USER MOD reduce.3.24.130724 H: found=0, std=0, add=669, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 669 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 68 SER OG : rot 120:sc= -0.311 USER MOD Set 1.2: A 72 THR OG1 : rot 160:sc= 0.00954 USER MOD Set 2.1: A 19 GLN : amide:sc= -0.181 K(o=0.44,f=-7.5!) USER MOD Set 2.2: A 20 LYS NZ :NH3+ -138:sc= 0.622 (180deg=-0.332) USER MOD Single : A 6 THR OG1 : rot 180:sc= 0 USER MOD Single : A 8 GLN : amide:sc= 0 K(o=0,f=-0.81) USER MOD Single : A 15 GLN : amide:sc= 0.826 K(o=0.83,f=-0.97) USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 23 ASN : amide:sc= -0.378 X(o=-0.38,f=0) USER MOD Single : A 29 TYR OH : rot 180:sc= 0 USER MOD Single : A 30 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 31 HIS : no HD1:sc= 0.404 K(o=0.4,f=-2.2!) USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 35 SER OG : rot 180:sc= 0 USER MOD Single : A 38 SER OG : rot -25:sc= 0.0135 USER MOD Single : A 40 TYR OH : rot 180:sc= 0 USER MOD Single : A 43 SER OG : rot 180:sc= 0 USER MOD Single : A 51 GLN : amide:sc= 0.553 K(o=0.55,f=0) USER MOD Single : A 56 LYS NZ :NH3+ -162:sc= -0.0478 (180deg=-0.387) USER MOD Single : A 58 TYR OH : rot 180:sc= 0 USER MOD Single : A 63 SER OG : rot 180:sc= 0 USER MOD Single : A 71 TYR OH : rot 180:sc= 0 USER MOD Single : A 75 TYR OH : rot 180:sc= 0 USER MOD Single : A 80 ASN : amide:sc= -0.017 K(o=-0.017,f=-1.5!) USER MOD Single : A 81 THR OG1 : rot 96:sc= 1.24 USER MOD Single : A 83 LYS NZ :NH3+ -175:sc= 0 (180deg=-0.0475) USER MOD Single : A 84 ASN : amide:sc= -0.0116 X(o=-0.012,f=-0.47) USER MOD Single : A 85 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 82 N THR A 6 11.055 -6.194 -11.285 1.00 0.00 N ATOM 83 CA THR A 6 11.735 -6.595 -10.060 1.00 0.00 C ATOM 84 C THR A 6 12.150 -8.060 -10.123 1.00 0.00 C ATOM 85 O THR A 6 11.760 -8.791 -11.033 1.00 0.00 O ATOM 86 CB THR A 6 10.823 -6.363 -8.852 1.00 0.00 C ATOM 87 OG1 THR A 6 9.660 -7.152 -8.980 1.00 0.00 O ATOM 88 CG2 THR A 6 10.421 -4.893 -8.749 1.00 0.00 C ATOM 0 HA THR A 6 12.633 -5.987 -9.954 1.00 0.00 H new ATOM 0 HB THR A 6 11.369 -6.642 -7.951 1.00 0.00 H new ATOM 0 HG1 THR A 6 9.078 -7.004 -8.206 1.00 0.00 H new ATOM 0 HG21 THR A 6 9.773 -4.753 -7.884 1.00 0.00 H new ATOM 0 HG22 THR A 6 11.314 -4.278 -8.637 1.00 0.00 H new ATOM 0 HG23 THR A 6 9.888 -4.597 -9.653 1.00 0.00 H new ATOM 96 N ASP A 7 12.948 -8.501 -9.147 1.00 0.00 N ATOM 97 CA ASP A 7 13.429 -9.870 -9.104 1.00 0.00 C ATOM 98 C ASP A 7 12.285 -10.867 -8.903 1.00 0.00 C ATOM 99 O ASP A 7 12.468 -12.061 -9.115 1.00 0.00 O ATOM 100 CB ASP A 7 14.452 -9.999 -7.974 1.00 0.00 C ATOM 101 CG ASP A 7 13.846 -9.634 -6.619 1.00 0.00 C ATOM 102 OD1 ASP A 7 13.702 -8.418 -6.362 1.00 0.00 O ATOM 103 OD2 ASP A 7 13.528 -10.571 -5.854 1.00 0.00 O ATOM 0 H ASP A 7 13.272 -7.919 -8.374 1.00 0.00 H new ATOM 0 HA ASP A 7 13.896 -10.106 -10.060 1.00 0.00 H new ATOM 0 HB2 ASP A 7 14.830 -11.021 -7.940 1.00 0.00 H new ATOM 0 HB3 ASP A 7 15.304 -9.350 -8.178 1.00 0.00 H new ATOM 108 N GLN A 8 11.103 -10.398 -8.493 1.00 0.00 N ATOM 109 CA GLN A 8 9.977 -11.289 -8.264 1.00 0.00 C ATOM 110 C GLN A 8 9.365 -11.736 -9.586 1.00 0.00 C ATOM 111 O GLN A 8 9.075 -12.920 -9.766 1.00 0.00 O ATOM 112 CB GLN A 8 8.929 -10.578 -7.410 1.00 0.00 C ATOM 113 CG GLN A 8 9.514 -10.181 -6.055 1.00 0.00 C ATOM 114 CD GLN A 8 8.477 -9.524 -5.148 1.00 0.00 C ATOM 115 OE1 GLN A 8 7.317 -9.369 -5.516 1.00 0.00 O ATOM 116 NE2 GLN A 8 8.894 -9.128 -3.948 1.00 0.00 N ATOM 0 H GLN A 8 10.908 -9.413 -8.316 1.00 0.00 H new ATOM 0 HA GLN A 8 10.331 -12.176 -7.738 1.00 0.00 H new ATOM 0 HB2 GLN A 8 8.570 -9.690 -7.931 1.00 0.00 H new ATOM 0 HB3 GLN A 8 8.069 -11.231 -7.263 1.00 0.00 H new ATOM 0 HG2 GLN A 8 9.917 -11.066 -5.562 1.00 0.00 H new ATOM 0 HG3 GLN A 8 10.347 -9.495 -6.208 1.00 0.00 H new ATOM 0 HE21 GLN A 8 9.866 -9.272 -3.673 1.00 0.00 H new ATOM 0 HE22 GLN A 8 8.242 -8.681 -3.304 1.00 0.00 H new ATOM 125 N VAL A 9 9.173 -10.795 -10.513 1.00 0.00 N ATOM 126 CA VAL A 9 8.589 -11.094 -11.816 1.00 0.00 C ATOM 127 C VAL A 9 9.650 -11.634 -12.767 1.00 0.00 C ATOM 128 O VAL A 9 9.332 -12.361 -13.706 1.00 0.00 O ATOM 129 CB VAL A 9 7.907 -9.839 -12.373 1.00 0.00 C ATOM 130 CG1 VAL A 9 8.896 -8.686 -12.526 1.00 0.00 C ATOM 131 CG2 VAL A 9 7.268 -10.122 -13.732 1.00 0.00 C ATOM 0 H VAL A 9 9.417 -9.813 -10.381 1.00 0.00 H new ATOM 0 HA VAL A 9 7.832 -11.871 -11.707 1.00 0.00 H new ATOM 0 HB VAL A 9 7.136 -9.555 -11.657 1.00 0.00 H new ATOM 0 HG11 VAL A 9 8.378 -7.813 -12.923 1.00 0.00 H new ATOM 0 HG12 VAL A 9 9.324 -8.443 -11.554 1.00 0.00 H new ATOM 0 HG13 VAL A 9 9.692 -8.978 -13.211 1.00 0.00 H new ATOM 0 HG21 VAL A 9 6.791 -9.216 -14.105 1.00 0.00 H new ATOM 0 HG22 VAL A 9 8.036 -10.444 -14.435 1.00 0.00 H new ATOM 0 HG23 VAL A 9 6.521 -10.908 -13.626 1.00 0.00 H new ATOM 141 N LEU A 10 10.917 -11.283 -12.534 1.00 0.00 N ATOM 142 CA LEU A 10 11.994 -11.711 -13.403 1.00 0.00 C ATOM 143 C LEU A 10 12.374 -13.168 -13.123 1.00 0.00 C ATOM 144 O LEU A 10 12.829 -13.868 -14.023 1.00 0.00 O ATOM 145 CB LEU A 10 13.163 -10.746 -13.219 1.00 0.00 C ATOM 146 CG LEU A 10 14.264 -10.919 -14.266 1.00 0.00 C ATOM 147 CD1 LEU A 10 13.738 -10.671 -15.680 1.00 0.00 C ATOM 148 CD2 LEU A 10 15.359 -9.894 -13.990 1.00 0.00 C ATOM 0 H LEU A 10 11.213 -10.703 -11.749 1.00 0.00 H new ATOM 0 HA LEU A 10 11.682 -11.683 -14.447 1.00 0.00 H new ATOM 0 HB2 LEU A 10 12.790 -9.723 -13.261 1.00 0.00 H new ATOM 0 HB3 LEU A 10 13.590 -10.889 -12.226 1.00 0.00 H new ATOM 0 HG LEU A 10 14.637 -11.941 -14.202 1.00 0.00 H new ATOM 0 HD11 LEU A 10 14.548 -10.803 -16.398 1.00 0.00 H new ATOM 0 HD12 LEU A 10 12.939 -11.379 -15.900 1.00 0.00 H new ATOM 0 HD13 LEU A 10 13.352 -9.654 -15.751 1.00 0.00 H new ATOM 0 HD21 LEU A 10 16.154 -10.003 -14.728 1.00 0.00 H new ATOM 0 HD22 LEU A 10 14.941 -8.889 -14.052 1.00 0.00 H new ATOM 0 HD23 LEU A 10 15.766 -10.056 -12.992 1.00 0.00 H new ATOM 160 N VAL A 11 12.188 -13.635 -11.882 1.00 0.00 N ATOM 161 CA VAL A 11 12.494 -15.018 -11.523 1.00 0.00 C ATOM 162 C VAL A 11 11.397 -15.954 -12.019 1.00 0.00 C ATOM 163 O VAL A 11 11.704 -17.047 -12.491 1.00 0.00 O ATOM 164 CB VAL A 11 12.683 -15.125 -10.007 1.00 0.00 C ATOM 165 CG1 VAL A 11 12.655 -16.579 -9.529 1.00 0.00 C ATOM 166 CG2 VAL A 11 14.038 -14.531 -9.632 1.00 0.00 C ATOM 0 H VAL A 11 11.827 -13.072 -11.112 1.00 0.00 H new ATOM 0 HA VAL A 11 13.423 -15.321 -12.006 1.00 0.00 H new ATOM 0 HB VAL A 11 11.863 -14.586 -9.532 1.00 0.00 H new ATOM 0 HG11 VAL A 11 12.793 -16.609 -8.448 1.00 0.00 H new ATOM 0 HG12 VAL A 11 11.695 -17.028 -9.785 1.00 0.00 H new ATOM 0 HG13 VAL A 11 13.457 -17.137 -10.013 1.00 0.00 H new ATOM 0 HG21 VAL A 11 14.181 -14.603 -8.554 1.00 0.00 H new ATOM 0 HG22 VAL A 11 14.830 -15.081 -10.141 1.00 0.00 H new ATOM 0 HG23 VAL A 11 14.072 -13.484 -9.933 1.00 0.00 H new ATOM 176 N GLU A 12 10.122 -15.559 -11.931 1.00 0.00 N ATOM 177 CA GLU A 12 9.058 -16.422 -12.429 1.00 0.00 C ATOM 178 C GLU A 12 9.063 -16.449 -13.957 1.00 0.00 C ATOM 179 O GLU A 12 8.559 -17.393 -14.563 1.00 0.00 O ATOM 180 CB GLU A 12 7.696 -15.985 -11.886 1.00 0.00 C ATOM 181 CG GLU A 12 7.293 -14.608 -12.412 1.00 0.00 C ATOM 182 CD GLU A 12 5.886 -14.232 -11.942 1.00 0.00 C ATOM 183 OE1 GLU A 12 5.770 -13.730 -10.800 1.00 0.00 O ATOM 184 OE2 GLU A 12 4.939 -14.451 -12.732 1.00 0.00 O ATOM 0 H GLU A 12 9.812 -14.673 -11.531 1.00 0.00 H new ATOM 0 HA GLU A 12 9.243 -17.435 -12.072 1.00 0.00 H new ATOM 0 HB2 GLU A 12 6.940 -16.718 -12.168 1.00 0.00 H new ATOM 0 HB3 GLU A 12 7.728 -15.963 -10.797 1.00 0.00 H new ATOM 0 HG2 GLU A 12 8.007 -13.860 -12.068 1.00 0.00 H new ATOM 0 HG3 GLU A 12 7.329 -14.606 -13.501 1.00 0.00 H new ATOM 191 N ARG A 13 9.635 -15.419 -14.588 1.00 0.00 N ATOM 192 CA ARG A 13 9.730 -15.359 -16.039 1.00 0.00 C ATOM 193 C ARG A 13 10.768 -16.351 -16.550 1.00 0.00 C ATOM 194 O ARG A 13 10.622 -16.886 -17.647 1.00 0.00 O ATOM 195 CB ARG A 13 10.049 -13.918 -16.432 1.00 0.00 C ATOM 196 CG ARG A 13 10.136 -13.780 -17.952 1.00 0.00 C ATOM 197 CD ARG A 13 10.246 -12.302 -18.313 1.00 0.00 C ATOM 198 NE ARG A 13 8.965 -11.611 -18.125 1.00 0.00 N ATOM 199 CZ ARG A 13 7.986 -11.578 -19.037 1.00 0.00 C ATOM 200 NH1 ARG A 13 8.130 -12.193 -20.209 1.00 0.00 N ATOM 201 NH2 ARG A 13 6.855 -10.928 -18.775 1.00 0.00 N ATOM 0 H ARG A 13 10.039 -14.615 -14.109 1.00 0.00 H new ATOM 0 HA ARG A 13 8.786 -15.647 -16.502 1.00 0.00 H new ATOM 0 HB2 ARG A 13 9.279 -13.251 -16.045 1.00 0.00 H new ATOM 0 HB3 ARG A 13 10.992 -13.613 -15.979 1.00 0.00 H new ATOM 0 HG2 ARG A 13 11.001 -14.325 -18.330 1.00 0.00 H new ATOM 0 HG3 ARG A 13 9.254 -14.217 -18.420 1.00 0.00 H new ATOM 0 HD2 ARG A 13 11.010 -11.830 -17.695 1.00 0.00 H new ATOM 0 HD3 ARG A 13 10.567 -12.201 -19.350 1.00 0.00 H new ATOM 0 HE ARG A 13 8.811 -11.124 -17.242 1.00 0.00 H new ATOM 0 HH11 ARG A 13 8.993 -12.695 -20.419 1.00 0.00 H new ATOM 0 HH12 ARG A 13 7.378 -12.162 -20.897 1.00 0.00 H new ATOM 0 HH21 ARG A 13 6.734 -10.455 -17.879 1.00 0.00 H new ATOM 0 HH22 ARG A 13 6.109 -10.903 -19.470 1.00 0.00 H new ATOM 215 N VAL A 14 11.817 -16.611 -15.764 1.00 0.00 N ATOM 216 CA VAL A 14 12.804 -17.625 -16.123 1.00 0.00 C ATOM 217 C VAL A 14 12.217 -19.022 -15.927 1.00 0.00 C ATOM 218 O VAL A 14 12.600 -19.956 -16.627 1.00 0.00 O ATOM 219 CB VAL A 14 14.081 -17.429 -15.299 1.00 0.00 C ATOM 220 CG1 VAL A 14 15.101 -18.531 -15.584 1.00 0.00 C ATOM 221 CG2 VAL A 14 14.717 -16.086 -15.656 1.00 0.00 C ATOM 0 H VAL A 14 12.001 -16.135 -14.881 1.00 0.00 H new ATOM 0 HA VAL A 14 13.066 -17.519 -17.176 1.00 0.00 H new ATOM 0 HB VAL A 14 13.806 -17.462 -14.245 1.00 0.00 H new ATOM 0 HG11 VAL A 14 15.995 -18.363 -14.984 1.00 0.00 H new ATOM 0 HG12 VAL A 14 14.670 -19.500 -15.330 1.00 0.00 H new ATOM 0 HG13 VAL A 14 15.366 -18.517 -16.641 1.00 0.00 H new ATOM 0 HG21 VAL A 14 15.625 -15.946 -15.070 1.00 0.00 H new ATOM 0 HG22 VAL A 14 14.964 -16.071 -16.718 1.00 0.00 H new ATOM 0 HG23 VAL A 14 14.016 -15.281 -15.435 1.00 0.00 H new ATOM 231 N GLN A 15 11.284 -19.182 -14.982 1.00 0.00 N ATOM 232 CA GLN A 15 10.607 -20.452 -14.771 1.00 0.00 C ATOM 233 C GLN A 15 9.631 -20.747 -15.913 1.00 0.00 C ATOM 234 O GLN A 15 9.184 -21.882 -16.063 1.00 0.00 O ATOM 235 CB GLN A 15 9.882 -20.441 -13.426 1.00 0.00 C ATOM 236 CG GLN A 15 10.888 -20.412 -12.272 1.00 0.00 C ATOM 237 CD GLN A 15 10.201 -20.389 -10.911 1.00 0.00 C ATOM 238 OE1 GLN A 15 8.993 -20.183 -10.811 1.00 0.00 O ATOM 239 NE2 GLN A 15 10.966 -20.603 -9.845 1.00 0.00 N ATOM 0 H GLN A 15 10.984 -18.439 -14.351 1.00 0.00 H new ATOM 0 HA GLN A 15 11.354 -21.246 -14.759 1.00 0.00 H new ATOM 0 HB2 GLN A 15 9.227 -19.572 -13.367 1.00 0.00 H new ATOM 0 HB3 GLN A 15 9.248 -21.324 -13.341 1.00 0.00 H new ATOM 0 HG2 GLN A 15 11.536 -21.286 -12.335 1.00 0.00 H new ATOM 0 HG3 GLN A 15 11.526 -19.534 -12.370 1.00 0.00 H new ATOM 0 HE21 GLN A 15 11.965 -20.771 -9.960 1.00 0.00 H new ATOM 0 HE22 GLN A 15 10.553 -20.599 -8.912 1.00 0.00 H new ATOM 248 N LYS A 16 9.304 -19.729 -16.719 1.00 0.00 N ATOM 249 CA LYS A 16 8.472 -19.880 -17.909 1.00 0.00 C ATOM 250 C LYS A 16 9.318 -20.231 -19.133 1.00 0.00 C ATOM 251 O LYS A 16 8.804 -20.271 -20.249 1.00 0.00 O ATOM 252 CB LYS A 16 7.630 -18.620 -18.116 1.00 0.00 C ATOM 253 CG LYS A 16 6.598 -18.503 -16.994 1.00 0.00 C ATOM 254 CD LYS A 16 5.886 -17.155 -17.063 1.00 0.00 C ATOM 255 CE LYS A 16 4.971 -17.008 -15.848 1.00 0.00 C ATOM 256 NZ LYS A 16 4.298 -15.698 -15.838 1.00 0.00 N ATOM 0 H LYS A 16 9.615 -18.771 -16.558 1.00 0.00 H new ATOM 0 HA LYS A 16 7.786 -20.715 -17.764 1.00 0.00 H new ATOM 0 HB2 LYS A 16 8.272 -17.739 -18.127 1.00 0.00 H new ATOM 0 HB3 LYS A 16 7.128 -18.660 -19.083 1.00 0.00 H new ATOM 0 HG2 LYS A 16 5.870 -19.310 -17.075 1.00 0.00 H new ATOM 0 HG3 LYS A 16 7.089 -18.613 -16.027 1.00 0.00 H new ATOM 0 HD2 LYS A 16 6.616 -16.345 -17.084 1.00 0.00 H new ATOM 0 HD3 LYS A 16 5.304 -17.084 -17.982 1.00 0.00 H new ATOM 0 HE2 LYS A 16 4.225 -17.802 -15.854 1.00 0.00 H new ATOM 0 HE3 LYS A 16 5.554 -17.126 -14.935 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 3.684 -15.629 -15.001 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 5.011 -14.942 -15.807 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 3.723 -15.597 -16.698 1.00 0.00 H new ATOM 270 N GLY A 17 10.617 -20.486 -18.927 1.00 0.00 N ATOM 271 CA GLY A 17 11.518 -20.945 -19.977 1.00 0.00 C ATOM 272 C GLY A 17 12.242 -19.803 -20.691 1.00 0.00 C ATOM 273 O GLY A 17 12.922 -20.044 -21.686 1.00 0.00 O ATOM 0 H GLY A 17 11.069 -20.377 -18.019 1.00 0.00 H new ATOM 0 HA2 GLY A 17 12.256 -21.620 -19.544 1.00 0.00 H new ATOM 0 HA3 GLY A 17 10.950 -21.520 -20.708 1.00 0.00 H new ATOM 277 N ASP A 18 12.109 -18.567 -20.204 1.00 0.00 N ATOM 278 CA ASP A 18 12.759 -17.423 -20.825 1.00 0.00 C ATOM 279 C ASP A 18 14.213 -17.332 -20.368 1.00 0.00 C ATOM 280 O ASP A 18 14.487 -16.967 -19.223 1.00 0.00 O ATOM 281 CB ASP A 18 11.978 -16.157 -20.455 1.00 0.00 C ATOM 282 CG ASP A 18 12.397 -14.955 -21.298 1.00 0.00 C ATOM 283 OD1 ASP A 18 13.549 -14.954 -21.782 1.00 0.00 O ATOM 284 OD2 ASP A 18 11.552 -14.044 -21.447 1.00 0.00 O ATOM 0 H ASP A 18 11.554 -18.338 -19.379 1.00 0.00 H new ATOM 0 HA ASP A 18 12.763 -17.534 -21.909 1.00 0.00 H new ATOM 0 HB2 ASP A 18 10.911 -16.338 -20.588 1.00 0.00 H new ATOM 0 HB3 ASP A 18 12.134 -15.931 -19.400 1.00 0.00 H new ATOM 289 N GLN A 19 15.152 -17.662 -21.261 1.00 0.00 N ATOM 290 CA GLN A 19 16.567 -17.631 -20.928 1.00 0.00 C ATOM 291 C GLN A 19 17.114 -16.203 -21.005 1.00 0.00 C ATOM 292 O GLN A 19 18.095 -15.877 -20.339 1.00 0.00 O ATOM 293 CB GLN A 19 17.313 -18.605 -21.844 1.00 0.00 C ATOM 294 CG GLN A 19 18.690 -18.989 -21.289 1.00 0.00 C ATOM 295 CD GLN A 19 19.754 -17.916 -21.491 1.00 0.00 C ATOM 296 OE1 GLN A 19 19.691 -17.129 -22.433 1.00 0.00 O ATOM 297 NE2 GLN A 19 20.745 -17.876 -20.603 1.00 0.00 N ATOM 0 H GLN A 19 14.951 -17.953 -22.218 1.00 0.00 H new ATOM 0 HA GLN A 19 16.718 -17.954 -19.898 1.00 0.00 H new ATOM 0 HB2 GLN A 19 16.714 -19.506 -21.978 1.00 0.00 H new ATOM 0 HB3 GLN A 19 17.434 -18.154 -22.829 1.00 0.00 H new ATOM 0 HG2 GLN A 19 18.597 -19.199 -20.224 1.00 0.00 H new ATOM 0 HG3 GLN A 19 19.021 -19.911 -21.768 1.00 0.00 H new ATOM 0 HE21 GLN A 19 20.767 -18.544 -19.833 1.00 0.00 H new ATOM 0 HE22 GLN A 19 21.482 -17.177 -20.693 1.00 0.00 H new ATOM 306 N LYS A 20 16.486 -15.339 -21.811 1.00 0.00 N ATOM 307 CA LYS A 20 16.916 -13.951 -21.938 1.00 0.00 C ATOM 308 C LYS A 20 16.565 -13.192 -20.669 1.00 0.00 C ATOM 309 O LYS A 20 17.287 -12.278 -20.280 1.00 0.00 O ATOM 310 CB LYS A 20 16.231 -13.306 -23.144 1.00 0.00 C ATOM 311 CG LYS A 20 16.582 -13.953 -24.487 1.00 0.00 C ATOM 312 CD LYS A 20 18.031 -13.696 -24.926 1.00 0.00 C ATOM 313 CE LYS A 20 19.028 -14.691 -24.331 1.00 0.00 C ATOM 314 NZ LYS A 20 18.798 -16.051 -24.853 1.00 0.00 N ATOM 0 H LYS A 20 15.678 -15.582 -22.384 1.00 0.00 H new ATOM 0 HA LYS A 20 17.995 -13.917 -22.086 1.00 0.00 H new ATOM 0 HB2 LYS A 20 15.151 -13.353 -23.002 1.00 0.00 H new ATOM 0 HB3 LYS A 20 16.502 -12.251 -23.180 1.00 0.00 H new ATOM 0 HG2 LYS A 20 16.416 -15.028 -24.419 1.00 0.00 H new ATOM 0 HG3 LYS A 20 15.905 -13.574 -25.253 1.00 0.00 H new ATOM 0 HD2 LYS A 20 18.088 -13.742 -26.014 1.00 0.00 H new ATOM 0 HD3 LYS A 20 18.318 -12.686 -24.634 1.00 0.00 H new ATOM 0 HE2 LYS A 20 20.045 -14.376 -24.565 1.00 0.00 H new ATOM 0 HE3 LYS A 20 18.938 -14.695 -23.245 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 18.883 -16.739 -24.078 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 17.845 -16.108 -25.264 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 19.504 -16.266 -25.585 1.00 0.00 H new ATOM 328 N ALA A 21 15.464 -13.565 -20.014 1.00 0.00 N ATOM 329 CA ALA A 21 15.094 -12.958 -18.749 1.00 0.00 C ATOM 330 C ALA A 21 16.135 -13.295 -17.683 1.00 0.00 C ATOM 331 O ALA A 21 16.342 -12.519 -16.752 1.00 0.00 O ATOM 332 CB ALA A 21 13.709 -13.465 -18.341 1.00 0.00 C ATOM 0 H ALA A 21 14.819 -14.283 -20.343 1.00 0.00 H new ATOM 0 HA ALA A 21 15.059 -11.873 -18.853 1.00 0.00 H new ATOM 0 HB1 ALA A 21 13.422 -13.014 -17.391 1.00 0.00 H new ATOM 0 HB2 ALA A 21 12.982 -13.193 -19.106 1.00 0.00 H new ATOM 0 HB3 ALA A 21 13.735 -14.549 -18.235 1.00 0.00 H new ATOM 338 N PHE A 22 16.798 -14.449 -17.811 1.00 0.00 N ATOM 339 CA PHE A 22 17.843 -14.818 -16.875 1.00 0.00 C ATOM 340 C PHE A 22 19.112 -14.024 -17.157 1.00 0.00 C ATOM 341 O PHE A 22 19.869 -13.727 -16.238 1.00 0.00 O ATOM 342 CB PHE A 22 18.116 -16.320 -16.952 1.00 0.00 C ATOM 343 CG PHE A 22 19.063 -16.793 -15.872 1.00 0.00 C ATOM 344 CD1 PHE A 22 18.624 -16.864 -14.541 1.00 0.00 C ATOM 345 CD2 PHE A 22 20.383 -17.151 -16.192 1.00 0.00 C ATOM 346 CE1 PHE A 22 19.498 -17.281 -13.530 1.00 0.00 C ATOM 347 CE2 PHE A 22 21.257 -17.573 -15.180 1.00 0.00 C ATOM 348 CZ PHE A 22 20.817 -17.631 -13.849 1.00 0.00 C ATOM 0 H PHE A 22 16.626 -15.132 -18.549 1.00 0.00 H new ATOM 0 HA PHE A 22 17.509 -14.581 -15.865 1.00 0.00 H new ATOM 0 HB2 PHE A 22 17.174 -16.862 -16.868 1.00 0.00 H new ATOM 0 HB3 PHE A 22 18.535 -16.560 -17.929 1.00 0.00 H new ATOM 0 HD1 PHE A 22 17.607 -16.596 -14.295 1.00 0.00 H new ATOM 0 HD2 PHE A 22 20.724 -17.101 -17.216 1.00 0.00 H new ATOM 0 HE1 PHE A 22 19.157 -17.333 -12.507 1.00 0.00 H new ATOM 0 HE2 PHE A 22 22.271 -17.854 -15.425 1.00 0.00 H new ATOM 0 HZ PHE A 22 21.495 -17.946 -13.070 1.00 0.00 H new ATOM 358 N ASN A 23 19.359 -13.670 -18.422 1.00 0.00 N ATOM 359 CA ASN A 23 20.541 -12.902 -18.783 1.00 0.00 C ATOM 360 C ASN A 23 20.489 -11.506 -18.159 1.00 0.00 C ATOM 361 O ASN A 23 21.526 -10.955 -17.802 1.00 0.00 O ATOM 362 CB ASN A 23 20.635 -12.834 -20.308 1.00 0.00 C ATOM 363 CG ASN A 23 21.856 -12.045 -20.756 1.00 0.00 C ATOM 364 OD1 ASN A 23 22.919 -12.611 -20.987 1.00 0.00 O ATOM 365 ND2 ASN A 23 21.706 -10.728 -20.883 1.00 0.00 N ATOM 0 H ASN A 23 18.753 -13.906 -19.208 1.00 0.00 H new ATOM 0 HA ASN A 23 21.435 -13.391 -18.395 1.00 0.00 H new ATOM 0 HB2 ASN A 23 20.683 -13.844 -20.716 1.00 0.00 H new ATOM 0 HB3 ASN A 23 19.734 -12.371 -20.709 1.00 0.00 H new ATOM 0 HD21 ASN A 23 22.493 -10.152 -21.182 1.00 0.00 H new ATOM 0 HD22 ASN A 23 20.805 -10.296 -20.681 1.00 0.00 H new ATOM 372 N LEU A 24 19.290 -10.929 -18.018 1.00 0.00 N ATOM 373 CA LEU A 24 19.148 -9.641 -17.359 1.00 0.00 C ATOM 374 C LEU A 24 19.269 -9.812 -15.844 1.00 0.00 C ATOM 375 O LEU A 24 19.674 -8.880 -15.152 1.00 0.00 O ATOM 376 CB LEU A 24 17.801 -9.003 -17.718 1.00 0.00 C ATOM 377 CG LEU A 24 17.769 -8.248 -19.052 1.00 0.00 C ATOM 378 CD1 LEU A 24 18.818 -7.137 -19.094 1.00 0.00 C ATOM 379 CD2 LEU A 24 17.985 -9.168 -20.250 1.00 0.00 C ATOM 0 H LEU A 24 18.416 -11.335 -18.351 1.00 0.00 H new ATOM 0 HA LEU A 24 19.944 -8.981 -17.703 1.00 0.00 H new ATOM 0 HB2 LEU A 24 17.042 -9.785 -17.744 1.00 0.00 H new ATOM 0 HB3 LEU A 24 17.521 -8.313 -16.922 1.00 0.00 H new ATOM 0 HG LEU A 24 16.771 -7.815 -19.120 1.00 0.00 H new ATOM 0 HD11 LEU A 24 18.766 -6.624 -20.054 1.00 0.00 H new ATOM 0 HD12 LEU A 24 18.626 -6.425 -18.291 1.00 0.00 H new ATOM 0 HD13 LEU A 24 19.811 -7.569 -18.967 1.00 0.00 H new ATOM 0 HD21 LEU A 24 17.953 -8.583 -21.169 1.00 0.00 H new ATOM 0 HD22 LEU A 24 18.956 -9.655 -20.164 1.00 0.00 H new ATOM 0 HD23 LEU A 24 17.200 -9.924 -20.274 1.00 0.00 H new ATOM 391 N LEU A 25 18.925 -10.994 -15.321 1.00 0.00 N ATOM 392 CA LEU A 25 19.050 -11.286 -13.902 1.00 0.00 C ATOM 393 C LEU A 25 20.519 -11.525 -13.536 1.00 0.00 C ATOM 394 O LEU A 25 20.938 -11.231 -12.417 1.00 0.00 O ATOM 395 CB LEU A 25 18.178 -12.514 -13.610 1.00 0.00 C ATOM 396 CG LEU A 25 18.094 -12.886 -12.130 1.00 0.00 C ATOM 397 CD1 LEU A 25 17.423 -11.787 -11.312 1.00 0.00 C ATOM 398 CD2 LEU A 25 17.260 -14.162 -11.998 1.00 0.00 C ATOM 0 H LEU A 25 18.554 -11.768 -15.873 1.00 0.00 H new ATOM 0 HA LEU A 25 18.712 -10.446 -13.295 1.00 0.00 H new ATOM 0 HB2 LEU A 25 17.171 -12.328 -13.984 1.00 0.00 H new ATOM 0 HB3 LEU A 25 18.572 -13.365 -14.165 1.00 0.00 H new ATOM 0 HG LEU A 25 19.107 -13.027 -11.753 1.00 0.00 H new ATOM 0 HD11 LEU A 25 17.381 -12.087 -10.265 1.00 0.00 H new ATOM 0 HD12 LEU A 25 17.996 -10.864 -11.403 1.00 0.00 H new ATOM 0 HD13 LEU A 25 16.411 -11.623 -11.683 1.00 0.00 H new ATOM 0 HD21 LEU A 25 17.189 -14.443 -10.947 1.00 0.00 H new ATOM 0 HD22 LEU A 25 16.260 -13.986 -12.395 1.00 0.00 H new ATOM 0 HD23 LEU A 25 17.736 -14.967 -12.558 1.00 0.00 H new ATOM 410 N VAL A 26 21.310 -12.053 -14.477 1.00 0.00 N ATOM 411 CA VAL A 26 22.735 -12.270 -14.270 1.00 0.00 C ATOM 412 C VAL A 26 23.447 -10.927 -14.173 1.00 0.00 C ATOM 413 O VAL A 26 24.217 -10.713 -13.243 1.00 0.00 O ATOM 414 CB VAL A 26 23.313 -13.103 -15.421 1.00 0.00 C ATOM 415 CG1 VAL A 26 24.844 -13.093 -15.390 1.00 0.00 C ATOM 416 CG2 VAL A 26 22.848 -14.553 -15.319 1.00 0.00 C ATOM 0 H VAL A 26 20.976 -12.339 -15.398 1.00 0.00 H new ATOM 0 HA VAL A 26 22.886 -12.817 -13.340 1.00 0.00 H new ATOM 0 HB VAL A 26 22.960 -12.658 -16.351 1.00 0.00 H new ATOM 0 HG11 VAL A 26 25.229 -13.691 -16.216 1.00 0.00 H new ATOM 0 HG12 VAL A 26 25.203 -12.068 -15.485 1.00 0.00 H new ATOM 0 HG13 VAL A 26 25.192 -13.513 -14.446 1.00 0.00 H new ATOM 0 HG21 VAL A 26 23.268 -15.129 -16.144 1.00 0.00 H new ATOM 0 HG22 VAL A 26 23.184 -14.977 -14.373 1.00 0.00 H new ATOM 0 HG23 VAL A 26 21.760 -14.590 -15.368 1.00 0.00 H new ATOM 426 N VAL A 27 23.192 -10.024 -15.124 1.00 0.00 N ATOM 427 CA VAL A 27 23.859 -8.728 -15.153 1.00 0.00 C ATOM 428 C VAL A 27 23.415 -7.869 -13.971 1.00 0.00 C ATOM 429 O VAL A 27 24.134 -6.963 -13.557 1.00 0.00 O ATOM 430 CB VAL A 27 23.575 -8.038 -16.492 1.00 0.00 C ATOM 431 CG1 VAL A 27 24.188 -6.637 -16.541 1.00 0.00 C ATOM 432 CG2 VAL A 27 24.181 -8.856 -17.632 1.00 0.00 C ATOM 0 H VAL A 27 22.527 -10.171 -15.883 1.00 0.00 H new ATOM 0 HA VAL A 27 24.936 -8.871 -15.061 1.00 0.00 H new ATOM 0 HB VAL A 27 22.493 -7.961 -16.597 1.00 0.00 H new ATOM 0 HG11 VAL A 27 23.967 -6.177 -17.504 1.00 0.00 H new ATOM 0 HG12 VAL A 27 23.766 -6.027 -15.742 1.00 0.00 H new ATOM 0 HG13 VAL A 27 25.268 -6.708 -16.412 1.00 0.00 H new ATOM 0 HG21 VAL A 27 23.977 -8.363 -18.582 1.00 0.00 H new ATOM 0 HG22 VAL A 27 25.259 -8.937 -17.489 1.00 0.00 H new ATOM 0 HG23 VAL A 27 23.740 -9.853 -17.639 1.00 0.00 H new ATOM 442 N ARG A 28 22.228 -8.147 -13.419 1.00 0.00 N ATOM 443 CA ARG A 28 21.698 -7.406 -12.286 1.00 0.00 C ATOM 444 C ARG A 28 22.489 -7.696 -11.012 1.00 0.00 C ATOM 445 O ARG A 28 22.603 -6.828 -10.151 1.00 0.00 O ATOM 446 CB ARG A 28 20.225 -7.777 -12.116 1.00 0.00 C ATOM 447 CG ARG A 28 19.581 -6.994 -10.971 1.00 0.00 C ATOM 448 CD ARG A 28 18.076 -7.256 -10.920 1.00 0.00 C ATOM 449 NE ARG A 28 17.403 -6.716 -12.109 1.00 0.00 N ATOM 450 CZ ARG A 28 16.084 -6.762 -12.308 1.00 0.00 C ATOM 451 NH1 ARG A 28 15.281 -7.337 -11.419 1.00 0.00 N ATOM 452 NH2 ARG A 28 15.555 -6.224 -13.403 1.00 0.00 N ATOM 0 H ARG A 28 21.615 -8.892 -13.750 1.00 0.00 H new ATOM 0 HA ARG A 28 21.790 -6.336 -12.474 1.00 0.00 H new ATOM 0 HB2 ARG A 28 19.688 -7.576 -13.043 1.00 0.00 H new ATOM 0 HB3 ARG A 28 20.137 -8.846 -11.922 1.00 0.00 H new ATOM 0 HG2 ARG A 28 20.038 -7.282 -10.024 1.00 0.00 H new ATOM 0 HG3 ARG A 28 19.766 -5.928 -11.103 1.00 0.00 H new ATOM 0 HD2 ARG A 28 17.893 -8.328 -10.851 1.00 0.00 H new ATOM 0 HD3 ARG A 28 17.655 -6.802 -10.023 1.00 0.00 H new ATOM 0 HE ARG A 28 17.980 -6.279 -12.827 1.00 0.00 H new ATOM 0 HH11 ARG A 28 15.671 -7.750 -10.572 1.00 0.00 H new ATOM 0 HH12 ARG A 28 14.275 -7.365 -11.584 1.00 0.00 H new ATOM 0 HH21 ARG A 28 16.157 -5.775 -14.093 1.00 0.00 H new ATOM 0 HH22 ARG A 28 14.547 -6.260 -13.553 1.00 0.00 H new ATOM 466 N TYR A 29 23.034 -8.909 -10.888 1.00 0.00 N ATOM 467 CA TYR A 29 23.801 -9.300 -9.716 1.00 0.00 C ATOM 468 C TYR A 29 25.271 -9.570 -10.025 1.00 0.00 C ATOM 469 O TYR A 29 26.024 -9.903 -9.114 1.00 0.00 O ATOM 470 CB TYR A 29 23.140 -10.514 -9.072 1.00 0.00 C ATOM 471 CG TYR A 29 21.799 -10.193 -8.456 1.00 0.00 C ATOM 472 CD1 TYR A 29 21.726 -9.375 -7.320 1.00 0.00 C ATOM 473 CD2 TYR A 29 20.628 -10.713 -9.029 1.00 0.00 C ATOM 474 CE1 TYR A 29 20.483 -9.068 -6.751 1.00 0.00 C ATOM 475 CE2 TYR A 29 19.381 -10.405 -8.466 1.00 0.00 C ATOM 476 CZ TYR A 29 19.303 -9.585 -7.323 1.00 0.00 C ATOM 477 OH TYR A 29 18.091 -9.291 -6.774 1.00 0.00 O ATOM 0 H TYR A 29 22.953 -9.639 -11.596 1.00 0.00 H new ATOM 0 HA TYR A 29 23.798 -8.462 -9.019 1.00 0.00 H new ATOM 0 HB2 TYR A 29 23.012 -11.293 -9.823 1.00 0.00 H new ATOM 0 HB3 TYR A 29 23.800 -10.917 -8.304 1.00 0.00 H new ATOM 0 HD1 TYR A 29 22.631 -8.980 -6.882 1.00 0.00 H new ATOM 0 HD2 TYR A 29 20.687 -11.348 -9.900 1.00 0.00 H new ATOM 0 HE1 TYR A 29 20.429 -8.437 -5.876 1.00 0.00 H new ATOM 0 HE2 TYR A 29 18.478 -10.797 -8.910 1.00 0.00 H new ATOM 0 HH TYR A 29 17.383 -9.727 -7.292 1.00 0.00 H new ATOM 487 N GLN A 30 25.696 -9.434 -11.283 1.00 0.00 N ATOM 488 CA GLN A 30 27.045 -9.801 -11.692 1.00 0.00 C ATOM 489 C GLN A 30 28.115 -9.035 -10.910 1.00 0.00 C ATOM 490 O GLN A 30 29.149 -9.605 -10.572 1.00 0.00 O ATOM 491 CB GLN A 30 27.186 -9.551 -13.195 1.00 0.00 C ATOM 492 CG GLN A 30 28.605 -9.863 -13.669 1.00 0.00 C ATOM 493 CD GLN A 30 28.723 -9.714 -15.179 1.00 0.00 C ATOM 494 OE1 GLN A 30 29.239 -8.717 -15.676 1.00 0.00 O ATOM 495 NE2 GLN A 30 28.243 -10.708 -15.925 1.00 0.00 N ATOM 0 H GLN A 30 25.116 -9.069 -12.039 1.00 0.00 H new ATOM 0 HA GLN A 30 27.201 -10.857 -11.472 1.00 0.00 H new ATOM 0 HB2 GLN A 30 26.472 -10.170 -13.739 1.00 0.00 H new ATOM 0 HB3 GLN A 30 26.944 -8.512 -13.419 1.00 0.00 H new ATOM 0 HG2 GLN A 30 29.311 -9.193 -13.178 1.00 0.00 H new ATOM 0 HG3 GLN A 30 28.874 -10.879 -13.378 1.00 0.00 H new ATOM 0 HE21 GLN A 30 27.821 -11.522 -15.479 1.00 0.00 H new ATOM 0 HE22 GLN A 30 28.298 -10.655 -16.942 1.00 0.00 H new ATOM 504 N HIS A 31 27.883 -7.752 -10.624 1.00 0.00 N ATOM 505 CA HIS A 31 28.851 -6.942 -9.903 1.00 0.00 C ATOM 506 C HIS A 31 28.733 -7.158 -8.398 1.00 0.00 C ATOM 507 O HIS A 31 29.689 -6.936 -7.657 1.00 0.00 O ATOM 508 CB HIS A 31 28.627 -5.472 -10.258 1.00 0.00 C ATOM 509 CG HIS A 31 27.275 -4.966 -9.831 1.00 0.00 C ATOM 510 ND1 HIS A 31 26.049 -5.376 -10.365 1.00 0.00 N ATOM 511 CD2 HIS A 31 27.049 -4.036 -8.858 1.00 0.00 C ATOM 512 CE1 HIS A 31 25.116 -4.676 -9.698 1.00 0.00 C ATOM 513 NE2 HIS A 31 25.688 -3.867 -8.788 1.00 0.00 N ATOM 0 H HIS A 31 27.030 -7.257 -10.884 1.00 0.00 H new ATOM 0 HA HIS A 31 29.858 -7.239 -10.196 1.00 0.00 H new ATOM 0 HB2 HIS A 31 29.401 -4.867 -9.786 1.00 0.00 H new ATOM 0 HB3 HIS A 31 28.734 -5.343 -11.335 1.00 0.00 H new ATOM 0 HD2 HIS A 31 27.794 -3.532 -8.260 1.00 0.00 H new ATOM 0 HE1 HIS A 31 24.052 -4.752 -9.869 1.00 0.00 H new ATOM 0 HE2 HIS A 31 25.196 -3.237 -8.155 1.00 0.00 H new ATOM 521 N LYS A 32 27.554 -7.594 -7.944 1.00 0.00 N ATOM 522 CA LYS A 32 27.280 -7.762 -6.524 1.00 0.00 C ATOM 523 C LYS A 32 27.758 -9.126 -6.038 1.00 0.00 C ATOM 524 O LYS A 32 28.209 -9.263 -4.900 1.00 0.00 O ATOM 525 CB LYS A 32 25.778 -7.577 -6.305 1.00 0.00 C ATOM 526 CG LYS A 32 25.458 -7.349 -4.830 1.00 0.00 C ATOM 527 CD LYS A 32 23.952 -7.154 -4.654 1.00 0.00 C ATOM 528 CE LYS A 32 23.634 -6.864 -3.190 1.00 0.00 C ATOM 529 NZ LYS A 32 22.181 -6.711 -2.981 1.00 0.00 N ATOM 0 H LYS A 32 26.771 -7.838 -8.551 1.00 0.00 H new ATOM 0 HA LYS A 32 27.824 -7.017 -5.943 1.00 0.00 H new ATOM 0 HB2 LYS A 32 25.424 -6.729 -6.892 1.00 0.00 H new ATOM 0 HB3 LYS A 32 25.245 -8.457 -6.663 1.00 0.00 H new ATOM 0 HG2 LYS A 32 25.796 -8.200 -4.239 1.00 0.00 H new ATOM 0 HG3 LYS A 32 25.993 -6.473 -4.463 1.00 0.00 H new ATOM 0 HD2 LYS A 32 23.607 -6.331 -5.280 1.00 0.00 H new ATOM 0 HD3 LYS A 32 23.420 -8.048 -4.981 1.00 0.00 H new ATOM 0 HE2 LYS A 32 24.011 -7.674 -2.566 1.00 0.00 H new ATOM 0 HE3 LYS A 32 24.147 -5.955 -2.877 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 21.993 -6.515 -1.977 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 21.828 -5.922 -3.560 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 21.696 -7.588 -3.259 1.00 0.00 H new ATOM 543 N VAL A 33 27.668 -10.140 -6.902 1.00 0.00 N ATOM 544 CA VAL A 33 28.133 -11.479 -6.573 1.00 0.00 C ATOM 545 C VAL A 33 29.648 -11.554 -6.731 1.00 0.00 C ATOM 546 O VAL A 33 30.302 -12.341 -6.051 1.00 0.00 O ATOM 547 CB VAL A 33 27.409 -12.502 -7.449 1.00 0.00 C ATOM 548 CG1 VAL A 33 27.931 -12.487 -8.880 1.00 0.00 C ATOM 549 CG2 VAL A 33 27.586 -13.904 -6.870 1.00 0.00 C ATOM 0 H VAL A 33 27.274 -10.053 -7.839 1.00 0.00 H new ATOM 0 HA VAL A 33 27.902 -11.712 -5.533 1.00 0.00 H new ATOM 0 HB VAL A 33 26.353 -12.231 -7.463 1.00 0.00 H new ATOM 0 HG11 VAL A 33 27.392 -13.227 -9.472 1.00 0.00 H new ATOM 0 HG12 VAL A 33 27.780 -11.498 -9.312 1.00 0.00 H new ATOM 0 HG13 VAL A 33 28.995 -12.725 -8.882 1.00 0.00 H new ATOM 0 HG21 VAL A 33 27.067 -14.626 -7.500 1.00 0.00 H new ATOM 0 HG22 VAL A 33 28.647 -14.151 -6.833 1.00 0.00 H new ATOM 0 HG23 VAL A 33 27.170 -13.937 -5.863 1.00 0.00 H new ATOM 559 N ALA A 34 30.218 -10.738 -7.626 1.00 0.00 N ATOM 560 CA ALA A 34 31.659 -10.687 -7.801 1.00 0.00 C ATOM 561 C ALA A 34 32.317 -10.051 -6.579 1.00 0.00 C ATOM 562 O ALA A 34 33.475 -10.333 -6.285 1.00 0.00 O ATOM 563 CB ALA A 34 31.979 -9.899 -9.070 1.00 0.00 C ATOM 0 H ALA A 34 29.697 -10.108 -8.236 1.00 0.00 H new ATOM 0 HA ALA A 34 32.055 -11.697 -7.903 1.00 0.00 H new ATOM 0 HB1 ALA A 34 33.059 -9.856 -9.209 1.00 0.00 H new ATOM 0 HB2 ALA A 34 31.522 -10.391 -9.929 1.00 0.00 H new ATOM 0 HB3 ALA A 34 31.584 -8.887 -8.979 1.00 0.00 H new ATOM 569 N SER A 35 31.581 -9.195 -5.865 1.00 0.00 N ATOM 570 CA SER A 35 32.073 -8.577 -4.644 1.00 0.00 C ATOM 571 C SER A 35 32.033 -9.579 -3.490 1.00 0.00 C ATOM 572 O SER A 35 32.805 -9.469 -2.540 1.00 0.00 O ATOM 573 CB SER A 35 31.195 -7.372 -4.324 1.00 0.00 C ATOM 574 OG SER A 35 31.783 -6.596 -3.301 1.00 0.00 O ATOM 0 H SER A 35 30.634 -8.916 -6.120 1.00 0.00 H new ATOM 0 HA SER A 35 33.106 -8.258 -4.781 1.00 0.00 H new ATOM 0 HB2 SER A 35 31.059 -6.764 -5.219 1.00 0.00 H new ATOM 0 HB3 SER A 35 30.205 -7.707 -4.013 1.00 0.00 H new ATOM 0 HG SER A 35 31.211 -5.825 -3.106 1.00 0.00 H new ATOM 580 N LEU A 36 31.131 -10.558 -3.581 1.00 0.00 N ATOM 581 CA LEU A 36 30.974 -11.584 -2.563 1.00 0.00 C ATOM 582 C LEU A 36 31.984 -12.720 -2.733 1.00 0.00 C ATOM 583 O LEU A 36 32.570 -13.158 -1.745 1.00 0.00 O ATOM 584 CB LEU A 36 29.537 -12.109 -2.623 1.00 0.00 C ATOM 585 CG LEU A 36 29.291 -13.314 -1.709 1.00 0.00 C ATOM 586 CD1 LEU A 36 29.590 -13.009 -0.242 1.00 0.00 C ATOM 587 CD2 LEU A 36 27.821 -13.712 -1.829 1.00 0.00 C ATOM 0 H LEU A 36 30.489 -10.657 -4.368 1.00 0.00 H new ATOM 0 HA LEU A 36 31.170 -11.147 -1.584 1.00 0.00 H new ATOM 0 HB2 LEU A 36 28.853 -11.307 -2.346 1.00 0.00 H new ATOM 0 HB3 LEU A 36 29.302 -12.388 -3.650 1.00 0.00 H new ATOM 0 HG LEU A 36 29.960 -14.115 -2.024 1.00 0.00 H new ATOM 0 HD11 LEU A 36 29.399 -13.897 0.361 1.00 0.00 H new ATOM 0 HD12 LEU A 36 30.635 -12.717 -0.137 1.00 0.00 H new ATOM 0 HD13 LEU A 36 28.950 -12.195 0.098 1.00 0.00 H new ATOM 0 HD21 LEU A 36 27.623 -14.569 -1.186 1.00 0.00 H new ATOM 0 HD22 LEU A 36 27.192 -12.876 -1.524 1.00 0.00 H new ATOM 0 HD23 LEU A 36 27.599 -13.975 -2.863 1.00 0.00 H new ATOM 599 N VAL A 37 32.205 -13.213 -3.958 1.00 0.00 N ATOM 600 CA VAL A 37 33.131 -14.327 -4.135 1.00 0.00 C ATOM 601 C VAL A 37 34.577 -13.850 -4.108 1.00 0.00 C ATOM 602 O VAL A 37 35.484 -14.647 -3.895 1.00 0.00 O ATOM 603 CB VAL A 37 32.832 -15.123 -5.410 1.00 0.00 C ATOM 604 CG1 VAL A 37 31.370 -15.558 -5.459 1.00 0.00 C ATOM 605 CG2 VAL A 37 33.160 -14.331 -6.667 1.00 0.00 C ATOM 0 H VAL A 37 31.769 -12.869 -4.813 1.00 0.00 H new ATOM 0 HA VAL A 37 32.985 -15.004 -3.293 1.00 0.00 H new ATOM 0 HB VAL A 37 33.472 -16.005 -5.379 1.00 0.00 H new ATOM 0 HG11 VAL A 37 31.188 -16.121 -6.375 1.00 0.00 H new ATOM 0 HG12 VAL A 37 31.148 -16.187 -4.597 1.00 0.00 H new ATOM 0 HG13 VAL A 37 30.728 -14.678 -5.440 1.00 0.00 H new ATOM 0 HG21 VAL A 37 32.933 -14.934 -7.546 1.00 0.00 H new ATOM 0 HG22 VAL A 37 32.564 -13.419 -6.688 1.00 0.00 H new ATOM 0 HG23 VAL A 37 34.219 -14.072 -6.668 1.00 0.00 H new ATOM 615 N SER A 38 34.807 -12.548 -4.321 1.00 0.00 N ATOM 616 CA SER A 38 36.148 -11.980 -4.234 1.00 0.00 C ATOM 617 C SER A 38 36.708 -12.148 -2.818 1.00 0.00 C ATOM 618 O SER A 38 37.911 -12.014 -2.599 1.00 0.00 O ATOM 619 CB SER A 38 36.095 -10.504 -4.627 1.00 0.00 C ATOM 620 OG SER A 38 37.378 -9.922 -4.545 1.00 0.00 O ATOM 0 H SER A 38 34.079 -11.873 -4.554 1.00 0.00 H new ATOM 0 HA SER A 38 36.812 -12.507 -4.920 1.00 0.00 H new ATOM 0 HB2 SER A 38 35.709 -10.406 -5.642 1.00 0.00 H new ATOM 0 HB3 SER A 38 35.406 -9.972 -3.971 1.00 0.00 H new ATOM 0 HG SER A 38 37.922 -10.419 -3.899 1.00 0.00 H new ATOM 626 N ARG A 39 35.833 -12.446 -1.849 1.00 0.00 N ATOM 627 CA ARG A 39 36.219 -12.670 -0.463 1.00 0.00 C ATOM 628 C ARG A 39 36.814 -14.062 -0.265 1.00 0.00 C ATOM 629 O ARG A 39 37.386 -14.334 0.790 1.00 0.00 O ATOM 630 CB ARG A 39 34.994 -12.501 0.436 1.00 0.00 C ATOM 631 CG ARG A 39 34.327 -11.136 0.246 1.00 0.00 C ATOM 632 CD ARG A 39 33.068 -11.037 1.102 1.00 0.00 C ATOM 633 NE ARG A 39 33.375 -11.151 2.534 1.00 0.00 N ATOM 634 CZ ARG A 39 32.532 -11.641 3.448 1.00 0.00 C ATOM 635 NH1 ARG A 39 31.315 -12.059 3.106 1.00 0.00 N ATOM 636 NH2 ARG A 39 32.908 -11.713 4.720 1.00 0.00 N ATOM 0 H ARG A 39 34.831 -12.538 -2.013 1.00 0.00 H new ATOM 0 HA ARG A 39 36.983 -11.939 -0.199 1.00 0.00 H new ATOM 0 HB2 ARG A 39 34.274 -13.290 0.219 1.00 0.00 H new ATOM 0 HB3 ARG A 39 35.290 -12.618 1.478 1.00 0.00 H new ATOM 0 HG2 ARG A 39 35.023 -10.343 0.518 1.00 0.00 H new ATOM 0 HG3 ARG A 39 34.073 -10.991 -0.804 1.00 0.00 H new ATOM 0 HD2 ARG A 39 32.572 -10.086 0.911 1.00 0.00 H new ATOM 0 HD3 ARG A 39 32.370 -11.824 0.816 1.00 0.00 H new ATOM 0 HE ARG A 39 34.292 -10.836 2.852 1.00 0.00 H new ATOM 0 HH11 ARG A 39 31.013 -12.008 2.133 1.00 0.00 H new ATOM 0 HH12 ARG A 39 30.685 -12.430 3.817 1.00 0.00 H new ATOM 0 HH21 ARG A 39 33.837 -11.395 4.996 1.00 0.00 H new ATOM 0 HH22 ARG A 39 32.268 -12.086 5.421 1.00 0.00 H new ATOM 650 N TYR A 40 36.684 -14.946 -1.263 1.00 0.00 N ATOM 651 CA TYR A 40 37.121 -16.330 -1.134 1.00 0.00 C ATOM 652 C TYR A 40 38.060 -16.769 -2.259 1.00 0.00 C ATOM 653 O TYR A 40 38.696 -17.813 -2.138 1.00 0.00 O ATOM 654 CB TYR A 40 35.885 -17.230 -1.053 1.00 0.00 C ATOM 655 CG TYR A 40 34.870 -16.763 -0.031 1.00 0.00 C ATOM 656 CD1 TYR A 40 35.140 -16.917 1.338 1.00 0.00 C ATOM 657 CD2 TYR A 40 33.666 -16.170 -0.446 1.00 0.00 C ATOM 658 CE1 TYR A 40 34.212 -16.473 2.292 1.00 0.00 C ATOM 659 CE2 TYR A 40 32.740 -15.716 0.504 1.00 0.00 C ATOM 660 CZ TYR A 40 33.011 -15.865 1.878 1.00 0.00 C ATOM 661 OH TYR A 40 32.111 -15.424 2.803 1.00 0.00 O ATOM 0 H TYR A 40 36.277 -14.719 -2.170 1.00 0.00 H new ATOM 0 HA TYR A 40 37.706 -16.419 -0.219 1.00 0.00 H new ATOM 0 HB2 TYR A 40 35.410 -17.272 -2.033 1.00 0.00 H new ATOM 0 HB3 TYR A 40 36.198 -18.244 -0.806 1.00 0.00 H new ATOM 0 HD1 TYR A 40 36.063 -17.378 1.657 1.00 0.00 H new ATOM 0 HD2 TYR A 40 33.453 -16.064 -1.499 1.00 0.00 H new ATOM 0 HE1 TYR A 40 34.419 -16.598 3.345 1.00 0.00 H new ATOM 0 HE2 TYR A 40 31.819 -15.252 0.182 1.00 0.00 H new ATOM 0 HH TYR A 40 31.339 -15.030 2.346 1.00 0.00 H new ATOM 671 N VAL A 41 38.168 -15.999 -3.345 1.00 0.00 N ATOM 672 CA VAL A 41 39.094 -16.312 -4.432 1.00 0.00 C ATOM 673 C VAL A 41 39.804 -15.060 -4.942 1.00 0.00 C ATOM 674 O VAL A 41 39.277 -13.957 -4.809 1.00 0.00 O ATOM 675 CB VAL A 41 38.386 -16.999 -5.609 1.00 0.00 C ATOM 676 CG1 VAL A 41 38.083 -18.459 -5.287 1.00 0.00 C ATOM 677 CG2 VAL A 41 37.084 -16.301 -5.997 1.00 0.00 C ATOM 0 H VAL A 41 37.622 -15.150 -3.493 1.00 0.00 H new ATOM 0 HA VAL A 41 39.831 -16.998 -4.014 1.00 0.00 H new ATOM 0 HB VAL A 41 39.074 -16.938 -6.452 1.00 0.00 H new ATOM 0 HG11 VAL A 41 37.582 -18.923 -6.137 1.00 0.00 H new ATOM 0 HG12 VAL A 41 39.014 -18.987 -5.083 1.00 0.00 H new ATOM 0 HG13 VAL A 41 37.436 -18.512 -4.411 1.00 0.00 H new ATOM 0 HG21 VAL A 41 36.624 -16.827 -6.834 1.00 0.00 H new ATOM 0 HG22 VAL A 41 36.402 -16.305 -5.147 1.00 0.00 H new ATOM 0 HG23 VAL A 41 37.295 -15.272 -6.288 1.00 0.00 H new ATOM 687 N PRO A 42 41.000 -15.223 -5.528 1.00 0.00 N ATOM 688 CA PRO A 42 41.734 -14.147 -6.172 1.00 0.00 C ATOM 689 C PRO A 42 40.924 -13.538 -7.312 1.00 0.00 C ATOM 690 O PRO A 42 40.043 -14.193 -7.864 1.00 0.00 O ATOM 691 CB PRO A 42 43.015 -14.785 -6.713 1.00 0.00 C ATOM 692 CG PRO A 42 43.181 -16.049 -5.880 1.00 0.00 C ATOM 693 CD PRO A 42 41.744 -16.468 -5.605 1.00 0.00 C ATOM 0 HA PRO A 42 41.946 -13.339 -5.471 1.00 0.00 H new ATOM 0 HB2 PRO A 42 42.928 -15.016 -7.775 1.00 0.00 H new ATOM 0 HB3 PRO A 42 43.870 -14.119 -6.601 1.00 0.00 H new ATOM 0 HG2 PRO A 42 43.730 -16.820 -6.421 1.00 0.00 H new ATOM 0 HG3 PRO A 42 43.729 -15.856 -4.958 1.00 0.00 H new ATOM 0 HD2 PRO A 42 41.361 -17.109 -6.399 1.00 0.00 H new ATOM 0 HD3 PRO A 42 41.668 -17.032 -4.675 1.00 0.00 H new ATOM 701 N SER A 43 41.222 -12.286 -7.673 1.00 0.00 N ATOM 702 CA SER A 43 40.499 -11.590 -8.731 1.00 0.00 C ATOM 703 C SER A 43 40.638 -12.312 -10.070 1.00 0.00 C ATOM 704 O SER A 43 39.827 -12.111 -10.973 1.00 0.00 O ATOM 705 CB SER A 43 41.026 -10.162 -8.829 1.00 0.00 C ATOM 706 OG SER A 43 40.248 -9.413 -9.737 1.00 0.00 O ATOM 0 H SER A 43 41.964 -11.735 -7.242 1.00 0.00 H new ATOM 0 HA SER A 43 39.437 -11.574 -8.486 1.00 0.00 H new ATOM 0 HB2 SER A 43 41.004 -9.691 -7.846 1.00 0.00 H new ATOM 0 HB3 SER A 43 42.066 -10.173 -9.154 1.00 0.00 H new ATOM 0 HG SER A 43 40.596 -8.498 -9.789 1.00 0.00 H new ATOM 712 N GLY A 44 41.663 -13.158 -10.209 1.00 0.00 N ATOM 713 CA GLY A 44 41.887 -13.927 -11.421 1.00 0.00 C ATOM 714 C GLY A 44 40.935 -15.118 -11.530 1.00 0.00 C ATOM 715 O GLY A 44 40.841 -15.718 -12.600 1.00 0.00 O ATOM 0 H GLY A 44 42.357 -13.324 -9.480 1.00 0.00 H new ATOM 0 HA2 GLY A 44 41.759 -13.280 -12.289 1.00 0.00 H new ATOM 0 HA3 GLY A 44 42.917 -14.284 -11.438 1.00 0.00 H new ATOM 719 N ASP A 45 40.234 -15.471 -10.446 1.00 0.00 N ATOM 720 CA ASP A 45 39.296 -16.589 -10.446 1.00 0.00 C ATOM 721 C ASP A 45 37.864 -16.129 -10.162 1.00 0.00 C ATOM 722 O ASP A 45 36.940 -16.937 -10.226 1.00 0.00 O ATOM 723 CB ASP A 45 39.761 -17.637 -9.434 1.00 0.00 C ATOM 724 CG ASP A 45 41.134 -18.189 -9.807 1.00 0.00 C ATOM 725 OD1 ASP A 45 41.221 -18.850 -10.866 1.00 0.00 O ATOM 726 OD2 ASP A 45 42.086 -17.949 -9.029 1.00 0.00 O ATOM 0 H ASP A 45 40.304 -14.989 -9.550 1.00 0.00 H new ATOM 0 HA ASP A 45 39.283 -17.036 -11.440 1.00 0.00 H new ATOM 0 HB2 ASP A 45 39.802 -17.193 -8.439 1.00 0.00 H new ATOM 0 HB3 ASP A 45 39.038 -18.451 -9.391 1.00 0.00 H new ATOM 731 N VAL A 46 37.665 -14.845 -9.853 1.00 0.00 N ATOM 732 CA VAL A 46 36.332 -14.310 -9.597 1.00 0.00 C ATOM 733 C VAL A 46 35.386 -14.525 -10.780 1.00 0.00 C ATOM 734 O VAL A 46 34.291 -15.038 -10.567 1.00 0.00 O ATOM 735 CB VAL A 46 36.417 -12.823 -9.225 1.00 0.00 C ATOM 736 CG1 VAL A 46 35.041 -12.164 -9.241 1.00 0.00 C ATOM 737 CG2 VAL A 46 36.982 -12.664 -7.817 1.00 0.00 C ATOM 0 H VAL A 46 38.415 -14.158 -9.775 1.00 0.00 H new ATOM 0 HA VAL A 46 35.914 -14.860 -8.754 1.00 0.00 H new ATOM 0 HB VAL A 46 37.063 -12.347 -9.963 1.00 0.00 H new ATOM 0 HG11 VAL A 46 35.138 -11.112 -8.973 1.00 0.00 H new ATOM 0 HG12 VAL A 46 34.610 -12.246 -10.239 1.00 0.00 H new ATOM 0 HG13 VAL A 46 34.390 -12.663 -8.523 1.00 0.00 H new ATOM 0 HG21 VAL A 46 37.037 -11.605 -7.565 1.00 0.00 H new ATOM 0 HG22 VAL A 46 36.333 -13.173 -7.105 1.00 0.00 H new ATOM 0 HG23 VAL A 46 37.980 -13.100 -7.774 1.00 0.00 H new ATOM 747 N PRO A 47 35.746 -14.161 -12.020 1.00 0.00 N ATOM 748 CA PRO A 47 34.811 -14.229 -13.134 1.00 0.00 C ATOM 749 C PRO A 47 34.426 -15.668 -13.482 1.00 0.00 C ATOM 750 O PRO A 47 33.365 -15.892 -14.065 1.00 0.00 O ATOM 751 CB PRO A 47 35.529 -13.550 -14.302 1.00 0.00 C ATOM 752 CG PRO A 47 37.003 -13.767 -13.978 1.00 0.00 C ATOM 753 CD PRO A 47 37.026 -13.635 -12.460 1.00 0.00 C ATOM 0 HA PRO A 47 33.870 -13.737 -12.887 1.00 0.00 H new ATOM 0 HB2 PRO A 47 35.257 -13.998 -15.258 1.00 0.00 H new ATOM 0 HB3 PRO A 47 35.282 -12.490 -14.365 1.00 0.00 H new ATOM 0 HG2 PRO A 47 37.351 -14.746 -14.306 1.00 0.00 H new ATOM 0 HG3 PRO A 47 37.639 -13.024 -14.460 1.00 0.00 H new ATOM 0 HD2 PRO A 47 37.854 -14.197 -12.027 1.00 0.00 H new ATOM 0 HD3 PRO A 47 37.152 -12.596 -12.156 1.00 0.00 H new ATOM 761 N ASP A 48 35.266 -16.649 -13.138 1.00 0.00 N ATOM 762 CA ASP A 48 34.959 -18.048 -13.412 1.00 0.00 C ATOM 763 C ASP A 48 34.139 -18.664 -12.279 1.00 0.00 C ATOM 764 O ASP A 48 33.390 -19.614 -12.498 1.00 0.00 O ATOM 765 CB ASP A 48 36.267 -18.811 -13.632 1.00 0.00 C ATOM 766 CG ASP A 48 36.008 -20.266 -14.014 1.00 0.00 C ATOM 767 OD1 ASP A 48 35.462 -20.483 -15.118 1.00 0.00 O ATOM 768 OD2 ASP A 48 36.359 -21.146 -13.201 1.00 0.00 O ATOM 0 H ASP A 48 36.160 -16.497 -12.671 1.00 0.00 H new ATOM 0 HA ASP A 48 34.351 -18.114 -14.315 1.00 0.00 H new ATOM 0 HB2 ASP A 48 36.845 -18.325 -14.418 1.00 0.00 H new ATOM 0 HB3 ASP A 48 36.869 -18.774 -12.724 1.00 0.00 H new ATOM 773 N VAL A 49 34.267 -18.125 -11.063 1.00 0.00 N ATOM 774 CA VAL A 49 33.485 -18.587 -9.925 1.00 0.00 C ATOM 775 C VAL A 49 32.122 -17.900 -9.920 1.00 0.00 C ATOM 776 O VAL A 49 31.151 -18.459 -9.417 1.00 0.00 O ATOM 777 CB VAL A 49 34.277 -18.315 -8.641 1.00 0.00 C ATOM 778 CG1 VAL A 49 33.426 -18.537 -7.393 1.00 0.00 C ATOM 779 CG2 VAL A 49 35.473 -19.266 -8.572 1.00 0.00 C ATOM 0 H VAL A 49 34.910 -17.364 -10.846 1.00 0.00 H new ATOM 0 HA VAL A 49 33.303 -19.660 -9.992 1.00 0.00 H new ATOM 0 HB VAL A 49 34.599 -17.274 -8.668 1.00 0.00 H new ATOM 0 HG11 VAL A 49 34.024 -18.334 -6.504 1.00 0.00 H new ATOM 0 HG12 VAL A 49 32.567 -17.866 -7.414 1.00 0.00 H new ATOM 0 HG13 VAL A 49 33.079 -19.570 -7.368 1.00 0.00 H new ATOM 0 HG21 VAL A 49 36.038 -19.075 -7.660 1.00 0.00 H new ATOM 0 HG22 VAL A 49 35.119 -20.297 -8.570 1.00 0.00 H new ATOM 0 HG23 VAL A 49 36.116 -19.105 -9.437 1.00 0.00 H new ATOM 789 N VAL A 50 32.042 -16.692 -10.485 1.00 0.00 N ATOM 790 CA VAL A 50 30.783 -15.970 -10.598 1.00 0.00 C ATOM 791 C VAL A 50 29.914 -16.601 -11.681 1.00 0.00 C ATOM 792 O VAL A 50 28.703 -16.714 -11.507 1.00 0.00 O ATOM 793 CB VAL A 50 31.055 -14.500 -10.923 1.00 0.00 C ATOM 794 CG1 VAL A 50 29.785 -13.823 -11.435 1.00 0.00 C ATOM 795 CG2 VAL A 50 31.542 -13.767 -9.678 1.00 0.00 C ATOM 0 H VAL A 50 32.844 -16.195 -10.872 1.00 0.00 H new ATOM 0 HA VAL A 50 30.251 -16.028 -9.648 1.00 0.00 H new ATOM 0 HB VAL A 50 31.823 -14.459 -11.695 1.00 0.00 H new ATOM 0 HG11 VAL A 50 29.996 -12.778 -11.662 1.00 0.00 H new ATOM 0 HG12 VAL A 50 29.442 -14.328 -12.338 1.00 0.00 H new ATOM 0 HG13 VAL A 50 29.009 -13.879 -10.671 1.00 0.00 H new ATOM 0 HG21 VAL A 50 31.732 -12.722 -9.922 1.00 0.00 H new ATOM 0 HG22 VAL A 50 30.781 -13.825 -8.900 1.00 0.00 H new ATOM 0 HG23 VAL A 50 32.462 -14.229 -9.320 1.00 0.00 H new ATOM 805 N GLN A 51 30.512 -17.018 -12.800 1.00 0.00 N ATOM 806 CA GLN A 51 29.723 -17.599 -13.872 1.00 0.00 C ATOM 807 C GLN A 51 29.246 -18.994 -13.476 1.00 0.00 C ATOM 808 O GLN A 51 28.167 -19.419 -13.877 1.00 0.00 O ATOM 809 CB GLN A 51 30.531 -17.596 -15.170 1.00 0.00 C ATOM 810 CG GLN A 51 31.610 -18.677 -15.209 1.00 0.00 C ATOM 811 CD GLN A 51 32.474 -18.523 -16.455 1.00 0.00 C ATOM 812 OE1 GLN A 51 32.464 -19.374 -17.338 1.00 0.00 O ATOM 813 NE2 GLN A 51 33.232 -17.433 -16.534 1.00 0.00 N ATOM 0 H GLN A 51 31.515 -16.964 -12.979 1.00 0.00 H new ATOM 0 HA GLN A 51 28.831 -16.998 -14.047 1.00 0.00 H new ATOM 0 HB2 GLN A 51 29.854 -17.737 -16.012 1.00 0.00 H new ATOM 0 HB3 GLN A 51 30.999 -16.620 -15.297 1.00 0.00 H new ATOM 0 HG2 GLN A 51 32.233 -18.610 -14.317 1.00 0.00 H new ATOM 0 HG3 GLN A 51 31.146 -19.663 -15.201 1.00 0.00 H new ATOM 0 HE21 GLN A 51 33.216 -16.745 -15.781 1.00 0.00 H new ATOM 0 HE22 GLN A 51 33.829 -17.285 -17.347 1.00 0.00 H new ATOM 822 N GLU A 52 30.044 -19.712 -12.682 1.00 0.00 N ATOM 823 CA GLU A 52 29.649 -21.023 -12.186 1.00 0.00 C ATOM 824 C GLU A 52 28.533 -20.868 -11.154 1.00 0.00 C ATOM 825 O GLU A 52 27.743 -21.790 -10.956 1.00 0.00 O ATOM 826 CB GLU A 52 30.875 -21.729 -11.602 1.00 0.00 C ATOM 827 CG GLU A 52 30.535 -23.160 -11.183 1.00 0.00 C ATOM 828 CD GLU A 52 31.792 -23.926 -10.783 1.00 0.00 C ATOM 829 OE1 GLU A 52 32.195 -23.804 -9.605 1.00 0.00 O ATOM 830 OE2 GLU A 52 32.341 -24.633 -11.657 1.00 0.00 O ATOM 0 H GLU A 52 30.966 -19.404 -12.372 1.00 0.00 H new ATOM 0 HA GLU A 52 29.261 -21.636 -12.999 1.00 0.00 H new ATOM 0 HB2 GLU A 52 31.677 -21.743 -12.340 1.00 0.00 H new ATOM 0 HB3 GLU A 52 31.244 -21.172 -10.741 1.00 0.00 H new ATOM 0 HG2 GLU A 52 29.835 -23.141 -10.348 1.00 0.00 H new ATOM 0 HG3 GLU A 52 30.037 -23.675 -12.005 1.00 0.00 H new ATOM 837 N ALA A 53 28.454 -19.708 -10.491 1.00 0.00 N ATOM 838 CA ALA A 53 27.413 -19.446 -9.512 1.00 0.00 C ATOM 839 C ALA A 53 26.084 -19.111 -10.196 1.00 0.00 C ATOM 840 O ALA A 53 25.027 -19.381 -9.631 1.00 0.00 O ATOM 841 CB ALA A 53 27.864 -18.308 -8.594 1.00 0.00 C ATOM 0 H ALA A 53 29.108 -18.936 -10.622 1.00 0.00 H new ATOM 0 HA ALA A 53 27.248 -20.343 -8.915 1.00 0.00 H new ATOM 0 HB1 ALA A 53 27.087 -18.106 -7.856 1.00 0.00 H new ATOM 0 HB2 ALA A 53 28.783 -18.595 -8.083 1.00 0.00 H new ATOM 0 HB3 ALA A 53 28.043 -17.411 -9.187 1.00 0.00 H new ATOM 847 N PHE A 54 26.123 -18.533 -11.401 1.00 0.00 N ATOM 848 CA PHE A 54 24.905 -18.231 -12.135 1.00 0.00 C ATOM 849 C PHE A 54 24.420 -19.445 -12.926 1.00 0.00 C ATOM 850 O PHE A 54 23.214 -19.641 -13.059 1.00 0.00 O ATOM 851 CB PHE A 54 25.131 -17.034 -13.062 1.00 0.00 C ATOM 852 CG PHE A 54 25.153 -15.695 -12.356 1.00 0.00 C ATOM 853 CD1 PHE A 54 24.028 -15.257 -11.639 1.00 0.00 C ATOM 854 CD2 PHE A 54 26.290 -14.881 -12.428 1.00 0.00 C ATOM 855 CE1 PHE A 54 24.038 -14.009 -11.004 1.00 0.00 C ATOM 856 CE2 PHE A 54 26.301 -13.630 -11.799 1.00 0.00 C ATOM 857 CZ PHE A 54 25.174 -13.193 -11.091 1.00 0.00 C ATOM 0 H PHE A 54 26.983 -18.269 -11.881 1.00 0.00 H new ATOM 0 HA PHE A 54 24.128 -17.975 -11.415 1.00 0.00 H new ATOM 0 HB2 PHE A 54 26.076 -17.170 -13.588 1.00 0.00 H new ATOM 0 HB3 PHE A 54 24.345 -17.021 -13.817 1.00 0.00 H new ATOM 0 HD1 PHE A 54 23.152 -15.885 -11.577 1.00 0.00 H new ATOM 0 HD2 PHE A 54 27.161 -15.219 -12.970 1.00 0.00 H new ATOM 0 HE1 PHE A 54 23.173 -13.676 -10.449 1.00 0.00 H new ATOM 0 HE2 PHE A 54 27.178 -13.002 -11.860 1.00 0.00 H new ATOM 0 HZ PHE A 54 25.181 -12.225 -10.611 1.00 0.00 H new ATOM 867 N ILE A 55 25.326 -20.273 -13.456 1.00 0.00 N ATOM 868 CA ILE A 55 24.903 -21.477 -14.162 1.00 0.00 C ATOM 869 C ILE A 55 24.335 -22.482 -13.162 1.00 0.00 C ATOM 870 O ILE A 55 23.457 -23.268 -13.514 1.00 0.00 O ATOM 871 CB ILE A 55 26.080 -22.049 -14.968 1.00 0.00 C ATOM 872 CG1 ILE A 55 26.116 -21.458 -16.382 1.00 0.00 C ATOM 873 CG2 ILE A 55 25.948 -23.568 -15.128 1.00 0.00 C ATOM 874 CD1 ILE A 55 26.272 -19.939 -16.418 1.00 0.00 C ATOM 0 H ILE A 55 26.335 -20.133 -13.410 1.00 0.00 H new ATOM 0 HA ILE A 55 24.112 -21.240 -14.873 1.00 0.00 H new ATOM 0 HB ILE A 55 26.986 -21.794 -14.419 1.00 0.00 H new ATOM 0 HG12 ILE A 55 26.941 -21.911 -16.933 1.00 0.00 H new ATOM 0 HG13 ILE A 55 25.198 -21.731 -16.902 1.00 0.00 H new ATOM 0 HG21 ILE A 55 26.793 -23.948 -15.702 1.00 0.00 H new ATOM 0 HG22 ILE A 55 25.936 -24.038 -14.145 1.00 0.00 H new ATOM 0 HG23 ILE A 55 25.020 -23.799 -15.652 1.00 0.00 H new ATOM 0 HD11 ILE A 55 26.289 -19.599 -17.454 1.00 0.00 H new ATOM 0 HD12 ILE A 55 25.434 -19.475 -15.897 1.00 0.00 H new ATOM 0 HD13 ILE A 55 27.204 -19.657 -15.929 1.00 0.00 H new ATOM 886 N LYS A 56 24.818 -22.467 -11.915 1.00 0.00 N ATOM 887 CA LYS A 56 24.284 -23.344 -10.882 1.00 0.00 C ATOM 888 C LYS A 56 22.932 -22.824 -10.412 1.00 0.00 C ATOM 889 O LYS A 56 22.066 -23.608 -10.029 1.00 0.00 O ATOM 890 CB LYS A 56 25.290 -23.435 -9.736 1.00 0.00 C ATOM 891 CG LYS A 56 24.877 -24.448 -8.668 1.00 0.00 C ATOM 892 CD LYS A 56 24.706 -25.859 -9.243 1.00 0.00 C ATOM 893 CE LYS A 56 24.388 -26.867 -8.137 1.00 0.00 C ATOM 894 NZ LYS A 56 25.482 -26.953 -7.155 1.00 0.00 N ATOM 0 H LYS A 56 25.574 -21.858 -11.603 1.00 0.00 H new ATOM 0 HA LYS A 56 24.128 -24.347 -11.279 1.00 0.00 H new ATOM 0 HB2 LYS A 56 26.266 -23.712 -10.135 1.00 0.00 H new ATOM 0 HB3 LYS A 56 25.401 -22.453 -9.276 1.00 0.00 H new ATOM 0 HG2 LYS A 56 25.628 -24.468 -7.879 1.00 0.00 H new ATOM 0 HG3 LYS A 56 23.941 -24.129 -8.209 1.00 0.00 H new ATOM 0 HD2 LYS A 56 23.905 -25.860 -9.982 1.00 0.00 H new ATOM 0 HD3 LYS A 56 25.618 -26.157 -9.761 1.00 0.00 H new ATOM 0 HE2 LYS A 56 23.467 -26.577 -7.632 1.00 0.00 H new ATOM 0 HE3 LYS A 56 24.214 -27.849 -8.577 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 25.388 -27.832 -6.607 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 26.396 -26.950 -7.652 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 25.436 -26.137 -6.511 1.00 0.00 H new ATOM 908 N ALA A 57 22.747 -21.501 -10.443 1.00 0.00 N ATOM 909 CA ALA A 57 21.474 -20.905 -10.084 1.00 0.00 C ATOM 910 C ALA A 57 20.456 -21.113 -11.200 1.00 0.00 C ATOM 911 O ALA A 57 19.266 -21.228 -10.924 1.00 0.00 O ATOM 912 CB ALA A 57 21.679 -19.417 -9.817 1.00 0.00 C ATOM 0 H ALA A 57 23.466 -20.830 -10.714 1.00 0.00 H new ATOM 0 HA ALA A 57 21.089 -21.384 -9.184 1.00 0.00 H new ATOM 0 HB1 ALA A 57 20.727 -18.961 -9.546 1.00 0.00 H new ATOM 0 HB2 ALA A 57 22.388 -19.288 -8.999 1.00 0.00 H new ATOM 0 HB3 ALA A 57 22.069 -18.937 -10.714 1.00 0.00 H new ATOM 918 N TYR A 58 20.902 -21.167 -12.458 1.00 0.00 N ATOM 919 CA TYR A 58 19.996 -21.331 -13.585 1.00 0.00 C ATOM 920 C TYR A 58 19.289 -22.681 -13.538 1.00 0.00 C ATOM 921 O TYR A 58 18.104 -22.767 -13.861 1.00 0.00 O ATOM 922 CB TYR A 58 20.800 -21.221 -14.878 1.00 0.00 C ATOM 923 CG TYR A 58 19.960 -21.433 -16.117 1.00 0.00 C ATOM 924 CD1 TYR A 58 19.045 -20.450 -16.519 1.00 0.00 C ATOM 925 CD2 TYR A 58 20.091 -22.620 -16.853 1.00 0.00 C ATOM 926 CE1 TYR A 58 18.256 -20.645 -17.663 1.00 0.00 C ATOM 927 CE2 TYR A 58 19.310 -22.821 -18.002 1.00 0.00 C ATOM 928 CZ TYR A 58 18.388 -21.834 -18.410 1.00 0.00 C ATOM 929 OH TYR A 58 17.626 -22.035 -19.521 1.00 0.00 O ATOM 0 H TYR A 58 21.886 -21.099 -12.716 1.00 0.00 H new ATOM 0 HA TYR A 58 19.234 -20.553 -13.539 1.00 0.00 H new ATOM 0 HB2 TYR A 58 21.267 -20.237 -14.926 1.00 0.00 H new ATOM 0 HB3 TYR A 58 21.605 -21.955 -14.862 1.00 0.00 H new ATOM 0 HD1 TYR A 58 18.947 -19.540 -15.946 1.00 0.00 H new ATOM 0 HD2 TYR A 58 20.792 -23.378 -16.536 1.00 0.00 H new ATOM 0 HE1 TYR A 58 17.550 -19.887 -17.970 1.00 0.00 H new ATOM 0 HE2 TYR A 58 19.415 -23.731 -18.574 1.00 0.00 H new ATOM 0 HH TYR A 58 17.845 -22.905 -19.915 1.00 0.00 H new ATOM 939 N ARG A 59 20.010 -23.729 -13.134 1.00 0.00 N ATOM 940 CA ARG A 59 19.464 -25.078 -13.060 1.00 0.00 C ATOM 941 C ARG A 59 18.798 -25.371 -11.716 1.00 0.00 C ATOM 942 O ARG A 59 18.132 -26.392 -11.580 1.00 0.00 O ATOM 943 CB ARG A 59 20.563 -26.092 -13.379 1.00 0.00 C ATOM 944 CG ARG A 59 21.713 -26.018 -12.373 1.00 0.00 C ATOM 945 CD ARG A 59 22.852 -26.940 -12.807 1.00 0.00 C ATOM 946 NE ARG A 59 22.438 -28.349 -12.791 1.00 0.00 N ATOM 947 CZ ARG A 59 23.169 -29.349 -13.295 1.00 0.00 C ATOM 948 NH1 ARG A 59 24.351 -29.109 -13.855 1.00 0.00 N ATOM 949 NH2 ARG A 59 22.720 -30.599 -13.244 1.00 0.00 N ATOM 0 H ARG A 59 20.987 -23.662 -12.850 1.00 0.00 H new ATOM 0 HA ARG A 59 18.673 -25.163 -13.805 1.00 0.00 H new ATOM 0 HB2 ARG A 59 20.142 -27.097 -13.376 1.00 0.00 H new ATOM 0 HB3 ARG A 59 20.946 -25.909 -14.383 1.00 0.00 H new ATOM 0 HG2 ARG A 59 22.074 -24.992 -12.297 1.00 0.00 H new ATOM 0 HG3 ARG A 59 21.359 -26.306 -11.383 1.00 0.00 H new ATOM 0 HD2 ARG A 59 23.181 -26.667 -13.810 1.00 0.00 H new ATOM 0 HD3 ARG A 59 23.706 -26.803 -12.144 1.00 0.00 H new ATOM 0 HE ARG A 59 21.538 -28.579 -12.370 1.00 0.00 H new ATOM 0 HH11 ARG A 59 24.708 -28.155 -13.903 1.00 0.00 H new ATOM 0 HH12 ARG A 59 24.900 -29.879 -14.236 1.00 0.00 H new ATOM 0 HH21 ARG A 59 21.814 -30.799 -12.819 1.00 0.00 H new ATOM 0 HH22 ARG A 59 23.281 -31.359 -13.630 1.00 0.00 H new ATOM 963 N ALA A 60 18.971 -24.484 -10.726 1.00 0.00 N ATOM 964 CA ALA A 60 18.355 -24.658 -9.415 1.00 0.00 C ATOM 965 C ALA A 60 17.223 -23.658 -9.164 1.00 0.00 C ATOM 966 O ALA A 60 16.493 -23.791 -8.184 1.00 0.00 O ATOM 967 CB ALA A 60 19.440 -24.547 -8.348 1.00 0.00 C ATOM 0 H ALA A 60 19.535 -23.639 -10.815 1.00 0.00 H new ATOM 0 HA ALA A 60 17.895 -25.645 -9.374 1.00 0.00 H new ATOM 0 HB1 ALA A 60 18.995 -24.675 -7.361 1.00 0.00 H new ATOM 0 HB2 ALA A 60 20.191 -25.321 -8.510 1.00 0.00 H new ATOM 0 HB3 ALA A 60 19.911 -23.566 -8.409 1.00 0.00 H new ATOM 973 N LEU A 61 17.066 -22.657 -10.039 1.00 0.00 N ATOM 974 CA LEU A 61 16.040 -21.632 -9.893 1.00 0.00 C ATOM 975 C LEU A 61 14.658 -22.211 -10.198 1.00 0.00 C ATOM 976 O LEU A 61 13.648 -21.639 -9.795 1.00 0.00 O ATOM 977 CB LEU A 61 16.423 -20.442 -10.782 1.00 0.00 C ATOM 978 CG LEU A 61 15.401 -19.304 -10.810 1.00 0.00 C ATOM 979 CD1 LEU A 61 16.149 -18.003 -11.077 1.00 0.00 C ATOM 980 CD2 LEU A 61 14.388 -19.492 -11.937 1.00 0.00 C ATOM 0 H LEU A 61 17.650 -22.540 -10.867 1.00 0.00 H new ATOM 0 HA LEU A 61 15.982 -21.274 -8.865 1.00 0.00 H new ATOM 0 HB2 LEU A 61 17.379 -20.044 -10.440 1.00 0.00 H new ATOM 0 HB3 LEU A 61 16.573 -20.801 -11.800 1.00 0.00 H new ATOM 0 HG LEU A 61 14.873 -19.290 -9.856 1.00 0.00 H new ATOM 0 HD11 LEU A 61 15.441 -17.175 -11.102 1.00 0.00 H new ATOM 0 HD12 LEU A 61 16.878 -17.833 -10.285 1.00 0.00 H new ATOM 0 HD13 LEU A 61 16.664 -18.069 -12.036 1.00 0.00 H new ATOM 0 HD21 LEU A 61 13.677 -18.666 -11.928 1.00 0.00 H new ATOM 0 HD22 LEU A 61 14.909 -19.512 -12.894 1.00 0.00 H new ATOM 0 HD23 LEU A 61 13.855 -20.432 -11.794 1.00 0.00 H new ATOM 992 N ASP A 62 14.603 -23.343 -10.902 1.00 0.00 N ATOM 993 CA ASP A 62 13.351 -24.044 -11.154 1.00 0.00 C ATOM 994 C ASP A 62 12.861 -24.738 -9.878 1.00 0.00 C ATOM 995 O ASP A 62 11.743 -25.244 -9.829 1.00 0.00 O ATOM 996 CB ASP A 62 13.567 -25.042 -12.294 1.00 0.00 C ATOM 997 CG ASP A 62 12.261 -25.713 -12.714 1.00 0.00 C ATOM 998 OD1 ASP A 62 11.351 -24.976 -13.155 1.00 0.00 O ATOM 999 OD2 ASP A 62 12.184 -26.956 -12.591 1.00 0.00 O ATOM 0 H ASP A 62 15.422 -23.794 -11.310 1.00 0.00 H new ATOM 0 HA ASP A 62 12.577 -23.335 -11.450 1.00 0.00 H new ATOM 0 HB2 ASP A 62 14.003 -24.527 -13.150 1.00 0.00 H new ATOM 0 HB3 ASP A 62 14.282 -25.803 -11.981 1.00 0.00 H new ATOM 1004 N SER A 63 13.707 -24.759 -8.841 1.00 0.00 N ATOM 1005 CA SER A 63 13.390 -25.338 -7.544 1.00 0.00 C ATOM 1006 C SER A 63 13.351 -24.264 -6.457 1.00 0.00 C ATOM 1007 O SER A 63 13.238 -24.583 -5.276 1.00 0.00 O ATOM 1008 CB SER A 63 14.403 -26.430 -7.200 1.00 0.00 C ATOM 1009 OG SER A 63 14.372 -27.444 -8.183 1.00 0.00 O ATOM 0 H SER A 63 14.647 -24.365 -8.888 1.00 0.00 H new ATOM 0 HA SER A 63 12.398 -25.786 -7.596 1.00 0.00 H new ATOM 0 HB2 SER A 63 15.404 -26.003 -7.138 1.00 0.00 H new ATOM 0 HB3 SER A 63 14.176 -26.853 -6.222 1.00 0.00 H new ATOM 0 HG SER A 63 15.025 -28.139 -7.957 1.00 0.00 H new ATOM 1015 N PHE A 64 13.448 -22.988 -6.845 1.00 0.00 N ATOM 1016 CA PHE A 64 13.387 -21.887 -5.897 1.00 0.00 C ATOM 1017 C PHE A 64 11.978 -21.801 -5.312 1.00 0.00 C ATOM 1018 O PHE A 64 10.995 -21.815 -6.053 1.00 0.00 O ATOM 1019 CB PHE A 64 13.783 -20.595 -6.615 1.00 0.00 C ATOM 1020 CG PHE A 64 13.751 -19.362 -5.739 1.00 0.00 C ATOM 1021 CD1 PHE A 64 14.580 -19.278 -4.611 1.00 0.00 C ATOM 1022 CD2 PHE A 64 12.896 -18.298 -6.059 1.00 0.00 C ATOM 1023 CE1 PHE A 64 14.554 -18.129 -3.809 1.00 0.00 C ATOM 1024 CE2 PHE A 64 12.877 -17.148 -5.260 1.00 0.00 C ATOM 1025 CZ PHE A 64 13.707 -17.062 -4.135 1.00 0.00 C ATOM 0 H PHE A 64 13.570 -22.698 -7.815 1.00 0.00 H new ATOM 0 HA PHE A 64 14.081 -22.047 -5.072 1.00 0.00 H new ATOM 0 HB2 PHE A 64 14.788 -20.712 -7.021 1.00 0.00 H new ATOM 0 HB3 PHE A 64 13.113 -20.443 -7.461 1.00 0.00 H new ATOM 0 HD1 PHE A 64 15.237 -20.097 -4.361 1.00 0.00 H new ATOM 0 HD2 PHE A 64 12.251 -18.365 -6.923 1.00 0.00 H new ATOM 0 HE1 PHE A 64 15.189 -18.066 -2.937 1.00 0.00 H new ATOM 0 HE2 PHE A 64 12.222 -16.327 -5.511 1.00 0.00 H new ATOM 0 HZ PHE A 64 13.694 -16.174 -3.520 1.00 0.00 H new ATOM 1035 N ARG A 65 11.876 -21.716 -3.981 1.00 0.00 N ATOM 1036 CA ARG A 65 10.591 -21.751 -3.294 1.00 0.00 C ATOM 1037 C ARG A 65 10.096 -20.360 -2.917 1.00 0.00 C ATOM 1038 O ARG A 65 8.923 -20.202 -2.580 1.00 0.00 O ATOM 1039 CB ARG A 65 10.699 -22.643 -2.054 1.00 0.00 C ATOM 1040 CG ARG A 65 11.231 -24.046 -2.368 1.00 0.00 C ATOM 1041 CD ARG A 65 10.405 -24.739 -3.452 1.00 0.00 C ATOM 1042 NE ARG A 65 10.906 -26.098 -3.691 1.00 0.00 N ATOM 1043 CZ ARG A 65 10.623 -26.829 -4.773 1.00 0.00 C ATOM 1044 NH1 ARG A 65 9.827 -26.355 -5.728 1.00 0.00 N ATOM 1045 NH2 ARG A 65 11.139 -28.045 -4.905 1.00 0.00 N ATOM 0 H ARG A 65 12.678 -21.622 -3.358 1.00 0.00 H new ATOM 0 HA ARG A 65 9.855 -22.167 -3.982 1.00 0.00 H new ATOM 0 HB2 ARG A 65 11.356 -22.166 -1.327 1.00 0.00 H new ATOM 0 HB3 ARG A 65 9.717 -22.729 -1.589 1.00 0.00 H new ATOM 0 HG2 ARG A 65 12.270 -23.977 -2.692 1.00 0.00 H new ATOM 0 HG3 ARG A 65 11.220 -24.650 -1.461 1.00 0.00 H new ATOM 0 HD2 ARG A 65 9.358 -24.779 -3.150 1.00 0.00 H new ATOM 0 HD3 ARG A 65 10.449 -24.162 -4.375 1.00 0.00 H new ATOM 0 HE ARG A 65 11.512 -26.513 -2.983 1.00 0.00 H new ATOM 0 HH11 ARG A 65 9.424 -25.422 -5.640 1.00 0.00 H new ATOM 0 HH12 ARG A 65 9.620 -26.924 -6.548 1.00 0.00 H new ATOM 0 HH21 ARG A 65 11.751 -28.421 -4.181 1.00 0.00 H new ATOM 0 HH22 ARG A 65 10.923 -28.604 -5.731 1.00 0.00 H new ATOM 1059 N GLY A 66 10.966 -19.349 -2.966 1.00 0.00 N ATOM 1060 CA GLY A 66 10.576 -17.986 -2.636 1.00 0.00 C ATOM 1061 C GLY A 66 10.418 -17.795 -1.126 1.00 0.00 C ATOM 1062 O GLY A 66 9.744 -16.867 -0.686 1.00 0.00 O ATOM 0 H GLY A 66 11.945 -19.454 -3.232 1.00 0.00 H new ATOM 0 HA2 GLY A 66 11.325 -17.291 -3.015 1.00 0.00 H new ATOM 0 HA3 GLY A 66 9.637 -17.745 -3.134 1.00 0.00 H new ATOM 1066 N ASP A 67 11.040 -18.674 -0.334 1.00 0.00 N ATOM 1067 CA ASP A 67 10.982 -18.613 1.121 1.00 0.00 C ATOM 1068 C ASP A 67 11.761 -17.411 1.662 1.00 0.00 C ATOM 1069 O ASP A 67 11.702 -17.121 2.856 1.00 0.00 O ATOM 1070 CB ASP A 67 11.538 -19.924 1.687 1.00 0.00 C ATOM 1071 CG ASP A 67 10.538 -21.075 1.562 1.00 0.00 C ATOM 1072 OD1 ASP A 67 9.330 -20.825 1.771 1.00 0.00 O ATOM 1073 OD2 ASP A 67 10.993 -22.199 1.259 1.00 0.00 O ATOM 0 H ASP A 67 11.599 -19.449 -0.690 1.00 0.00 H new ATOM 0 HA ASP A 67 9.946 -18.485 1.434 1.00 0.00 H new ATOM 0 HB2 ASP A 67 12.457 -20.184 1.162 1.00 0.00 H new ATOM 0 HB3 ASP A 67 11.799 -19.784 2.736 1.00 0.00 H new ATOM 1078 N SER A 68 12.488 -16.713 0.786 1.00 0.00 N ATOM 1079 CA SER A 68 13.243 -15.518 1.123 1.00 0.00 C ATOM 1080 C SER A 68 13.482 -14.696 -0.142 1.00 0.00 C ATOM 1081 O SER A 68 13.177 -15.151 -1.246 1.00 0.00 O ATOM 1082 CB SER A 68 14.570 -15.934 1.757 1.00 0.00 C ATOM 1083 OG SER A 68 15.360 -14.807 2.058 1.00 0.00 O ATOM 0 H SER A 68 12.566 -16.974 -0.197 1.00 0.00 H new ATOM 0 HA SER A 68 12.687 -14.906 1.833 1.00 0.00 H new ATOM 0 HB2 SER A 68 14.380 -16.503 2.667 1.00 0.00 H new ATOM 0 HB3 SER A 68 15.112 -16.592 1.077 1.00 0.00 H new ATOM 0 HG SER A 68 15.538 -14.780 3.021 1.00 0.00 H new ATOM 1089 N ALA A 69 14.027 -13.489 0.012 1.00 0.00 N ATOM 1090 CA ALA A 69 14.378 -12.630 -1.107 1.00 0.00 C ATOM 1091 C ALA A 69 15.371 -13.349 -2.021 1.00 0.00 C ATOM 1092 O ALA A 69 16.105 -14.234 -1.576 1.00 0.00 O ATOM 1093 CB ALA A 69 14.957 -11.317 -0.580 1.00 0.00 C ATOM 0 H ALA A 69 14.236 -13.082 0.924 1.00 0.00 H new ATOM 0 HA ALA A 69 13.487 -12.401 -1.692 1.00 0.00 H new ATOM 0 HB1 ALA A 69 15.220 -10.673 -1.419 1.00 0.00 H new ATOM 0 HB2 ALA A 69 14.216 -10.817 0.043 1.00 0.00 H new ATOM 0 HB3 ALA A 69 15.848 -11.524 0.012 1.00 0.00 H new ATOM 1099 N PHE A 70 15.405 -12.977 -3.303 1.00 0.00 N ATOM 1100 CA PHE A 70 16.210 -13.705 -4.268 1.00 0.00 C ATOM 1101 C PHE A 70 17.706 -13.593 -3.977 1.00 0.00 C ATOM 1102 O PHE A 70 18.449 -14.530 -4.259 1.00 0.00 O ATOM 1103 CB PHE A 70 15.909 -13.208 -5.682 1.00 0.00 C ATOM 1104 CG PHE A 70 16.676 -13.965 -6.738 1.00 0.00 C ATOM 1105 CD1 PHE A 70 16.367 -15.309 -6.997 1.00 0.00 C ATOM 1106 CD2 PHE A 70 17.704 -13.334 -7.447 1.00 0.00 C ATOM 1107 CE1 PHE A 70 17.093 -16.022 -7.961 1.00 0.00 C ATOM 1108 CE2 PHE A 70 18.432 -14.047 -8.412 1.00 0.00 C ATOM 1109 CZ PHE A 70 18.132 -15.392 -8.662 1.00 0.00 C ATOM 0 H PHE A 70 14.889 -12.185 -3.687 1.00 0.00 H new ATOM 0 HA PHE A 70 15.943 -14.759 -4.186 1.00 0.00 H new ATOM 0 HB2 PHE A 70 14.841 -13.302 -5.877 1.00 0.00 H new ATOM 0 HB3 PHE A 70 16.153 -12.148 -5.750 1.00 0.00 H new ATOM 0 HD1 PHE A 70 15.570 -15.794 -6.454 1.00 0.00 H new ATOM 0 HD2 PHE A 70 17.937 -12.298 -7.252 1.00 0.00 H new ATOM 0 HE1 PHE A 70 16.853 -17.055 -8.164 1.00 0.00 H new ATOM 0 HE2 PHE A 70 19.223 -13.559 -8.962 1.00 0.00 H new ATOM 0 HZ PHE A 70 18.701 -15.945 -9.395 1.00 0.00 H new ATOM 1119 N TYR A 71 18.167 -12.471 -3.413 1.00 0.00 N ATOM 1120 CA TYR A 71 19.590 -12.319 -3.135 1.00 0.00 C ATOM 1121 C TYR A 71 20.008 -13.173 -1.946 1.00 0.00 C ATOM 1122 O TYR A 71 21.169 -13.555 -1.846 1.00 0.00 O ATOM 1123 CB TYR A 71 19.931 -10.853 -2.868 1.00 0.00 C ATOM 1124 CG TYR A 71 21.418 -10.622 -2.717 1.00 0.00 C ATOM 1125 CD1 TYR A 71 22.229 -10.609 -3.864 1.00 0.00 C ATOM 1126 CD2 TYR A 71 21.995 -10.426 -1.451 1.00 0.00 C ATOM 1127 CE1 TYR A 71 23.611 -10.395 -3.753 1.00 0.00 C ATOM 1128 CE2 TYR A 71 23.372 -10.184 -1.336 1.00 0.00 C ATOM 1129 CZ TYR A 71 24.187 -10.181 -2.484 1.00 0.00 C ATOM 1130 OH TYR A 71 25.529 -9.974 -2.362 1.00 0.00 O ATOM 0 H TYR A 71 17.587 -11.675 -3.147 1.00 0.00 H new ATOM 0 HA TYR A 71 20.140 -12.656 -4.014 1.00 0.00 H new ATOM 0 HB2 TYR A 71 19.553 -10.241 -3.687 1.00 0.00 H new ATOM 0 HB3 TYR A 71 19.422 -10.524 -1.962 1.00 0.00 H new ATOM 0 HD1 TYR A 71 21.786 -10.765 -4.837 1.00 0.00 H new ATOM 0 HD2 TYR A 71 21.378 -10.462 -0.565 1.00 0.00 H new ATOM 0 HE1 TYR A 71 24.232 -10.394 -4.637 1.00 0.00 H new ATOM 0 HE2 TYR A 71 23.808 -10.000 -0.365 1.00 0.00 H new ATOM 0 HH TYR A 71 25.755 -9.843 -1.418 1.00 0.00 H new ATOM 1140 N THR A 72 19.078 -13.480 -1.040 1.00 0.00 N ATOM 1141 CA THR A 72 19.401 -14.297 0.120 1.00 0.00 C ATOM 1142 C THR A 72 19.735 -15.708 -0.333 1.00 0.00 C ATOM 1143 O THR A 72 20.586 -16.367 0.260 1.00 0.00 O ATOM 1144 CB THR A 72 18.214 -14.315 1.084 1.00 0.00 C ATOM 1145 OG1 THR A 72 17.765 -13.001 1.331 1.00 0.00 O ATOM 1146 CG2 THR A 72 18.612 -14.949 2.414 1.00 0.00 C ATOM 0 H THR A 72 18.106 -13.176 -1.090 1.00 0.00 H new ATOM 0 HA THR A 72 20.264 -13.876 0.636 1.00 0.00 H new ATOM 0 HB THR A 72 17.418 -14.900 0.623 1.00 0.00 H new ATOM 0 HG1 THR A 72 16.846 -13.028 1.669 1.00 0.00 H new ATOM 0 HG21 THR A 72 17.754 -14.953 3.086 1.00 0.00 H new ATOM 0 HG22 THR A 72 18.944 -15.973 2.244 1.00 0.00 H new ATOM 0 HG23 THR A 72 19.422 -14.375 2.863 1.00 0.00 H new ATOM 1154 N TRP A 73 19.065 -16.173 -1.387 1.00 0.00 N ATOM 1155 CA TRP A 73 19.299 -17.493 -1.942 1.00 0.00 C ATOM 1156 C TRP A 73 20.514 -17.476 -2.864 1.00 0.00 C ATOM 1157 O TRP A 73 21.239 -18.463 -2.951 1.00 0.00 O ATOM 1158 CB TRP A 73 18.032 -17.910 -2.687 1.00 0.00 C ATOM 1159 CG TRP A 73 18.084 -19.246 -3.346 1.00 0.00 C ATOM 1160 CD1 TRP A 73 18.022 -20.434 -2.711 1.00 0.00 C ATOM 1161 CD2 TRP A 73 18.206 -19.559 -4.768 1.00 0.00 C ATOM 1162 NE1 TRP A 73 18.072 -21.456 -3.639 1.00 0.00 N ATOM 1163 CE2 TRP A 73 18.189 -20.971 -4.925 1.00 0.00 C ATOM 1164 CE3 TRP A 73 18.325 -18.783 -5.938 1.00 0.00 C ATOM 1165 CZ2 TRP A 73 18.283 -21.587 -6.177 1.00 0.00 C ATOM 1166 CZ3 TRP A 73 18.423 -19.390 -7.198 1.00 0.00 C ATOM 1167 CH2 TRP A 73 18.404 -20.785 -7.322 1.00 0.00 C ATOM 0 H TRP A 73 18.346 -15.640 -1.876 1.00 0.00 H new ATOM 0 HA TRP A 73 19.515 -18.213 -1.153 1.00 0.00 H new ATOM 0 HB2 TRP A 73 17.199 -17.904 -1.984 1.00 0.00 H new ATOM 0 HB3 TRP A 73 17.814 -17.158 -3.446 1.00 0.00 H new ATOM 0 HD1 TRP A 73 17.945 -20.566 -1.642 1.00 0.00 H new ATOM 0 HE1 TRP A 73 18.028 -22.447 -3.402 1.00 0.00 H new ATOM 0 HE3 TRP A 73 18.341 -17.706 -5.863 1.00 0.00 H new ATOM 0 HZ2 TRP A 73 18.263 -22.664 -6.261 1.00 0.00 H new ATOM 0 HZ3 TRP A 73 18.514 -18.776 -8.082 1.00 0.00 H new ATOM 0 HH2 TRP A 73 18.482 -21.243 -8.297 1.00 0.00 H new ATOM 1178 N LEU A 74 20.743 -16.353 -3.553 1.00 0.00 N ATOM 1179 CA LEU A 74 21.879 -16.207 -4.447 1.00 0.00 C ATOM 1180 C LEU A 74 23.164 -16.110 -3.627 1.00 0.00 C ATOM 1181 O LEU A 74 24.214 -16.588 -4.047 1.00 0.00 O ATOM 1182 CB LEU A 74 21.671 -14.941 -5.287 1.00 0.00 C ATOM 1183 CG LEU A 74 22.207 -15.057 -6.718 1.00 0.00 C ATOM 1184 CD1 LEU A 74 21.998 -13.723 -7.425 1.00 0.00 C ATOM 1185 CD2 LEU A 74 23.691 -15.416 -6.772 1.00 0.00 C ATOM 0 H LEU A 74 20.145 -15.528 -3.502 1.00 0.00 H new ATOM 0 HA LEU A 74 21.962 -17.070 -5.108 1.00 0.00 H new ATOM 0 HB2 LEU A 74 20.606 -14.711 -5.325 1.00 0.00 H new ATOM 0 HB3 LEU A 74 22.161 -14.102 -4.792 1.00 0.00 H new ATOM 0 HG LEU A 74 21.661 -15.864 -7.208 1.00 0.00 H new ATOM 0 HD11 LEU A 74 22.375 -13.789 -8.446 1.00 0.00 H new ATOM 0 HD12 LEU A 74 20.935 -13.485 -7.445 1.00 0.00 H new ATOM 0 HD13 LEU A 74 22.535 -12.940 -6.890 1.00 0.00 H new ATOM 0 HD21 LEU A 74 24.011 -15.484 -7.812 1.00 0.00 H new ATOM 0 HD22 LEU A 74 24.270 -14.646 -6.263 1.00 0.00 H new ATOM 0 HD23 LEU A 74 23.851 -16.375 -6.280 1.00 0.00 H new ATOM 1197 N TYR A 75 23.080 -15.488 -2.447 1.00 0.00 N ATOM 1198 CA TYR A 75 24.225 -15.304 -1.579 1.00 0.00 C ATOM 1199 C TYR A 75 24.716 -16.659 -1.075 1.00 0.00 C ATOM 1200 O TYR A 75 25.922 -16.881 -1.003 1.00 0.00 O ATOM 1201 CB TYR A 75 23.815 -14.385 -0.424 1.00 0.00 C ATOM 1202 CG TYR A 75 24.945 -13.925 0.473 1.00 0.00 C ATOM 1203 CD1 TYR A 75 25.654 -14.833 1.278 1.00 0.00 C ATOM 1204 CD2 TYR A 75 25.273 -12.561 0.503 1.00 0.00 C ATOM 1205 CE1 TYR A 75 26.699 -14.379 2.096 1.00 0.00 C ATOM 1206 CE2 TYR A 75 26.307 -12.099 1.326 1.00 0.00 C ATOM 1207 CZ TYR A 75 27.029 -13.008 2.125 1.00 0.00 C ATOM 1208 OH TYR A 75 28.036 -12.565 2.929 1.00 0.00 O ATOM 0 H TYR A 75 22.212 -15.101 -2.076 1.00 0.00 H new ATOM 0 HA TYR A 75 25.049 -14.840 -2.121 1.00 0.00 H new ATOM 0 HB2 TYR A 75 23.322 -13.506 -0.839 1.00 0.00 H new ATOM 0 HB3 TYR A 75 23.077 -14.905 0.187 1.00 0.00 H new ATOM 0 HD1 TYR A 75 25.394 -15.881 1.267 1.00 0.00 H new ATOM 0 HD2 TYR A 75 24.724 -11.863 -0.113 1.00 0.00 H new ATOM 0 HE1 TYR A 75 27.251 -15.080 2.704 1.00 0.00 H new ATOM 0 HE2 TYR A 75 26.551 -11.047 1.349 1.00 0.00 H new ATOM 0 HH TYR A 75 28.133 -11.595 2.828 1.00 0.00 H new ATOM 1218 N ARG A 76 23.795 -17.569 -0.730 1.00 0.00 N ATOM 1219 CA ARG A 76 24.174 -18.887 -0.234 1.00 0.00 C ATOM 1220 C ARG A 76 24.845 -19.704 -1.334 1.00 0.00 C ATOM 1221 O ARG A 76 25.760 -20.471 -1.046 1.00 0.00 O ATOM 1222 CB ARG A 76 22.941 -19.640 0.270 1.00 0.00 C ATOM 1223 CG ARG A 76 22.303 -18.993 1.501 1.00 0.00 C ATOM 1224 CD ARG A 76 23.259 -18.960 2.693 1.00 0.00 C ATOM 1225 NE ARG A 76 22.592 -18.418 3.880 1.00 0.00 N ATOM 1226 CZ ARG A 76 23.216 -18.131 5.026 1.00 0.00 C ATOM 1227 NH1 ARG A 76 24.523 -18.335 5.159 1.00 0.00 N ATOM 1228 NH2 ARG A 76 22.531 -17.636 6.052 1.00 0.00 N ATOM 0 H ARG A 76 22.789 -17.412 -0.787 1.00 0.00 H new ATOM 0 HA ARG A 76 24.877 -18.748 0.588 1.00 0.00 H new ATOM 0 HB2 ARG A 76 22.202 -19.691 -0.530 1.00 0.00 H new ATOM 0 HB3 ARG A 76 23.222 -20.665 0.511 1.00 0.00 H new ATOM 0 HG2 ARG A 76 21.994 -17.977 1.257 1.00 0.00 H new ATOM 0 HG3 ARG A 76 21.403 -19.543 1.774 1.00 0.00 H new ATOM 0 HD2 ARG A 76 23.622 -19.966 2.902 1.00 0.00 H new ATOM 0 HD3 ARG A 76 24.130 -18.351 2.450 1.00 0.00 H new ATOM 0 HE ARG A 76 21.587 -18.249 3.828 1.00 0.00 H new ATOM 0 HH11 ARG A 76 25.062 -18.715 4.381 1.00 0.00 H new ATOM 0 HH12 ARG A 76 24.987 -18.112 6.039 1.00 0.00 H new ATOM 0 HH21 ARG A 76 21.528 -17.475 5.965 1.00 0.00 H new ATOM 0 HH22 ARG A 76 23.009 -17.417 6.926 1.00 0.00 H new ATOM 1242 N ILE A 77 24.409 -19.546 -2.586 1.00 0.00 N ATOM 1243 CA ILE A 77 25.005 -20.286 -3.690 1.00 0.00 C ATOM 1244 C ILE A 77 26.382 -19.718 -4.015 1.00 0.00 C ATOM 1245 O ILE A 77 27.285 -20.478 -4.357 1.00 0.00 O ATOM 1246 CB ILE A 77 24.080 -20.220 -4.916 1.00 0.00 C ATOM 1247 CG1 ILE A 77 22.776 -20.958 -4.596 1.00 0.00 C ATOM 1248 CG2 ILE A 77 24.761 -20.852 -6.139 1.00 0.00 C ATOM 1249 CD1 ILE A 77 21.797 -20.929 -5.769 1.00 0.00 C ATOM 0 H ILE A 77 23.652 -18.917 -2.855 1.00 0.00 H new ATOM 0 HA ILE A 77 25.127 -21.331 -3.404 1.00 0.00 H new ATOM 0 HB ILE A 77 23.864 -19.178 -5.150 1.00 0.00 H new ATOM 0 HG12 ILE A 77 23.000 -21.993 -4.336 1.00 0.00 H new ATOM 0 HG13 ILE A 77 22.308 -20.504 -3.722 1.00 0.00 H new ATOM 0 HG21 ILE A 77 24.092 -20.796 -6.997 1.00 0.00 H new ATOM 0 HG22 ILE A 77 25.682 -20.313 -6.362 1.00 0.00 H new ATOM 0 HG23 ILE A 77 24.993 -21.896 -5.927 1.00 0.00 H new ATOM 0 HD11 ILE A 77 20.887 -21.464 -5.497 1.00 0.00 H new ATOM 0 HD12 ILE A 77 21.551 -19.895 -6.012 1.00 0.00 H new ATOM 0 HD13 ILE A 77 22.253 -21.407 -6.636 1.00 0.00 H new ATOM 1261 N ALA A 78 26.558 -18.398 -3.915 1.00 0.00 N ATOM 1262 CA ALA A 78 27.805 -17.764 -4.309 1.00 0.00 C ATOM 1263 C ALA A 78 28.946 -18.107 -3.354 1.00 0.00 C ATOM 1264 O ALA A 78 30.064 -18.358 -3.803 1.00 0.00 O ATOM 1265 CB ALA A 78 27.568 -16.257 -4.361 1.00 0.00 C ATOM 0 H ALA A 78 25.850 -17.754 -3.564 1.00 0.00 H new ATOM 0 HA ALA A 78 28.107 -18.135 -5.288 1.00 0.00 H new ATOM 0 HB1 ALA A 78 28.489 -15.754 -4.655 1.00 0.00 H new ATOM 0 HB2 ALA A 78 26.786 -16.036 -5.088 1.00 0.00 H new ATOM 0 HB3 ALA A 78 27.259 -15.903 -3.377 1.00 0.00 H new ATOM 1271 N VAL A 79 28.686 -18.126 -2.042 1.00 0.00 N ATOM 1272 CA VAL A 79 29.732 -18.451 -1.080 1.00 0.00 C ATOM 1273 C VAL A 79 30.033 -19.948 -1.103 1.00 0.00 C ATOM 1274 O VAL A 79 31.171 -20.354 -0.869 1.00 0.00 O ATOM 1275 CB VAL A 79 29.328 -17.984 0.326 1.00 0.00 C ATOM 1276 CG1 VAL A 79 28.029 -18.625 0.809 1.00 0.00 C ATOM 1277 CG2 VAL A 79 30.422 -18.340 1.326 1.00 0.00 C ATOM 0 H VAL A 79 27.774 -17.923 -1.632 1.00 0.00 H new ATOM 0 HA VAL A 79 30.644 -17.924 -1.360 1.00 0.00 H new ATOM 0 HB VAL A 79 29.182 -16.906 0.262 1.00 0.00 H new ATOM 0 HG11 VAL A 79 27.792 -18.259 1.808 1.00 0.00 H new ATOM 0 HG12 VAL A 79 27.220 -18.366 0.126 1.00 0.00 H new ATOM 0 HG13 VAL A 79 28.147 -19.708 0.838 1.00 0.00 H new ATOM 0 HG21 VAL A 79 30.128 -18.006 2.321 1.00 0.00 H new ATOM 0 HG22 VAL A 79 30.569 -19.420 1.335 1.00 0.00 H new ATOM 0 HG23 VAL A 79 31.352 -17.849 1.038 1.00 0.00 H new ATOM 1287 N ASN A 80 29.021 -20.772 -1.386 1.00 0.00 N ATOM 1288 CA ASN A 80 29.195 -22.214 -1.428 1.00 0.00 C ATOM 1289 C ASN A 80 29.752 -22.667 -2.775 1.00 0.00 C ATOM 1290 O ASN A 80 30.244 -23.786 -2.878 1.00 0.00 O ATOM 1291 CB ASN A 80 27.866 -22.885 -1.080 1.00 0.00 C ATOM 1292 CG ASN A 80 27.560 -22.788 0.411 1.00 0.00 C ATOM 1293 OD1 ASN A 80 28.399 -22.378 1.210 1.00 0.00 O ATOM 1294 ND2 ASN A 80 26.349 -23.169 0.801 1.00 0.00 N ATOM 0 H ASN A 80 28.072 -20.457 -1.589 1.00 0.00 H new ATOM 0 HA ASN A 80 29.934 -22.518 -0.687 1.00 0.00 H new ATOM 0 HB2 ASN A 80 27.062 -22.417 -1.648 1.00 0.00 H new ATOM 0 HB3 ASN A 80 27.898 -23.933 -1.378 1.00 0.00 H new ATOM 0 HD21 ASN A 80 26.094 -23.126 1.788 1.00 0.00 H new ATOM 0 HD22 ASN A 80 25.674 -23.505 0.114 1.00 0.00 H new ATOM 1301 N THR A 81 29.685 -21.823 -3.810 1.00 0.00 N ATOM 1302 CA THR A 81 30.315 -22.133 -5.088 1.00 0.00 C ATOM 1303 C THR A 81 31.786 -21.728 -5.034 1.00 0.00 C ATOM 1304 O THR A 81 32.640 -22.425 -5.579 1.00 0.00 O ATOM 1305 CB THR A 81 29.591 -21.402 -6.222 1.00 0.00 C ATOM 1306 OG1 THR A 81 28.281 -21.903 -6.350 1.00 0.00 O ATOM 1307 CG2 THR A 81 30.304 -21.603 -7.557 1.00 0.00 C ATOM 0 H THR A 81 29.202 -20.925 -3.784 1.00 0.00 H new ATOM 0 HA THR A 81 30.249 -23.204 -5.280 1.00 0.00 H new ATOM 0 HB THR A 81 29.580 -20.340 -5.975 1.00 0.00 H new ATOM 0 HG1 THR A 81 27.662 -21.332 -5.848 1.00 0.00 H new ATOM 0 HG21 THR A 81 29.765 -21.071 -8.341 1.00 0.00 H new ATOM 0 HG22 THR A 81 31.320 -21.215 -7.489 1.00 0.00 H new ATOM 0 HG23 THR A 81 30.336 -22.666 -7.796 1.00 0.00 H new ATOM 1315 N ALA A 82 32.085 -20.605 -4.376 1.00 0.00 N ATOM 1316 CA ALA A 82 33.450 -20.123 -4.266 1.00 0.00 C ATOM 1317 C ALA A 82 34.257 -20.939 -3.254 1.00 0.00 C ATOM 1318 O ALA A 82 35.470 -21.063 -3.402 1.00 0.00 O ATOM 1319 CB ALA A 82 33.413 -18.647 -3.879 1.00 0.00 C ATOM 0 H ALA A 82 31.393 -20.016 -3.913 1.00 0.00 H new ATOM 0 HA ALA A 82 33.951 -20.240 -5.227 1.00 0.00 H new ATOM 0 HB1 ALA A 82 34.431 -18.268 -3.792 1.00 0.00 H new ATOM 0 HB2 ALA A 82 32.880 -18.083 -4.645 1.00 0.00 H new ATOM 0 HB3 ALA A 82 32.901 -18.534 -2.923 1.00 0.00 H new ATOM 1325 N LYS A 83 33.599 -21.500 -2.232 1.00 0.00 N ATOM 1326 CA LYS A 83 34.283 -22.303 -1.226 1.00 0.00 C ATOM 1327 C LYS A 83 34.438 -23.746 -1.693 1.00 0.00 C ATOM 1328 O LYS A 83 35.436 -24.393 -1.382 1.00 0.00 O ATOM 1329 CB LYS A 83 33.508 -22.216 0.087 1.00 0.00 C ATOM 1330 CG LYS A 83 34.330 -22.813 1.229 1.00 0.00 C ATOM 1331 CD LYS A 83 33.524 -22.859 2.527 1.00 0.00 C ATOM 1332 CE LYS A 83 33.031 -21.475 2.956 1.00 0.00 C ATOM 1333 NZ LYS A 83 34.154 -20.567 3.256 1.00 0.00 N ATOM 0 H LYS A 83 32.594 -21.409 -2.085 1.00 0.00 H new ATOM 0 HA LYS A 83 35.289 -21.914 -1.069 1.00 0.00 H new ATOM 0 HB2 LYS A 83 33.268 -21.176 0.307 1.00 0.00 H new ATOM 0 HB3 LYS A 83 32.561 -22.748 -0.006 1.00 0.00 H new ATOM 0 HG2 LYS A 83 34.651 -23.820 0.962 1.00 0.00 H new ATOM 0 HG3 LYS A 83 35.232 -22.220 1.379 1.00 0.00 H new ATOM 0 HD2 LYS A 83 32.669 -23.522 2.397 1.00 0.00 H new ATOM 0 HD3 LYS A 83 34.140 -23.284 3.319 1.00 0.00 H new ATOM 0 HE2 LYS A 83 32.417 -21.046 2.165 1.00 0.00 H new ATOM 0 HE3 LYS A 83 32.395 -21.571 3.836 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 33.784 -19.667 3.624 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 34.773 -21.004 3.968 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 34.698 -20.389 2.388 1.00 0.00 H new ATOM 1347 N ASN A 84 33.456 -24.258 -2.444 1.00 0.00 N ATOM 1348 CA ASN A 84 33.529 -25.608 -2.979 1.00 0.00 C ATOM 1349 C ASN A 84 34.544 -25.643 -4.128 1.00 0.00 C ATOM 1350 O ASN A 84 35.030 -26.705 -4.507 1.00 0.00 O ATOM 1351 CB ASN A 84 32.119 -26.056 -3.385 1.00 0.00 C ATOM 1352 CG ASN A 84 31.983 -27.556 -3.630 1.00 0.00 C ATOM 1353 OD1 ASN A 84 32.957 -28.302 -3.606 1.00 0.00 O ATOM 1354 ND2 ASN A 84 30.757 -28.011 -3.868 1.00 0.00 N ATOM 0 H ASN A 84 32.605 -23.752 -2.691 1.00 0.00 H new ATOM 0 HA ASN A 84 33.885 -26.318 -2.232 1.00 0.00 H new ATOM 0 HB2 ASN A 84 31.418 -25.762 -2.604 1.00 0.00 H new ATOM 0 HB3 ASN A 84 31.828 -25.524 -4.291 1.00 0.00 H new ATOM 0 HD21 ASN A 84 30.606 -29.005 -4.037 1.00 0.00 H new ATOM 0 HD22 ASN A 84 29.967 -27.366 -3.881 1.00 0.00 H new ATOM 1361 N TYR A 85 34.878 -24.477 -4.690 1.00 0.00 N ATOM 1362 CA TYR A 85 35.945 -24.392 -5.673 1.00 0.00 C ATOM 1363 C TYR A 85 37.293 -24.623 -4.997 1.00 0.00 C ATOM 1364 O TYR A 85 38.113 -25.365 -5.524 1.00 0.00 O ATOM 1365 CB TYR A 85 35.905 -23.024 -6.356 1.00 0.00 C ATOM 1366 CG TYR A 85 37.161 -22.688 -7.128 1.00 0.00 C ATOM 1367 CD1 TYR A 85 37.468 -23.359 -8.320 1.00 0.00 C ATOM 1368 CD2 TYR A 85 38.022 -21.695 -6.640 1.00 0.00 C ATOM 1369 CE1 TYR A 85 38.643 -23.047 -9.020 1.00 0.00 C ATOM 1370 CE2 TYR A 85 39.193 -21.367 -7.340 1.00 0.00 C ATOM 1371 CZ TYR A 85 39.510 -22.046 -8.536 1.00 0.00 C ATOM 1372 OH TYR A 85 40.652 -21.739 -9.212 1.00 0.00 O ATOM 0 H TYR A 85 34.424 -23.588 -4.478 1.00 0.00 H new ATOM 0 HA TYR A 85 35.806 -25.163 -6.431 1.00 0.00 H new ATOM 0 HB2 TYR A 85 35.053 -22.993 -7.035 1.00 0.00 H new ATOM 0 HB3 TYR A 85 35.738 -22.256 -5.600 1.00 0.00 H new ATOM 0 HD1 TYR A 85 36.799 -24.117 -8.700 1.00 0.00 H new ATOM 0 HD2 TYR A 85 37.783 -21.180 -5.721 1.00 0.00 H new ATOM 0 HE1 TYR A 85 38.884 -23.574 -9.931 1.00 0.00 H new ATOM 0 HE2 TYR A 85 39.850 -20.597 -6.964 1.00 0.00 H new ATOM 0 HH TYR A 85 41.131 -21.026 -8.739 1.00 0.00 H new ATOM 1382 N LEU A 86 37.526 -24.004 -3.834 1.00 0.00 N ATOM 1383 CA LEU A 86 38.808 -24.100 -3.145 1.00 0.00 C ATOM 1384 C LEU A 86 39.133 -25.537 -2.737 1.00 0.00 C ATOM 1385 O LEU A 86 40.302 -25.878 -2.558 1.00 0.00 O ATOM 1386 CB LEU A 86 38.780 -23.230 -1.885 1.00 0.00 C ATOM 1387 CG LEU A 86 38.632 -21.738 -2.181 1.00 0.00 C ATOM 1388 CD1 LEU A 86 38.498 -20.991 -0.855 1.00 0.00 C ATOM 1389 CD2 LEU A 86 39.838 -21.199 -2.946 1.00 0.00 C ATOM 0 H LEU A 86 36.835 -23.429 -3.352 1.00 0.00 H new ATOM 0 HA LEU A 86 39.576 -23.757 -3.838 1.00 0.00 H new ATOM 0 HB2 LEU A 86 37.954 -23.550 -1.249 1.00 0.00 H new ATOM 0 HB3 LEU A 86 39.698 -23.392 -1.320 1.00 0.00 H new ATOM 0 HG LEU A 86 37.748 -21.589 -2.801 1.00 0.00 H new ATOM 0 HD11 LEU A 86 38.391 -19.924 -1.048 1.00 0.00 H new ATOM 0 HD12 LEU A 86 37.619 -21.353 -0.321 1.00 0.00 H new ATOM 0 HD13 LEU A 86 39.387 -21.163 -0.249 1.00 0.00 H new ATOM 0 HD21 LEU A 86 39.700 -20.135 -3.140 1.00 0.00 H new ATOM 0 HD22 LEU A 86 40.740 -21.346 -2.353 1.00 0.00 H new ATOM 0 HD23 LEU A 86 39.936 -21.731 -3.892 1.00 0.00 H new ATOM 1401 N VAL A 87 38.114 -26.385 -2.586 1.00 0.00 N ATOM 1402 CA VAL A 87 38.321 -27.767 -2.177 1.00 0.00 C ATOM 1403 C VAL A 87 38.326 -28.702 -3.382 1.00 0.00 C ATOM 1404 O VAL A 87 38.774 -29.843 -3.279 1.00 0.00 O ATOM 1405 CB VAL A 87 37.255 -28.140 -1.142 1.00 0.00 C ATOM 1406 CG1 VAL A 87 35.887 -28.353 -1.783 1.00 0.00 C ATOM 1407 CG2 VAL A 87 37.635 -29.400 -0.372 1.00 0.00 C ATOM 0 H VAL A 87 37.138 -26.134 -2.742 1.00 0.00 H new ATOM 0 HA VAL A 87 39.301 -27.876 -1.713 1.00 0.00 H new ATOM 0 HB VAL A 87 37.199 -27.297 -0.453 1.00 0.00 H new ATOM 0 HG11 VAL A 87 35.161 -28.616 -1.013 1.00 0.00 H new ATOM 0 HG12 VAL A 87 35.572 -27.436 -2.281 1.00 0.00 H new ATOM 0 HG13 VAL A 87 35.949 -29.160 -2.513 1.00 0.00 H new ATOM 0 HG21 VAL A 87 36.855 -29.633 0.353 1.00 0.00 H new ATOM 0 HG22 VAL A 87 37.744 -30.232 -1.067 1.00 0.00 H new ATOM 0 HG23 VAL A 87 38.578 -29.237 0.150 1.00 0.00 H new