USER MOD reduce.3.24.130724 H: found=0, std=0, add=754, rem=0, adj=14 USER MOD reduce.3.24.130724 removed 753 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 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 92 HIS : no HD1:sc= -0.249 X(o=-0.25,f=-0.0036) USER MOD Single : A 97 THR OG1 : rot -75:sc= 0.98 USER MOD Single : A 100 LYS NZ :NH3+ -94:sc= -0.755 (180deg=-1.64!) USER MOD Single : A 102 TYR OH : rot 30:sc= -3.07! USER MOD Single : A 107 THR OG1 : rot 180:sc= 0 USER MOD Single : A 109 THR OG1 : rot 180:sc= 0 USER MOD Single : A 113 ASN : amide:sc= -0.744 K(o=-0.74,f=-1.9!) USER MOD Single : A 115 LYS NZ :NH3+ -168:sc= 0 (180deg=-0.0841) USER MOD Single : A 117 LYS NZ :NH3+ 169:sc=-0.00106 (180deg=-0.0885) USER MOD Single : A 121 THR OG1 : rot 180:sc= 0 USER MOD Single : A 125 ASN : amide:sc= -1.2 K(o=-1.2,f=-6!) USER MOD Single : A 134 SER OG : rot 180:sc= 0 USER MOD Single : A 144 THR OG1 : rot 180:sc= 0 USER MOD Single : A 146 HIS : no HD1:sc= -2.66! X(o=-2.7!,f=-3.2) USER MOD Single : A 150 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 155 LYS NZ :NH3+ 164:sc= 0.383 (180deg=-0.612) USER MOD Single : A 158 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 161 GLN : amide:sc= -0.176 K(o=-0.18,f=-2.1!) USER MOD Single : A 162 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 164 ASN : amide:sc= -0.332 X(o=-0.33,f=0) USER MOD Single : A 165 ASN : amide:sc= -0.224 K(o=-0.22,f=-1.4) USER MOD Single : A 169 SER OG : rot 120:sc= -1.51 USER MOD Single : A 176 SER OG : rot -77:sc= -0.38 USER MOD Single : A 178 ASN : amide:sc= -0.0383 X(o=-0.038,f=-0.038) USER MOD Single : A 179 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 16 N LYS A 88 0.604 -3.517 -2.415 1.00 40.53 N ATOM 17 CA LYS A 88 0.390 -4.495 -3.476 1.00 63.05 C ATOM 18 C LYS A 88 0.573 -3.856 -4.850 1.00 52.21 C ATOM 19 O LYS A 88 1.542 -4.140 -5.552 1.00 53.22 O ATOM 20 CB LYS A 88 -1.012 -5.099 -3.366 1.00 43.40 C ATOM 21 CG LYS A 88 -1.169 -6.063 -2.203 1.00 73.43 C ATOM 22 CD LYS A 88 -0.447 -7.375 -2.464 1.00 72.30 C ATOM 23 CE LYS A 88 -1.346 -8.371 -3.181 1.00 5.41 C ATOM 24 NZ LYS A 88 -0.615 -9.618 -3.539 1.00 62.21 N1+ ATOM 0 HA LYS A 88 1.130 -5.287 -3.361 1.00 63.05 H new ATOM 0 HB2 LYS A 88 -1.738 -4.293 -3.260 1.00 43.40 H new ATOM 0 HB3 LYS A 88 -1.248 -5.620 -4.294 1.00 43.40 H new ATOM 0 HG2 LYS A 88 -0.777 -5.605 -1.295 1.00 73.43 H new ATOM 0 HG3 LYS A 88 -2.228 -6.257 -2.031 1.00 73.43 H new ATOM 0 HD2 LYS A 88 0.443 -7.189 -3.064 1.00 72.30 H new ATOM 0 HD3 LYS A 88 -0.111 -7.801 -1.519 1.00 72.30 H new ATOM 0 HE2 LYS A 88 -2.195 -8.618 -2.544 1.00 5.41 H new ATOM 0 HE3 LYS A 88 -1.748 -7.913 -4.085 1.00 5.41 H new ATOM 0 HZ1 LYS A 88 -1.261 -10.272 -4.026 1.00 62.21 H new ATOM 0 HZ2 LYS A 88 0.181 -9.386 -4.167 1.00 62.21 H new ATOM 0 HZ3 LYS A 88 -0.253 -10.069 -2.674 1.00 62.21 H new ATOM 38 N ALA A 89 -0.364 -2.991 -5.224 1.00 2.12 N ATOM 39 CA ALA A 89 -0.303 -2.310 -6.512 1.00 32.13 C ATOM 40 C ALA A 89 0.998 -1.528 -6.658 1.00 63.45 C ATOM 41 O ALA A 89 1.623 -1.534 -7.719 1.00 5.31 O ATOM 42 CB ALA A 89 -1.499 -1.383 -6.675 1.00 44.04 C ATOM 0 H ALA A 89 -1.174 -2.745 -4.654 1.00 2.12 H new ATOM 0 HA ALA A 89 -0.332 -3.066 -7.297 1.00 32.13 H new ATOM 0 HB1 ALA A 89 -1.441 -0.881 -7.641 1.00 44.04 H new ATOM 0 HB2 ALA A 89 -2.420 -1.964 -6.623 1.00 44.04 H new ATOM 0 HB3 ALA A 89 -1.494 -0.639 -5.878 1.00 44.04 H new ATOM 48 N LYS A 90 1.403 -0.855 -5.587 1.00 51.00 N ATOM 49 CA LYS A 90 2.631 -0.069 -5.595 1.00 61.25 C ATOM 50 C LYS A 90 3.827 -0.932 -5.980 1.00 14.35 C ATOM 51 O LYS A 90 4.824 -0.430 -6.502 1.00 71.13 O ATOM 52 CB LYS A 90 2.865 0.563 -4.221 1.00 41.44 C ATOM 53 CG LYS A 90 1.860 1.647 -3.870 1.00 65.43 C ATOM 54 CD LYS A 90 2.091 2.906 -4.688 1.00 32.40 C ATOM 55 CE LYS A 90 3.068 3.848 -3.998 1.00 73.34 C ATOM 56 NZ LYS A 90 2.980 5.232 -4.540 1.00 11.23 N1+ ATOM 0 H LYS A 90 0.898 -0.838 -4.701 1.00 51.00 H new ATOM 0 HA LYS A 90 2.522 0.721 -6.338 1.00 61.25 H new ATOM 0 HB2 LYS A 90 2.826 -0.217 -3.460 1.00 41.44 H new ATOM 0 HB3 LYS A 90 3.869 0.987 -4.192 1.00 41.44 H new ATOM 0 HG2 LYS A 90 0.849 1.278 -4.045 1.00 65.43 H new ATOM 0 HG3 LYS A 90 1.934 1.883 -2.808 1.00 65.43 H new ATOM 0 HD2 LYS A 90 2.476 2.637 -5.671 1.00 32.40 H new ATOM 0 HD3 LYS A 90 1.142 3.417 -4.847 1.00 32.40 H new ATOM 0 HE2 LYS A 90 2.863 3.863 -2.928 1.00 73.34 H new ATOM 0 HE3 LYS A 90 4.084 3.473 -4.123 1.00 73.34 H new ATOM 0 HZ1 LYS A 90 3.661 5.843 -4.045 1.00 11.23 H new ATOM 0 HZ2 LYS A 90 3.200 5.221 -5.556 1.00 11.23 H new ATOM 0 HZ3 LYS A 90 2.018 5.600 -4.398 1.00 11.23 H new ATOM 70 N ARG A 91 3.722 -2.231 -5.723 1.00 52.32 N ATOM 71 CA ARG A 91 4.795 -3.164 -6.043 1.00 73.43 C ATOM 72 C ARG A 91 4.860 -3.423 -7.546 1.00 12.01 C ATOM 73 O ARG A 91 5.906 -3.796 -8.077 1.00 55.01 O ATOM 74 CB ARG A 91 4.593 -4.483 -5.296 1.00 55.15 C ATOM 75 CG ARG A 91 5.894 -5.185 -4.937 1.00 43.31 C ATOM 76 CD ARG A 91 6.532 -4.576 -3.699 1.00 24.02 C ATOM 77 NE ARG A 91 5.767 -4.866 -2.489 1.00 52.32 N ATOM 78 CZ ARG A 91 6.103 -4.422 -1.283 1.00 52.22 C ATOM 79 NH1 ARG A 91 7.185 -3.672 -1.127 1.00 64.04 N1+ ATOM 80 NH2 ARG A 91 5.356 -4.729 -0.230 1.00 70.21 N ATOM 0 H ARG A 91 2.903 -2.662 -5.293 1.00 52.32 H new ATOM 0 HA ARG A 91 5.737 -2.717 -5.727 1.00 73.43 H new ATOM 0 HB2 ARG A 91 4.029 -4.291 -4.383 1.00 55.15 H new ATOM 0 HB3 ARG A 91 3.988 -5.150 -5.910 1.00 55.15 H new ATOM 0 HG2 ARG A 91 5.702 -6.244 -4.765 1.00 43.31 H new ATOM 0 HG3 ARG A 91 6.588 -5.119 -5.775 1.00 43.31 H new ATOM 0 HD2 ARG A 91 7.546 -4.960 -3.588 1.00 24.02 H new ATOM 0 HD3 ARG A 91 6.613 -3.497 -3.827 1.00 24.02 H new ATOM 0 HE ARG A 91 4.929 -5.441 -2.575 1.00 52.32 H new ATOM 0 HH11 ARG A 91 7.762 -3.435 -1.934 1.00 64.04 H new ATOM 0 HH12 ARG A 91 7.441 -3.332 -0.200 1.00 64.04 H new ATOM 0 HH21 ARG A 91 4.523 -5.306 -0.346 1.00 70.21 H new ATOM 0 HH22 ARG A 91 5.615 -4.388 0.696 1.00 70.21 H new ATOM 94 N HIS A 92 3.735 -3.223 -8.224 1.00 20.10 N ATOM 95 CA HIS A 92 3.664 -3.435 -9.666 1.00 61.12 C ATOM 96 C HIS A 92 4.780 -2.681 -10.381 1.00 44.23 C ATOM 97 O HIS A 92 5.444 -3.226 -11.263 1.00 34.04 O ATOM 98 CB HIS A 92 2.303 -2.986 -10.201 1.00 61.10 C ATOM 99 CG HIS A 92 2.055 -3.394 -11.621 1.00 44.40 C ATOM 100 ND1 HIS A 92 1.110 -4.332 -11.981 1.00 73.45 N ATOM 101 CD2 HIS A 92 2.633 -2.985 -12.774 1.00 35.45 C ATOM 102 CE1 HIS A 92 1.120 -4.483 -13.293 1.00 42.11 C ATOM 103 NE2 HIS A 92 2.034 -3.677 -13.798 1.00 11.35 N ATOM 0 H HIS A 92 2.860 -2.915 -7.799 1.00 20.10 H new ATOM 0 HA HIS A 92 3.789 -4.500 -9.860 1.00 61.12 H new ATOM 0 HB2 HIS A 92 1.518 -3.402 -9.569 1.00 61.10 H new ATOM 0 HB3 HIS A 92 2.232 -1.901 -10.125 1.00 61.10 H new ATOM 0 HD2 HIS A 92 3.419 -2.251 -12.871 1.00 35.45 H new ATOM 0 HE1 HIS A 92 0.487 -5.153 -13.857 1.00 42.11 H new ATOM 0 HE2 HIS A 92 2.259 -3.583 -14.788 1.00 11.35 H new ATOM 111 N GLU A 93 4.980 -1.424 -9.997 1.00 62.03 N ATOM 112 CA GLU A 93 6.014 -0.596 -10.603 1.00 22.40 C ATOM 113 C GLU A 93 7.395 -0.969 -10.068 1.00 33.12 C ATOM 114 O GLU A 93 8.396 -0.866 -10.777 1.00 63.31 O ATOM 115 CB GLU A 93 5.737 0.885 -10.336 1.00 71.43 C ATOM 116 CG GLU A 93 5.547 1.212 -8.864 1.00 15.43 C ATOM 117 CD GLU A 93 5.453 2.704 -8.606 1.00 43.51 C ATOM 118 OE1 GLU A 93 6.478 3.399 -8.768 1.00 60.32 O1- ATOM 119 OE2 GLU A 93 4.355 3.175 -8.241 1.00 11.33 O ATOM 0 H GLU A 93 4.439 -0.958 -9.269 1.00 62.03 H new ATOM 0 HA GLU A 93 5.999 -0.773 -11.678 1.00 22.40 H new ATOM 0 HB2 GLU A 93 6.564 1.477 -10.727 1.00 71.43 H new ATOM 0 HB3 GLU A 93 4.844 1.184 -10.884 1.00 71.43 H new ATOM 0 HG2 GLU A 93 4.641 0.726 -8.502 1.00 15.43 H new ATOM 0 HG3 GLU A 93 6.379 0.800 -8.294 1.00 15.43 H new ATOM 126 N ALA A 94 7.438 -1.405 -8.814 1.00 71.42 N ATOM 127 CA ALA A 94 8.693 -1.796 -8.184 1.00 50.12 C ATOM 128 C ALA A 94 9.225 -3.096 -8.779 1.00 2.41 C ATOM 129 O ALA A 94 10.401 -3.424 -8.625 1.00 44.00 O ATOM 130 CB ALA A 94 8.507 -1.939 -6.681 1.00 70.33 C ATOM 0 H ALA A 94 6.618 -1.496 -8.214 1.00 71.42 H new ATOM 0 HA ALA A 94 9.426 -1.013 -8.376 1.00 50.12 H new ATOM 0 HB1 ALA A 94 9.452 -2.231 -6.224 1.00 70.33 H new ATOM 0 HB2 ALA A 94 8.181 -0.987 -6.263 1.00 70.33 H new ATOM 0 HB3 ALA A 94 7.755 -2.701 -6.478 1.00 70.33 H new ATOM 136 N TRP A 95 8.351 -3.830 -9.459 1.00 33.54 N ATOM 137 CA TRP A 95 8.733 -5.095 -10.077 1.00 2.43 C ATOM 138 C TRP A 95 9.891 -4.897 -11.050 1.00 64.44 C ATOM 139 O TRP A 95 10.633 -5.835 -11.343 1.00 61.23 O ATOM 140 CB TRP A 95 7.539 -5.713 -10.805 1.00 2.15 C ATOM 141 CG TRP A 95 6.557 -6.372 -9.883 1.00 41.24 C ATOM 142 CD1 TRP A 95 6.709 -6.586 -8.543 1.00 14.00 C ATOM 143 CD2 TRP A 95 5.276 -6.905 -10.235 1.00 42.31 C ATOM 144 NE1 TRP A 95 5.598 -7.221 -8.041 1.00 71.33 N ATOM 145 CE2 TRP A 95 4.704 -7.426 -9.058 1.00 74.32 C ATOM 146 CE3 TRP A 95 4.555 -6.991 -11.429 1.00 42.51 C ATOM 147 CZ2 TRP A 95 3.447 -8.025 -9.043 1.00 53.54 C ATOM 148 CZ3 TRP A 95 3.307 -7.584 -11.412 1.00 13.11 C ATOM 149 CH2 TRP A 95 2.764 -8.095 -10.226 1.00 33.31 C ATOM 0 H TRP A 95 7.374 -3.571 -9.596 1.00 33.54 H new ATOM 0 HA TRP A 95 9.057 -5.773 -9.287 1.00 2.43 H new ATOM 0 HB2 TRP A 95 7.028 -4.936 -11.374 1.00 2.15 H new ATOM 0 HB3 TRP A 95 7.901 -6.448 -11.524 1.00 2.15 H new ATOM 0 HD1 TRP A 95 7.574 -6.299 -7.963 1.00 14.00 H new ATOM 0 HE1 TRP A 95 5.461 -7.495 -7.068 1.00 71.33 H new ATOM 0 HE3 TRP A 95 4.966 -6.601 -12.349 1.00 42.51 H new ATOM 0 HZ2 TRP A 95 3.026 -8.420 -8.130 1.00 53.54 H new ATOM 0 HZ3 TRP A 95 2.740 -7.655 -12.329 1.00 13.11 H new ATOM 0 HH2 TRP A 95 1.786 -8.553 -10.246 1.00 33.31 H new ATOM 160 N ILE A 96 10.038 -3.674 -11.546 1.00 55.12 N ATOM 161 CA ILE A 96 11.106 -3.355 -12.485 1.00 34.21 C ATOM 162 C ILE A 96 12.468 -3.751 -11.924 1.00 70.15 C ATOM 163 O ILE A 96 13.400 -4.046 -12.673 1.00 2.25 O ATOM 164 CB ILE A 96 11.123 -1.854 -12.830 1.00 32.45 C ATOM 165 CG1 ILE A 96 9.775 -1.429 -13.414 1.00 12.32 C ATOM 166 CG2 ILE A 96 12.250 -1.547 -13.805 1.00 51.44 C ATOM 167 CD1 ILE A 96 9.589 0.072 -13.473 1.00 41.21 C ATOM 0 H ILE A 96 9.431 -2.888 -11.314 1.00 55.12 H new ATOM 0 HA ILE A 96 10.909 -3.926 -13.392 1.00 34.21 H new ATOM 0 HB ILE A 96 11.297 -1.287 -11.915 1.00 32.45 H new ATOM 0 HG12 ILE A 96 9.678 -1.839 -14.419 1.00 12.32 H new ATOM 0 HG13 ILE A 96 8.975 -1.863 -12.814 1.00 12.32 H new ATOM 0 HG21 ILE A 96 12.249 -0.482 -14.039 1.00 51.44 H new ATOM 0 HG22 ILE A 96 13.205 -1.818 -13.355 1.00 51.44 H new ATOM 0 HG23 ILE A 96 12.105 -2.120 -14.721 1.00 51.44 H new ATOM 0 HD11 ILE A 96 8.612 0.301 -13.898 1.00 41.21 H new ATOM 0 HD12 ILE A 96 9.654 0.486 -12.467 1.00 41.21 H new ATOM 0 HD13 ILE A 96 10.368 0.511 -14.097 1.00 41.21 H new ATOM 179 N THR A 97 12.577 -3.757 -10.599 1.00 51.42 N ATOM 180 CA THR A 97 13.824 -4.117 -9.936 1.00 31.44 C ATOM 181 C THR A 97 14.036 -5.627 -9.945 1.00 41.10 C ATOM 182 O THR A 97 15.031 -6.121 -10.476 1.00 50.20 O ATOM 183 CB THR A 97 13.852 -3.615 -8.480 1.00 14.40 C ATOM 184 OG1 THR A 97 12.739 -4.151 -7.755 1.00 50.05 O ATOM 185 CG2 THR A 97 13.811 -2.095 -8.430 1.00 60.33 C ATOM 0 H THR A 97 11.816 -3.516 -9.964 1.00 51.42 H new ATOM 0 HA THR A 97 14.628 -3.637 -10.494 1.00 31.44 H new ATOM 0 HB THR A 97 14.781 -3.953 -8.021 1.00 14.40 H new ATOM 0 HG1 THR A 97 11.920 -3.683 -8.020 1.00 50.05 H new ATOM 0 HG21 THR A 97 13.832 -1.764 -7.392 1.00 60.33 H new ATOM 0 HG22 THR A 97 14.675 -1.690 -8.957 1.00 60.33 H new ATOM 0 HG23 THR A 97 12.897 -1.740 -8.906 1.00 60.33 H new ATOM 193 N LEU A 98 13.094 -6.355 -9.357 1.00 70.21 N ATOM 194 CA LEU A 98 13.176 -7.810 -9.297 1.00 75.55 C ATOM 195 C LEU A 98 13.176 -8.412 -10.699 1.00 22.22 C ATOM 196 O LEU A 98 13.565 -9.563 -10.889 1.00 13.11 O ATOM 197 CB LEU A 98 12.009 -8.375 -8.487 1.00 74.34 C ATOM 198 CG LEU A 98 10.614 -7.898 -8.897 1.00 35.43 C ATOM 199 CD1 LEU A 98 10.036 -8.805 -9.974 1.00 20.42 C ATOM 200 CD2 LEU A 98 9.692 -7.846 -7.689 1.00 61.11 C ATOM 0 H LEU A 98 12.264 -5.961 -8.914 1.00 70.21 H new ATOM 0 HA LEU A 98 14.112 -8.077 -8.806 1.00 75.55 H new ATOM 0 HB2 LEU A 98 12.035 -9.462 -8.559 1.00 74.34 H new ATOM 0 HB3 LEU A 98 12.164 -8.122 -7.438 1.00 74.34 H new ATOM 0 HG LEU A 98 10.700 -6.891 -9.306 1.00 35.43 H new ATOM 0 HD11 LEU A 98 9.044 -8.451 -10.254 1.00 20.42 H new ATOM 0 HD12 LEU A 98 10.686 -8.791 -10.849 1.00 20.42 H new ATOM 0 HD13 LEU A 98 9.964 -9.823 -9.592 1.00 20.42 H new ATOM 0 HD21 LEU A 98 8.704 -7.505 -7.999 1.00 61.11 H new ATOM 0 HD22 LEU A 98 9.611 -8.840 -7.250 1.00 61.11 H new ATOM 0 HD23 LEU A 98 10.099 -7.155 -6.950 1.00 61.11 H new ATOM 212 N GLU A 99 12.738 -7.624 -11.676 1.00 4.44 N ATOM 213 CA GLU A 99 12.689 -8.080 -13.060 1.00 1.33 C ATOM 214 C GLU A 99 14.051 -8.601 -13.511 1.00 35.40 C ATOM 215 O GLU A 99 14.197 -9.773 -13.860 1.00 24.30 O ATOM 216 CB GLU A 99 12.236 -6.944 -13.979 1.00 15.35 C ATOM 217 CG GLU A 99 12.759 -7.066 -15.401 1.00 32.50 C ATOM 218 CD GLU A 99 11.842 -6.413 -16.417 1.00 23.42 C ATOM 219 OE1 GLU A 99 11.977 -5.190 -16.636 1.00 23.50 O1- ATOM 220 OE2 GLU A 99 10.992 -7.122 -16.993 1.00 0.21 O ATOM 0 H GLU A 99 12.412 -6.668 -11.535 1.00 4.44 H new ATOM 0 HA GLU A 99 11.969 -8.896 -13.121 1.00 1.33 H new ATOM 0 HB2 GLU A 99 11.147 -6.919 -14.002 1.00 15.35 H new ATOM 0 HB3 GLU A 99 12.567 -5.994 -13.559 1.00 15.35 H new ATOM 0 HG2 GLU A 99 13.747 -6.609 -15.462 1.00 32.50 H new ATOM 0 HG3 GLU A 99 12.880 -8.120 -15.651 1.00 32.50 H new ATOM 227 N LYS A 100 15.046 -7.721 -13.500 1.00 11.05 N ATOM 228 CA LYS A 100 16.398 -8.090 -13.906 1.00 40.42 C ATOM 229 C LYS A 100 17.010 -9.083 -12.924 1.00 54.22 C ATOM 230 O LYS A 100 17.913 -9.840 -13.274 1.00 73.30 O ATOM 231 CB LYS A 100 17.280 -6.843 -14.004 1.00 73.52 C ATOM 232 CG LYS A 100 16.788 -5.827 -15.019 1.00 14.42 C ATOM 233 CD LYS A 100 17.177 -4.412 -14.626 1.00 74.54 C ATOM 234 CE LYS A 100 16.034 -3.695 -13.924 1.00 0.53 C ATOM 235 NZ LYS A 100 16.171 -3.751 -12.442 1.00 11.21 N1+ ATOM 0 H LYS A 100 14.942 -6.747 -13.215 1.00 11.05 H new ATOM 0 HA LYS A 100 16.340 -8.565 -14.885 1.00 40.42 H new ATOM 0 HB2 LYS A 100 17.333 -6.368 -13.024 1.00 73.52 H new ATOM 0 HB3 LYS A 100 18.294 -7.145 -14.267 1.00 73.52 H new ATOM 0 HG2 LYS A 100 17.203 -6.060 -15.999 1.00 14.42 H new ATOM 0 HG3 LYS A 100 15.704 -5.896 -15.108 1.00 14.42 H new ATOM 0 HD2 LYS A 100 18.047 -4.441 -13.970 1.00 74.54 H new ATOM 0 HD3 LYS A 100 17.467 -3.853 -15.515 1.00 74.54 H new ATOM 0 HE2 LYS A 100 16.005 -2.654 -14.247 1.00 0.53 H new ATOM 0 HE3 LYS A 100 15.087 -4.147 -14.218 1.00 0.53 H new ATOM 0 HZ1 LYS A 100 15.633 -4.561 -12.074 1.00 11.21 H new ATOM 0 HZ2 LYS A 100 17.174 -3.859 -12.190 1.00 11.21 H new ATOM 0 HZ3 LYS A 100 15.802 -2.872 -12.026 1.00 11.21 H new ATOM 249 N ALA A 101 16.510 -9.074 -11.692 1.00 55.34 N ATOM 250 CA ALA A 101 17.004 -9.977 -10.660 1.00 52.53 C ATOM 251 C ALA A 101 16.971 -11.426 -11.135 1.00 52.15 C ATOM 252 O ALA A 101 17.932 -12.172 -10.952 1.00 73.43 O ATOM 253 CB ALA A 101 16.189 -9.819 -9.385 1.00 21.20 C ATOM 0 H ALA A 101 15.763 -8.451 -11.385 1.00 55.34 H new ATOM 0 HA ALA A 101 18.041 -9.715 -10.450 1.00 52.53 H new ATOM 0 HB1 ALA A 101 16.569 -10.500 -8.623 1.00 21.20 H new ATOM 0 HB2 ALA A 101 16.269 -8.793 -9.027 1.00 21.20 H new ATOM 0 HB3 ALA A 101 15.144 -10.051 -9.590 1.00 21.20 H new ATOM 259 N TYR A 102 15.857 -11.817 -11.746 1.00 21.11 N ATOM 260 CA TYR A 102 15.697 -13.178 -12.244 1.00 31.20 C ATOM 261 C TYR A 102 16.858 -13.564 -13.156 1.00 54.12 C ATOM 262 O TYR A 102 17.270 -14.723 -13.196 1.00 14.45 O ATOM 263 CB TYR A 102 14.374 -13.314 -13.000 1.00 13.11 C ATOM 264 CG TYR A 102 13.168 -12.894 -12.191 1.00 64.12 C ATOM 265 CD1 TYR A 102 12.867 -13.513 -10.984 1.00 62.33 C ATOM 266 CD2 TYR A 102 12.329 -11.877 -12.632 1.00 0.35 C ATOM 267 CE1 TYR A 102 11.766 -13.133 -10.241 1.00 42.33 C ATOM 268 CE2 TYR A 102 11.228 -11.490 -11.895 1.00 40.03 C ATOM 269 CZ TYR A 102 10.950 -12.120 -10.700 1.00 31.20 C ATOM 270 OH TYR A 102 9.852 -11.738 -9.963 1.00 20.33 O ATOM 0 H TYR A 102 15.053 -11.211 -11.908 1.00 21.11 H new ATOM 0 HA TYR A 102 15.690 -13.853 -11.388 1.00 31.20 H new ATOM 0 HB2 TYR A 102 14.420 -12.711 -13.907 1.00 13.11 H new ATOM 0 HB3 TYR A 102 14.248 -14.351 -13.312 1.00 13.11 H new ATOM 0 HD1 TYR A 102 13.505 -14.305 -10.620 1.00 62.33 H new ATOM 0 HD2 TYR A 102 12.542 -11.381 -13.567 1.00 0.35 H new ATOM 0 HE1 TYR A 102 11.545 -13.626 -9.306 1.00 42.33 H new ATOM 0 HE2 TYR A 102 10.587 -10.698 -12.252 1.00 40.03 H new ATOM 0 HH TYR A 102 10.029 -11.888 -9.011 1.00 20.33 H new ATOM 280 N GLU A 103 17.381 -12.584 -13.885 1.00 1.02 N ATOM 281 CA GLU A 103 18.495 -12.820 -14.796 1.00 60.41 C ATOM 282 C GLU A 103 19.690 -13.409 -14.053 1.00 12.44 C ATOM 283 O GLU A 103 20.516 -14.109 -14.639 1.00 10.12 O ATOM 284 CB GLU A 103 18.903 -11.518 -15.488 1.00 65.01 C ATOM 285 CG GLU A 103 19.166 -11.677 -16.977 1.00 0.13 C ATOM 286 CD GLU A 103 20.619 -11.985 -17.283 1.00 52.23 C ATOM 287 OE1 GLU A 103 21.499 -11.451 -16.576 1.00 62.03 O ATOM 288 OE2 GLU A 103 20.875 -12.760 -18.227 1.00 20.11 O1- ATOM 0 H GLU A 103 17.051 -11.619 -13.863 1.00 1.02 H new ATOM 0 HA GLU A 103 18.168 -13.536 -15.550 1.00 60.41 H new ATOM 0 HB2 GLU A 103 18.116 -10.777 -15.343 1.00 65.01 H new ATOM 0 HB3 GLU A 103 19.801 -11.127 -15.009 1.00 65.01 H new ATOM 0 HG2 GLU A 103 18.538 -12.477 -17.370 1.00 0.13 H new ATOM 0 HG3 GLU A 103 18.876 -10.762 -17.493 1.00 0.13 H new ATOM 295 N ASP A 104 19.775 -13.121 -12.759 1.00 24.32 N ATOM 296 CA ASP A 104 20.869 -13.622 -11.934 1.00 22.21 C ATOM 297 C ASP A 104 20.439 -14.863 -11.158 1.00 53.01 C ATOM 298 O ASP A 104 21.045 -15.216 -10.147 1.00 74.24 O ATOM 299 CB ASP A 104 21.342 -12.538 -10.965 1.00 44.00 C ATOM 300 CG ASP A 104 22.437 -11.671 -11.555 1.00 42.43 C ATOM 301 OD1 ASP A 104 23.611 -12.097 -11.526 1.00 73.33 O ATOM 302 OD2 ASP A 104 22.120 -10.567 -12.046 1.00 63.21 O1- ATOM 0 H ASP A 104 19.100 -12.543 -12.258 1.00 24.32 H new ATOM 0 HA ASP A 104 21.694 -13.895 -12.593 1.00 22.21 H new ATOM 0 HB2 ASP A 104 20.496 -11.910 -10.686 1.00 44.00 H new ATOM 0 HB3 ASP A 104 21.706 -13.006 -10.051 1.00 44.00 H new ATOM 307 N ALA A 105 19.389 -15.521 -11.639 1.00 63.33 N ATOM 308 CA ALA A 105 18.879 -16.724 -10.991 1.00 75.23 C ATOM 309 C ALA A 105 18.589 -16.471 -9.515 1.00 40.43 C ATOM 310 O ALA A 105 19.221 -17.063 -8.640 1.00 42.15 O ATOM 311 CB ALA A 105 19.870 -17.868 -11.148 1.00 34.51 C ATOM 0 H ALA A 105 18.875 -15.242 -12.475 1.00 63.33 H new ATOM 0 HA ALA A 105 17.943 -17.000 -11.476 1.00 75.23 H new ATOM 0 HB1 ALA A 105 19.477 -18.760 -10.660 1.00 34.51 H new ATOM 0 HB2 ALA A 105 20.025 -18.073 -12.207 1.00 34.51 H new ATOM 0 HB3 ALA A 105 20.820 -17.592 -10.690 1.00 34.51 H new ATOM 317 N GLU A 106 17.632 -15.589 -9.248 1.00 74.03 N ATOM 318 CA GLU A 106 17.260 -15.259 -7.877 1.00 75.25 C ATOM 319 C GLU A 106 16.354 -16.333 -7.284 1.00 23.20 C ATOM 320 O GLU A 106 16.006 -17.308 -7.954 1.00 54.54 O ATOM 321 CB GLU A 106 16.557 -13.901 -7.830 1.00 21.20 C ATOM 322 CG GLU A 106 17.491 -12.742 -7.527 1.00 43.42 C ATOM 323 CD GLU A 106 18.270 -12.940 -6.241 1.00 0.21 C ATOM 324 OE1 GLU A 106 17.658 -13.356 -5.235 1.00 14.12 O1- ATOM 325 OE2 GLU A 106 19.491 -12.680 -6.242 1.00 44.33 O ATOM 0 H GLU A 106 17.100 -15.090 -9.962 1.00 74.03 H new ATOM 0 HA GLU A 106 18.172 -15.210 -7.282 1.00 75.25 H new ATOM 0 HB2 GLU A 106 16.068 -13.721 -8.787 1.00 21.20 H new ATOM 0 HB3 GLU A 106 15.774 -13.933 -7.073 1.00 21.20 H new ATOM 0 HG2 GLU A 106 18.189 -12.617 -8.355 1.00 43.42 H new ATOM 0 HG3 GLU A 106 16.911 -11.822 -7.458 1.00 43.42 H new ATOM 332 N THR A 107 15.974 -16.150 -6.024 1.00 4.24 N ATOM 333 CA THR A 107 15.110 -17.105 -5.339 1.00 44.41 C ATOM 334 C THR A 107 13.814 -16.444 -4.883 1.00 60.01 C ATOM 335 O THR A 107 13.672 -15.223 -4.948 1.00 43.33 O ATOM 336 CB THR A 107 15.815 -17.724 -4.118 1.00 43.42 C ATOM 337 OG1 THR A 107 16.456 -16.700 -3.349 1.00 2.32 O ATOM 338 CG2 THR A 107 16.843 -18.758 -4.553 1.00 72.55 C ATOM 0 H THR A 107 16.251 -15.349 -5.456 1.00 4.24 H new ATOM 0 HA THR A 107 14.880 -17.894 -6.055 1.00 44.41 H new ATOM 0 HB THR A 107 15.062 -18.219 -3.505 1.00 43.42 H new ATOM 0 HG1 THR A 107 16.900 -17.103 -2.574 1.00 2.32 H new ATOM 0 HG21 THR A 107 17.328 -19.181 -3.673 1.00 72.55 H new ATOM 0 HG22 THR A 107 16.347 -19.552 -5.111 1.00 72.55 H new ATOM 0 HG23 THR A 107 17.592 -18.282 -5.186 1.00 72.55 H new ATOM 346 N VAL A 108 12.872 -17.258 -4.419 1.00 20.54 N ATOM 347 CA VAL A 108 11.587 -16.752 -3.950 1.00 41.44 C ATOM 348 C VAL A 108 11.183 -17.412 -2.636 1.00 71.21 C ATOM 349 O VAL A 108 11.911 -18.247 -2.098 1.00 42.35 O ATOM 350 CB VAL A 108 10.478 -16.985 -4.992 1.00 65.54 C ATOM 351 CG1 VAL A 108 10.613 -16.003 -6.145 1.00 22.45 C ATOM 352 CG2 VAL A 108 10.513 -18.420 -5.496 1.00 1.14 C ATOM 0 H VAL A 108 12.974 -18.271 -4.358 1.00 20.54 H new ATOM 0 HA VAL A 108 11.707 -15.680 -3.793 1.00 41.44 H new ATOM 0 HB VAL A 108 9.513 -16.816 -4.514 1.00 65.54 H new ATOM 0 HG11 VAL A 108 9.820 -16.183 -6.871 1.00 22.45 H new ATOM 0 HG12 VAL A 108 10.533 -14.984 -5.766 1.00 22.45 H new ATOM 0 HG13 VAL A 108 11.582 -16.137 -6.625 1.00 22.45 H new ATOM 0 HG21 VAL A 108 9.722 -18.567 -6.232 1.00 1.14 H new ATOM 0 HG22 VAL A 108 11.480 -18.620 -5.958 1.00 1.14 H new ATOM 0 HG23 VAL A 108 10.362 -19.103 -4.660 1.00 1.14 H new ATOM 362 N THR A 109 10.016 -17.033 -2.124 1.00 0.35 N ATOM 363 CA THR A 109 9.514 -17.588 -0.874 1.00 72.43 C ATOM 364 C THR A 109 7.996 -17.487 -0.797 1.00 62.13 C ATOM 365 O THR A 109 7.431 -16.395 -0.871 1.00 25.51 O ATOM 366 CB THR A 109 10.128 -16.871 0.344 1.00 21.55 C ATOM 367 OG1 THR A 109 9.504 -17.332 1.549 1.00 40.31 O ATOM 368 CG2 THR A 109 9.959 -15.364 0.227 1.00 24.53 C ATOM 0 H THR A 109 9.401 -16.344 -2.556 1.00 0.35 H new ATOM 0 HA THR A 109 9.806 -18.638 -0.854 1.00 72.43 H new ATOM 0 HB THR A 109 11.193 -17.101 0.374 1.00 21.55 H new ATOM 0 HG1 THR A 109 9.900 -16.873 2.319 1.00 40.31 H new ATOM 0 HG21 THR A 109 10.400 -14.880 1.098 1.00 24.53 H new ATOM 0 HG22 THR A 109 10.458 -15.011 -0.676 1.00 24.53 H new ATOM 0 HG23 THR A 109 8.898 -15.120 0.175 1.00 24.53 H new ATOM 376 N GLY A 110 7.338 -18.632 -0.647 1.00 43.33 N ATOM 377 CA GLY A 110 5.888 -18.650 -0.563 1.00 13.05 C ATOM 378 C GLY A 110 5.329 -20.057 -0.479 1.00 3.55 C ATOM 379 O GLY A 110 6.047 -21.031 -0.703 1.00 41.25 O ATOM 0 H GLY A 110 7.782 -19.548 -0.582 1.00 43.33 H new ATOM 0 HA2 GLY A 110 5.571 -18.084 0.313 1.00 13.05 H new ATOM 0 HA3 GLY A 110 5.470 -18.148 -1.436 1.00 13.05 H new ATOM 383 N VAL A 111 4.045 -20.163 -0.155 1.00 54.30 N ATOM 384 CA VAL A 111 3.390 -21.461 -0.042 1.00 20.01 C ATOM 385 C VAL A 111 2.292 -21.615 -1.087 1.00 45.43 C ATOM 386 O VAL A 111 1.675 -20.634 -1.505 1.00 13.55 O ATOM 387 CB VAL A 111 2.782 -21.662 1.359 1.00 12.42 C ATOM 388 CG1 VAL A 111 3.827 -21.416 2.436 1.00 14.12 C ATOM 389 CG2 VAL A 111 1.580 -20.750 1.554 1.00 40.44 C ATOM 0 H VAL A 111 3.437 -19.366 0.034 1.00 54.30 H new ATOM 0 HA VAL A 111 4.156 -22.218 -0.210 1.00 20.01 H new ATOM 0 HB VAL A 111 2.444 -22.695 1.444 1.00 12.42 H new ATOM 0 HG11 VAL A 111 3.378 -21.563 3.419 1.00 14.12 H new ATOM 0 HG12 VAL A 111 4.654 -22.114 2.307 1.00 14.12 H new ATOM 0 HG13 VAL A 111 4.199 -20.394 2.356 1.00 14.12 H new ATOM 0 HG21 VAL A 111 1.163 -20.905 2.549 1.00 40.44 H new ATOM 0 HG22 VAL A 111 1.891 -19.711 1.449 1.00 40.44 H new ATOM 0 HG23 VAL A 111 0.823 -20.980 0.804 1.00 40.44 H new ATOM 399 N ILE A 112 2.051 -22.853 -1.507 1.00 15.31 N ATOM 400 CA ILE A 112 1.026 -23.135 -2.503 1.00 63.34 C ATOM 401 C ILE A 112 -0.351 -22.700 -2.014 1.00 32.02 C ATOM 402 O ILE A 112 -1.002 -23.409 -1.247 1.00 22.02 O ATOM 403 CB ILE A 112 0.982 -24.634 -2.856 1.00 73.40 C ATOM 404 CG1 ILE A 112 2.332 -25.089 -3.413 1.00 51.40 C ATOM 405 CG2 ILE A 112 -0.130 -24.911 -3.856 1.00 51.04 C ATOM 406 CD1 ILE A 112 2.806 -26.409 -2.847 1.00 44.52 C ATOM 0 H ILE A 112 2.552 -23.676 -1.173 1.00 15.31 H new ATOM 0 HA ILE A 112 1.288 -22.566 -3.395 1.00 63.34 H new ATOM 0 HB ILE A 112 0.776 -25.200 -1.947 1.00 73.40 H new ATOM 0 HG12 ILE A 112 2.259 -25.173 -4.497 1.00 51.40 H new ATOM 0 HG13 ILE A 112 3.079 -24.324 -3.203 1.00 51.40 H new ATOM 0 HG21 ILE A 112 -0.148 -25.974 -4.095 1.00 51.04 H new ATOM 0 HG22 ILE A 112 -1.088 -24.620 -3.425 1.00 51.04 H new ATOM 0 HG23 ILE A 112 0.048 -24.338 -4.766 1.00 51.04 H new ATOM 0 HD11 ILE A 112 3.769 -26.669 -3.287 1.00 44.52 H new ATOM 0 HD12 ILE A 112 2.912 -26.324 -1.766 1.00 44.52 H new ATOM 0 HD13 ILE A 112 2.079 -27.187 -3.080 1.00 44.52 H new ATOM 418 N ASN A 113 -0.789 -21.529 -2.464 1.00 70.02 N ATOM 419 CA ASN A 113 -2.090 -20.998 -2.073 1.00 33.21 C ATOM 420 C ASN A 113 -3.186 -21.497 -3.010 1.00 62.31 C ATOM 421 O ASN A 113 -4.280 -21.847 -2.572 1.00 53.33 O ATOM 422 CB ASN A 113 -2.062 -19.468 -2.073 1.00 33.10 C ATOM 423 CG ASN A 113 -3.336 -18.866 -1.514 1.00 43.33 C ATOM 424 OD1 ASN A 113 -4.339 -19.558 -1.340 1.00 34.24 O ATOM 425 ND2 ASN A 113 -3.301 -17.569 -1.227 1.00 44.13 N ATOM 0 H ASN A 113 -0.262 -20.930 -3.100 1.00 70.02 H new ATOM 0 HA ASN A 113 -2.309 -21.351 -1.065 1.00 33.21 H new ATOM 0 HB2 ASN A 113 -1.212 -19.123 -1.484 1.00 33.10 H new ATOM 0 HB3 ASN A 113 -1.911 -19.110 -3.091 1.00 33.10 H new ATOM 0 HD21 ASN A 113 -4.128 -17.108 -0.846 1.00 44.13 H new ATOM 0 HD22 ASN A 113 -2.448 -17.034 -1.387 1.00 44.13 H new ATOM 432 N GLY A 114 -2.881 -21.527 -4.305 1.00 13.12 N ATOM 433 CA GLY A 114 -3.849 -21.984 -5.284 1.00 74.52 C ATOM 434 C GLY A 114 -3.423 -23.272 -5.962 1.00 51.31 C ATOM 435 O GLY A 114 -2.246 -23.464 -6.265 1.00 72.15 O ATOM 0 H GLY A 114 -1.981 -21.243 -4.692 1.00 13.12 H new ATOM 0 HA2 GLY A 114 -4.812 -22.135 -4.796 1.00 74.52 H new ATOM 0 HA3 GLY A 114 -3.992 -21.210 -6.038 1.00 74.52 H new ATOM 439 N LYS A 115 -4.384 -24.159 -6.201 1.00 74.23 N ATOM 440 CA LYS A 115 -4.104 -25.435 -6.847 1.00 34.25 C ATOM 441 C LYS A 115 -4.969 -25.618 -8.089 1.00 42.21 C ATOM 442 O LYS A 115 -6.197 -25.568 -8.016 1.00 24.11 O ATOM 443 CB LYS A 115 -4.345 -26.589 -5.870 1.00 22.32 C ATOM 444 CG LYS A 115 -5.777 -26.669 -5.367 1.00 35.33 C ATOM 445 CD LYS A 115 -5.900 -27.621 -4.189 1.00 22.31 C ATOM 446 CE LYS A 115 -7.311 -28.178 -4.069 1.00 75.20 C ATOM 447 NZ LYS A 115 -8.330 -27.096 -3.989 1.00 11.23 N1+ ATOM 0 H LYS A 115 -5.364 -24.017 -5.956 1.00 74.23 H new ATOM 0 HA LYS A 115 -3.057 -25.437 -7.151 1.00 34.25 H new ATOM 0 HB2 LYS A 115 -4.087 -27.528 -6.359 1.00 22.32 H new ATOM 0 HB3 LYS A 115 -3.675 -26.479 -5.018 1.00 22.32 H new ATOM 0 HG2 LYS A 115 -6.116 -25.676 -5.071 1.00 35.33 H new ATOM 0 HG3 LYS A 115 -6.430 -27.001 -6.174 1.00 35.33 H new ATOM 0 HD2 LYS A 115 -5.192 -28.442 -4.307 1.00 22.31 H new ATOM 0 HD3 LYS A 115 -5.634 -27.100 -3.269 1.00 22.31 H new ATOM 0 HE2 LYS A 115 -7.524 -28.815 -4.928 1.00 75.20 H new ATOM 0 HE3 LYS A 115 -7.379 -28.807 -3.181 1.00 75.20 H new ATOM 0 HZ1 LYS A 115 -9.245 -27.501 -3.706 1.00 11.23 H new ATOM 0 HZ2 LYS A 115 -8.032 -26.390 -3.286 1.00 11.23 H new ATOM 0 HZ3 LYS A 115 -8.426 -26.640 -4.919 1.00 11.23 H new ATOM 461 N VAL A 116 -4.321 -25.831 -9.231 1.00 23.14 N ATOM 462 CA VAL A 116 -5.031 -26.024 -10.489 1.00 34.23 C ATOM 463 C VAL A 116 -4.950 -27.474 -10.949 1.00 0.13 C ATOM 464 O VAL A 116 -4.291 -28.303 -10.319 1.00 22.41 O ATOM 465 CB VAL A 116 -4.468 -25.113 -11.596 1.00 11.42 C ATOM 466 CG1 VAL A 116 -4.744 -23.651 -11.277 1.00 22.33 C ATOM 467 CG2 VAL A 116 -2.977 -25.355 -11.778 1.00 71.40 C ATOM 0 H VAL A 116 -3.305 -25.874 -9.310 1.00 23.14 H new ATOM 0 HA VAL A 116 -6.073 -25.762 -10.308 1.00 34.23 H new ATOM 0 HB VAL A 116 -4.970 -25.357 -12.533 1.00 11.42 H new ATOM 0 HG11 VAL A 116 -4.339 -23.023 -12.070 1.00 22.33 H new ATOM 0 HG12 VAL A 116 -5.820 -23.492 -11.202 1.00 22.33 H new ATOM 0 HG13 VAL A 116 -4.271 -23.390 -10.330 1.00 22.33 H new ATOM 0 HG21 VAL A 116 -2.596 -24.703 -12.564 1.00 71.40 H new ATOM 0 HG22 VAL A 116 -2.457 -25.140 -10.844 1.00 71.40 H new ATOM 0 HG23 VAL A 116 -2.809 -26.395 -12.056 1.00 71.40 H new ATOM 477 N LYS A 117 -5.623 -27.778 -12.054 1.00 32.33 N ATOM 478 CA LYS A 117 -5.626 -29.128 -12.602 1.00 42.33 C ATOM 479 C LYS A 117 -4.241 -29.513 -13.111 1.00 14.34 C ATOM 480 O LYS A 117 -3.849 -29.140 -14.216 1.00 60.05 O ATOM 481 CB LYS A 117 -6.647 -29.238 -13.738 1.00 61.43 C ATOM 482 CG LYS A 117 -6.899 -30.664 -14.193 1.00 62.31 C ATOM 483 CD LYS A 117 -7.650 -30.703 -15.514 1.00 13.11 C ATOM 484 CE LYS A 117 -8.019 -32.126 -15.904 1.00 34.15 C ATOM 485 NZ LYS A 117 -9.084 -32.685 -15.025 1.00 72.03 N1+ ATOM 0 H LYS A 117 -6.174 -27.106 -12.588 1.00 32.33 H new ATOM 0 HA LYS A 117 -5.904 -29.816 -11.803 1.00 42.33 H new ATOM 0 HB2 LYS A 117 -7.589 -28.798 -13.412 1.00 61.43 H new ATOM 0 HB3 LYS A 117 -6.298 -28.651 -14.587 1.00 61.43 H new ATOM 0 HG2 LYS A 117 -5.948 -31.187 -14.298 1.00 62.31 H new ATOM 0 HG3 LYS A 117 -7.472 -31.194 -13.432 1.00 62.31 H new ATOM 0 HD2 LYS A 117 -8.554 -30.100 -15.437 1.00 13.11 H new ATOM 0 HD3 LYS A 117 -7.035 -30.258 -16.296 1.00 13.11 H new ATOM 0 HE2 LYS A 117 -8.358 -32.142 -16.940 1.00 34.15 H new ATOM 0 HE3 LYS A 117 -7.133 -32.759 -15.848 1.00 34.15 H new ATOM 0 HZ1 LYS A 117 -9.438 -33.575 -15.431 1.00 72.03 H new ATOM 0 HZ2 LYS A 117 -8.693 -32.868 -14.079 1.00 72.03 H new ATOM 0 HZ3 LYS A 117 -9.866 -32.003 -14.951 1.00 72.03 H new ATOM 499 N GLY A 118 -3.504 -30.263 -12.298 1.00 2.22 N ATOM 500 CA GLY A 118 -2.171 -30.687 -12.685 1.00 23.52 C ATOM 501 C GLY A 118 -1.100 -29.710 -12.241 1.00 73.33 C ATOM 502 O GLY A 118 0.003 -30.111 -11.875 1.00 53.41 O ATOM 0 H GLY A 118 -3.806 -30.585 -11.378 1.00 2.22 H new ATOM 0 HA2 GLY A 118 -1.965 -31.667 -12.254 1.00 23.52 H new ATOM 0 HA3 GLY A 118 -2.129 -30.800 -13.768 1.00 23.52 H new ATOM 506 N GLY A 119 -1.426 -28.421 -12.274 1.00 73.01 N ATOM 507 CA GLY A 119 -0.473 -27.404 -11.872 1.00 40.10 C ATOM 508 C GLY A 119 -0.689 -26.939 -10.445 1.00 3.33 C ATOM 509 O GLY A 119 -1.663 -27.327 -9.800 1.00 23.40 O ATOM 0 H GLY A 119 -2.334 -28.064 -12.572 1.00 73.01 H new ATOM 0 HA2 GLY A 119 0.538 -27.798 -11.973 1.00 40.10 H new ATOM 0 HA3 GLY A 119 -0.552 -26.550 -12.545 1.00 40.10 H new ATOM 513 N PHE A 120 0.221 -26.107 -9.951 1.00 21.13 N ATOM 514 CA PHE A 120 0.128 -25.591 -8.591 1.00 73.13 C ATOM 515 C PHE A 120 0.623 -24.150 -8.520 1.00 33.45 C ATOM 516 O PHE A 120 1.784 -23.864 -8.819 1.00 42.12 O ATOM 517 CB PHE A 120 0.937 -26.468 -7.632 1.00 45.15 C ATOM 518 CG PHE A 120 0.129 -27.561 -6.993 1.00 10.53 C ATOM 519 CD1 PHE A 120 -0.896 -27.257 -6.113 1.00 40.45 C ATOM 520 CD2 PHE A 120 0.395 -28.892 -7.273 1.00 41.15 C ATOM 521 CE1 PHE A 120 -1.641 -28.261 -5.522 1.00 33.12 C ATOM 522 CE2 PHE A 120 -0.347 -29.899 -6.686 1.00 24.30 C ATOM 523 CZ PHE A 120 -1.367 -29.584 -5.810 1.00 54.21 C ATOM 0 H PHE A 120 1.032 -25.775 -10.473 1.00 21.13 H new ATOM 0 HA PHE A 120 -0.920 -25.611 -8.294 1.00 73.13 H new ATOM 0 HB2 PHE A 120 1.770 -26.913 -8.175 1.00 45.15 H new ATOM 0 HB3 PHE A 120 1.365 -25.839 -6.851 1.00 45.15 H new ATOM 0 HD1 PHE A 120 -1.116 -26.224 -5.886 1.00 40.45 H new ATOM 0 HD2 PHE A 120 1.191 -29.145 -7.958 1.00 41.15 H new ATOM 0 HE1 PHE A 120 -2.437 -28.011 -4.836 1.00 33.12 H new ATOM 0 HE2 PHE A 120 -0.129 -30.932 -6.912 1.00 24.30 H new ATOM 0 HZ PHE A 120 -1.949 -30.370 -5.351 1.00 54.21 H new ATOM 533 N THR A 121 -0.264 -23.243 -8.124 1.00 3.13 N ATOM 534 CA THR A 121 0.081 -21.831 -8.015 1.00 4.13 C ATOM 535 C THR A 121 0.739 -21.527 -6.674 1.00 21.42 C ATOM 536 O THR A 121 0.452 -22.178 -5.669 1.00 71.30 O ATOM 537 CB THR A 121 -1.161 -20.935 -8.181 1.00 11.34 C ATOM 538 OG1 THR A 121 -2.122 -21.579 -9.024 1.00 20.12 O ATOM 539 CG2 THR A 121 -0.781 -19.587 -8.773 1.00 43.11 C ATOM 0 H THR A 121 -1.228 -23.461 -7.873 1.00 3.13 H new ATOM 0 HA THR A 121 0.785 -21.615 -8.818 1.00 4.13 H new ATOM 0 HB THR A 121 -1.597 -20.771 -7.195 1.00 11.34 H new ATOM 0 HG1 THR A 121 -2.909 -21.003 -9.123 1.00 20.12 H new ATOM 0 HG21 THR A 121 -1.674 -18.972 -8.881 1.00 43.11 H new ATOM 0 HG22 THR A 121 -0.073 -19.086 -8.113 1.00 43.11 H new ATOM 0 HG23 THR A 121 -0.323 -19.735 -9.751 1.00 43.11 H new ATOM 547 N VAL A 122 1.622 -20.534 -6.665 1.00 12.32 N ATOM 548 CA VAL A 122 2.319 -20.143 -5.446 1.00 62.52 C ATOM 549 C VAL A 122 2.522 -18.633 -5.389 1.00 11.44 C ATOM 550 O VAL A 122 2.872 -18.006 -6.389 1.00 22.11 O ATOM 551 CB VAL A 122 3.690 -20.837 -5.336 1.00 61.21 C ATOM 552 CG1 VAL A 122 4.289 -20.620 -3.954 1.00 4.33 C ATOM 553 CG2 VAL A 122 3.561 -22.321 -5.643 1.00 4.41 C ATOM 0 H VAL A 122 1.872 -19.986 -7.488 1.00 12.32 H new ATOM 0 HA VAL A 122 1.693 -20.455 -4.610 1.00 62.52 H new ATOM 0 HB VAL A 122 4.362 -20.394 -6.071 1.00 61.21 H new ATOM 0 HG11 VAL A 122 5.257 -21.117 -3.895 1.00 4.33 H new ATOM 0 HG12 VAL A 122 4.418 -19.552 -3.777 1.00 4.33 H new ATOM 0 HG13 VAL A 122 3.621 -21.035 -3.199 1.00 4.33 H new ATOM 0 HG21 VAL A 122 4.539 -22.796 -5.561 1.00 4.41 H new ATOM 0 HG22 VAL A 122 2.873 -22.781 -4.933 1.00 4.41 H new ATOM 0 HG23 VAL A 122 3.178 -22.451 -6.655 1.00 4.41 H new ATOM 563 N GLU A 123 2.297 -18.055 -4.213 1.00 1.41 N ATOM 564 CA GLU A 123 2.456 -16.617 -4.027 1.00 24.31 C ATOM 565 C GLU A 123 3.879 -16.277 -3.598 1.00 24.33 C ATOM 566 O GLU A 123 4.264 -16.498 -2.449 1.00 63.43 O ATOM 567 CB GLU A 123 1.460 -16.104 -2.982 1.00 10.44 C ATOM 568 CG GLU A 123 1.416 -14.589 -2.878 1.00 13.44 C ATOM 569 CD GLU A 123 0.804 -14.113 -1.575 1.00 44.22 C ATOM 570 OE1 GLU A 123 0.528 -14.962 -0.703 1.00 5.32 O ATOM 571 OE2 GLU A 123 0.600 -12.889 -1.429 1.00 14.32 O1- ATOM 0 H GLU A 123 2.005 -18.559 -3.376 1.00 1.41 H new ATOM 0 HA GLU A 123 2.257 -16.129 -4.981 1.00 24.31 H new ATOM 0 HB2 GLU A 123 0.464 -16.472 -3.229 1.00 10.44 H new ATOM 0 HB3 GLU A 123 1.721 -16.520 -2.009 1.00 10.44 H new ATOM 0 HG2 GLU A 123 2.428 -14.193 -2.967 1.00 13.44 H new ATOM 0 HG3 GLU A 123 0.842 -14.187 -3.713 1.00 13.44 H new ATOM 578 N LEU A 124 4.658 -15.739 -4.531 1.00 13.23 N ATOM 579 CA LEU A 124 6.041 -15.368 -4.251 1.00 3.34 C ATOM 580 C LEU A 124 6.152 -13.880 -3.931 1.00 14.51 C ATOM 581 O LEU A 124 6.443 -13.066 -4.805 1.00 51.32 O ATOM 582 CB LEU A 124 6.933 -15.711 -5.446 1.00 74.20 C ATOM 583 CG LEU A 124 6.651 -17.048 -6.132 1.00 25.45 C ATOM 584 CD1 LEU A 124 7.513 -17.203 -7.375 1.00 35.05 C ATOM 585 CD2 LEU A 124 6.889 -18.202 -5.168 1.00 14.43 C ATOM 0 H LEU A 124 4.356 -15.550 -5.487 1.00 13.23 H new ATOM 0 HA LEU A 124 6.374 -15.934 -3.381 1.00 3.34 H new ATOM 0 HB2 LEU A 124 6.835 -14.917 -6.187 1.00 74.20 H new ATOM 0 HB3 LEU A 124 7.971 -15.709 -5.112 1.00 74.20 H new ATOM 0 HG LEU A 124 5.605 -17.065 -6.437 1.00 25.45 H new ATOM 0 HD11 LEU A 124 7.298 -18.160 -7.850 1.00 35.05 H new ATOM 0 HD12 LEU A 124 7.294 -16.395 -8.073 1.00 35.05 H new ATOM 0 HD13 LEU A 124 8.566 -17.165 -7.095 1.00 35.05 H new ATOM 0 HD21 LEU A 124 6.684 -19.146 -5.673 1.00 14.43 H new ATOM 0 HD22 LEU A 124 7.926 -18.188 -4.833 1.00 14.43 H new ATOM 0 HD23 LEU A 124 6.228 -18.099 -4.307 1.00 14.43 H new ATOM 597 N ASN A 125 5.918 -13.533 -2.669 1.00 42.42 N ATOM 598 CA ASN A 125 5.993 -12.144 -2.232 1.00 23.03 C ATOM 599 C ASN A 125 5.145 -11.246 -3.127 1.00 71.21 C ATOM 600 O ASN A 125 5.576 -10.164 -3.525 1.00 12.11 O ATOM 601 CB ASN A 125 7.445 -11.664 -2.237 1.00 41.54 C ATOM 602 CG ASN A 125 8.397 -12.691 -1.654 1.00 2.20 C ATOM 603 OD1 ASN A 125 8.391 -12.946 -0.449 1.00 61.54 O ATOM 604 ND2 ASN A 125 9.220 -13.287 -2.509 1.00 75.40 N ATOM 0 H ASN A 125 5.675 -14.195 -1.932 1.00 42.42 H new ATOM 0 HA ASN A 125 5.602 -12.087 -1.216 1.00 23.03 H new ATOM 0 HB2 ASN A 125 7.745 -11.434 -3.259 1.00 41.54 H new ATOM 0 HB3 ASN A 125 7.520 -10.738 -1.667 1.00 41.54 H new ATOM 0 HD21 ASN A 125 9.882 -13.988 -2.175 1.00 75.40 H new ATOM 0 HD22 ASN A 125 9.190 -13.044 -3.499 1.00 75.40 H new ATOM 611 N GLY A 126 3.936 -11.702 -3.439 1.00 44.14 N ATOM 612 CA GLY A 126 3.047 -10.927 -4.284 1.00 71.51 C ATOM 613 C GLY A 126 2.973 -11.468 -5.698 1.00 14.11 C ATOM 614 O GLY A 126 1.927 -11.397 -6.344 1.00 40.40 O ATOM 0 H GLY A 126 3.556 -12.594 -3.122 1.00 44.14 H new ATOM 0 HA2 GLY A 126 2.048 -10.922 -3.847 1.00 71.51 H new ATOM 0 HA3 GLY A 126 3.388 -9.892 -4.312 1.00 71.51 H new ATOM 618 N ILE A 127 4.086 -12.009 -6.182 1.00 22.22 N ATOM 619 CA ILE A 127 4.143 -12.563 -7.528 1.00 73.32 C ATOM 620 C ILE A 127 3.397 -13.891 -7.609 1.00 14.32 C ATOM 621 O ILE A 127 3.275 -14.608 -6.615 1.00 64.31 O ATOM 622 CB ILE A 127 5.597 -12.776 -7.989 1.00 24.54 C ATOM 623 CG1 ILE A 127 6.441 -11.538 -7.675 1.00 35.23 C ATOM 624 CG2 ILE A 127 5.642 -13.092 -9.476 1.00 3.54 C ATOM 625 CD1 ILE A 127 5.963 -10.288 -8.381 1.00 1.33 C ATOM 0 H ILE A 127 4.961 -12.075 -5.661 1.00 22.22 H new ATOM 0 HA ILE A 127 3.664 -11.839 -8.187 1.00 73.32 H new ATOM 0 HB ILE A 127 6.014 -13.624 -7.446 1.00 24.54 H new ATOM 0 HG12 ILE A 127 6.431 -11.364 -6.599 1.00 35.23 H new ATOM 0 HG13 ILE A 127 7.476 -11.732 -7.957 1.00 35.23 H new ATOM 0 HG21 ILE A 127 6.677 -13.240 -9.785 1.00 3.54 H new ATOM 0 HG22 ILE A 127 5.071 -14.000 -9.673 1.00 3.54 H new ATOM 0 HG23 ILE A 127 5.210 -12.263 -10.037 1.00 3.54 H new ATOM 0 HD11 ILE A 127 6.606 -9.450 -8.113 1.00 1.33 H new ATOM 0 HD12 ILE A 127 5.999 -10.443 -9.459 1.00 1.33 H new ATOM 0 HD13 ILE A 127 4.938 -10.069 -8.080 1.00 1.33 H new ATOM 637 N ARG A 128 2.902 -14.214 -8.799 1.00 34.50 N ATOM 638 CA ARG A 128 2.169 -15.457 -9.009 1.00 4.34 C ATOM 639 C ARG A 128 3.023 -16.471 -9.764 1.00 60.24 C ATOM 640 O ARG A 128 3.445 -16.224 -10.893 1.00 55.21 O ATOM 641 CB ARG A 128 0.877 -15.186 -9.783 1.00 35.11 C ATOM 642 CG ARG A 128 -0.187 -14.474 -8.962 1.00 21.23 C ATOM 643 CD ARG A 128 0.018 -12.967 -8.972 1.00 73.51 C ATOM 644 NE ARG A 128 -1.226 -12.244 -8.727 1.00 62.14 N ATOM 645 CZ ARG A 128 -1.279 -10.950 -8.432 1.00 54.34 C ATOM 646 NH1 ARG A 128 -0.161 -10.240 -8.346 1.00 63.40 N1+ ATOM 647 NH2 ARG A 128 -2.450 -10.362 -8.223 1.00 13.12 N ATOM 0 H ARG A 128 2.995 -13.633 -9.632 1.00 34.50 H new ATOM 0 HA ARG A 128 1.920 -15.873 -8.033 1.00 4.34 H new ATOM 0 HB2 ARG A 128 1.109 -14.584 -10.662 1.00 35.11 H new ATOM 0 HB3 ARG A 128 0.473 -16.133 -10.143 1.00 35.11 H new ATOM 0 HG2 ARG A 128 -1.174 -14.711 -9.360 1.00 21.23 H new ATOM 0 HG3 ARG A 128 -0.161 -14.839 -7.935 1.00 21.23 H new ATOM 0 HD2 ARG A 128 0.751 -12.696 -8.212 1.00 73.51 H new ATOM 0 HD3 ARG A 128 0.430 -12.664 -9.934 1.00 73.51 H new ATOM 0 HE ARG A 128 -2.103 -12.761 -8.786 1.00 62.14 H new ATOM 0 HH11 ARG A 128 0.741 -10.688 -8.507 1.00 63.40 H new ATOM 0 HH12 ARG A 128 -0.204 -9.246 -8.119 1.00 63.40 H new ATOM 0 HH21 ARG A 128 -3.312 -10.904 -8.289 1.00 13.12 H new ATOM 0 HH22 ARG A 128 -2.488 -9.368 -7.997 1.00 13.12 H new ATOM 661 N ALA A 129 3.274 -17.612 -9.132 1.00 23.11 N ATOM 662 CA ALA A 129 4.076 -18.664 -9.743 1.00 52.14 C ATOM 663 C ALA A 129 3.191 -19.777 -10.297 1.00 51.23 C ATOM 664 O ALA A 129 1.982 -19.795 -10.068 1.00 40.33 O ATOM 665 CB ALA A 129 5.066 -19.227 -8.734 1.00 63.52 C ATOM 0 H ALA A 129 2.933 -17.832 -8.196 1.00 23.11 H new ATOM 0 HA ALA A 129 4.630 -18.228 -10.574 1.00 52.14 H new ATOM 0 HB1 ALA A 129 5.658 -20.012 -9.204 1.00 63.52 H new ATOM 0 HB2 ALA A 129 5.726 -18.431 -8.389 1.00 63.52 H new ATOM 0 HB3 ALA A 129 4.523 -19.642 -7.884 1.00 63.52 H new ATOM 671 N PHE A 130 3.802 -20.704 -11.027 1.00 51.13 N ATOM 672 CA PHE A 130 3.071 -21.820 -11.615 1.00 11.43 C ATOM 673 C PHE A 130 3.931 -23.080 -11.644 1.00 70.34 C ATOM 674 O PHE A 130 5.003 -23.099 -12.250 1.00 70.32 O ATOM 675 CB PHE A 130 2.614 -21.467 -13.031 1.00 33.32 C ATOM 676 CG PHE A 130 1.418 -22.254 -13.488 1.00 74.44 C ATOM 677 CD1 PHE A 130 1.557 -23.563 -13.920 1.00 63.42 C ATOM 678 CD2 PHE A 130 0.155 -21.684 -13.486 1.00 15.20 C ATOM 679 CE1 PHE A 130 0.459 -24.288 -14.342 1.00 15.24 C ATOM 680 CE2 PHE A 130 -0.947 -22.405 -13.906 1.00 51.42 C ATOM 681 CZ PHE A 130 -0.795 -23.708 -14.334 1.00 35.35 C ATOM 0 H PHE A 130 4.802 -20.704 -11.226 1.00 51.13 H new ATOM 0 HA PHE A 130 2.195 -22.015 -10.996 1.00 11.43 H new ATOM 0 HB2 PHE A 130 2.377 -20.404 -13.074 1.00 33.32 H new ATOM 0 HB3 PHE A 130 3.438 -21.638 -13.724 1.00 33.32 H new ATOM 0 HD1 PHE A 130 2.535 -24.022 -13.927 1.00 63.42 H new ATOM 0 HD2 PHE A 130 0.030 -20.664 -13.152 1.00 15.20 H new ATOM 0 HE1 PHE A 130 0.581 -25.307 -14.678 1.00 15.24 H new ATOM 0 HE2 PHE A 130 -1.926 -21.949 -13.899 1.00 51.42 H new ATOM 0 HZ PHE A 130 -1.655 -24.273 -14.662 1.00 35.35 H new ATOM 691 N LEU A 131 3.454 -24.130 -10.985 1.00 42.32 N ATOM 692 CA LEU A 131 4.178 -25.396 -10.935 1.00 71.54 C ATOM 693 C LEU A 131 3.722 -26.329 -12.051 1.00 33.11 C ATOM 694 O LEU A 131 2.530 -26.559 -12.253 1.00 13.54 O ATOM 695 CB LEU A 131 3.975 -26.068 -9.577 1.00 3.45 C ATOM 696 CG LEU A 131 5.016 -25.742 -8.504 1.00 1.01 C ATOM 697 CD1 LEU A 131 4.986 -24.260 -8.165 1.00 72.14 C ATOM 698 CD2 LEU A 131 4.777 -26.582 -7.257 1.00 1.05 C ATOM 0 H LEU A 131 2.569 -24.130 -10.478 1.00 42.32 H new ATOM 0 HA LEU A 131 5.238 -25.186 -11.074 1.00 71.54 H new ATOM 0 HB2 LEU A 131 2.992 -25.787 -9.198 1.00 3.45 H new ATOM 0 HB3 LEU A 131 3.962 -27.148 -9.727 1.00 3.45 H new ATOM 0 HG LEU A 131 6.004 -25.984 -8.897 1.00 1.01 H new ATOM 0 HD11 LEU A 131 5.733 -24.046 -7.400 1.00 72.14 H new ATOM 0 HD12 LEU A 131 5.206 -23.678 -9.060 1.00 72.14 H new ATOM 0 HD13 LEU A 131 3.998 -23.992 -7.792 1.00 72.14 H new ATOM 0 HD21 LEU A 131 5.526 -26.337 -6.504 1.00 1.05 H new ATOM 0 HD22 LEU A 131 3.783 -26.372 -6.862 1.00 1.05 H new ATOM 0 HD23 LEU A 131 4.850 -27.639 -7.511 1.00 1.05 H new ATOM 710 N PRO A 132 4.692 -26.882 -12.794 1.00 44.13 N ATOM 711 CA PRO A 132 4.415 -27.804 -13.900 1.00 23.41 C ATOM 712 C PRO A 132 3.883 -29.148 -13.416 1.00 0.41 C ATOM 713 O PRO A 132 4.400 -29.723 -12.460 1.00 50.35 O ATOM 714 CB PRO A 132 5.781 -27.977 -14.568 1.00 2.04 C ATOM 715 CG PRO A 132 6.769 -27.696 -13.489 1.00 70.40 C ATOM 716 CD PRO A 132 6.136 -26.653 -12.610 1.00 11.23 C ATOM 0 HA PRO A 132 3.645 -27.419 -14.568 1.00 23.41 H new ATOM 0 HB2 PRO A 132 5.903 -28.985 -14.964 1.00 2.04 H new ATOM 0 HB3 PRO A 132 5.902 -27.289 -15.405 1.00 2.04 H new ATOM 0 HG2 PRO A 132 6.995 -28.599 -12.922 1.00 70.40 H new ATOM 0 HG3 PRO A 132 7.710 -27.337 -13.905 1.00 70.40 H new ATOM 0 HD2 PRO A 132 6.432 -26.772 -11.568 1.00 11.23 H new ATOM 0 HD3 PRO A 132 6.425 -25.646 -12.910 1.00 11.23 H new ATOM 724 N GLY A 133 2.846 -29.645 -14.085 1.00 51.13 N ATOM 725 CA GLY A 133 2.262 -30.918 -13.708 1.00 72.20 C ATOM 726 C GLY A 133 3.195 -32.084 -13.970 1.00 24.31 C ATOM 727 O GLY A 133 2.942 -33.202 -13.522 1.00 62.54 O ATOM 0 H GLY A 133 2.401 -29.188 -14.881 1.00 51.13 H new ATOM 0 HA2 GLY A 133 2.002 -30.896 -12.650 1.00 72.20 H new ATOM 0 HA3 GLY A 133 1.335 -31.067 -14.261 1.00 72.20 H new ATOM 731 N SER A 134 4.274 -31.823 -14.701 1.00 13.24 N ATOM 732 CA SER A 134 5.245 -32.862 -15.027 1.00 0.03 C ATOM 733 C SER A 134 5.731 -33.567 -13.765 1.00 14.21 C ATOM 734 O SER A 134 5.994 -34.770 -13.774 1.00 33.45 O ATOM 735 CB SER A 134 6.433 -32.259 -15.778 1.00 71.14 C ATOM 736 OG SER A 134 6.070 -31.893 -17.098 1.00 54.54 O ATOM 0 H SER A 134 4.498 -30.902 -15.079 1.00 13.24 H new ATOM 0 HA SER A 134 4.755 -33.597 -15.666 1.00 0.03 H new ATOM 0 HB2 SER A 134 6.799 -31.383 -15.242 1.00 71.14 H new ATOM 0 HB3 SER A 134 7.251 -32.979 -15.809 1.00 71.14 H new ATOM 0 HG SER A 134 6.846 -31.509 -17.556 1.00 54.54 H new ATOM 742 N LEU A 135 5.848 -32.810 -12.680 1.00 22.34 N ATOM 743 CA LEU A 135 6.302 -33.361 -11.408 1.00 71.02 C ATOM 744 C LEU A 135 5.277 -33.107 -10.307 1.00 43.52 C ATOM 745 O LEU A 135 5.635 -32.812 -9.167 1.00 62.30 O ATOM 746 CB LEU A 135 7.649 -32.750 -11.017 1.00 1.33 C ATOM 747 CG LEU A 135 8.667 -33.708 -10.398 1.00 35.31 C ATOM 748 CD1 LEU A 135 9.930 -32.960 -9.998 1.00 35.24 C ATOM 749 CD2 LEU A 135 8.065 -34.423 -9.196 1.00 24.21 C ATOM 0 H LEU A 135 5.635 -31.813 -12.655 1.00 22.34 H new ATOM 0 HA LEU A 135 6.419 -34.438 -11.528 1.00 71.02 H new ATOM 0 HB2 LEU A 135 8.094 -32.304 -11.906 1.00 1.33 H new ATOM 0 HB3 LEU A 135 7.466 -31.940 -10.311 1.00 1.33 H new ATOM 0 HG LEU A 135 8.933 -34.456 -11.145 1.00 35.31 H new ATOM 0 HD11 LEU A 135 10.643 -33.658 -9.559 1.00 35.24 H new ATOM 0 HD12 LEU A 135 10.372 -32.496 -10.879 1.00 35.24 H new ATOM 0 HD13 LEU A 135 9.681 -32.190 -9.268 1.00 35.24 H new ATOM 0 HD21 LEU A 135 8.804 -35.101 -8.768 1.00 24.21 H new ATOM 0 HD22 LEU A 135 7.769 -33.689 -8.447 1.00 24.21 H new ATOM 0 HD23 LEU A 135 7.190 -34.992 -9.512 1.00 24.21 H new ATOM 761 N VAL A 136 4.000 -33.228 -10.656 1.00 10.15 N ATOM 762 CA VAL A 136 2.922 -33.016 -9.697 1.00 65.54 C ATOM 763 C VAL A 136 2.092 -34.281 -9.515 1.00 40.25 C ATOM 764 O VAL A 136 1.447 -34.470 -8.483 1.00 34.33 O ATOM 765 CB VAL A 136 1.998 -31.865 -10.138 1.00 44.33 C ATOM 766 CG1 VAL A 136 0.810 -31.744 -9.194 1.00 72.44 C ATOM 767 CG2 VAL A 136 2.771 -30.557 -10.207 1.00 24.52 C ATOM 0 H VAL A 136 3.687 -33.472 -11.596 1.00 10.15 H new ATOM 0 HA VAL A 136 3.389 -32.753 -8.748 1.00 65.54 H new ATOM 0 HB VAL A 136 1.619 -32.088 -11.135 1.00 44.33 H new ATOM 0 HG11 VAL A 136 0.168 -30.926 -9.520 1.00 72.44 H new ATOM 0 HG12 VAL A 136 0.243 -32.675 -9.201 1.00 72.44 H new ATOM 0 HG13 VAL A 136 1.167 -31.544 -8.184 1.00 72.44 H new ATOM 0 HG21 VAL A 136 2.102 -29.755 -10.520 1.00 24.52 H new ATOM 0 HG22 VAL A 136 3.181 -30.324 -9.224 1.00 24.52 H new ATOM 0 HG23 VAL A 136 3.584 -30.653 -10.926 1.00 24.52 H new ATOM 777 N ASP A 137 2.111 -35.145 -10.524 1.00 63.00 N ATOM 778 CA ASP A 137 1.360 -36.394 -10.476 1.00 72.00 C ATOM 779 C ASP A 137 2.264 -37.556 -10.076 1.00 1.41 C ATOM 780 O ASP A 137 3.155 -37.950 -10.829 1.00 33.31 O ATOM 781 CB ASP A 137 0.714 -36.678 -11.833 1.00 42.44 C ATOM 782 CG ASP A 137 -0.323 -37.782 -11.759 1.00 44.32 C ATOM 783 OD1 ASP A 137 0.074 -38.965 -11.701 1.00 53.44 O1- ATOM 784 OD2 ASP A 137 -1.530 -37.464 -11.761 1.00 15.05 O ATOM 0 H ASP A 137 2.639 -35.003 -11.385 1.00 63.00 H new ATOM 0 HA ASP A 137 0.577 -36.290 -9.724 1.00 72.00 H new ATOM 0 HB2 ASP A 137 0.246 -35.768 -12.207 1.00 42.44 H new ATOM 0 HB3 ASP A 137 1.487 -36.956 -12.549 1.00 42.44 H new ATOM 789 N VAL A 138 2.029 -38.101 -8.887 1.00 53.41 N ATOM 790 CA VAL A 138 2.821 -39.218 -8.387 1.00 15.53 C ATOM 791 C VAL A 138 2.027 -40.051 -7.388 1.00 1.43 C ATOM 792 O VAL A 138 1.408 -39.514 -6.468 1.00 34.11 O ATOM 793 CB VAL A 138 4.119 -38.730 -7.715 1.00 13.01 C ATOM 794 CG1 VAL A 138 5.139 -38.311 -8.763 1.00 11.43 C ATOM 795 CG2 VAL A 138 3.824 -37.584 -6.759 1.00 50.50 C ATOM 0 H VAL A 138 1.296 -37.787 -8.251 1.00 53.41 H new ATOM 0 HA VAL A 138 3.076 -39.835 -9.248 1.00 15.53 H new ATOM 0 HB VAL A 138 4.542 -39.554 -7.140 1.00 13.01 H new ATOM 0 HG11 VAL A 138 6.049 -37.969 -8.269 1.00 11.43 H new ATOM 0 HG12 VAL A 138 5.372 -39.161 -9.405 1.00 11.43 H new ATOM 0 HG13 VAL A 138 4.729 -37.502 -9.367 1.00 11.43 H new ATOM 0 HG21 VAL A 138 4.751 -37.251 -6.293 1.00 50.50 H new ATOM 0 HG22 VAL A 138 3.377 -36.756 -7.310 1.00 50.50 H new ATOM 0 HG23 VAL A 138 3.132 -37.922 -5.988 1.00 50.50 H new ATOM 805 N ARG A 139 2.049 -41.367 -7.573 1.00 35.25 N ATOM 806 CA ARG A 139 1.330 -42.276 -6.688 1.00 31.31 C ATOM 807 C ARG A 139 -0.172 -42.017 -6.747 1.00 33.22 C ATOM 808 O ARG A 139 -0.628 -40.960 -7.184 1.00 64.02 O ATOM 809 CB ARG A 139 1.830 -42.123 -5.250 1.00 30.13 C ATOM 810 CG ARG A 139 2.821 -43.197 -4.832 1.00 20.12 C ATOM 811 CD ARG A 139 3.239 -43.034 -3.379 1.00 14.14 C ATOM 812 NE ARG A 139 3.597 -41.654 -3.064 1.00 54.24 N ATOM 813 CZ ARG A 139 4.737 -41.086 -3.442 1.00 72.02 C ATOM 814 NH1 ARG A 139 5.625 -41.776 -4.145 1.00 5.33 N1+ ATOM 815 NH2 ARG A 139 4.992 -39.824 -3.117 1.00 4.43 N ATOM 0 H ARG A 139 2.557 -41.828 -8.328 1.00 35.25 H new ATOM 0 HA ARG A 139 1.518 -43.296 -7.024 1.00 31.31 H new ATOM 0 HB2 ARG A 139 2.299 -41.145 -5.139 1.00 30.13 H new ATOM 0 HB3 ARG A 139 0.976 -42.145 -4.573 1.00 30.13 H new ATOM 0 HG2 ARG A 139 2.375 -44.181 -4.975 1.00 20.12 H new ATOM 0 HG3 ARG A 139 3.702 -43.150 -5.473 1.00 20.12 H new ATOM 0 HD2 ARG A 139 2.424 -43.354 -2.729 1.00 14.14 H new ATOM 0 HD3 ARG A 139 4.088 -43.685 -3.171 1.00 14.14 H new ATOM 0 HE ARG A 139 2.936 -41.096 -2.524 1.00 54.24 H new ATOM 0 HH11 ARG A 139 5.434 -42.746 -4.397 1.00 5.33 H new ATOM 0 HH12 ARG A 139 6.499 -41.337 -4.434 1.00 5.33 H new ATOM 0 HH21 ARG A 139 4.312 -39.289 -2.576 1.00 4.43 H new ATOM 0 HH22 ARG A 139 5.868 -39.389 -3.408 1.00 4.43 H new ATOM 829 N PRO A 140 -0.962 -43.003 -6.295 1.00 72.14 N ATOM 830 CA PRO A 140 -2.424 -42.905 -6.285 1.00 14.50 C ATOM 831 C PRO A 140 -2.930 -41.898 -5.259 1.00 3.15 C ATOM 832 O PRO A 140 -2.195 -41.488 -4.361 1.00 52.42 O ATOM 833 CB PRO A 140 -2.872 -44.320 -5.913 1.00 25.24 C ATOM 834 CG PRO A 140 -1.724 -44.893 -5.155 1.00 34.04 C ATOM 835 CD PRO A 140 -0.486 -44.290 -5.760 1.00 45.02 C ATOM 0 HA PRO A 140 -2.816 -42.557 -7.241 1.00 14.50 H new ATOM 0 HB2 PRO A 140 -3.778 -44.302 -5.307 1.00 25.24 H new ATOM 0 HB3 PRO A 140 -3.095 -44.911 -6.801 1.00 25.24 H new ATOM 0 HG2 PRO A 140 -1.797 -44.652 -4.095 1.00 34.04 H new ATOM 0 HG3 PRO A 140 -1.708 -45.980 -5.234 1.00 34.04 H new ATOM 0 HD2 PRO A 140 0.298 -44.151 -5.016 1.00 45.02 H new ATOM 0 HD3 PRO A 140 -0.072 -44.923 -6.545 1.00 45.02 H new ATOM 843 N VAL A 141 -4.193 -41.503 -5.397 1.00 14.24 N ATOM 844 CA VAL A 141 -4.798 -40.544 -4.480 1.00 40.14 C ATOM 845 C VAL A 141 -4.593 -40.967 -3.029 1.00 51.04 C ATOM 846 O VAL A 141 -4.699 -42.146 -2.695 1.00 50.42 O ATOM 847 CB VAL A 141 -6.307 -40.387 -4.748 1.00 61.41 C ATOM 848 CG1 VAL A 141 -7.012 -41.730 -4.637 1.00 4.11 C ATOM 849 CG2 VAL A 141 -6.915 -39.374 -3.791 1.00 2.25 C ATOM 0 H VAL A 141 -4.816 -41.832 -6.134 1.00 14.24 H new ATOM 0 HA VAL A 141 -4.304 -39.587 -4.651 1.00 40.14 H new ATOM 0 HB VAL A 141 -6.442 -40.017 -5.765 1.00 61.41 H new ATOM 0 HG11 VAL A 141 -8.077 -41.599 -4.829 1.00 4.11 H new ATOM 0 HG12 VAL A 141 -6.594 -42.422 -5.368 1.00 4.11 H new ATOM 0 HG13 VAL A 141 -6.872 -42.133 -3.634 1.00 4.11 H new ATOM 0 HG21 VAL A 141 -7.981 -39.276 -3.995 1.00 2.25 H new ATOM 0 HG22 VAL A 141 -6.771 -39.711 -2.765 1.00 2.25 H new ATOM 0 HG23 VAL A 141 -6.429 -38.408 -3.927 1.00 2.25 H new ATOM 859 N ARG A 142 -4.299 -39.995 -2.172 1.00 71.04 N ATOM 860 CA ARG A 142 -4.078 -40.265 -0.756 1.00 53.24 C ATOM 861 C ARG A 142 -3.797 -38.974 0.007 1.00 4.13 C ATOM 862 O ARG A 142 -2.710 -38.406 -0.093 1.00 5.33 O ATOM 863 CB ARG A 142 -2.912 -41.240 -0.577 1.00 34.10 C ATOM 864 CG ARG A 142 -1.646 -40.815 -1.305 1.00 34.45 C ATOM 865 CD ARG A 142 -0.644 -41.955 -1.391 1.00 41.42 C ATOM 866 NE ARG A 142 0.660 -41.579 -0.851 1.00 32.52 N ATOM 867 CZ ARG A 142 1.571 -42.460 -0.452 1.00 43.31 C ATOM 868 NH1 ARG A 142 1.322 -43.759 -0.531 1.00 73.12 N1+ ATOM 869 NH2 ARG A 142 2.735 -42.040 0.029 1.00 14.02 N ATOM 0 H ARG A 142 -4.208 -39.013 -2.433 1.00 71.04 H new ATOM 0 HA ARG A 142 -4.985 -40.715 -0.352 1.00 53.24 H new ATOM 0 HB2 ARG A 142 -2.693 -41.341 0.486 1.00 34.10 H new ATOM 0 HB3 ARG A 142 -3.214 -42.224 -0.935 1.00 34.10 H new ATOM 0 HG2 ARG A 142 -1.899 -40.475 -2.309 1.00 34.45 H new ATOM 0 HG3 ARG A 142 -1.193 -39.970 -0.787 1.00 34.45 H new ATOM 0 HD2 ARG A 142 -1.028 -42.817 -0.845 1.00 41.42 H new ATOM 0 HD3 ARG A 142 -0.531 -42.261 -2.431 1.00 41.42 H new ATOM 0 HE ARG A 142 0.883 -40.587 -0.776 1.00 32.52 H new ATOM 0 HH11 ARG A 142 0.429 -44.086 -0.899 1.00 73.12 H new ATOM 0 HH12 ARG A 142 2.024 -44.432 -0.224 1.00 73.12 H new ATOM 0 HH21 ARG A 142 2.930 -41.041 0.092 1.00 14.02 H new ATOM 0 HH22 ARG A 142 3.434 -42.717 0.335 1.00 14.02 H new ATOM 883 N ASP A 143 -4.785 -38.517 0.768 1.00 41.32 N ATOM 884 CA ASP A 143 -4.645 -37.292 1.549 1.00 33.40 C ATOM 885 C ASP A 143 -4.334 -36.104 0.644 1.00 60.23 C ATOM 886 O ASP A 143 -3.184 -35.880 0.267 1.00 42.31 O ATOM 887 CB ASP A 143 -3.543 -37.454 2.596 1.00 30.13 C ATOM 888 CG ASP A 143 -3.893 -38.485 3.651 1.00 23.42 C ATOM 889 OD1 ASP A 143 -3.944 -39.686 3.314 1.00 65.31 O ATOM 890 OD2 ASP A 143 -4.117 -38.089 4.815 1.00 1.43 O1- ATOM 0 H ASP A 143 -5.691 -38.975 0.861 1.00 41.32 H new ATOM 0 HA ASP A 143 -5.591 -37.102 2.055 1.00 33.40 H new ATOM 0 HB2 ASP A 143 -2.616 -37.745 2.102 1.00 30.13 H new ATOM 0 HB3 ASP A 143 -3.360 -36.494 3.078 1.00 30.13 H new ATOM 895 N THR A 144 -5.370 -35.344 0.299 1.00 33.51 N ATOM 896 CA THR A 144 -5.208 -34.180 -0.563 1.00 12.22 C ATOM 897 C THR A 144 -4.812 -32.949 0.245 1.00 32.31 C ATOM 898 O THR A 144 -4.711 -31.845 -0.294 1.00 31.31 O ATOM 899 CB THR A 144 -6.501 -33.874 -1.342 1.00 3.12 C ATOM 900 OG1 THR A 144 -7.225 -35.086 -1.585 1.00 2.12 O ATOM 901 CG2 THR A 144 -6.187 -33.191 -2.665 1.00 34.45 C ATOM 0 H THR A 144 -6.329 -35.514 0.603 1.00 33.51 H new ATOM 0 HA THR A 144 -4.414 -34.418 -1.271 1.00 12.22 H new ATOM 0 HB THR A 144 -7.111 -33.201 -0.740 1.00 3.12 H new ATOM 0 HG1 THR A 144 -8.047 -34.883 -2.079 1.00 2.12 H new ATOM 0 HG21 THR A 144 -7.116 -32.985 -3.197 1.00 34.45 H new ATOM 0 HG22 THR A 144 -5.662 -32.255 -2.476 1.00 34.45 H new ATOM 0 HG23 THR A 144 -5.558 -33.843 -3.271 1.00 34.45 H new ATOM 909 N LEU A 145 -4.588 -33.143 1.539 1.00 25.21 N ATOM 910 CA LEU A 145 -4.201 -32.049 2.422 1.00 41.45 C ATOM 911 C LEU A 145 -2.688 -31.858 2.422 1.00 44.04 C ATOM 912 O LEU A 145 -2.176 -30.875 2.959 1.00 41.05 O ATOM 913 CB LEU A 145 -4.693 -32.316 3.846 1.00 72.14 C ATOM 914 CG LEU A 145 -6.153 -31.961 4.129 1.00 12.03 C ATOM 915 CD1 LEU A 145 -6.403 -30.483 3.871 1.00 10.12 C ATOM 916 CD2 LEU A 145 -7.084 -32.817 3.283 1.00 72.53 C ATOM 0 H LEU A 145 -4.668 -34.049 2.001 1.00 25.21 H new ATOM 0 HA LEU A 145 -4.664 -31.135 2.050 1.00 41.45 H new ATOM 0 HB2 LEU A 145 -4.548 -33.373 4.067 1.00 72.14 H new ATOM 0 HB3 LEU A 145 -4.063 -31.756 4.538 1.00 72.14 H new ATOM 0 HG LEU A 145 -6.359 -32.165 5.180 1.00 12.03 H new ATOM 0 HD11 LEU A 145 -7.447 -30.249 4.078 1.00 10.12 H new ATOM 0 HD12 LEU A 145 -5.762 -29.887 4.521 1.00 10.12 H new ATOM 0 HD13 LEU A 145 -6.179 -30.252 2.829 1.00 10.12 H new ATOM 0 HD21 LEU A 145 -8.119 -32.550 3.498 1.00 72.53 H new ATOM 0 HD22 LEU A 145 -6.877 -32.645 2.227 1.00 72.53 H new ATOM 0 HD23 LEU A 145 -6.924 -33.869 3.518 1.00 72.53 H new ATOM 928 N HIS A 146 -1.977 -32.803 1.816 1.00 33.21 N ATOM 929 CA HIS A 146 -0.522 -32.737 1.744 1.00 1.43 C ATOM 930 C HIS A 146 -0.074 -31.708 0.710 1.00 63.11 C ATOM 931 O HIS A 146 1.117 -31.426 0.575 1.00 22.21 O ATOM 932 CB HIS A 146 0.055 -34.110 1.397 1.00 72.35 C ATOM 933 CG HIS A 146 -0.136 -34.494 -0.038 1.00 0.24 C ATOM 934 ND1 HIS A 146 -1.248 -34.138 -0.772 1.00 1.44 N ATOM 935 CD2 HIS A 146 0.653 -35.207 -0.876 1.00 32.41 C ATOM 936 CE1 HIS A 146 -1.135 -34.616 -1.997 1.00 40.02 C ATOM 937 NE2 HIS A 146 0.009 -35.269 -2.087 1.00 53.34 N ATOM 0 H HIS A 146 -2.385 -33.624 1.368 1.00 33.21 H new ATOM 0 HA HIS A 146 -0.149 -32.430 2.721 1.00 1.43 H new ATOM 0 HB2 HIS A 146 1.120 -34.116 1.628 1.00 72.35 H new ATOM 0 HB3 HIS A 146 -0.413 -34.863 2.031 1.00 72.35 H new ATOM 0 HD2 HIS A 146 1.611 -35.645 -0.636 1.00 32.41 H new ATOM 0 HE1 HIS A 146 -1.856 -34.494 -2.791 1.00 40.02 H new ATOM 0 HE2 HIS A 146 0.358 -35.742 -2.920 1.00 53.34 H new ATOM 945 N LEU A 147 -1.037 -31.152 -0.018 1.00 3.03 N ATOM 946 CA LEU A 147 -0.742 -30.153 -1.040 1.00 14.44 C ATOM 947 C LEU A 147 -1.411 -28.823 -0.710 1.00 54.12 C ATOM 948 O LEU A 147 -1.781 -28.065 -1.607 1.00 62.14 O ATOM 949 CB LEU A 147 -1.210 -30.646 -2.410 1.00 15.31 C ATOM 950 CG LEU A 147 -2.615 -31.247 -2.465 1.00 63.33 C ATOM 951 CD1 LEU A 147 -3.664 -30.147 -2.519 1.00 5.30 C ATOM 952 CD2 LEU A 147 -2.752 -32.177 -3.662 1.00 24.23 C ATOM 0 H LEU A 147 -2.027 -31.376 0.080 1.00 3.03 H new ATOM 0 HA LEU A 147 0.337 -29.999 -1.064 1.00 14.44 H new ATOM 0 HB2 LEU A 147 -1.167 -29.810 -3.108 1.00 15.31 H new ATOM 0 HB3 LEU A 147 -0.502 -31.395 -2.765 1.00 15.31 H new ATOM 0 HG LEU A 147 -2.776 -31.830 -1.558 1.00 63.33 H new ATOM 0 HD11 LEU A 147 -4.658 -30.593 -2.558 1.00 5.30 H new ATOM 0 HD12 LEU A 147 -3.582 -29.522 -1.630 1.00 5.30 H new ATOM 0 HD13 LEU A 147 -3.506 -29.537 -3.408 1.00 5.30 H new ATOM 0 HD21 LEU A 147 -3.758 -32.595 -3.685 1.00 24.23 H new ATOM 0 HD22 LEU A 147 -2.571 -31.618 -4.580 1.00 24.23 H new ATOM 0 HD23 LEU A 147 -2.025 -32.985 -3.580 1.00 24.23 H new ATOM 964 N GLU A 148 -1.560 -28.545 0.580 1.00 71.13 N ATOM 965 CA GLU A 148 -2.182 -27.305 1.028 1.00 1.45 C ATOM 966 C GLU A 148 -1.302 -26.593 2.051 1.00 64.53 C ATOM 967 O GLU A 148 -0.899 -27.179 3.054 1.00 52.44 O ATOM 968 CB GLU A 148 -3.559 -27.587 1.632 1.00 74.44 C ATOM 969 CG GLU A 148 -4.455 -28.426 0.737 1.00 61.21 C ATOM 970 CD GLU A 148 -5.018 -27.638 -0.430 1.00 71.04 C ATOM 971 OE1 GLU A 148 -4.315 -27.513 -1.455 1.00 15.42 O ATOM 972 OE2 GLU A 148 -6.160 -27.145 -0.319 1.00 61.21 O1- ATOM 0 H GLU A 148 -1.258 -29.162 1.334 1.00 71.13 H new ATOM 0 HA GLU A 148 -2.300 -26.655 0.161 1.00 1.45 H new ATOM 0 HB2 GLU A 148 -3.430 -28.099 2.586 1.00 74.44 H new ATOM 0 HB3 GLU A 148 -4.055 -26.640 1.843 1.00 74.44 H new ATOM 0 HG2 GLU A 148 -3.889 -29.276 0.357 1.00 61.21 H new ATOM 0 HG3 GLU A 148 -5.277 -28.830 1.328 1.00 61.21 H new ATOM 979 N GLY A 149 -1.008 -25.322 1.788 1.00 54.43 N ATOM 980 CA GLY A 149 -0.177 -24.551 2.694 1.00 25.32 C ATOM 981 C GLY A 149 1.229 -25.106 2.807 1.00 34.35 C ATOM 982 O GLY A 149 1.860 -25.007 3.859 1.00 65.23 O ATOM 0 H GLY A 149 -1.330 -24.814 0.964 1.00 54.43 H new ATOM 0 HA2 GLY A 149 -0.130 -23.518 2.348 1.00 25.32 H new ATOM 0 HA3 GLY A 149 -0.639 -24.536 3.681 1.00 25.32 H new ATOM 986 N LYS A 150 1.720 -25.695 1.722 1.00 70.04 N ATOM 987 CA LYS A 150 3.060 -26.270 1.704 1.00 31.31 C ATOM 988 C LYS A 150 4.121 -25.174 1.691 1.00 54.12 C ATOM 989 O LYS A 150 4.044 -24.232 0.904 1.00 22.52 O ATOM 990 CB LYS A 150 3.231 -27.174 0.481 1.00 50.15 C ATOM 991 CG LYS A 150 4.283 -28.254 0.666 1.00 10.22 C ATOM 992 CD LYS A 150 5.280 -28.264 -0.480 1.00 65.53 C ATOM 993 CE LYS A 150 5.421 -29.653 -1.084 1.00 15.14 C ATOM 994 NZ LYS A 150 6.110 -30.593 -0.157 1.00 42.30 N1+ ATOM 0 H LYS A 150 1.210 -25.787 0.843 1.00 70.04 H new ATOM 0 HA LYS A 150 3.187 -26.864 2.609 1.00 31.31 H new ATOM 0 HB2 LYS A 150 2.275 -27.645 0.251 1.00 50.15 H new ATOM 0 HB3 LYS A 150 3.499 -26.561 -0.379 1.00 50.15 H new ATOM 0 HG2 LYS A 150 4.810 -28.092 1.606 1.00 10.22 H new ATOM 0 HG3 LYS A 150 3.798 -29.228 0.736 1.00 10.22 H new ATOM 0 HD2 LYS A 150 4.958 -27.562 -1.250 1.00 65.53 H new ATOM 0 HD3 LYS A 150 6.251 -27.921 -0.122 1.00 65.53 H new ATOM 0 HE2 LYS A 150 4.434 -30.044 -1.330 1.00 15.14 H new ATOM 0 HE3 LYS A 150 5.980 -29.588 -2.017 1.00 15.14 H new ATOM 0 HZ1 LYS A 150 6.187 -31.528 -0.605 1.00 42.30 H new ATOM 0 HZ2 LYS A 150 7.062 -30.233 0.058 1.00 42.30 H new ATOM 0 HZ3 LYS A 150 5.563 -30.675 0.724 1.00 42.30 H new ATOM 1008 N GLU A 151 5.112 -25.306 2.569 1.00 41.22 N ATOM 1009 CA GLU A 151 6.189 -24.328 2.657 1.00 55.31 C ATOM 1010 C GLU A 151 7.433 -24.821 1.925 1.00 33.43 C ATOM 1011 O GLU A 151 8.231 -25.581 2.476 1.00 74.30 O ATOM 1012 CB GLU A 151 6.526 -24.038 4.121 1.00 5.22 C ATOM 1013 CG GLU A 151 6.753 -25.289 4.952 1.00 51.44 C ATOM 1014 CD GLU A 151 7.981 -25.188 5.836 1.00 14.32 C ATOM 1015 OE1 GLU A 151 8.029 -24.272 6.684 1.00 24.15 O ATOM 1016 OE2 GLU A 151 8.895 -26.024 5.679 1.00 1.24 O1- ATOM 0 H GLU A 151 5.190 -26.080 3.228 1.00 41.22 H new ATOM 0 HA GLU A 151 5.850 -23.408 2.181 1.00 55.31 H new ATOM 0 HB2 GLU A 151 7.421 -23.417 4.163 1.00 5.22 H new ATOM 0 HB3 GLU A 151 5.715 -23.460 4.564 1.00 5.22 H new ATOM 0 HG2 GLU A 151 5.877 -25.471 5.574 1.00 51.44 H new ATOM 0 HG3 GLU A 151 6.857 -26.147 4.288 1.00 51.44 H new ATOM 1023 N LEU A 152 7.593 -24.383 0.681 1.00 4.40 N ATOM 1024 CA LEU A 152 8.740 -24.780 -0.128 1.00 14.53 C ATOM 1025 C LEU A 152 9.286 -23.595 -0.918 1.00 1.52 C ATOM 1026 O LEU A 152 8.524 -22.769 -1.420 1.00 22.54 O ATOM 1027 CB LEU A 152 8.349 -25.909 -1.084 1.00 72.43 C ATOM 1028 CG LEU A 152 8.717 -27.324 -0.637 1.00 52.41 C ATOM 1029 CD1 LEU A 152 8.275 -28.343 -1.676 1.00 52.35 C ATOM 1030 CD2 LEU A 152 10.213 -27.432 -0.386 1.00 3.13 C ATOM 0 H LEU A 152 6.943 -23.753 0.211 1.00 4.40 H new ATOM 0 HA LEU A 152 9.521 -25.136 0.544 1.00 14.53 H new ATOM 0 HB2 LEU A 152 7.271 -25.868 -1.241 1.00 72.43 H new ATOM 0 HB3 LEU A 152 8.819 -25.720 -2.049 1.00 72.43 H new ATOM 0 HG LEU A 152 8.196 -27.537 0.296 1.00 52.41 H new ATOM 0 HD11 LEU A 152 8.545 -29.345 -1.341 1.00 52.35 H new ATOM 0 HD12 LEU A 152 7.195 -28.283 -1.808 1.00 52.35 H new ATOM 0 HD13 LEU A 152 8.768 -28.132 -2.625 1.00 52.35 H new ATOM 0 HD21 LEU A 152 10.456 -28.446 -0.069 1.00 3.13 H new ATOM 0 HD22 LEU A 152 10.754 -27.199 -1.303 1.00 3.13 H new ATOM 0 HD23 LEU A 152 10.503 -26.728 0.394 1.00 3.13 H new ATOM 1042 N GLU A 153 10.609 -23.519 -1.024 1.00 64.45 N ATOM 1043 CA GLU A 153 11.254 -22.435 -1.755 1.00 72.24 C ATOM 1044 C GLU A 153 11.442 -22.805 -3.224 1.00 52.22 C ATOM 1045 O GLU A 153 11.964 -23.873 -3.544 1.00 74.32 O ATOM 1046 CB GLU A 153 12.609 -22.101 -1.124 1.00 65.41 C ATOM 1047 CG GLU A 153 13.601 -23.251 -1.173 1.00 32.34 C ATOM 1048 CD GLU A 153 14.910 -22.919 -0.482 1.00 54.31 C ATOM 1049 OE1 GLU A 153 14.929 -22.876 0.766 1.00 31.43 O ATOM 1050 OE2 GLU A 153 15.917 -22.704 -1.189 1.00 12.13 O1- ATOM 0 H GLU A 153 11.254 -24.194 -0.614 1.00 64.45 H new ATOM 0 HA GLU A 153 10.609 -21.558 -1.699 1.00 72.24 H new ATOM 0 HB2 GLU A 153 13.037 -21.240 -1.637 1.00 65.41 H new ATOM 0 HB3 GLU A 153 12.455 -21.809 -0.085 1.00 65.41 H new ATOM 0 HG2 GLU A 153 13.158 -24.129 -0.703 1.00 32.34 H new ATOM 0 HG3 GLU A 153 13.799 -23.512 -2.213 1.00 32.34 H new ATOM 1057 N PHE A 154 11.012 -21.915 -4.112 1.00 71.32 N ATOM 1058 CA PHE A 154 11.131 -22.147 -5.546 1.00 73.31 C ATOM 1059 C PHE A 154 12.157 -21.203 -6.167 1.00 21.25 C ATOM 1060 O PHE A 154 12.773 -20.395 -5.473 1.00 32.42 O ATOM 1061 CB PHE A 154 9.773 -21.962 -6.228 1.00 71.02 C ATOM 1062 CG PHE A 154 8.666 -22.747 -5.583 1.00 21.14 C ATOM 1063 CD1 PHE A 154 8.010 -22.254 -4.467 1.00 72.32 C ATOM 1064 CD2 PHE A 154 8.281 -23.975 -6.094 1.00 33.11 C ATOM 1065 CE1 PHE A 154 6.991 -22.974 -3.871 1.00 33.30 C ATOM 1066 CE2 PHE A 154 7.264 -24.699 -5.503 1.00 3.41 C ATOM 1067 CZ PHE A 154 6.618 -24.198 -4.391 1.00 31.11 C ATOM 0 H PHE A 154 10.578 -21.026 -3.863 1.00 71.32 H new ATOM 0 HA PHE A 154 11.469 -23.172 -5.696 1.00 73.31 H new ATOM 0 HB2 PHE A 154 9.511 -20.904 -6.217 1.00 71.02 H new ATOM 0 HB3 PHE A 154 9.857 -22.259 -7.273 1.00 71.02 H new ATOM 0 HD1 PHE A 154 8.298 -21.297 -4.058 1.00 72.32 H new ATOM 0 HD2 PHE A 154 8.782 -24.371 -6.965 1.00 33.11 H new ATOM 0 HE1 PHE A 154 6.488 -22.580 -3.000 1.00 33.30 H new ATOM 0 HE2 PHE A 154 6.975 -25.656 -5.911 1.00 3.41 H new ATOM 0 HZ PHE A 154 5.822 -24.762 -3.928 1.00 31.11 H new ATOM 1077 N LYS A 155 12.336 -21.314 -7.479 1.00 14.10 N ATOM 1078 CA LYS A 155 13.285 -20.472 -8.195 1.00 52.02 C ATOM 1079 C LYS A 155 12.757 -20.113 -9.581 1.00 34.24 C ATOM 1080 O LYS A 155 11.998 -20.872 -10.183 1.00 74.34 O ATOM 1081 CB LYS A 155 14.635 -21.183 -8.321 1.00 22.41 C ATOM 1082 CG LYS A 155 14.515 -22.661 -8.651 1.00 33.03 C ATOM 1083 CD LYS A 155 14.321 -22.886 -10.141 1.00 61.52 C ATOM 1084 CE LYS A 155 13.301 -23.982 -10.411 1.00 44.24 C ATOM 1085 NZ LYS A 155 11.964 -23.644 -9.850 1.00 21.03 N1+ ATOM 0 H LYS A 155 11.835 -21.980 -8.068 1.00 14.10 H new ATOM 0 HA LYS A 155 13.417 -19.552 -7.626 1.00 52.02 H new ATOM 0 HB2 LYS A 155 15.224 -20.693 -9.096 1.00 22.41 H new ATOM 0 HB3 LYS A 155 15.184 -21.071 -7.386 1.00 22.41 H new ATOM 0 HG2 LYS A 155 15.412 -23.183 -8.317 1.00 33.03 H new ATOM 0 HG3 LYS A 155 13.675 -23.090 -8.105 1.00 33.03 H new ATOM 0 HD2 LYS A 155 13.993 -21.959 -10.610 1.00 61.52 H new ATOM 0 HD3 LYS A 155 15.274 -23.154 -10.597 1.00 61.52 H new ATOM 0 HE2 LYS A 155 13.214 -24.141 -11.486 1.00 44.24 H new ATOM 0 HE3 LYS A 155 13.651 -24.919 -9.977 1.00 44.24 H new ATOM 0 HZ1 LYS A 155 11.243 -24.262 -10.274 1.00 21.03 H new ATOM 0 HZ2 LYS A 155 11.975 -23.782 -8.819 1.00 21.03 H new ATOM 0 HZ3 LYS A 155 11.738 -22.652 -10.064 1.00 21.03 H new ATOM 1099 N VAL A 156 13.166 -18.952 -10.082 1.00 14.23 N ATOM 1100 CA VAL A 156 12.735 -18.493 -11.397 1.00 74.32 C ATOM 1101 C VAL A 156 13.710 -18.940 -12.481 1.00 51.23 C ATOM 1102 O VAL A 156 14.852 -18.484 -12.529 1.00 60.42 O ATOM 1103 CB VAL A 156 12.605 -16.958 -11.442 1.00 20.45 C ATOM 1104 CG1 VAL A 156 12.124 -16.504 -12.811 1.00 14.03 C ATOM 1105 CG2 VAL A 156 11.665 -16.473 -10.349 1.00 31.34 C ATOM 0 H VAL A 156 13.795 -18.312 -9.597 1.00 14.23 H new ATOM 0 HA VAL A 156 11.758 -18.939 -11.583 1.00 74.32 H new ATOM 0 HB VAL A 156 13.588 -16.520 -11.266 1.00 20.45 H new ATOM 0 HG11 VAL A 156 12.038 -15.417 -12.825 1.00 14.03 H new ATOM 0 HG12 VAL A 156 12.838 -16.821 -13.571 1.00 14.03 H new ATOM 0 HG13 VAL A 156 11.151 -16.948 -13.020 1.00 14.03 H new ATOM 0 HG21 VAL A 156 11.584 -15.387 -10.394 1.00 31.34 H new ATOM 0 HG22 VAL A 156 10.680 -16.917 -10.493 1.00 31.34 H new ATOM 0 HG23 VAL A 156 12.057 -16.767 -9.375 1.00 31.34 H new ATOM 1115 N ILE A 157 13.251 -19.836 -13.349 1.00 64.23 N ATOM 1116 CA ILE A 157 14.082 -20.344 -14.433 1.00 1.32 C ATOM 1117 C ILE A 157 13.984 -19.451 -15.665 1.00 51.51 C ATOM 1118 O ILE A 157 14.954 -19.286 -16.405 1.00 50.24 O ATOM 1119 CB ILE A 157 13.684 -21.781 -14.821 1.00 71.04 C ATOM 1120 CG1 ILE A 157 14.637 -22.326 -15.886 1.00 51.24 C ATOM 1121 CG2 ILE A 157 12.247 -21.816 -15.320 1.00 54.14 C ATOM 1122 CD1 ILE A 157 14.379 -23.774 -16.242 1.00 30.43 C ATOM 0 H ILE A 157 12.308 -20.225 -13.322 1.00 64.23 H new ATOM 0 HA ILE A 157 15.110 -20.346 -14.069 1.00 1.32 H new ATOM 0 HB ILE A 157 13.756 -22.414 -13.937 1.00 71.04 H new ATOM 0 HG12 ILE A 157 14.550 -21.718 -16.786 1.00 51.24 H new ATOM 0 HG13 ILE A 157 15.663 -22.224 -15.531 1.00 51.24 H new ATOM 0 HG21 ILE A 157 11.980 -22.838 -15.590 1.00 54.14 H new ATOM 0 HG22 ILE A 157 11.580 -21.463 -14.533 1.00 54.14 H new ATOM 0 HG23 ILE A 157 12.150 -21.172 -16.194 1.00 54.14 H new ATOM 0 HD11 ILE A 157 15.091 -24.094 -17.003 1.00 30.43 H new ATOM 0 HD12 ILE A 157 14.495 -24.394 -15.353 1.00 30.43 H new ATOM 0 HD13 ILE A 157 13.365 -23.879 -16.627 1.00 30.43 H new ATOM 1134 N LYS A 158 12.806 -18.874 -15.879 1.00 11.20 N ATOM 1135 CA LYS A 158 12.581 -17.994 -17.020 1.00 74.04 C ATOM 1136 C LYS A 158 11.164 -17.428 -16.999 1.00 3.31 C ATOM 1137 O LYS A 158 10.188 -18.176 -16.921 1.00 5.10 O ATOM 1138 CB LYS A 158 12.820 -18.750 -18.328 1.00 24.24 C ATOM 1139 CG LYS A 158 12.401 -17.974 -19.565 1.00 25.34 C ATOM 1140 CD LYS A 158 12.587 -18.796 -20.829 1.00 75.32 C ATOM 1141 CE LYS A 158 11.526 -19.878 -20.952 1.00 1.33 C ATOM 1142 NZ LYS A 158 10.284 -19.366 -21.598 1.00 35.23 N1+ ATOM 0 H LYS A 158 11.992 -19.000 -15.277 1.00 11.20 H new ATOM 0 HA LYS A 158 13.286 -17.165 -16.953 1.00 74.04 H new ATOM 0 HB2 LYS A 158 13.879 -18.998 -18.406 1.00 24.24 H new ATOM 0 HB3 LYS A 158 12.273 -19.692 -18.298 1.00 24.24 H new ATOM 0 HG2 LYS A 158 11.356 -17.678 -19.473 1.00 25.34 H new ATOM 0 HG3 LYS A 158 12.987 -17.058 -19.636 1.00 25.34 H new ATOM 0 HD2 LYS A 158 12.543 -18.141 -21.699 1.00 75.32 H new ATOM 0 HD3 LYS A 158 13.576 -19.254 -20.824 1.00 75.32 H new ATOM 0 HE2 LYS A 158 11.922 -20.710 -21.534 1.00 1.33 H new ATOM 0 HE3 LYS A 158 11.287 -20.267 -19.962 1.00 1.33 H new ATOM 0 HZ1 LYS A 158 9.585 -20.133 -21.664 1.00 35.23 H new ATOM 0 HZ2 LYS A 158 9.892 -18.588 -21.029 1.00 35.23 H new ATOM 0 HZ3 LYS A 158 10.507 -19.018 -22.552 1.00 35.23 H new ATOM 1156 N LEU A 159 11.060 -16.106 -17.070 1.00 22.41 N ATOM 1157 CA LEU A 159 9.762 -15.441 -17.061 1.00 43.12 C ATOM 1158 C LEU A 159 9.362 -15.007 -18.467 1.00 63.43 C ATOM 1159 O LEU A 159 10.056 -14.214 -19.104 1.00 65.04 O ATOM 1160 CB LEU A 159 9.795 -14.226 -16.131 1.00 4.42 C ATOM 1161 CG LEU A 159 11.029 -13.329 -16.243 1.00 11.11 C ATOM 1162 CD1 LEU A 159 10.646 -11.869 -16.060 1.00 0.52 C ATOM 1163 CD2 LEU A 159 12.081 -13.738 -15.222 1.00 43.35 C ATOM 0 H LEU A 159 11.858 -15.474 -17.134 1.00 22.41 H new ATOM 0 HA LEU A 159 9.021 -16.152 -16.695 1.00 43.12 H new ATOM 0 HB2 LEU A 159 8.911 -13.620 -16.327 1.00 4.42 H new ATOM 0 HB3 LEU A 159 9.719 -14.579 -15.102 1.00 4.42 H new ATOM 0 HG LEU A 159 11.453 -13.450 -17.240 1.00 11.11 H new ATOM 0 HD11 LEU A 159 11.537 -11.246 -16.143 1.00 0.52 H new ATOM 0 HD12 LEU A 159 9.929 -11.582 -16.829 1.00 0.52 H new ATOM 0 HD13 LEU A 159 10.197 -11.731 -15.076 1.00 0.52 H new ATOM 0 HD21 LEU A 159 12.952 -13.089 -15.317 1.00 43.35 H new ATOM 0 HD22 LEU A 159 11.668 -13.647 -14.217 1.00 43.35 H new ATOM 0 HD23 LEU A 159 12.378 -14.772 -15.400 1.00 43.35 H new ATOM 1175 N ASP A 160 8.237 -15.529 -18.944 1.00 63.41 N ATOM 1176 CA ASP A 160 7.743 -15.194 -20.274 1.00 74.52 C ATOM 1177 C ASP A 160 7.169 -13.780 -20.301 1.00 55.45 C ATOM 1178 O ASP A 160 6.306 -13.436 -19.494 1.00 12.23 O ATOM 1179 CB ASP A 160 6.677 -16.199 -20.715 1.00 1.44 C ATOM 1180 CG ASP A 160 6.186 -15.941 -22.126 1.00 35.14 C ATOM 1181 OD1 ASP A 160 6.961 -15.383 -22.930 1.00 20.24 O ATOM 1182 OD2 ASP A 160 5.028 -16.297 -22.425 1.00 74.23 O1- ATOM 0 H ASP A 160 7.650 -16.186 -18.429 1.00 63.41 H new ATOM 0 HA ASP A 160 8.583 -15.239 -20.968 1.00 74.52 H new ATOM 0 HB2 ASP A 160 7.086 -17.208 -20.654 1.00 1.44 H new ATOM 0 HB3 ASP A 160 5.833 -16.155 -20.026 1.00 1.44 H new ATOM 1187 N GLN A 161 7.656 -12.967 -21.232 1.00 71.33 N ATOM 1188 CA GLN A 161 7.193 -11.590 -21.361 1.00 43.43 C ATOM 1189 C GLN A 161 5.842 -11.535 -22.066 1.00 43.02 C ATOM 1190 O GLN A 161 5.043 -10.628 -21.830 1.00 33.42 O ATOM 1191 CB GLN A 161 8.218 -10.754 -22.130 1.00 3.00 C ATOM 1192 CG GLN A 161 8.419 -11.209 -23.567 1.00 42.43 C ATOM 1193 CD GLN A 161 9.785 -10.840 -24.109 1.00 42.32 C ATOM 1194 OE1 GLN A 161 10.652 -10.367 -23.373 1.00 31.54 O ATOM 1195 NE2 GLN A 161 9.985 -11.056 -25.404 1.00 21.10 N ATOM 0 H GLN A 161 8.371 -13.237 -21.908 1.00 71.33 H new ATOM 0 HA GLN A 161 7.077 -11.177 -20.359 1.00 43.43 H new ATOM 0 HB2 GLN A 161 7.899 -9.712 -22.129 1.00 3.00 H new ATOM 0 HB3 GLN A 161 9.174 -10.795 -21.607 1.00 3.00 H new ATOM 0 HG2 GLN A 161 8.290 -12.290 -23.624 1.00 42.43 H new ATOM 0 HG3 GLN A 161 7.649 -10.762 -24.197 1.00 42.43 H new ATOM 0 HE21 GLN A 161 9.238 -11.450 -25.977 1.00 21.10 H new ATOM 0 HE22 GLN A 161 10.885 -10.828 -25.826 1.00 21.10 H new ATOM 1204 N LYS A 162 5.592 -12.509 -22.933 1.00 74.31 N ATOM 1205 CA LYS A 162 4.338 -12.574 -23.673 1.00 0.03 C ATOM 1206 C LYS A 162 3.143 -12.509 -22.727 1.00 53.11 C ATOM 1207 O LYS A 162 2.090 -11.978 -23.077 1.00 52.53 O ATOM 1208 CB LYS A 162 4.277 -13.858 -24.503 1.00 22.24 C ATOM 1209 CG LYS A 162 3.256 -13.808 -25.627 1.00 53.23 C ATOM 1210 CD LYS A 162 3.732 -12.929 -26.772 1.00 14.41 C ATOM 1211 CE LYS A 162 3.114 -13.356 -28.095 1.00 61.10 C ATOM 1212 NZ LYS A 162 3.788 -14.558 -28.661 1.00 71.30 N1+ ATOM 0 H LYS A 162 6.243 -13.266 -23.141 1.00 74.31 H new ATOM 0 HA LYS A 162 4.296 -11.715 -24.342 1.00 0.03 H new ATOM 0 HB2 LYS A 162 5.262 -14.054 -24.927 1.00 22.24 H new ATOM 0 HB3 LYS A 162 4.041 -14.695 -23.846 1.00 22.24 H new ATOM 0 HG2 LYS A 162 3.068 -14.817 -25.995 1.00 53.23 H new ATOM 0 HG3 LYS A 162 2.309 -13.427 -25.244 1.00 53.23 H new ATOM 0 HD2 LYS A 162 3.474 -11.890 -26.567 1.00 14.41 H new ATOM 0 HD3 LYS A 162 4.819 -12.979 -26.843 1.00 14.41 H new ATOM 0 HE2 LYS A 162 2.055 -13.569 -27.949 1.00 61.10 H new ATOM 0 HE3 LYS A 162 3.179 -12.534 -28.808 1.00 61.10 H new ATOM 0 HZ1 LYS A 162 3.338 -14.817 -29.562 1.00 71.30 H new ATOM 0 HZ2 LYS A 162 4.793 -14.348 -28.824 1.00 71.30 H new ATOM 0 HZ3 LYS A 162 3.704 -15.350 -27.992 1.00 71.30 H new ATOM 1226 N ARG A 163 3.317 -13.053 -21.527 1.00 24.25 N ATOM 1227 CA ARG A 163 2.252 -13.057 -20.530 1.00 62.53 C ATOM 1228 C ARG A 163 2.623 -12.182 -19.335 1.00 54.45 C ATOM 1229 O ARG A 163 1.768 -11.825 -18.527 1.00 65.14 O ATOM 1230 CB ARG A 163 1.970 -14.485 -20.060 1.00 3.31 C ATOM 1231 CG ARG A 163 0.525 -14.718 -19.652 1.00 22.22 C ATOM 1232 CD ARG A 163 -0.320 -15.176 -20.831 1.00 13.20 C ATOM 1233 NE ARG A 163 -1.711 -15.408 -20.451 1.00 12.45 N ATOM 1234 CZ ARG A 163 -2.110 -16.443 -19.719 1.00 22.53 C ATOM 1235 NH1 ARG A 163 -1.227 -17.335 -19.291 1.00 24.04 N1+ ATOM 1236 NH2 ARG A 163 -3.393 -16.585 -19.415 1.00 20.22 N ATOM 0 H ARG A 163 4.183 -13.496 -21.221 1.00 24.25 H new ATOM 0 HA ARG A 163 1.353 -12.649 -20.993 1.00 62.53 H new ATOM 0 HB2 ARG A 163 2.229 -15.179 -20.859 1.00 3.31 H new ATOM 0 HB3 ARG A 163 2.619 -14.715 -19.215 1.00 3.31 H new ATOM 0 HG2 ARG A 163 0.485 -15.468 -18.862 1.00 22.22 H new ATOM 0 HG3 ARG A 163 0.109 -13.798 -19.240 1.00 22.22 H new ATOM 0 HD2 ARG A 163 -0.280 -14.424 -21.619 1.00 13.20 H new ATOM 0 HD3 ARG A 163 0.101 -16.093 -21.244 1.00 13.20 H new ATOM 0 HE ARG A 163 -2.415 -14.739 -20.764 1.00 12.45 H new ATOM 0 HH11 ARG A 163 -0.240 -17.227 -19.523 1.00 24.04 H new ATOM 0 HH12 ARG A 163 -1.535 -18.129 -18.729 1.00 24.04 H new ATOM 0 HH21 ARG A 163 -4.074 -15.900 -19.743 1.00 20.22 H new ATOM 0 HH22 ARG A 163 -3.699 -17.379 -18.853 1.00 20.22 H new ATOM 1250 N ASN A 164 3.904 -11.839 -19.234 1.00 34.44 N ATOM 1251 CA ASN A 164 4.387 -11.007 -18.139 1.00 31.41 C ATOM 1252 C ASN A 164 4.171 -11.696 -16.795 1.00 13.15 C ATOM 1253 O ASN A 164 3.665 -11.092 -15.850 1.00 31.11 O ATOM 1254 CB ASN A 164 3.677 -9.652 -18.150 1.00 35.43 C ATOM 1255 CG ASN A 164 4.593 -8.517 -17.733 1.00 23.04 C ATOM 1256 OD1 ASN A 164 4.657 -7.481 -18.396 1.00 72.53 O ATOM 1257 ND2 ASN A 164 5.309 -8.707 -16.631 1.00 42.42 N ATOM 0 H ASN A 164 4.625 -12.125 -19.897 1.00 34.44 H new ATOM 0 HA ASN A 164 5.457 -10.851 -18.279 1.00 31.41 H new ATOM 0 HB2 ASN A 164 3.291 -9.455 -19.150 1.00 35.43 H new ATOM 0 HB3 ASN A 164 2.819 -9.689 -17.479 1.00 35.43 H new ATOM 0 HD21 ASN A 164 5.943 -7.979 -16.303 1.00 42.42 H new ATOM 0 HD22 ASN A 164 5.225 -9.581 -16.112 1.00 42.42 H new ATOM 1264 N ASN A 165 4.560 -12.965 -16.718 1.00 24.24 N ATOM 1265 CA ASN A 165 4.408 -13.737 -15.490 1.00 24.21 C ATOM 1266 C ASN A 165 5.603 -14.663 -15.279 1.00 75.13 C ATOM 1267 O ASN A 165 6.274 -15.055 -16.234 1.00 12.32 O ATOM 1268 CB ASN A 165 3.117 -14.555 -15.532 1.00 52.22 C ATOM 1269 CG ASN A 165 3.282 -15.857 -16.292 1.00 64.44 C ATOM 1270 OD1 ASN A 165 3.759 -15.870 -17.427 1.00 33.43 O ATOM 1271 ND2 ASN A 165 2.885 -16.961 -15.668 1.00 51.05 N ATOM 0 H ASN A 165 4.982 -13.480 -17.491 1.00 24.24 H new ATOM 0 HA ASN A 165 4.359 -13.038 -14.655 1.00 24.21 H new ATOM 0 HB2 ASN A 165 2.793 -14.770 -14.514 1.00 52.22 H new ATOM 0 HB3 ASN A 165 2.330 -13.963 -15.998 1.00 52.22 H new ATOM 0 HD21 ASN A 165 2.970 -17.866 -16.130 1.00 51.05 H new ATOM 0 HD22 ASN A 165 2.495 -16.903 -14.727 1.00 51.05 H new ATOM 1278 N VAL A 166 5.862 -15.008 -14.022 1.00 14.54 N ATOM 1279 CA VAL A 166 6.975 -15.889 -13.685 1.00 71.02 C ATOM 1280 C VAL A 166 6.485 -17.301 -13.381 1.00 3.03 C ATOM 1281 O VAL A 166 5.412 -17.487 -12.805 1.00 35.01 O ATOM 1282 CB VAL A 166 7.763 -15.358 -12.473 1.00 45.01 C ATOM 1283 CG1 VAL A 166 8.222 -13.929 -12.718 1.00 21.30 C ATOM 1284 CG2 VAL A 166 6.921 -15.448 -11.209 1.00 20.03 C ATOM 0 H VAL A 166 5.317 -14.691 -13.220 1.00 14.54 H new ATOM 0 HA VAL A 166 7.633 -15.915 -14.553 1.00 71.02 H new ATOM 0 HB VAL A 166 8.648 -15.979 -12.337 1.00 45.01 H new ATOM 0 HG11 VAL A 166 8.777 -13.571 -11.851 1.00 21.30 H new ATOM 0 HG12 VAL A 166 8.865 -13.899 -13.598 1.00 21.30 H new ATOM 0 HG13 VAL A 166 7.354 -13.291 -12.881 1.00 21.30 H new ATOM 0 HG21 VAL A 166 7.494 -15.069 -10.363 1.00 20.03 H new ATOM 0 HG22 VAL A 166 6.016 -14.852 -11.331 1.00 20.03 H new ATOM 0 HG23 VAL A 166 6.649 -16.488 -11.026 1.00 20.03 H new ATOM 1294 N VAL A 167 7.279 -18.293 -13.770 1.00 13.11 N ATOM 1295 CA VAL A 167 6.928 -19.689 -13.537 1.00 13.14 C ATOM 1296 C VAL A 167 8.102 -20.460 -12.945 1.00 22.44 C ATOM 1297 O VAL A 167 9.220 -19.949 -12.870 1.00 43.21 O ATOM 1298 CB VAL A 167 6.479 -20.379 -14.839 1.00 34.31 C ATOM 1299 CG1 VAL A 167 5.190 -19.758 -15.357 1.00 72.33 C ATOM 1300 CG2 VAL A 167 7.577 -20.300 -15.889 1.00 20.40 C ATOM 0 H VAL A 167 8.170 -18.156 -14.248 1.00 13.11 H new ATOM 0 HA VAL A 167 6.100 -19.693 -12.828 1.00 13.14 H new ATOM 0 HB VAL A 167 6.287 -21.430 -14.624 1.00 34.31 H new ATOM 0 HG11 VAL A 167 4.889 -20.259 -16.277 1.00 72.33 H new ATOM 0 HG12 VAL A 167 4.405 -19.871 -14.609 1.00 72.33 H new ATOM 0 HG13 VAL A 167 5.351 -18.699 -15.556 1.00 72.33 H new ATOM 0 HG21 VAL A 167 7.243 -20.792 -16.802 1.00 20.40 H new ATOM 0 HG22 VAL A 167 7.803 -19.255 -16.102 1.00 20.40 H new ATOM 0 HG23 VAL A 167 8.473 -20.796 -15.516 1.00 20.40 H new ATOM 1310 N VAL A 168 7.842 -21.694 -12.525 1.00 51.55 N ATOM 1311 CA VAL A 168 8.877 -22.537 -11.941 1.00 64.01 C ATOM 1312 C VAL A 168 9.067 -23.814 -12.750 1.00 10.40 C ATOM 1313 O VAL A 168 8.155 -24.262 -13.446 1.00 41.54 O ATOM 1314 CB VAL A 168 8.541 -22.910 -10.485 1.00 22.31 C ATOM 1315 CG1 VAL A 168 8.567 -21.675 -9.597 1.00 30.42 C ATOM 1316 CG2 VAL A 168 7.189 -23.601 -10.411 1.00 74.30 C ATOM 0 H VAL A 168 6.922 -22.132 -12.579 1.00 51.55 H new ATOM 0 HA VAL A 168 9.802 -21.960 -11.957 1.00 64.01 H new ATOM 0 HB VAL A 168 9.299 -23.604 -10.122 1.00 22.31 H new ATOM 0 HG11 VAL A 168 8.327 -21.959 -8.572 1.00 30.42 H new ATOM 0 HG12 VAL A 168 9.560 -21.227 -9.626 1.00 30.42 H new ATOM 0 HG13 VAL A 168 7.832 -20.954 -9.955 1.00 30.42 H new ATOM 0 HG21 VAL A 168 6.968 -23.857 -9.375 1.00 74.30 H new ATOM 0 HG22 VAL A 168 6.417 -22.932 -10.792 1.00 74.30 H new ATOM 0 HG23 VAL A 168 7.211 -24.510 -11.013 1.00 74.30 H new ATOM 1326 N SER A 169 10.257 -24.398 -12.654 1.00 61.10 N ATOM 1327 CA SER A 169 10.569 -25.624 -13.380 1.00 42.35 C ATOM 1328 C SER A 169 10.737 -26.797 -12.419 1.00 41.01 C ATOM 1329 O SER A 169 11.148 -26.619 -11.273 1.00 55.21 O ATOM 1330 CB SER A 169 11.843 -25.441 -14.208 1.00 11.22 C ATOM 1331 OG SER A 169 12.649 -24.402 -13.681 1.00 62.55 O ATOM 0 H SER A 169 11.021 -24.042 -12.080 1.00 61.10 H new ATOM 0 HA SER A 169 9.737 -25.842 -14.050 1.00 42.35 H new ATOM 0 HB2 SER A 169 12.408 -26.373 -14.222 1.00 11.22 H new ATOM 0 HB3 SER A 169 11.580 -25.213 -15.241 1.00 11.22 H new ATOM 0 HG SER A 169 13.524 -24.763 -13.427 1.00 62.55 H new ATOM 1337 N ARG A 170 10.417 -27.995 -12.896 1.00 13.32 N ATOM 1338 CA ARG A 170 10.531 -29.198 -12.080 1.00 64.45 C ATOM 1339 C ARG A 170 11.965 -29.717 -12.075 1.00 32.44 C ATOM 1340 O ARG A 170 12.268 -30.729 -11.442 1.00 71.21 O ATOM 1341 CB ARG A 170 9.586 -30.283 -12.600 1.00 3.01 C ATOM 1342 CG ARG A 170 9.815 -30.643 -14.058 1.00 21.22 C ATOM 1343 CD ARG A 170 9.531 -32.114 -14.321 1.00 64.43 C ATOM 1344 NE ARG A 170 9.831 -32.492 -15.698 1.00 33.33 N ATOM 1345 CZ ARG A 170 9.898 -33.751 -16.117 1.00 12.34 C ATOM 1346 NH1 ARG A 170 9.686 -34.748 -15.268 1.00 3.35 N1+ ATOM 1347 NH2 ARG A 170 10.177 -34.016 -17.386 1.00 44.41 N ATOM 0 H ARG A 170 10.077 -28.159 -13.843 1.00 13.32 H new ATOM 0 HA ARG A 170 10.252 -28.942 -11.058 1.00 64.45 H new ATOM 0 HB2 ARG A 170 9.705 -31.179 -11.991 1.00 3.01 H new ATOM 0 HB3 ARG A 170 8.557 -29.947 -12.475 1.00 3.01 H new ATOM 0 HG2 ARG A 170 9.174 -30.029 -14.690 1.00 21.22 H new ATOM 0 HG3 ARG A 170 10.845 -30.416 -14.332 1.00 21.22 H new ATOM 0 HD2 ARG A 170 10.124 -32.725 -13.640 1.00 64.43 H new ATOM 0 HD3 ARG A 170 8.483 -32.325 -14.108 1.00 64.43 H new ATOM 0 HE ARG A 170 9.998 -31.749 -16.376 1.00 33.33 H new ATOM 0 HH11 ARG A 170 9.471 -34.549 -14.291 1.00 3.35 H new ATOM 0 HH12 ARG A 170 9.738 -35.714 -15.592 1.00 3.35 H new ATOM 0 HH21 ARG A 170 10.341 -33.253 -18.042 1.00 44.41 H new ATOM 0 HH22 ARG A 170 10.228 -34.983 -17.706 1.00 44.41 H new ATOM 1361 N ARG A 171 12.845 -29.017 -12.784 1.00 61.43 N ATOM 1362 CA ARG A 171 14.248 -29.408 -12.862 1.00 54.13 C ATOM 1363 C ARG A 171 15.009 -28.951 -11.622 1.00 41.13 C ATOM 1364 O ARG A 171 15.589 -29.763 -10.903 1.00 64.11 O ATOM 1365 CB ARG A 171 14.894 -28.820 -14.118 1.00 13.15 C ATOM 1366 CG ARG A 171 16.042 -29.655 -14.660 1.00 24.35 C ATOM 1367 CD ARG A 171 17.371 -29.240 -14.047 1.00 42.03 C ATOM 1368 NE ARG A 171 18.484 -30.027 -14.571 1.00 64.34 N ATOM 1369 CZ ARG A 171 18.762 -31.264 -14.172 1.00 51.24 C ATOM 1370 NH1 ARG A 171 18.010 -31.851 -13.251 1.00 23.41 N1+ ATOM 1371 NH2 ARG A 171 19.793 -31.915 -14.697 1.00 34.32 N ATOM 0 H ARG A 171 12.611 -28.176 -13.313 1.00 61.43 H new ATOM 0 HA ARG A 171 14.294 -30.496 -12.914 1.00 54.13 H new ATOM 0 HB2 ARG A 171 14.134 -28.716 -14.893 1.00 13.15 H new ATOM 0 HB3 ARG A 171 15.259 -27.818 -13.893 1.00 13.15 H new ATOM 0 HG2 ARG A 171 15.857 -30.709 -14.451 1.00 24.35 H new ATOM 0 HG3 ARG A 171 16.091 -29.548 -15.744 1.00 24.35 H new ATOM 0 HD2 ARG A 171 17.548 -28.183 -14.247 1.00 42.03 H new ATOM 0 HD3 ARG A 171 17.323 -29.356 -12.964 1.00 42.03 H new ATOM 0 HE ARG A 171 19.081 -29.604 -15.282 1.00 64.34 H new ATOM 0 HH11 ARG A 171 17.216 -31.353 -12.847 1.00 23.41 H new ATOM 0 HH12 ARG A 171 18.225 -32.800 -12.946 1.00 23.41 H new ATOM 0 HH21 ARG A 171 20.372 -31.466 -15.407 1.00 34.32 H new ATOM 0 HH22 ARG A 171 20.006 -32.864 -14.391 1.00 34.32 H new ATOM 1385 N ALA A 172 15.004 -27.645 -11.379 1.00 63.40 N ATOM 1386 CA ALA A 172 15.693 -27.079 -10.225 1.00 2.13 C ATOM 1387 C ALA A 172 14.827 -27.165 -8.973 1.00 45.02 C ATOM 1388 O ALA A 172 15.282 -26.858 -7.870 1.00 44.21 O ATOM 1389 CB ALA A 172 16.084 -25.634 -10.501 1.00 62.22 C ATOM 0 H ALA A 172 14.530 -26.958 -11.966 1.00 63.40 H new ATOM 0 HA ALA A 172 16.597 -27.662 -10.050 1.00 2.13 H new ATOM 0 HB1 ALA A 172 16.597 -25.224 -9.632 1.00 62.22 H new ATOM 0 HB2 ALA A 172 16.747 -25.595 -11.366 1.00 62.22 H new ATOM 0 HB3 ALA A 172 15.188 -25.047 -10.704 1.00 62.22 H new ATOM 1395 N VAL A 173 13.578 -27.581 -9.150 1.00 4.21 N ATOM 1396 CA VAL A 173 12.649 -27.707 -8.033 1.00 11.43 C ATOM 1397 C VAL A 173 13.263 -28.516 -6.896 1.00 14.32 C ATOM 1398 O VAL A 173 12.918 -28.326 -5.729 1.00 63.23 O ATOM 1399 CB VAL A 173 11.333 -28.375 -8.471 1.00 61.53 C ATOM 1400 CG1 VAL A 173 11.558 -29.846 -8.786 1.00 60.30 C ATOM 1401 CG2 VAL A 173 10.268 -28.209 -7.397 1.00 52.12 C ATOM 0 H VAL A 173 13.185 -27.837 -10.056 1.00 4.21 H new ATOM 0 HA VAL A 173 12.436 -26.697 -7.683 1.00 11.43 H new ATOM 0 HB VAL A 173 10.982 -27.884 -9.379 1.00 61.53 H new ATOM 0 HG11 VAL A 173 10.616 -30.300 -9.094 1.00 60.30 H new ATOM 0 HG12 VAL A 173 12.286 -29.938 -9.592 1.00 60.30 H new ATOM 0 HG13 VAL A 173 11.933 -30.355 -7.898 1.00 60.30 H new ATOM 0 HG21 VAL A 173 9.344 -28.687 -7.723 1.00 52.12 H new ATOM 0 HG22 VAL A 173 10.609 -28.673 -6.471 1.00 52.12 H new ATOM 0 HG23 VAL A 173 10.086 -27.148 -7.226 1.00 52.12 H new ATOM 1411 N ILE A 174 14.174 -29.419 -7.245 1.00 53.34 N ATOM 1412 CA ILE A 174 14.837 -30.256 -6.253 1.00 61.21 C ATOM 1413 C ILE A 174 15.398 -29.415 -5.111 1.00 61.34 C ATOM 1414 O ILE A 174 15.475 -29.873 -3.971 1.00 73.44 O ATOM 1415 CB ILE A 174 15.979 -31.075 -6.882 1.00 31.14 C ATOM 1416 CG1 ILE A 174 16.957 -30.152 -7.612 1.00 21.44 C ATOM 1417 CG2 ILE A 174 15.419 -32.122 -7.832 1.00 1.52 C ATOM 1418 CD1 ILE A 174 18.154 -30.875 -8.188 1.00 43.50 C ATOM 0 H ILE A 174 14.469 -29.589 -8.206 1.00 53.34 H new ATOM 0 HA ILE A 174 14.084 -30.939 -5.861 1.00 61.21 H new ATOM 0 HB ILE A 174 16.519 -31.588 -6.086 1.00 31.14 H new ATOM 0 HG12 ILE A 174 16.429 -29.641 -8.417 1.00 21.44 H new ATOM 0 HG13 ILE A 174 17.304 -29.384 -6.921 1.00 21.44 H new ATOM 0 HG21 ILE A 174 16.239 -32.693 -8.269 1.00 1.52 H new ATOM 0 HG22 ILE A 174 14.760 -32.795 -7.284 1.00 1.52 H new ATOM 0 HG23 ILE A 174 14.857 -31.630 -8.625 1.00 1.52 H new ATOM 0 HD11 ILE A 174 18.804 -30.159 -8.691 1.00 43.50 H new ATOM 0 HD12 ILE A 174 18.705 -31.364 -7.385 1.00 43.50 H new ATOM 0 HD13 ILE A 174 17.817 -31.624 -8.904 1.00 43.50 H new ATOM 1430 N GLU A 175 15.787 -28.184 -5.425 1.00 41.14 N ATOM 1431 CA GLU A 175 16.340 -27.280 -4.424 1.00 41.22 C ATOM 1432 C GLU A 175 15.387 -27.127 -3.242 1.00 41.13 C ATOM 1433 O GLU A 175 15.801 -27.188 -2.084 1.00 64.54 O ATOM 1434 CB GLU A 175 16.625 -25.909 -5.044 1.00 45.13 C ATOM 1435 CG GLU A 175 17.662 -25.947 -6.154 1.00 52.34 C ATOM 1436 CD GLU A 175 19.079 -25.812 -5.633 1.00 64.43 C ATOM 1437 OE1 GLU A 175 19.498 -26.665 -4.823 1.00 13.32 O1- ATOM 1438 OE2 GLU A 175 19.770 -24.852 -6.035 1.00 72.13 O ATOM 0 H GLU A 175 15.730 -27.790 -6.364 1.00 41.14 H new ATOM 0 HA GLU A 175 17.274 -27.709 -4.062 1.00 41.22 H new ATOM 0 HB2 GLU A 175 15.696 -25.498 -5.440 1.00 45.13 H new ATOM 0 HB3 GLU A 175 16.966 -25.230 -4.263 1.00 45.13 H new ATOM 0 HG2 GLU A 175 17.568 -26.885 -6.702 1.00 52.34 H new ATOM 0 HG3 GLU A 175 17.461 -25.143 -6.862 1.00 52.34 H new ATOM 1445 N SER A 176 14.107 -26.928 -3.543 1.00 33.30 N ATOM 1446 CA SER A 176 13.095 -26.763 -2.507 1.00 74.04 C ATOM 1447 C SER A 176 13.172 -27.893 -1.486 1.00 63.41 C ATOM 1448 O SER A 176 13.101 -27.661 -0.280 1.00 54.23 O ATOM 1449 CB SER A 176 11.698 -26.718 -3.131 1.00 15.31 C ATOM 1450 OG SER A 176 11.173 -28.023 -3.299 1.00 72.12 O ATOM 0 H SER A 176 13.747 -26.877 -4.496 1.00 33.30 H new ATOM 0 HA SER A 176 13.287 -25.821 -1.994 1.00 74.04 H new ATOM 0 HB2 SER A 176 11.032 -26.133 -2.497 1.00 15.31 H new ATOM 0 HB3 SER A 176 11.743 -26.214 -4.096 1.00 15.31 H new ATOM 0 HG SER A 176 11.590 -28.445 -4.079 1.00 72.12 H new ATOM 1456 N GLU A 177 13.319 -29.119 -1.981 1.00 54.35 N ATOM 1457 CA GLU A 177 13.405 -30.287 -1.111 1.00 44.40 C ATOM 1458 C GLU A 177 14.658 -30.227 -0.241 1.00 62.41 C ATOM 1459 O GLU A 177 14.588 -30.379 0.977 1.00 45.33 O ATOM 1460 CB GLU A 177 13.411 -31.570 -1.944 1.00 54.14 C ATOM 1461 CG GLU A 177 12.087 -31.854 -2.634 1.00 45.50 C ATOM 1462 CD GLU A 177 11.890 -33.327 -2.937 1.00 30.24 C ATOM 1463 OE1 GLU A 177 12.413 -34.165 -2.173 1.00 54.53 O1- ATOM 1464 OE2 GLU A 177 11.213 -33.641 -3.939 1.00 1.22 O ATOM 0 H GLU A 177 13.381 -29.329 -2.977 1.00 54.35 H new ATOM 0 HA GLU A 177 12.531 -30.288 -0.459 1.00 44.40 H new ATOM 0 HB2 GLU A 177 14.196 -31.501 -2.697 1.00 54.14 H new ATOM 0 HB3 GLU A 177 13.662 -32.411 -1.298 1.00 54.14 H new ATOM 0 HG2 GLU A 177 11.270 -31.505 -2.002 1.00 45.50 H new ATOM 0 HG3 GLU A 177 12.037 -31.286 -3.563 1.00 45.50 H new ATOM 1471 N ASN A 178 15.803 -30.003 -0.879 1.00 31.53 N ATOM 1472 CA ASN A 178 17.072 -29.924 -0.164 1.00 54.34 C ATOM 1473 C ASN A 178 17.302 -28.517 0.380 1.00 61.14 C ATOM 1474 O ASN A 178 18.332 -27.899 0.114 1.00 23.32 O ATOM 1475 CB ASN A 178 18.226 -30.321 -1.086 1.00 24.22 C ATOM 1476 CG ASN A 178 19.498 -30.632 -0.320 1.00 53.15 C ATOM 1477 OD1 ASN A 178 19.552 -31.589 0.451 1.00 22.43 O ATOM 1478 ND2 ASN A 178 20.528 -29.821 -0.531 1.00 41.11 N ATOM 0 H ASN A 178 15.878 -29.873 -1.888 1.00 31.53 H new ATOM 0 HA ASN A 178 17.032 -30.618 0.676 1.00 54.34 H new ATOM 0 HB2 ASN A 178 17.936 -31.193 -1.672 1.00 24.22 H new ATOM 0 HB3 ASN A 178 18.418 -29.513 -1.791 1.00 24.22 H new ATOM 0 HD21 ASN A 178 21.410 -29.980 -0.044 1.00 41.11 H new ATOM 0 HD22 ASN A 178 20.437 -29.039 -1.180 1.00 41.11 H new ATOM 1485 N SER A 179 16.336 -28.020 1.147 1.00 21.43 N ATOM 1486 CA SER A 179 16.432 -26.685 1.727 1.00 15.51 C ATOM 1487 C SER A 179 15.190 -26.362 2.552 1.00 64.24 C ATOM 1488 O SER A 179 14.071 -26.690 2.163 1.00 71.22 O ATOM 1489 CB SER A 179 16.613 -25.639 0.625 1.00 21.23 C ATOM 1490 OG SER A 179 17.678 -24.756 0.931 1.00 74.50 O ATOM 0 H SER A 179 15.479 -28.521 1.381 1.00 21.43 H new ATOM 0 HA SER A 179 17.301 -26.662 2.385 1.00 15.51 H new ATOM 0 HB2 SER A 179 16.810 -26.137 -0.324 1.00 21.23 H new ATOM 0 HB3 SER A 179 15.690 -25.072 0.502 1.00 21.23 H new ATOM 0 HG SER A 179 17.775 -24.098 0.211 1.00 74.50 H new