CB SER A 50 1.679 -14.592 -19.792 1.00 41.52 C ATOM 833 OG SER A 50 1.209 -15.486 -18.799 1.00 13.01 O ATOM 0 H SER A 50 1.805 -12.410 -20.941 1.00 64.41 H new ATOM 0 HA SER A 50 0.285 -14.749 -21.420 1.00 32.20 H new ATOM 0 HB2 SER A 50 2.388 -15.105 -20.441 1.00 41.52 H new ATOM 0 HB3 SER A 50 2.216 -13.769 -19.320 1.00 41.52 H new ATOM 0 HG SER A 50 1.967 -15.826 -18.280 1.00 13.01 H new ATOM 839 N GLN A 51 -0.830 -12.682 -19.141 1.00 63.33 N ATOM 840 CA GLN A 51 -1.963 -12.382 -18.275 1.00 10.25 C ATOM 841 C GLN A 51 -3.268 -12.384 -19.064 1.00 62.11 C ATOM 842 O GLN A 51 -4.334 -12.674 -18.520 1.00 73.44 O ATOM 843 CB GLN A 51 -1.767 -11.026 -17.595 1.00 2.41 C ATOM 844 CG GLN A 51 -0.639 -11.013 -16.576 1.00 30.44 C ATOM 845 CD GLN A 51 -0.248 -9.610 -16.155 1.00 23.51 C ATOM 846 OE1 GLN A 51 -0.096 -8.719 -16.991 1.00 22.03 O ATOM 847 NE2 GLN A 51 -0.082 -9.407 -14.853 1.00 53.12 N ATOM 0 H GLN A 51 -0.155 -11.923 -19.231 1.00 63.33 H new ATOM 0 HA GLN A 51 -2.020 -13.159 -17.512 1.00 10.25 H new ATOM 0 HB2 GLN A 51 -1.566 -10.273 -18.357 1.00 2.41 H new ATOM 0 HB3 GLN A 51 -2.695 -10.739 -17.101 1.00 2.41 H new ATOM 0 HG2 GLN A 51 -0.943 -11.581 -15.696 1.00 30.44 H new ATOM 0 HG3 GLN A 51 0.231 -11.518 -16.996 1.00 30.44 H new ATOM 0 HE21 GLN A 51 -0.219 -10.175 -14.196 1.00 53.12 H new ATOM 0 HE22 GLN A 51 0.182 -8.483 -14.510 1.00 53.12 H new ATOM 856 N LEU A 52 -3.177 -12.059 -20.349 1.00 4.52 N ATOM 857 CA LEU A 52 -4.350 -12.023 -21.214 1.00 54.42 C ATOM 858 C LEU A 52 -4.941 -13.418 -21.389 1.00 61.11 C ATOM 859 O LEU A 52 -6.147 -13.615 -21.246 1.00 53.35 O ATOM 860 CB LEU A 52 -3.984 -11.437 -22.579 1.00 15.50 C ATOM 861 CG LEU A 52 -3.291 -10.074 -22.560 1.00 64.11 C ATOM 862 CD1 LEU A 52 -2.587 -9.815 -23.883 1.00 55.25 C ATOM 863 CD2 LEU A 52 -4.293 -8.969 -22.261 1.00 72.04 C ATOM 0 H LEU A 52 -2.302 -11.817 -20.815 1.00 4.52 H new ATOM 0 HA LEU A 52 -5.099 -11.388 -20.742 1.00 54.42 H new ATOM 0 HB2 LEU A 52 -3.335 -12.145 -23.094 1.00 15.50 H new ATOM 0 HB3 LEU A 52 -4.895 -11.351 -23.171 1.00 15.50 H new ATOM 0 HG LEU A 52 -2.542 -10.080 -21.768 1.00 64.11 H new ATOM 0 HD11 LEU A 52 -2.100 -8.841 -23.851 1.00 55.25 H new ATOM 0 HD12 LEU A 52 -1.839 -10.589 -24.055 1.00 55.25 H new ATOM 0 HD13 LEU A 52 -3.317 -9.829 -24.692 1.00 55.25 H new ATOM 0 HD21 LEU A 52 -3.781 -8.007 -22.252 1.00 72.04 H new ATOM 0 HD22 LEU A 52 -5.066 -8.961 -23.029 1.00 72.04 H new ATOM 0 HD23 LEU A 52 -4.750 -9.146 -21.288 1.00 72.04 H new ATOM 875 N ALA A 53 -4.082 -14.384 -21.697 1.00 23.21 N ATOM 876 CA ALA A 53 -4.518 -15.762 -21.887 1.00 24.12 C ATOM 877 C ALA A 53 -4.958 -16.386 -20.567 1.00 1.53 C ATOM 878 O ALA A 53 -5.863 -17.219 -20.535 1.00 41.42 O ATOM 879 CB ALA A 53 -3.404 -16.586 -22.516 1.00 41.13 C ATOM 0 H ALA A 53 -3.080 -14.238 -21.820 1.00 23.21 H new ATOM 0 HA ALA A 53 -5.376 -15.756 -22.560 1.00 24.12 H new ATOM 0 HB1 ALA A 53 -3.743 -17.613 -22.652 1.00 41.13 H new ATOM 0 HB2 ALA A 53 -3.138 -16.160 -23.484 1.00 41.13 H new ATOM 0 HB3 ALA A 53 -2.531 -16.576 -21.863 1.00 41.13 H new ATOM 885 N GLU A 54 -4.311 -15.977 -19.480 1.00 12.45 N ATOM 886 CA GLU A 54 -4.636 -16.497 -18.157 1.00 34.41 C ATOM 887 C GLU A 54 -6.047 -16.089 -17.743 1.00 74.23 C ATOM 888 O GLU A 54 -6.850 -16.925 -17.328 1.00 2.54 O ATOM 889 CB GLU A 54 -3.625 -15.996 -17.124 1.00 51.30 C ATOM 890 CG GLU A 54 -2.404 -16.889 -16.985 1.00 4.53 C ATOM 891 CD GLU A 54 -2.697 -18.164 -16.219 1.00 13.34 C ATOM 892 OE1 GLU A 54 -3.492 -18.107 -15.257 1.00 30.42 O ATOM 893 OE2 GLU A 54 -2.133 -19.217 -16.580 1.00 63.10 O ATOM 0 H GLU A 54 -3.559 -15.288 -19.490 1.00 12.45 H new ATOM 0 HA GLU A 54 -4.589 -17.585 -18.202 1.00 34.41 H new ATOM 0 HB2 GLU A 54 -3.301 -14.993 -17.402 1.00 51.30 H new ATOM 0 HB3 GLU A 54 -4.118 -15.915 -16.155 1.00 51.30 H new ATOM 0 HG2 GLU A 54 -2.030 -17.143 -17.977 1.00 4.53 H new ATOM 0 HG3 GLU A 54 -1.612 -16.339 -16.477 1.00 4.53 H new ATOM 900 N ALA A 55 -6.342 -14.799 -17.860 1.00 41.51 N ATOM 901 CA ALA A 55 -7.655 -14.279 -17.500 1.00 73.02 C ATOM 902 C ALA A 55 -8.711 -14.707 -18.514 1.00 14.53 C ATOM 903 O ALA A 55 -9.840 -15.034 -18.148 1.00 34.44 O ATOM 904 CB ALA A 55 -7.611 -12.762 -17.390 1.00 23.25 C ATOM 0 H ALA A 55 -5.689 -14.094 -18.202 1.00 41.51 H new ATOM 0 HA ALA A 55 -7.929 -14.694 -16.530 1.00 73.02 H new ATOM 0 HB1 ALA A 55 -8.599 -12.388 -17.121 1.00 23.25 H new ATOM 0 HB2 ALA A 55 -6.892 -12.474 -16.623 1.00 23.25 H new ATOM 0 HB3 ALA A 55 -7.311 -12.336 -18.347 1.00 23.25 H new ATOM 910 N TYR A 56 -8.338 -14.700 -19.788 1.00 60.24 N ATOM 911 CA TYR A 56 -9.255 -15.084 -20.855 1.00 65.43 C ATOM 912 C TYR A 56 -9.681 -16.542 -20.709 1.00 1.14 C ATOM 913 O TYR A 56 -10.765 -16.929 -21.144 1.00 64.21 O ATOM 914 CB TYR A 56 -8.600 -14.868 -22.221 1.00 14.31 C ATOM 915 CG TYR A 56 -9.326 -15.555 -23.356 1.00 10.43 C ATOM 916 CD1 TYR A 56 -10.386 -14.933 -24.006 1.00 24.45 C ATOM 917 CD2 TYR A 56 -8.953 -16.825 -23.778 1.00 10.35 C ATOM 918 CE1 TYR A 56 -11.052 -15.557 -25.042 1.00 71.34 C ATOM 919 CE2 TYR A 56 -9.613 -17.455 -24.814 1.00 62.44 C ATOM 920 CZ TYR A 56 -10.662 -16.818 -25.444 1.00 3.15 C ATOM 921 OH TYR A 56 -11.322 -17.443 -26.476 1.00 34.41 O ATOM 0 H TYR A 56 -7.407 -14.433 -20.108 1.00 60.24 H new ATOM 0 HA TYR A 56 -10.142 -14.455 -20.780 1.00 65.43 H new ATOM 0 HB2 TYR A 56 -8.551 -13.799 -22.426 1.00 14.31 H new ATOM 0 HB3 TYR A 56 -7.573 -15.232 -22.184 1.00 14.31 H new ATOM 0 HD1 TYR A 56 -10.694 -13.945 -23.695 1.00 24.45 H new ATOM 0 HD2 TYR A 56 -8.133 -17.328 -23.287 1.00 10.35 H new ATOM 0 HE1 TYR A 56 -11.874 -15.060 -25.535 1.00 71.34 H new ATOM 0 HE2 TYR A 56 -9.309 -18.442 -25.130 1.00 62.44 H new ATOM 0 HH TYR A 56 -10.922 -18.324 -26.634 1.00 34.41 H new ATOM 931 N GLU A 57 -8.819 -17.344 -20.091 1.00 75.42 N ATOM 932 CA GLU A 57 -9.106 -18.759 -19.887 1.00 34.42 C ATOM 933 C GLU A 57 -10.344 -18.943 -19.013 1.00 51.04 C ATOM 934 O GLU A 57 -11.214 -19.761 -19.313 1.00 63.14 O ATOM 935 CB GLU A 57 -7.907 -19.458 -19.244 1.00 24.14 C ATOM 936 CG GLU A 57 -6.927 -20.037 -20.251 1.00 14.01 C ATOM 937 CD GLU A 57 -7.356 -21.397 -20.766 1.00 72.11 C ATOM 938 OE1 GLU A 57 -6.967 -22.414 -20.155 1.00 2.34 O ATOM 939 OE2 GLU A 57 -8.082 -21.444 -21.781 1.00 60.35 O ATOM 0 H GLU A 57 -7.918 -17.038 -19.724 1.00 75.42 H new ATOM 0 HA GLU A 57 -9.300 -19.208 -20.861 1.00 34.42 H new ATOM 0 HB2 GLU A 57 -7.382 -18.747 -18.606 1.00 24.14 H new ATOM 0 HB3 GLU A 57 -8.267 -20.259 -18.599 1.00 24.14 H new ATOM 0 HG2 GLU A 57 -6.826 -19.350 -21.091 1.00 14.01 H new ATOM 0 HG3 GLU A 57 -5.944 -20.121 -19.788 1.00 14.01 H new ATOM 946 N VAL A 58 -10.416 -18.176 -17.930 1.00 50.33 N ATOM 947 CA VAL A 58 -11.547 -18.252 -17.013 1.00 25.33 C ATOM 948 C VAL A 58 -12.785 -17.594 -17.610 1.00 41.33 C ATOM 949 O VAL A 58 -13.892 -18.126 -17.515 1.00 43.20 O ATOM 950 CB VAL A 58 -11.222 -17.582 -15.665 1.00 2.33 C ATOM 951 CG1 VAL A 58 -12.422 -17.647 -14.733 1.00 20.44 C ATOM 952 CG2 VAL A 58 -10.004 -18.232 -15.026 1.00 70.41 C ATOM 0 H VAL A 58 -9.704 -17.495 -17.666 1.00 50.33 H new ATOM 0 HA VAL A 58 -11.748 -19.310 -16.846 1.00 25.33 H new ATOM 0 HB VAL A 58 -10.991 -16.533 -15.848 1.00 2.33 H new ATOM 0 HG11 VAL A 58 -12.173 -17.169 -13.786 1.00 20.44 H new ATOM 0 HG12 VAL A 58 -13.266 -17.130 -15.190 1.00 20.44 H new ATOM 0 HG13 VAL A 58 -12.688 -18.689 -14.554 1.00 20.44 H new ATOM 0 HG21 VAL A 58 -9.789 -17.746 -14.074 1.00 70.41 H new ATOM 0 HG22 VAL A 58 -10.203 -19.290 -14.856 1.00 70.41 H new ATOM 0 HG23 VAL A 58 -9.145 -18.127 -15.689 1.00 70.41 H new ATOM 962 N LEU A 59 -12.591 -16.433 -18.227 1.00 35.20 N ATOM 963 CA LEU A 59 -13.693 -15.701 -18.842 1.00 10.42 C ATOM 964 C LEU A 59 -14.149 -16.382 -20.128 1.00 53.31 C ATOM 965 O LEU A 59 -15.163 -16.005 -20.716 1.00 33.24 O ATOM 966 CB LEU A 59 -13.272 -14.260 -19.136 1.00 10.32 C ATOM 967 CG LEU A 59 -13.703 -13.212 -18.109 1.00 54.44 C ATOM 968 CD1 LEU A 59 -13.304 -13.642 -16.707 1.00 32.44 C ATOM 969 CD2 LEU A 59 -13.099 -11.856 -18.445 1.00 51.12 C ATOM 0 H LEU A 59 -11.682 -15.979 -18.315 1.00 35.20 H new ATOM 0 HA LEU A 59 -14.528 -15.694 -18.141 1.00 10.42 H new ATOM 0 HB2 LEU A 59 -12.186 -14.230 -19.222 1.00 10.32 H new ATOM 0 HB3 LEU A 59 -13.676 -13.975 -20.107 1.00 10.32 H new ATOM 0 HG LEU A 59 -14.789 -13.123 -18.144 1.00 54.44 H new ATOM 0 HD11 LEU A 59 -13.619 -12.884 -15.990 1.00 32.44 H new ATOM 0 HD12 LEU A 59 -13.785 -14.590 -16.467 1.00 32.44 H new ATOM 0 HD13 LEU A 59 -12.222 -13.761 -16.657 1.00 32.44 H new ATOM 0 HD21 LEU A 59 -13.416 -11.123 -17.704 1.00 51.12 H new ATOM 0 HD22 LEU A 59 -12.012 -11.931 -18.439 1.00 51.12 H new ATOM 0 HD23 LEU A 59 -13.436 -11.542 -19.433 1.00 51.12 H new ATOM 981 N SER A 60 -13.395 -17.387 -20.559 1.00 24.52 N ATOM 982 CA SER A 60 -13.720 -18.121 -21.776 1.00 54.35 C ATOM 983 C SER A 60 -14.920 -19.037 -21.554 1.00 40.24 C ATOM 984 O SER A 60 -15.527 -19.525 -22.508 1.00 21.33 O ATOM 985 CB SER A 60 -12.516 -18.942 -22.240 1.00 61.12 C ATOM 986 OG SER A 60 -12.919 -20.217 -22.711 1.00 5.41 O ATOM 0 H SER A 60 -12.554 -17.712 -20.083 1.00 24.52 H new ATOM 0 HA SER A 60 -13.976 -17.397 -22.550 1.00 54.35 H new ATOM 0 HB2 SER A 60 -11.991 -18.408 -23.032 1.00 61.12 H new ATOM 0 HB3 SER A 60 -11.813 -19.061 -21.415 1.00 61.12 H new ATOM 0 HG SER A 60 -12.131 -20.722 -23.003 1.00 5.41 H new ATOM 992 N ASP A 61 -15.256 -19.265 -20.290 1.00 24.24 N ATOM 993 CA ASP A 61 -16.383 -20.122 -19.940 1.00 50.33 C ATOM 994 C ASP A 61 -17.223 -19.490 -18.835 1.00 34.00 C ATOM 995 O ASP A 61 -16.688 -18.949 -17.868 1.00 40.44 O ATOM 996 CB ASP A 61 -15.887 -21.499 -19.497 1.00 3.20 C ATOM 997 CG ASP A 61 -16.828 -22.614 -19.909 1.00 42.30 C ATOM 998 OD1 ASP A 61 -16.391 -23.783 -19.923 1.00 70.33 O ATOM 999 OD2 ASP A 61 -18.001 -22.316 -20.218 1.00 60.51 O ATOM 0 H ASP A 61 -14.764 -18.868 -19.490 1.00 24.24 H new ATOM 0 HA ASP A 61 -17.008 -20.238 -20.826 1.00 50.33 H new ATOM 0 HB2 ASP A 61 -14.902 -21.682 -19.926 1.00 3.20 H new ATOM 0 HB3 ASP A 61 -15.770 -21.508 -18.413 1.00 3.20 H new ATOM 1004 N GLU A 62 -18.542 -19.563 -18.986 1.00 52.21 N ATOM 1005 CA GLU A 62 -19.456 -18.996 -18.001 1.00 23.00 C ATOM 1006 C GLU A 62 -19.234 -19.625 -16.628 1.00 41.43 C ATOM 1007 O GLU A 62 -19.222 -18.932 -15.610 1.00 62.15 O ATOM 1008 CB GLU A 62 -20.907 -19.203 -18.440 1.00 42.41 C ATOM 1009 CG GLU A 62 -21.173 -18.788 -19.878 1.00 24.14 C ATOM 1010 CD GLU A 62 -22.641 -18.869 -20.246 1.00 73.21 C ATOM 1011 OE1 GLU A 62 -23.475 -18.332 -19.487 1.00 24.31 O ATOM 1012 OE2 GLU A 62 -22.957 -19.470 -21.295 1.00 2.13 O ATOM 0 H GLU A 62 -19.001 -20.009 -19.780 1.00 52.21 H new ATOM 0 HA GLU A 62 -19.255 -17.927 -17.929 1.00 23.00 H new ATOM 0 HB2 GLU A 62 -21.168 -20.255 -18.320 1.00 42.41 H new ATOM 0 HB3 GLU A 62 -21.562 -18.635 -17.780 1.00 42.41 H new ATOM 0 HG2 GLU A 62 -20.820 -17.768 -20.029 1.00 24.14 H new ATOM 0 HG3 GLU A 62 -20.598 -19.427 -20.549 1.00 24.14 H new ATOM 1019 N VAL A 63 -19.059 -20.942 -16.608 1.00 72.25 N ATOM 1020 CA VAL A 63 -18.837 -21.665 -15.362 1.00 73.40 C ATOM 1021 C VAL A 63 -17.613 -21.131 -14.627 1.00 60.23 C ATOM 1022 O VAL A 63 -17.689 -20.766 -13.454 1.00 12.01 O ATOM 1023 CB VAL A 63 -18.654 -23.174 -15.613 1.00 41.13 C ATOM 1024 CG1 VAL A 63 -18.569 -23.928 -14.295 1.00 73.53 C ATOM 1025 CG2 VAL A 63 -19.787 -23.712 -16.473 1.00 55.14 C ATOM 0 H VAL A 63 -19.067 -21.530 -17.441 1.00 72.25 H new ATOM 0 HA VAL A 63 -19.723 -21.512 -14.745 1.00 73.40 H new ATOM 0 HB VAL A 63 -17.718 -23.325 -16.151 1.00 41.13 H new ATOM 0 HG11 VAL A 63 -18.440 -24.992 -14.492 1.00 73.53 H new ATOM 0 HG12 VAL A 63 -17.720 -23.560 -13.719 1.00 73.53 H new ATOM 0 HG13 VAL A 63 -19.486 -23.773 -13.727 1.00 73.53 H new ATOM 0 HG21 VAL A 63 -19.642 -24.779 -16.640 1.00 55.14 H new ATOM 0 HG22 VAL A 63 -20.738 -23.551 -15.965 1.00 55.14 H new ATOM 0 HG23 VAL A 63 -19.795 -23.192 -17.431 1.00 55.14 H new ATOM 1035 N LYS A 64 -16.483 -21.088 -15.325 1.00 53.54 N ATOM 1036 CA LYS A 64 -15.241 -20.596 -14.741 1.00 61.23 C ATOM 1037 C LYS A 64 -15.370 -19.130 -14.341 1.00 35.12 C ATOM 1038 O LYS A 64 -14.988 -18.742 -13.237 1.00 25.42 O ATOM 1039 CB LYS A 64 -14.086 -20.765 -15.731 1.00 71.32 C ATOM 1040 CG LYS A 64 -13.632 -22.205 -15.896 1.00 21.33 C ATOM 1041 CD LYS A 64 -12.157 -22.288 -16.251 1.00 3.35 C ATOM 1042 CE LYS A 64 -11.278 -21.869 -15.082 1.00 11.42 C ATOM 1043 NZ LYS A 64 -9.839 -22.152 -15.340 1.00 32.30 N ATOM 0 H LYS A 64 -16.402 -21.388 -16.296 1.00 53.54 H new ATOM 0 HA LYS A 64 -15.034 -21.182 -13.845 1.00 61.23 H new ATOM 0 HB2 LYS A 64 -14.391 -20.376 -16.702 1.00 71.32 H new ATOM 0 HB3 LYS A 64 -13.241 -20.163 -15.397 1.00 71.32 H new ATOM 0 HG2 LYS A 64 -13.816 -22.753 -14.972 1.00 21.33 H new ATOM 0 HG3 LYS A 64 -14.222 -22.686 -16.676 1.00 21.33 H new ATOM 0 HD2 LYS A 64 -11.910 -23.308 -16.547 1.00 3.35 H new ATOM 0 HD3 LYS A 64 -11.952 -21.649 -17.110 1.00 3.35 H new ATOM 0 HE2 LYS A 64 -11.410 -20.804 -14.892 1.00 11.42 H new ATOM 0 HE3 LYS A 64 -11.596 -22.395 -14.182 1.00 11.42 H new ATOM 0 HZ1 LYS A 64 -9.274 -21.852 -14.520 1.00 32.30 H new ATOM 0 HZ2 LYS A 64 -9.708 -23.172 -15.496 1.00 32.30 H new ATOM 0 HZ3 LYS A 64 -9.528 -21.630 -16.184 1.00 32.30 H new ATOM 1057 N ARG A 65 -15.914 -18.320 -15.244 1.00 25.41 N ATOM 1058 CA ARG A 65 -16.094 -16.897 -14.984 1.00 23.21 C ATOM 1059 C ARG A 65 -16.942 -16.676 -13.735 1.00 3.21 C ATOM 1060 O ARG A 65 -16.587 -15.883 -12.863 1.00 1.35 O ATOM 1061 CB ARG A 65 -16.750 -16.216 -16.186 1.00 71.43 C ATOM 1062 CG ARG A 65 -17.000 -14.731 -15.984 1.00 0.13 C ATOM 1063 CD ARG A 65 -17.948 -14.177 -17.036 1.00 10.13 C ATOM 1064 NE ARG A 65 -18.972 -13.315 -16.451 1.00 5.14 N ATOM 1065 CZ ARG A 65 -20.115 -13.015 -17.057 1.00 63.42 C ATOM 1066 NH1 ARG A 65 -20.379 -13.506 -18.260 1.00 71.12 N ATOM 1067 NH2 ARG A 65 -20.997 -12.224 -16.460 1.00 45.11 N ATOM 0 H ARG A 65 -16.238 -18.625 -16.162 1.00 25.41 H new ATOM 0 HA ARG A 65 -15.111 -16.456 -14.818 1.00 23.21 H new ATOM 0 HB2 ARG A 65 -16.115 -16.353 -17.061 1.00 71.43 H new ATOM 0 HB3 ARG A 65 -17.698 -16.710 -16.399 1.00 71.43 H new ATOM 0 HG2 ARG A 65 -17.418 -14.563 -14.991 1.00 0.13 H new ATOM 0 HG3 ARG A 65 -16.053 -14.193 -16.026 1.00 0.13 H new ATOM 0 HD2 ARG A 65 -17.379 -13.614 -17.776 1.00 10.13 H new ATOM 0 HD3 ARG A 65 -18.427 -15.002 -17.563 1.00 10.13 H new ATOM 0 HE ARG A 65 -18.800 -12.922 -15.526 1.00 5.14 H new ATOM 0 HH11 ARG A 65 -19.704 -14.115 -18.722 1.00 71.12 H new ATOM 0 HH12 ARG A 65 -21.257 -13.274 -18.724 1.00 71.12 H new ATOM 0 HH21 ARG A 65 -20.798 -11.845 -15.534 1.00 45.11 H new ATOM 0 HH22 ARG A 65 -21.874 -11.995 -16.927 1.00 45.11 H new ATOM 1081 N LYS A 66 -18.065 -17.382 -13.656 1.00 4.23 N ATOM 1082 CA LYS A 66 -18.964 -17.264 -12.514 1.00 70.11 C ATOM 1083 C LYS A 66 -18.295 -17.769 -11.240 1.00 22.31 C ATOM 1084 O LYS A 66 -18.396 -17.143 -10.185 1.00 74.14 O ATOM 1085 CB LYS A 66 -20.253 -18.048 -12.771 1.00 61.23 C ATOM 1086 CG LYS A 66 -21.158 -17.407 -13.809 1.00 31.11 C ATOM 1087 CD LYS A 66 -21.605 -16.020 -13.378 1.00 73.31 C ATOM 1088 CE LYS A 66 -22.745 -15.508 -14.245 1.00 34.11 C ATOM 1089 NZ LYS A 66 -23.603 -14.534 -13.514 1.00 74.54 N ATOM 0 H LYS A 66 -18.374 -18.042 -14.369 1.00 4.23 H new ATOM 0 HA LYS A 66 -19.207 -16.210 -12.382 1.00 70.11 H new ATOM 0 HB2 LYS A 66 -19.996 -19.056 -13.098 1.00 61.23 H new ATOM 0 HB3 LYS A 66 -20.801 -18.146 -11.834 1.00 61.23 H new ATOM 0 HG2 LYS A 66 -20.632 -17.341 -14.761 1.00 31.11 H new ATOM 0 HG3 LYS A 66 -22.032 -18.038 -13.971 1.00 31.11 H new ATOM 0 HD2 LYS A 66 -21.923 -16.046 -12.336 1.00 73.31 H new ATOM 0 HD3 LYS A 66 -20.763 -15.330 -13.437 1.00 73.31 H new ATOM 0 HE2 LYS A 66 -22.338 -15.034 -15.138 1.00 34.11 H new ATOM 0 HE3 LYS A 66 -23.353 -16.349 -14.579 1.00 34.11 H new ATOM 0 HZ1 LYS A 66 -24.368 -14.208 -14.139 1.00 74.54 H new ATOM 0 HZ2 LYS A 66 -24.012 -14.993 -12.675 1.00 74.54 H new ATOM 0 HZ3 LYS A 66 -23.028 -13.720 -13.217 1.00 74.54 H new