USER MOD reduce.3.24.130724 H: found=0, std=0, add=713, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 711 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 41 THR OG1 : rot -77:sc= 0.498 USER MOD Set 1.2: A 48 GLN : amide:sc= -1.32 K(o=-0.82,f=-1.5!) USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 66:sc= 0.111 USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 17 GLN : amide:sc= -0.508 X(o=-0.51,f=-0.56) USER MOD Single : A 19 TYR OH : rot 180:sc= -0.374 USER MOD Single : A 20 SER OG : rot 40:sc= 0.143 USER MOD Single : A 22 THR OG1 : rot 180:sc= 0 USER MOD Single : A 23 THR OG1 : rot 180:sc= 0 USER MOD Single : A 25 SER OG : rot 180:sc= 0 USER MOD Single : A 29 THR OG1 : rot 180:sc= 0.0815 USER MOD Single : A 34 LYS NZ :NH3+ 140:sc= -3.04! (180deg=-6.45!) USER MOD Single : A 35 GLN : amide:sc= -0.145 K(o=-0.15,f=-2.1!) USER MOD Single : A 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 THR OG1 : rot 180:sc= 0 USER MOD Single : A 49 LYS NZ :NH3+ -166:sc= -7.77! (180deg=-9.79!) USER MOD Single : A 54 LYS NZ :NH3+ -178:sc= -0.237 (180deg=-0.243) USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 62 ASN : amide:sc=-0.00953 K(o=-0.0095,f=-1.2) USER MOD Single : A 65 LYS NZ :NH3+ -153:sc= 0 (180deg=-0.232) USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 ASN : amide:sc= -5.24! C(o=-5.2!,f=-7.7!) USER MOD Single : A 75 THR OG1 : rot 124:sc= 1.01 USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 79 MET CE :methyl -161:sc= -2.67 (180deg=-4.09!) USER MOD Single : A 80 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 82 THR OG1 : rot 110:sc= -0.484 USER MOD Single : A 85 SER OG : rot 180:sc= 0 USER MOD Single : A 88 SER OG : rot 180:sc= 0 USER MOD Single : A 89 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 27.421 14.995 -7.420 1.00 0.00 N ATOM 2 CA GLY A 1 27.538 13.858 -6.522 1.00 0.00 C ATOM 3 C GLY A 1 26.241 13.047 -6.493 1.00 0.00 C ATOM 4 O GLY A 1 26.230 11.873 -6.859 1.00 0.00 O ATOM 0 H1 GLY A 1 28.313 15.529 -7.422 1.00 0.00 H new ATOM 0 H2 GLY A 1 27.217 14.658 -8.382 1.00 0.00 H new ATOM 0 H3 GLY A 1 26.649 15.613 -7.099 1.00 0.00 H new ATOM 0 HA2 GLY A 1 28.363 13.221 -6.842 1.00 0.00 H new ATOM 0 HA3 GLY A 1 27.776 14.207 -5.517 1.00 0.00 H new ATOM 8 N SER A 2 25.178 13.706 -6.054 1.00 0.00 N ATOM 9 CA SER A 2 23.879 13.061 -5.973 1.00 0.00 C ATOM 10 C SER A 2 22.953 13.609 -7.060 1.00 0.00 C ATOM 11 O SER A 2 22.897 14.818 -7.281 1.00 0.00 O ATOM 12 CB SER A 2 23.251 13.259 -4.591 1.00 0.00 C ATOM 13 OG SER A 2 24.153 12.921 -3.542 1.00 0.00 O ATOM 0 H SER A 2 25.190 14.680 -5.751 1.00 0.00 H new ATOM 0 HA SER A 2 24.018 11.991 -6.129 1.00 0.00 H new ATOM 0 HB2 SER A 2 22.939 14.297 -4.480 1.00 0.00 H new ATOM 0 HB3 SER A 2 22.354 12.646 -4.509 1.00 0.00 H new ATOM 0 HG SER A 2 23.716 13.062 -2.676 1.00 0.00 H new ATOM 19 N SER A 3 22.249 12.694 -7.710 1.00 0.00 N ATOM 20 CA SER A 3 21.329 13.071 -8.769 1.00 0.00 C ATOM 21 C SER A 3 19.902 12.666 -8.392 1.00 0.00 C ATOM 22 O SER A 3 19.012 13.511 -8.318 1.00 0.00 O ATOM 23 CB SER A 3 21.728 12.431 -10.100 1.00 0.00 C ATOM 24 OG SER A 3 21.820 13.392 -11.149 1.00 0.00 O ATOM 0 H SER A 3 22.297 11.692 -7.524 1.00 0.00 H new ATOM 0 HA SER A 3 21.373 14.153 -8.890 1.00 0.00 H new ATOM 0 HB2 SER A 3 22.687 11.926 -9.986 1.00 0.00 H new ATOM 0 HB3 SER A 3 20.997 11.669 -10.370 1.00 0.00 H new ATOM 0 HG SER A 3 22.079 12.944 -11.981 1.00 0.00 H new ATOM 30 N GLY A 4 19.730 11.372 -8.163 1.00 0.00 N ATOM 31 CA GLY A 4 18.428 10.844 -7.795 1.00 0.00 C ATOM 32 C GLY A 4 18.017 11.319 -6.400 1.00 0.00 C ATOM 33 O GLY A 4 18.308 12.451 -6.015 1.00 0.00 O ATOM 0 H GLY A 4 20.471 10.674 -8.225 1.00 0.00 H new ATOM 0 HA2 GLY A 4 17.683 11.162 -8.525 1.00 0.00 H new ATOM 0 HA3 GLY A 4 18.454 9.755 -7.819 1.00 0.00 H new ATOM 37 N SER A 5 17.348 10.431 -5.680 1.00 0.00 N ATOM 38 CA SER A 5 16.895 10.746 -4.336 1.00 0.00 C ATOM 39 C SER A 5 15.919 11.924 -4.375 1.00 0.00 C ATOM 40 O SER A 5 16.317 13.070 -4.172 1.00 0.00 O ATOM 41 CB SER A 5 18.076 11.064 -3.417 1.00 0.00 C ATOM 42 OG SER A 5 17.660 11.295 -2.074 1.00 0.00 O ATOM 0 H SER A 5 17.109 9.493 -6.002 1.00 0.00 H new ATOM 0 HA SER A 5 16.383 9.872 -3.934 1.00 0.00 H new ATOM 0 HB2 SER A 5 18.786 10.237 -3.440 1.00 0.00 H new ATOM 0 HB3 SER A 5 18.600 11.944 -3.791 1.00 0.00 H new ATOM 0 HG SER A 5 18.443 11.493 -1.519 1.00 0.00 H new ATOM 48 N SER A 6 14.662 11.601 -4.637 1.00 0.00 N ATOM 49 CA SER A 6 13.626 12.618 -4.705 1.00 0.00 C ATOM 50 C SER A 6 12.298 11.986 -5.126 1.00 0.00 C ATOM 51 O SER A 6 12.000 11.894 -6.315 1.00 0.00 O ATOM 52 CB SER A 6 14.014 13.734 -5.676 1.00 0.00 C ATOM 53 OG SER A 6 14.260 14.966 -5.003 1.00 0.00 O ATOM 0 H SER A 6 14.337 10.649 -4.805 1.00 0.00 H new ATOM 0 HA SER A 6 13.513 13.058 -3.714 1.00 0.00 H new ATOM 0 HB2 SER A 6 14.905 13.439 -6.230 1.00 0.00 H new ATOM 0 HB3 SER A 6 13.217 13.873 -6.406 1.00 0.00 H new ATOM 0 HG SER A 6 15.050 14.874 -4.431 1.00 0.00 H new ATOM 59 N GLY A 7 11.536 11.566 -4.126 1.00 0.00 N ATOM 60 CA GLY A 7 10.247 10.946 -4.378 1.00 0.00 C ATOM 61 C GLY A 7 9.515 10.651 -3.067 1.00 0.00 C ATOM 62 O GLY A 7 9.855 11.206 -2.023 1.00 0.00 O ATOM 0 H GLY A 7 11.787 11.643 -3.140 1.00 0.00 H new ATOM 0 HA2 GLY A 7 9.638 11.604 -4.999 1.00 0.00 H new ATOM 0 HA3 GLY A 7 10.387 10.021 -4.936 1.00 0.00 H new ATOM 66 N LEU A 8 8.524 9.777 -3.163 1.00 0.00 N ATOM 67 CA LEU A 8 7.741 9.402 -1.998 1.00 0.00 C ATOM 68 C LEU A 8 7.772 7.881 -1.836 1.00 0.00 C ATOM 69 O LEU A 8 7.009 7.168 -2.485 1.00 0.00 O ATOM 70 CB LEU A 8 6.328 9.981 -2.092 1.00 0.00 C ATOM 71 CG LEU A 8 5.445 9.800 -0.856 1.00 0.00 C ATOM 72 CD1 LEU A 8 4.835 11.133 -0.419 1.00 0.00 C ATOM 73 CD2 LEU A 8 4.376 8.732 -1.097 1.00 0.00 C ATOM 0 H LEU A 8 8.245 9.318 -4.030 1.00 0.00 H new ATOM 0 HA LEU A 8 8.176 9.829 -1.094 1.00 0.00 H new ATOM 0 HB2 LEU A 8 6.407 11.047 -2.304 1.00 0.00 H new ATOM 0 HB3 LEU A 8 5.825 9.523 -2.944 1.00 0.00 H new ATOM 0 HG LEU A 8 6.072 9.448 -0.037 1.00 0.00 H new ATOM 0 HD11 LEU A 8 4.212 10.977 0.461 1.00 0.00 H new ATOM 0 HD12 LEU A 8 5.632 11.837 -0.179 1.00 0.00 H new ATOM 0 HD13 LEU A 8 4.226 11.537 -1.228 1.00 0.00 H new ATOM 0 HD21 LEU A 8 3.762 8.623 -0.203 1.00 0.00 H new ATOM 0 HD22 LEU A 8 3.746 9.030 -1.935 1.00 0.00 H new ATOM 0 HD23 LEU A 8 4.857 7.781 -1.325 1.00 0.00 H new ATOM 85 N PRO A 9 8.688 7.417 -0.943 1.00 0.00 N ATOM 86 CA PRO A 9 8.829 5.993 -0.688 1.00 0.00 C ATOM 87 C PRO A 9 7.675 5.473 0.172 1.00 0.00 C ATOM 88 O PRO A 9 7.173 6.186 1.040 1.00 0.00 O ATOM 89 CB PRO A 9 10.184 5.847 -0.015 1.00 0.00 C ATOM 90 CG PRO A 9 10.545 7.230 0.500 1.00 0.00 C ATOM 91 CD PRO A 9 9.609 8.231 -0.156 1.00 0.00 C ATOM 0 HA PRO A 9 8.785 5.396 -1.599 1.00 0.00 H new ATOM 0 HB2 PRO A 9 10.139 5.126 0.801 1.00 0.00 H new ATOM 0 HB3 PRO A 9 10.933 5.485 -0.719 1.00 0.00 H new ATOM 0 HG2 PRO A 9 10.448 7.271 1.585 1.00 0.00 H new ATOM 0 HG3 PRO A 9 11.583 7.466 0.264 1.00 0.00 H new ATOM 0 HD2 PRO A 9 9.077 8.823 0.589 1.00 0.00 H new ATOM 0 HD3 PRO A 9 10.157 8.931 -0.787 1.00 0.00 H new ATOM 99 N ILE A 10 7.288 4.235 -0.099 1.00 0.00 N ATOM 100 CA ILE A 10 6.203 3.612 0.640 1.00 0.00 C ATOM 101 C ILE A 10 6.590 2.173 0.989 1.00 0.00 C ATOM 102 O ILE A 10 6.705 1.325 0.106 1.00 0.00 O ATOM 103 CB ILE A 10 4.892 3.723 -0.140 1.00 0.00 C ATOM 104 CG1 ILE A 10 4.498 5.188 -0.344 1.00 0.00 C ATOM 105 CG2 ILE A 10 3.780 2.920 0.539 1.00 0.00 C ATOM 106 CD1 ILE A 10 3.248 5.302 -1.219 1.00 0.00 C ATOM 0 H ILE A 10 7.706 3.647 -0.820 1.00 0.00 H new ATOM 0 HA ILE A 10 6.033 4.135 1.581 1.00 0.00 H new ATOM 0 HB ILE A 10 5.045 3.289 -1.128 1.00 0.00 H new ATOM 0 HG12 ILE A 10 4.314 5.657 0.623 1.00 0.00 H new ATOM 0 HG13 ILE A 10 5.322 5.729 -0.809 1.00 0.00 H new ATOM 0 HG21 ILE A 10 2.859 3.016 -0.036 1.00 0.00 H new ATOM 0 HG22 ILE A 10 4.068 1.870 0.590 1.00 0.00 H new ATOM 0 HG23 ILE A 10 3.620 3.301 1.547 1.00 0.00 H new ATOM 0 HD11 ILE A 10 2.989 6.353 -1.349 1.00 0.00 H new ATOM 0 HD12 ILE A 10 3.444 4.854 -2.193 1.00 0.00 H new ATOM 0 HD13 ILE A 10 2.419 4.781 -0.740 1.00 0.00 H new ATOM 118 N ILE A 11 6.781 1.943 2.280 1.00 0.00 N ATOM 119 CA ILE A 11 7.152 0.622 2.757 1.00 0.00 C ATOM 120 C ILE A 11 5.888 -0.160 3.118 1.00 0.00 C ATOM 121 O ILE A 11 4.972 0.383 3.733 1.00 0.00 O ATOM 122 CB ILE A 11 8.157 0.730 3.907 1.00 0.00 C ATOM 123 CG1 ILE A 11 9.422 1.467 3.461 1.00 0.00 C ATOM 124 CG2 ILE A 11 8.472 -0.648 4.492 1.00 0.00 C ATOM 125 CD1 ILE A 11 10.367 1.696 4.642 1.00 0.00 C ATOM 0 H ILE A 11 6.686 2.649 3.010 1.00 0.00 H new ATOM 0 HA ILE A 11 7.660 0.063 1.971 1.00 0.00 H new ATOM 0 HB ILE A 11 7.704 1.321 4.703 1.00 0.00 H new ATOM 0 HG12 ILE A 11 9.931 0.889 2.690 1.00 0.00 H new ATOM 0 HG13 ILE A 11 9.152 2.424 3.016 1.00 0.00 H new ATOM 0 HG21 ILE A 11 9.188 -0.542 5.307 1.00 0.00 H new ATOM 0 HG22 ILE A 11 7.556 -1.101 4.871 1.00 0.00 H new ATOM 0 HG23 ILE A 11 8.897 -1.284 3.716 1.00 0.00 H new ATOM 0 HD11 ILE A 11 11.258 2.221 4.298 1.00 0.00 H new ATOM 0 HD12 ILE A 11 9.863 2.295 5.401 1.00 0.00 H new ATOM 0 HD13 ILE A 11 10.654 0.735 5.070 1.00 0.00 H new ATOM 137 N VAL A 12 5.878 -1.423 2.719 1.00 0.00 N ATOM 138 CA VAL A 12 4.741 -2.286 2.992 1.00 0.00 C ATOM 139 C VAL A 12 5.215 -3.519 3.763 1.00 0.00 C ATOM 140 O VAL A 12 6.261 -4.086 3.451 1.00 0.00 O ATOM 141 CB VAL A 12 4.024 -2.636 1.686 1.00 0.00 C ATOM 142 CG1 VAL A 12 2.625 -3.192 1.961 1.00 0.00 C ATOM 143 CG2 VAL A 12 3.958 -1.424 0.755 1.00 0.00 C ATOM 0 H VAL A 12 6.640 -1.870 2.208 1.00 0.00 H new ATOM 0 HA VAL A 12 4.013 -1.771 3.619 1.00 0.00 H new ATOM 0 HB VAL A 12 4.601 -3.413 1.185 1.00 0.00 H new ATOM 0 HG11 VAL A 12 2.137 -3.433 1.017 1.00 0.00 H new ATOM 0 HG12 VAL A 12 2.705 -4.094 2.568 1.00 0.00 H new ATOM 0 HG13 VAL A 12 2.035 -2.446 2.494 1.00 0.00 H new ATOM 0 HG21 VAL A 12 3.444 -1.700 -0.166 1.00 0.00 H new ATOM 0 HG22 VAL A 12 3.415 -0.617 1.246 1.00 0.00 H new ATOM 0 HG23 VAL A 12 4.969 -1.090 0.520 1.00 0.00 H new ATOM 153 N LYS A 13 4.422 -3.899 4.754 1.00 0.00 N ATOM 154 CA LYS A 13 4.748 -5.055 5.572 1.00 0.00 C ATOM 155 C LYS A 13 3.674 -6.128 5.381 1.00 0.00 C ATOM 156 O LYS A 13 2.556 -5.987 5.874 1.00 0.00 O ATOM 157 CB LYS A 13 4.950 -4.640 7.031 1.00 0.00 C ATOM 158 CG LYS A 13 6.288 -3.921 7.216 1.00 0.00 C ATOM 159 CD LYS A 13 6.667 -3.842 8.697 1.00 0.00 C ATOM 160 CE LYS A 13 7.307 -5.149 9.170 1.00 0.00 C ATOM 161 NZ LYS A 13 7.589 -5.092 10.621 1.00 0.00 N ATOM 0 H LYS A 13 3.555 -3.427 5.009 1.00 0.00 H new ATOM 0 HA LYS A 13 5.695 -5.491 5.255 1.00 0.00 H new ATOM 0 HB2 LYS A 13 4.136 -3.986 7.343 1.00 0.00 H new ATOM 0 HB3 LYS A 13 4.915 -5.521 7.672 1.00 0.00 H new ATOM 0 HG2 LYS A 13 7.067 -4.447 6.665 1.00 0.00 H new ATOM 0 HG3 LYS A 13 6.226 -2.916 6.799 1.00 0.00 H new ATOM 0 HD2 LYS A 13 7.360 -3.016 8.855 1.00 0.00 H new ATOM 0 HD3 LYS A 13 5.779 -3.632 9.293 1.00 0.00 H new ATOM 0 HE2 LYS A 13 6.642 -5.985 8.955 1.00 0.00 H new ATOM 0 HE3 LYS A 13 8.231 -5.328 8.621 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 8.023 -5.987 10.926 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 8.241 -4.306 10.817 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 6.701 -4.943 11.142 1.00 0.00 H new ATOM 175 N TRP A 14 4.052 -7.177 4.665 1.00 0.00 N ATOM 176 CA TRP A 14 3.136 -8.273 4.403 1.00 0.00 C ATOM 177 C TRP A 14 3.579 -9.472 5.244 1.00 0.00 C ATOM 178 O TRP A 14 4.591 -10.104 4.946 1.00 0.00 O ATOM 179 CB TRP A 14 3.068 -8.586 2.907 1.00 0.00 C ATOM 180 CG TRP A 14 2.132 -9.744 2.554 1.00 0.00 C ATOM 181 CD1 TRP A 14 1.065 -10.180 3.238 1.00 0.00 C ATOM 182 CD2 TRP A 14 2.223 -10.601 1.397 1.00 0.00 C ATOM 183 NE1 TRP A 14 0.465 -11.251 2.609 1.00 0.00 N ATOM 184 CE2 TRP A 14 1.191 -11.516 1.454 1.00 0.00 C ATOM 185 CE3 TRP A 14 3.147 -10.605 0.338 1.00 0.00 C ATOM 186 CZ2 TRP A 14 0.985 -12.500 0.480 1.00 0.00 C ATOM 187 CZ3 TRP A 14 2.928 -11.595 -0.627 1.00 0.00 C ATOM 188 CH2 TRP A 14 1.893 -12.523 -0.585 1.00 0.00 C ATOM 0 H TRP A 14 4.981 -7.291 4.258 1.00 0.00 H new ATOM 0 HA TRP A 14 2.120 -8.002 4.690 1.00 0.00 H new ATOM 0 HB2 TRP A 14 2.741 -7.693 2.374 1.00 0.00 H new ATOM 0 HB3 TRP A 14 4.071 -8.821 2.550 1.00 0.00 H new ATOM 0 HD1 TRP A 14 0.719 -9.747 4.165 1.00 0.00 H new ATOM 0 HE1 TRP A 14 -0.360 -11.756 2.932 1.00 0.00 H new ATOM 0 HE3 TRP A 14 3.962 -9.899 0.274 1.00 0.00 H new ATOM 0 HZ2 TRP A 14 0.169 -13.204 0.547 1.00 0.00 H new ATOM 0 HZ3 TRP A 14 3.611 -11.641 -1.463 1.00 0.00 H new ATOM 0 HH2 TRP A 14 1.790 -13.258 -1.370 1.00 0.00 H new ATOM 199 N GLY A 15 2.800 -9.748 6.280 1.00 0.00 N ATOM 200 CA GLY A 15 3.100 -10.859 7.167 1.00 0.00 C ATOM 201 C GLY A 15 4.496 -10.714 7.775 1.00 0.00 C ATOM 202 O GLY A 15 4.664 -10.065 8.806 1.00 0.00 O ATOM 0 H GLY A 15 1.962 -9.221 6.525 1.00 0.00 H new ATOM 0 HA2 GLY A 15 2.356 -10.905 7.962 1.00 0.00 H new ATOM 0 HA3 GLY A 15 3.035 -11.797 6.615 1.00 0.00 H new ATOM 206 N GLY A 16 5.463 -11.330 7.110 1.00 0.00 N ATOM 207 CA GLY A 16 6.840 -11.277 7.571 1.00 0.00 C ATOM 208 C GLY A 16 7.779 -10.834 6.448 1.00 0.00 C ATOM 209 O GLY A 16 8.956 -11.191 6.440 1.00 0.00 O ATOM 0 H GLY A 16 5.320 -11.868 6.256 1.00 0.00 H new ATOM 0 HA2 GLY A 16 6.920 -10.586 8.410 1.00 0.00 H new ATOM 0 HA3 GLY A 16 7.143 -12.258 7.937 1.00 0.00 H new ATOM 213 N GLN A 17 7.222 -10.063 5.525 1.00 0.00 N ATOM 214 CA GLN A 17 7.995 -9.567 4.399 1.00 0.00 C ATOM 215 C GLN A 17 7.818 -8.054 4.259 1.00 0.00 C ATOM 216 O GLN A 17 6.728 -7.529 4.483 1.00 0.00 O ATOM 217 CB GLN A 17 7.605 -10.287 3.107 1.00 0.00 C ATOM 218 CG GLN A 17 8.498 -11.506 2.866 1.00 0.00 C ATOM 219 CD GLN A 17 9.970 -11.097 2.777 1.00 0.00 C ATOM 220 OE1 GLN A 17 10.338 -10.150 2.102 1.00 0.00 O ATOM 221 NE2 GLN A 17 10.788 -11.863 3.494 1.00 0.00 N ATOM 0 H GLN A 17 6.245 -9.770 5.534 1.00 0.00 H new ATOM 0 HA GLN A 17 9.049 -9.774 4.587 1.00 0.00 H new ATOM 0 HB2 GLN A 17 6.563 -10.601 3.162 1.00 0.00 H new ATOM 0 HB3 GLN A 17 7.687 -9.600 2.265 1.00 0.00 H new ATOM 0 HG2 GLN A 17 8.365 -12.225 3.674 1.00 0.00 H new ATOM 0 HG3 GLN A 17 8.199 -12.004 1.944 1.00 0.00 H new ATOM 0 HE21 GLN A 17 10.413 -12.641 4.037 1.00 0.00 H new ATOM 0 HE22 GLN A 17 11.790 -11.673 3.501 1.00 0.00 H new ATOM 230 N GLU A 18 8.906 -7.394 3.888 1.00 0.00 N ATOM 231 CA GLU A 18 8.885 -5.952 3.715 1.00 0.00 C ATOM 232 C GLU A 18 9.095 -5.590 2.244 1.00 0.00 C ATOM 233 O GLU A 18 9.908 -6.209 1.559 1.00 0.00 O ATOM 234 CB GLU A 18 9.934 -5.278 4.601 1.00 0.00 C ATOM 235 CG GLU A 18 9.762 -5.688 6.065 1.00 0.00 C ATOM 236 CD GLU A 18 10.719 -4.908 6.969 1.00 0.00 C ATOM 237 OE1 GLU A 18 10.366 -3.759 7.311 1.00 0.00 O ATOM 238 OE2 GLU A 18 11.781 -5.479 7.298 1.00 0.00 O ATOM 0 H GLU A 18 9.808 -7.832 3.702 1.00 0.00 H new ATOM 0 HA GLU A 18 7.906 -5.583 4.023 1.00 0.00 H new ATOM 0 HB2 GLU A 18 10.933 -5.549 4.259 1.00 0.00 H new ATOM 0 HB3 GLU A 18 9.850 -4.195 4.511 1.00 0.00 H new ATOM 0 HG2 GLU A 18 8.733 -5.509 6.378 1.00 0.00 H new ATOM 0 HG3 GLU A 18 9.946 -6.757 6.171 1.00 0.00 H new ATOM 245 N TYR A 19 8.348 -4.590 1.800 1.00 0.00 N ATOM 246 CA TYR A 19 8.442 -4.139 0.422 1.00 0.00 C ATOM 247 C TYR A 19 8.649 -2.624 0.354 1.00 0.00 C ATOM 248 O TYR A 19 7.949 -1.868 1.025 1.00 0.00 O ATOM 249 CB TYR A 19 7.103 -4.489 -0.229 1.00 0.00 C ATOM 250 CG TYR A 19 6.815 -5.990 -0.292 1.00 0.00 C ATOM 251 CD1 TYR A 19 6.462 -6.674 0.854 1.00 0.00 C ATOM 252 CD2 TYR A 19 6.907 -6.660 -1.494 1.00 0.00 C ATOM 253 CE1 TYR A 19 6.191 -8.087 0.795 1.00 0.00 C ATOM 254 CE2 TYR A 19 6.636 -8.073 -1.554 1.00 0.00 C ATOM 255 CZ TYR A 19 6.291 -8.717 -0.406 1.00 0.00 C ATOM 256 OH TYR A 19 6.035 -10.051 -0.462 1.00 0.00 O ATOM 0 H TYR A 19 7.674 -4.079 2.371 1.00 0.00 H new ATOM 0 HA TYR A 19 9.286 -4.612 -0.080 1.00 0.00 H new ATOM 0 HB2 TYR A 19 6.302 -3.999 0.325 1.00 0.00 H new ATOM 0 HB3 TYR A 19 7.085 -4.083 -1.241 1.00 0.00 H new ATOM 0 HD1 TYR A 19 6.389 -6.149 1.795 1.00 0.00 H new ATOM 0 HD2 TYR A 19 7.182 -6.125 -2.391 1.00 0.00 H new ATOM 0 HE1 TYR A 19 5.915 -8.634 1.684 1.00 0.00 H new ATOM 0 HE2 TYR A 19 6.705 -8.609 -2.489 1.00 0.00 H new ATOM 0 HH TYR A 19 6.144 -10.367 -1.383 1.00 0.00 H new ATOM 266 N SER A 20 9.613 -2.227 -0.463 1.00 0.00 N ATOM 267 CA SER A 20 9.921 -0.817 -0.627 1.00 0.00 C ATOM 268 C SER A 20 9.363 -0.311 -1.959 1.00 0.00 C ATOM 269 O SER A 20 9.781 -0.765 -3.023 1.00 0.00 O ATOM 270 CB SER A 20 11.429 -0.570 -0.556 1.00 0.00 C ATOM 271 OG SER A 20 12.156 -1.455 -1.403 1.00 0.00 O ATOM 0 H SER A 20 10.191 -2.857 -1.019 1.00 0.00 H new ATOM 0 HA SER A 20 9.452 -0.268 0.189 1.00 0.00 H new ATOM 0 HB2 SER A 20 11.641 0.460 -0.841 1.00 0.00 H new ATOM 0 HB3 SER A 20 11.768 -0.692 0.473 1.00 0.00 H new ATOM 0 HG SER A 20 11.671 -1.573 -2.246 1.00 0.00 H new ATOM 277 N VAL A 21 8.427 0.621 -1.857 1.00 0.00 N ATOM 278 CA VAL A 21 7.808 1.193 -3.040 1.00 0.00 C ATOM 279 C VAL A 21 8.414 2.571 -3.312 1.00 0.00 C ATOM 280 O VAL A 21 8.261 3.490 -2.509 1.00 0.00 O ATOM 281 CB VAL A 21 6.288 1.231 -2.869 1.00 0.00 C ATOM 282 CG1 VAL A 21 5.623 1.959 -4.039 1.00 0.00 C ATOM 283 CG2 VAL A 21 5.719 -0.179 -2.705 1.00 0.00 C ATOM 0 H VAL A 21 8.082 0.994 -0.973 1.00 0.00 H new ATOM 0 HA VAL A 21 8.008 0.572 -3.913 1.00 0.00 H new ATOM 0 HB VAL A 21 6.067 1.788 -1.959 1.00 0.00 H new ATOM 0 HG11 VAL A 21 4.543 1.972 -3.893 1.00 0.00 H new ATOM 0 HG12 VAL A 21 5.995 2.982 -4.089 1.00 0.00 H new ATOM 0 HG13 VAL A 21 5.857 1.442 -4.970 1.00 0.00 H new ATOM 0 HG21 VAL A 21 4.637 -0.123 -2.585 1.00 0.00 H new ATOM 0 HG22 VAL A 21 5.956 -0.772 -3.588 1.00 0.00 H new ATOM 0 HG23 VAL A 21 6.158 -0.648 -1.824 1.00 0.00 H new ATOM 293 N THR A 22 9.088 2.672 -4.448 1.00 0.00 N ATOM 294 CA THR A 22 9.718 3.923 -4.836 1.00 0.00 C ATOM 295 C THR A 22 9.714 4.072 -6.359 1.00 0.00 C ATOM 296 O THR A 22 10.674 4.577 -6.939 1.00 0.00 O ATOM 297 CB THR A 22 11.121 3.955 -4.226 1.00 0.00 C ATOM 298 OG1 THR A 22 11.736 2.764 -4.707 1.00 0.00 O ATOM 299 CG2 THR A 22 11.102 3.779 -2.706 1.00 0.00 C ATOM 0 H THR A 22 9.212 1.908 -5.112 1.00 0.00 H new ATOM 0 HA THR A 22 9.163 4.780 -4.455 1.00 0.00 H new ATOM 0 HB THR A 22 11.604 4.900 -4.476 1.00 0.00 H new ATOM 0 HG1 THR A 22 12.651 2.705 -4.361 1.00 0.00 H new ATOM 0 HG21 THR A 22 12.122 3.809 -2.323 1.00 0.00 H new ATOM 0 HG22 THR A 22 10.521 4.583 -2.254 1.00 0.00 H new ATOM 0 HG23 THR A 22 10.649 2.819 -2.456 1.00 0.00 H new ATOM 307 N THR A 23 8.624 3.622 -6.963 1.00 0.00 N ATOM 308 CA THR A 23 8.483 3.699 -8.407 1.00 0.00 C ATOM 309 C THR A 23 7.481 4.791 -8.788 1.00 0.00 C ATOM 310 O THR A 23 7.648 5.467 -9.801 1.00 0.00 O ATOM 311 CB THR A 23 8.093 2.311 -8.919 1.00 0.00 C ATOM 312 OG1 THR A 23 9.319 1.586 -8.923 1.00 0.00 O ATOM 313 CG2 THR A 23 7.664 2.327 -10.387 1.00 0.00 C ATOM 0 H THR A 23 7.830 3.203 -6.479 1.00 0.00 H new ATOM 0 HA THR A 23 9.422 3.984 -8.881 1.00 0.00 H new ATOM 0 HB THR A 23 7.282 1.914 -8.309 1.00 0.00 H new ATOM 0 HG1 THR A 23 9.158 0.673 -9.240 1.00 0.00 H new ATOM 0 HG21 THR A 23 7.398 1.317 -10.699 1.00 0.00 H new ATOM 0 HG22 THR A 23 6.802 2.983 -10.507 1.00 0.00 H new ATOM 0 HG23 THR A 23 8.486 2.692 -11.002 1.00 0.00 H new ATOM 321 N LEU A 24 6.460 4.929 -7.954 1.00 0.00 N ATOM 322 CA LEU A 24 5.431 5.927 -8.190 1.00 0.00 C ATOM 323 C LEU A 24 5.682 7.136 -7.287 1.00 0.00 C ATOM 324 O LEU A 24 6.410 7.038 -6.300 1.00 0.00 O ATOM 325 CB LEU A 24 4.040 5.312 -8.022 1.00 0.00 C ATOM 326 CG LEU A 24 3.867 4.358 -6.838 1.00 0.00 C ATOM 327 CD1 LEU A 24 2.480 4.510 -6.209 1.00 0.00 C ATOM 328 CD2 LEU A 24 4.153 2.913 -7.253 1.00 0.00 C ATOM 0 H LEU A 24 6.324 4.366 -7.114 1.00 0.00 H new ATOM 0 HA LEU A 24 5.475 6.283 -9.219 1.00 0.00 H new ATOM 0 HB2 LEU A 24 3.317 6.121 -7.920 1.00 0.00 H new ATOM 0 HB3 LEU A 24 3.789 4.774 -8.936 1.00 0.00 H new ATOM 0 HG LEU A 24 4.597 4.625 -6.074 1.00 0.00 H new ATOM 0 HD11 LEU A 24 2.383 3.821 -5.370 1.00 0.00 H new ATOM 0 HD12 LEU A 24 2.351 5.533 -5.855 1.00 0.00 H new ATOM 0 HD13 LEU A 24 1.716 4.285 -6.953 1.00 0.00 H new ATOM 0 HD21 LEU A 24 4.023 2.255 -6.394 1.00 0.00 H new ATOM 0 HD22 LEU A 24 3.463 2.618 -8.043 1.00 0.00 H new ATOM 0 HD23 LEU A 24 5.177 2.835 -7.618 1.00 0.00 H new ATOM 340 N SER A 25 5.065 8.249 -7.656 1.00 0.00 N ATOM 341 CA SER A 25 5.212 9.476 -6.892 1.00 0.00 C ATOM 342 C SER A 25 3.836 10.071 -6.586 1.00 0.00 C ATOM 343 O SER A 25 2.816 9.538 -7.020 1.00 0.00 O ATOM 344 CB SER A 25 6.075 10.492 -7.642 1.00 0.00 C ATOM 345 OG SER A 25 7.429 10.062 -7.757 1.00 0.00 O ATOM 0 H SER A 25 4.462 8.327 -8.475 1.00 0.00 H new ATOM 0 HA SER A 25 5.713 9.236 -5.954 1.00 0.00 H new ATOM 0 HB2 SER A 25 5.661 10.655 -8.637 1.00 0.00 H new ATOM 0 HB3 SER A 25 6.042 11.450 -7.122 1.00 0.00 H new ATOM 0 HG SER A 25 7.946 10.737 -8.243 1.00 0.00 H new ATOM 351 N GLU A 26 3.853 11.167 -5.843 1.00 0.00 N ATOM 352 CA GLU A 26 2.619 11.840 -5.474 1.00 0.00 C ATOM 353 C GLU A 26 1.643 11.842 -6.653 1.00 0.00 C ATOM 354 O GLU A 26 0.457 11.567 -6.482 1.00 0.00 O ATOM 355 CB GLU A 26 2.895 13.264 -4.988 1.00 0.00 C ATOM 356 CG GLU A 26 3.820 13.258 -3.770 1.00 0.00 C ATOM 357 CD GLU A 26 4.876 14.360 -3.877 1.00 0.00 C ATOM 358 OE1 GLU A 26 5.692 14.274 -4.819 1.00 0.00 O ATOM 359 OE2 GLU A 26 4.842 15.264 -3.014 1.00 0.00 O ATOM 0 H GLU A 26 4.702 11.606 -5.486 1.00 0.00 H new ATOM 0 HA GLU A 26 2.162 11.293 -4.650 1.00 0.00 H new ATOM 0 HB2 GLU A 26 3.349 13.845 -5.791 1.00 0.00 H new ATOM 0 HB3 GLU A 26 1.955 13.754 -4.733 1.00 0.00 H new ATOM 0 HG2 GLU A 26 3.233 13.399 -2.863 1.00 0.00 H new ATOM 0 HG3 GLU A 26 4.309 12.288 -3.685 1.00 0.00 H new ATOM 366 N ASP A 27 2.180 12.156 -7.823 1.00 0.00 N ATOM 367 CA ASP A 27 1.371 12.198 -9.030 1.00 0.00 C ATOM 368 C ASP A 27 0.472 10.962 -9.079 1.00 0.00 C ATOM 369 O ASP A 27 -0.753 11.079 -9.052 1.00 0.00 O ATOM 370 CB ASP A 27 2.250 12.193 -10.282 1.00 0.00 C ATOM 371 CG ASP A 27 3.243 13.353 -10.380 1.00 0.00 C ATOM 372 OD1 ASP A 27 4.011 13.526 -9.409 1.00 0.00 O ATOM 373 OD2 ASP A 27 3.212 14.040 -11.423 1.00 0.00 O ATOM 0 H ASP A 27 3.165 12.384 -7.961 1.00 0.00 H new ATOM 0 HA ASP A 27 0.779 13.113 -9.008 1.00 0.00 H new ATOM 0 HB2 ASP A 27 2.805 11.256 -10.314 1.00 0.00 H new ATOM 0 HB3 ASP A 27 1.605 12.212 -11.160 1.00 0.00 H new ATOM 378 N ASP A 28 1.113 9.805 -9.151 1.00 0.00 N ATOM 379 CA ASP A 28 0.386 8.548 -9.204 1.00 0.00 C ATOM 380 C ASP A 28 -0.665 8.524 -8.092 1.00 0.00 C ATOM 381 O ASP A 28 -0.475 9.134 -7.041 1.00 0.00 O ATOM 382 CB ASP A 28 1.325 7.359 -8.992 1.00 0.00 C ATOM 383 CG ASP A 28 2.288 7.081 -10.148 1.00 0.00 C ATOM 384 OD1 ASP A 28 3.115 7.977 -10.425 1.00 0.00 O ATOM 385 OD2 ASP A 28 2.176 5.980 -10.729 1.00 0.00 O ATOM 0 H ASP A 28 2.128 9.711 -9.174 1.00 0.00 H new ATOM 0 HA ASP A 28 -0.080 8.469 -10.186 1.00 0.00 H new ATOM 0 HB2 ASP A 28 1.908 7.532 -8.087 1.00 0.00 H new ATOM 0 HB3 ASP A 28 0.723 6.467 -8.818 1.00 0.00 H new ATOM 390 N THR A 29 -1.750 7.814 -8.363 1.00 0.00 N ATOM 391 CA THR A 29 -2.831 7.702 -7.399 1.00 0.00 C ATOM 392 C THR A 29 -2.660 6.442 -6.549 1.00 0.00 C ATOM 393 O THR A 29 -1.692 5.703 -6.716 1.00 0.00 O ATOM 394 CB THR A 29 -4.155 7.744 -8.165 1.00 0.00 C ATOM 395 OG1 THR A 29 -3.939 6.878 -9.276 1.00 0.00 O ATOM 396 CG2 THR A 29 -4.420 9.109 -8.803 1.00 0.00 C ATOM 0 H THR A 29 -1.904 7.310 -9.237 1.00 0.00 H new ATOM 0 HA THR A 29 -2.820 8.534 -6.695 1.00 0.00 H new ATOM 0 HB THR A 29 -4.973 7.495 -7.490 1.00 0.00 H new ATOM 0 HG1 THR A 29 -4.749 6.844 -9.827 1.00 0.00 H new ATOM 0 HG21 THR A 29 -5.372 9.084 -9.334 1.00 0.00 H new ATOM 0 HG22 THR A 29 -4.458 9.873 -8.026 1.00 0.00 H new ATOM 0 HG23 THR A 29 -3.619 9.344 -9.504 1.00 0.00 H new ATOM 404 N VAL A 30 -3.617 6.235 -5.655 1.00 0.00 N ATOM 405 CA VAL A 30 -3.584 5.077 -4.779 1.00 0.00 C ATOM 406 C VAL A 30 -3.569 3.802 -5.625 1.00 0.00 C ATOM 407 O VAL A 30 -2.642 3.000 -5.530 1.00 0.00 O ATOM 408 CB VAL A 30 -4.757 5.129 -3.798 1.00 0.00 C ATOM 409 CG1 VAL A 30 -4.843 3.842 -2.976 1.00 0.00 C ATOM 410 CG2 VAL A 30 -4.657 6.355 -2.888 1.00 0.00 C ATOM 0 H VAL A 30 -4.419 6.850 -5.519 1.00 0.00 H new ATOM 0 HA VAL A 30 -2.674 5.079 -4.178 1.00 0.00 H new ATOM 0 HB VAL A 30 -5.675 5.217 -4.379 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -5.685 3.906 -2.287 1.00 0.00 H new ATOM 0 HG12 VAL A 30 -4.984 2.992 -3.644 1.00 0.00 H new ATOM 0 HG13 VAL A 30 -3.921 3.709 -2.410 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -5.503 6.368 -2.201 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -3.728 6.311 -2.320 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -4.669 7.260 -3.495 1.00 0.00 H new ATOM 420 N LEU A 31 -4.608 3.655 -6.434 1.00 0.00 N ATOM 421 CA LEU A 31 -4.727 2.492 -7.297 1.00 0.00 C ATOM 422 C LEU A 31 -3.350 2.142 -7.865 1.00 0.00 C ATOM 423 O LEU A 31 -2.893 1.007 -7.739 1.00 0.00 O ATOM 424 CB LEU A 31 -5.793 2.726 -8.369 1.00 0.00 C ATOM 425 CG LEU A 31 -6.095 1.539 -9.285 1.00 0.00 C ATOM 426 CD1 LEU A 31 -7.213 0.670 -8.706 1.00 0.00 C ATOM 427 CD2 LEU A 31 -6.413 2.009 -10.706 1.00 0.00 C ATOM 0 H LEU A 31 -5.376 4.322 -6.510 1.00 0.00 H new ATOM 0 HA LEU A 31 -5.067 1.628 -6.727 1.00 0.00 H new ATOM 0 HB2 LEU A 31 -6.718 3.022 -7.875 1.00 0.00 H new ATOM 0 HB3 LEU A 31 -5.479 3.566 -8.988 1.00 0.00 H new ATOM 0 HG LEU A 31 -5.201 0.918 -9.344 1.00 0.00 H new ATOM 0 HD11 LEU A 31 -7.408 -0.167 -9.377 1.00 0.00 H new ATOM 0 HD12 LEU A 31 -6.910 0.290 -7.730 1.00 0.00 H new ATOM 0 HD13 LEU A 31 -8.119 1.267 -8.598 1.00 0.00 H new ATOM 0 HD21 LEU A 31 -6.624 1.145 -11.336 1.00 0.00 H new ATOM 0 HD22 LEU A 31 -7.283 2.665 -10.686 1.00 0.00 H new ATOM 0 HD23 LEU A 31 -5.559 2.552 -11.109 1.00 0.00 H new ATOM 439 N ASP A 32 -2.728 3.138 -8.479 1.00 0.00 N ATOM 440 CA ASP A 32 -1.412 2.949 -9.067 1.00 0.00 C ATOM 441 C ASP A 32 -0.558 2.092 -8.130 1.00 0.00 C ATOM 442 O ASP A 32 0.102 1.153 -8.572 1.00 0.00 O ATOM 443 CB ASP A 32 -0.700 4.289 -9.263 1.00 0.00 C ATOM 444 CG ASP A 32 -0.469 4.691 -10.721 1.00 0.00 C ATOM 445 OD1 ASP A 32 -0.508 3.778 -11.574 1.00 0.00 O ATOM 446 OD2 ASP A 32 -0.259 5.902 -10.950 1.00 0.00 O ATOM 0 H ASP A 32 -3.110 4.078 -8.582 1.00 0.00 H new ATOM 0 HA ASP A 32 -1.541 2.464 -10.034 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -1.285 5.069 -8.775 1.00 0.00 H new ATOM 0 HB3 ASP A 32 0.264 4.249 -8.756 1.00 0.00 H new ATOM 451 N LEU A 33 -0.598 2.446 -6.854 1.00 0.00 N ATOM 452 CA LEU A 33 0.164 1.721 -5.852 1.00 0.00 C ATOM 453 C LEU A 33 -0.351 0.283 -5.768 1.00 0.00 C ATOM 454 O LEU A 33 0.428 -0.665 -5.847 1.00 0.00 O ATOM 455 CB LEU A 33 0.134 2.464 -4.515 1.00 0.00 C ATOM 456 CG LEU A 33 1.192 2.046 -3.491 1.00 0.00 C ATOM 457 CD1 LEU A 33 2.598 2.398 -3.981 1.00 0.00 C ATOM 458 CD2 LEU A 33 0.895 2.651 -2.118 1.00 0.00 C ATOM 0 H LEU A 33 -1.146 3.226 -6.491 1.00 0.00 H new ATOM 0 HA LEU A 33 1.215 1.668 -6.137 1.00 0.00 H new ATOM 0 HB2 LEU A 33 0.249 3.530 -4.712 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -0.850 2.326 -4.068 1.00 0.00 H new ATOM 0 HG LEU A 33 1.152 0.962 -3.381 1.00 0.00 H new ATOM 0 HD11 LEU A 33 3.331 2.091 -3.235 1.00 0.00 H new ATOM 0 HD12 LEU A 33 2.796 1.880 -4.920 1.00 0.00 H new ATOM 0 HD13 LEU A 33 2.670 3.474 -4.138 1.00 0.00 H new ATOM 0 HD21 LEU A 33 1.662 2.338 -1.409 1.00 0.00 H new ATOM 0 HD22 LEU A 33 0.892 3.738 -2.193 1.00 0.00 H new ATOM 0 HD23 LEU A 33 -0.080 2.308 -1.772 1.00 0.00 H new ATOM 470 N LYS A 34 -1.661 0.166 -5.608 1.00 0.00 N ATOM 471 CA LYS A 34 -2.290 -1.141 -5.512 1.00 0.00 C ATOM 472 C LYS A 34 -1.861 -1.997 -6.705 1.00 0.00 C ATOM 473 O LYS A 34 -1.222 -3.034 -6.532 1.00 0.00 O ATOM 474 CB LYS A 34 -3.807 -0.997 -5.372 1.00 0.00 C ATOM 475 CG LYS A 34 -4.207 -0.812 -3.907 1.00 0.00 C ATOM 476 CD LYS A 34 -4.269 0.671 -3.538 1.00 0.00 C ATOM 477 CE LYS A 34 -3.778 0.902 -2.108 1.00 0.00 C ATOM 478 NZ LYS A 34 -2.692 1.907 -2.088 1.00 0.00 N ATOM 0 H LYS A 34 -2.304 0.955 -5.542 1.00 0.00 H new ATOM 0 HA LYS A 34 -1.958 -1.658 -4.612 1.00 0.00 H new ATOM 0 HB2 LYS A 34 -4.150 -0.144 -5.957 1.00 0.00 H new ATOM 0 HB3 LYS A 34 -4.299 -1.881 -5.778 1.00 0.00 H new ATOM 0 HG2 LYS A 34 -5.178 -1.275 -3.730 1.00 0.00 H new ATOM 0 HG3 LYS A 34 -3.489 -1.321 -3.263 1.00 0.00 H new ATOM 0 HD2 LYS A 34 -3.659 1.248 -4.233 1.00 0.00 H new ATOM 0 HD3 LYS A 34 -5.293 1.031 -3.637 1.00 0.00 H new ATOM 0 HE2 LYS A 34 -4.605 1.240 -1.483 1.00 0.00 H new ATOM 0 HE3 LYS A 34 -3.421 -0.036 -1.684 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 -2.812 2.532 -1.265 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 -1.773 1.424 -2.025 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 -2.726 2.473 -2.960 1.00 0.00 H new ATOM 492 N GLN A 35 -2.229 -1.532 -7.890 1.00 0.00 N ATOM 493 CA GLN A 35 -1.890 -2.242 -9.111 1.00 0.00 C ATOM 494 C GLN A 35 -0.442 -2.733 -9.055 1.00 0.00 C ATOM 495 O GLN A 35 -0.140 -3.838 -9.504 1.00 0.00 O ATOM 496 CB GLN A 35 -2.124 -1.362 -10.340 1.00 0.00 C ATOM 497 CG GLN A 35 -3.605 -1.336 -10.723 1.00 0.00 C ATOM 498 CD GLN A 35 -3.777 -1.262 -12.242 1.00 0.00 C ATOM 499 OE1 GLN A 35 -2.826 -1.134 -12.995 1.00 0.00 O ATOM 500 NE2 GLN A 35 -5.041 -1.349 -12.647 1.00 0.00 N ATOM 0 H GLN A 35 -2.759 -0.672 -8.030 1.00 0.00 H new ATOM 0 HA GLN A 35 -2.544 -3.110 -9.197 1.00 0.00 H new ATOM 0 HB2 GLN A 35 -1.780 -0.348 -10.136 1.00 0.00 H new ATOM 0 HB3 GLN A 35 -1.535 -1.737 -11.177 1.00 0.00 H new ATOM 0 HG2 GLN A 35 -4.099 -2.229 -10.341 1.00 0.00 H new ATOM 0 HG3 GLN A 35 -4.090 -0.479 -10.256 1.00 0.00 H new ATOM 0 HE21 GLN A 35 -5.790 -1.455 -11.962 1.00 0.00 H new ATOM 0 HE22 GLN A 35 -5.262 -1.310 -13.642 1.00 0.00 H new ATOM 509 N PHE A 36 0.415 -1.888 -8.500 1.00 0.00 N ATOM 510 CA PHE A 36 1.824 -2.223 -8.380 1.00 0.00 C ATOM 511 C PHE A 36 2.053 -3.236 -7.256 1.00 0.00 C ATOM 512 O PHE A 36 2.880 -4.137 -7.388 1.00 0.00 O ATOM 513 CB PHE A 36 2.563 -0.927 -8.041 1.00 0.00 C ATOM 514 CG PHE A 36 4.072 -0.988 -8.289 1.00 0.00 C ATOM 515 CD1 PHE A 36 4.546 -1.348 -9.512 1.00 0.00 C ATOM 516 CD2 PHE A 36 4.938 -0.683 -7.286 1.00 0.00 C ATOM 517 CE1 PHE A 36 5.946 -1.405 -9.742 1.00 0.00 C ATOM 518 CE2 PHE A 36 6.339 -0.740 -7.516 1.00 0.00 C ATOM 519 CZ PHE A 36 6.813 -1.099 -8.739 1.00 0.00 C ATOM 0 H PHE A 36 0.161 -0.973 -8.129 1.00 0.00 H new ATOM 0 HA PHE A 36 2.182 -2.665 -9.309 1.00 0.00 H new ATOM 0 HB2 PHE A 36 2.141 -0.115 -8.632 1.00 0.00 H new ATOM 0 HB3 PHE A 36 2.387 -0.684 -6.993 1.00 0.00 H new ATOM 0 HD1 PHE A 36 3.858 -1.590 -10.308 1.00 0.00 H new ATOM 0 HD2 PHE A 36 4.561 -0.398 -6.315 1.00 0.00 H new ATOM 0 HE1 PHE A 36 6.323 -1.691 -10.713 1.00 0.00 H new ATOM 0 HE2 PHE A 36 7.027 -0.498 -6.720 1.00 0.00 H new ATOM 0 HZ PHE A 36 7.878 -1.141 -8.914 1.00 0.00 H new ATOM 529 N LEU A 37 1.306 -3.054 -6.177 1.00 0.00 N ATOM 530 CA LEU A 37 1.417 -3.941 -5.032 1.00 0.00 C ATOM 531 C LEU A 37 0.915 -5.333 -5.419 1.00 0.00 C ATOM 532 O LEU A 37 1.172 -6.308 -4.715 1.00 0.00 O ATOM 533 CB LEU A 37 0.699 -3.343 -3.820 1.00 0.00 C ATOM 534 CG LEU A 37 1.332 -2.087 -3.217 1.00 0.00 C ATOM 535 CD1 LEU A 37 0.261 -1.145 -2.665 1.00 0.00 C ATOM 536 CD2 LEU A 37 2.375 -2.453 -2.159 1.00 0.00 C ATOM 0 H LEU A 37 0.621 -2.305 -6.072 1.00 0.00 H new ATOM 0 HA LEU A 37 2.460 -4.050 -4.734 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -0.325 -3.106 -4.110 1.00 0.00 H new ATOM 0 HB3 LEU A 37 0.642 -4.106 -3.043 1.00 0.00 H new ATOM 0 HG LEU A 37 1.853 -1.552 -4.011 1.00 0.00 H new ATOM 0 HD11 LEU A 37 0.737 -0.260 -2.242 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -0.410 -0.846 -3.470 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -0.308 -1.656 -1.889 1.00 0.00 H new ATOM 0 HD21 LEU A 37 2.810 -1.543 -1.746 1.00 0.00 H new ATOM 0 HD22 LEU A 37 1.899 -3.022 -1.361 1.00 0.00 H new ATOM 0 HD23 LEU A 37 3.160 -3.055 -2.615 1.00 0.00 H new ATOM 548 N LYS A 38 0.209 -5.381 -6.539 1.00 0.00 N ATOM 549 CA LYS A 38 -0.332 -6.638 -7.029 1.00 0.00 C ATOM 550 C LYS A 38 0.790 -7.454 -7.674 1.00 0.00 C ATOM 551 O LYS A 38 0.710 -8.679 -7.745 1.00 0.00 O ATOM 552 CB LYS A 38 -1.520 -6.384 -7.958 1.00 0.00 C ATOM 553 CG LYS A 38 -2.116 -7.702 -8.459 1.00 0.00 C ATOM 554 CD LYS A 38 -3.368 -7.452 -9.302 1.00 0.00 C ATOM 555 CE LYS A 38 -3.100 -7.744 -10.780 1.00 0.00 C ATOM 556 NZ LYS A 38 -2.424 -6.594 -11.422 1.00 0.00 N ATOM 0 H LYS A 38 -0.001 -4.570 -7.121 1.00 0.00 H new ATOM 0 HA LYS A 38 -0.724 -7.232 -6.203 1.00 0.00 H new ATOM 0 HB2 LYS A 38 -2.284 -5.813 -7.430 1.00 0.00 H new ATOM 0 HB3 LYS A 38 -1.200 -5.780 -8.807 1.00 0.00 H new ATOM 0 HG2 LYS A 38 -1.375 -8.238 -9.052 1.00 0.00 H new ATOM 0 HG3 LYS A 38 -2.366 -8.338 -7.610 1.00 0.00 H new ATOM 0 HD2 LYS A 38 -4.183 -8.082 -8.945 1.00 0.00 H new ATOM 0 HD3 LYS A 38 -3.690 -6.417 -9.184 1.00 0.00 H new ATOM 0 HE2 LYS A 38 -2.481 -8.636 -10.874 1.00 0.00 H new ATOM 0 HE3 LYS A 38 -4.040 -7.953 -11.292 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 -2.250 -6.809 -12.424 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 -3.029 -5.751 -11.349 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 -1.518 -6.413 -10.944 1.00 0.00 H new ATOM 570 N THR A 39 1.811 -6.741 -8.128 1.00 0.00 N ATOM 571 CA THR A 39 2.948 -7.384 -8.765 1.00 0.00 C ATOM 572 C THR A 39 4.089 -7.564 -7.762 1.00 0.00 C ATOM 573 O THR A 39 4.966 -8.405 -7.958 1.00 0.00 O ATOM 574 CB THR A 39 3.339 -6.550 -9.987 1.00 0.00 C ATOM 575 OG1 THR A 39 3.867 -7.505 -10.904 1.00 0.00 O ATOM 576 CG2 THR A 39 4.515 -5.614 -9.705 1.00 0.00 C ATOM 0 H THR A 39 1.874 -5.725 -8.067 1.00 0.00 H new ATOM 0 HA THR A 39 2.695 -8.388 -9.106 1.00 0.00 H new ATOM 0 HB THR A 39 2.481 -5.965 -10.317 1.00 0.00 H new ATOM 0 HG1 THR A 39 4.144 -7.050 -11.727 1.00 0.00 H new ATOM 0 HG21 THR A 39 4.752 -5.046 -10.605 1.00 0.00 H new ATOM 0 HG22 THR A 39 4.249 -4.927 -8.901 1.00 0.00 H new ATOM 0 HG23 THR A 39 5.384 -6.201 -9.408 1.00 0.00 H new ATOM 584 N LEU A 40 4.042 -6.761 -6.709 1.00 0.00 N ATOM 585 CA LEU A 40 5.061 -6.822 -5.675 1.00 0.00 C ATOM 586 C LEU A 40 4.836 -8.067 -4.816 1.00 0.00 C ATOM 587 O LEU A 40 5.779 -8.797 -4.515 1.00 0.00 O ATOM 588 CB LEU A 40 5.089 -5.519 -4.874 1.00 0.00 C ATOM 589 CG LEU A 40 5.837 -4.350 -5.521 1.00 0.00 C ATOM 590 CD1 LEU A 40 5.558 -3.043 -4.778 1.00 0.00 C ATOM 591 CD2 LEU A 40 7.335 -4.645 -5.619 1.00 0.00 C ATOM 0 H LEU A 40 3.314 -6.065 -6.550 1.00 0.00 H new ATOM 0 HA LEU A 40 6.051 -6.917 -6.121 1.00 0.00 H new ATOM 0 HB2 LEU A 40 4.061 -5.208 -4.687 1.00 0.00 H new ATOM 0 HB3 LEU A 40 5.542 -5.722 -3.903 1.00 0.00 H new ATOM 0 HG LEU A 40 5.466 -4.228 -6.538 1.00 0.00 H new ATOM 0 HD11 LEU A 40 6.101 -2.229 -5.258 1.00 0.00 H new ATOM 0 HD12 LEU A 40 4.489 -2.831 -4.804 1.00 0.00 H new ATOM 0 HD13 LEU A 40 5.885 -3.136 -3.742 1.00 0.00 H new ATOM 0 HD21 LEU A 40 7.843 -3.799 -6.082 1.00 0.00 H new ATOM 0 HD22 LEU A 40 7.740 -4.809 -4.620 1.00 0.00 H new ATOM 0 HD23 LEU A 40 7.491 -5.538 -6.225 1.00 0.00 H new ATOM 603 N THR A 41 3.580 -8.271 -4.444 1.00 0.00 N ATOM 604 CA THR A 41 3.219 -9.416 -3.624 1.00 0.00 C ATOM 605 C THR A 41 2.650 -10.537 -4.496 1.00 0.00 C ATOM 606 O THR A 41 3.150 -11.660 -4.474 1.00 0.00 O ATOM 607 CB THR A 41 2.251 -8.936 -2.542 1.00 0.00 C ATOM 608 OG1 THR A 41 1.030 -8.711 -3.243 1.00 0.00 O ATOM 609 CG2 THR A 41 2.623 -7.557 -1.992 1.00 0.00 C ATOM 0 H THR A 41 2.800 -7.663 -4.695 1.00 0.00 H new ATOM 0 HA THR A 41 4.093 -9.842 -3.131 1.00 0.00 H new ATOM 0 HB THR A 41 2.232 -9.659 -1.727 1.00 0.00 H new ATOM 0 HG1 THR A 41 1.087 -7.866 -3.736 1.00 0.00 H new ATOM 0 HG21 THR A 41 1.904 -7.264 -1.227 1.00 0.00 H new ATOM 0 HG22 THR A 41 3.621 -7.597 -1.555 1.00 0.00 H new ATOM 0 HG23 THR A 41 2.610 -6.827 -2.801 1.00 0.00 H new ATOM 617 N GLY A 42 1.610 -10.193 -5.242 1.00 0.00 N ATOM 618 CA GLY A 42 0.967 -11.156 -6.119 1.00 0.00 C ATOM 619 C GLY A 42 -0.466 -11.439 -5.665 1.00 0.00 C ATOM 620 O GLY A 42 -0.981 -12.538 -5.870 1.00 0.00 O ATOM 0 H GLY A 42 1.197 -9.260 -5.257 1.00 0.00 H new ATOM 0 HA2 GLY A 42 0.960 -10.775 -7.140 1.00 0.00 H new ATOM 0 HA3 GLY A 42 1.539 -12.084 -6.128 1.00 0.00 H new ATOM 624 N VAL A 43 -1.071 -10.429 -5.058 1.00 0.00 N ATOM 625 CA VAL A 43 -2.435 -10.555 -4.573 1.00 0.00 C ATOM 626 C VAL A 43 -3.288 -9.431 -5.165 1.00 0.00 C ATOM 627 O VAL A 43 -2.808 -8.313 -5.347 1.00 0.00 O ATOM 628 CB VAL A 43 -2.448 -10.573 -3.043 1.00 0.00 C ATOM 629 CG1 VAL A 43 -3.880 -10.586 -2.507 1.00 0.00 C ATOM 630 CG2 VAL A 43 -1.649 -11.761 -2.502 1.00 0.00 C ATOM 0 H VAL A 43 -0.641 -9.519 -4.891 1.00 0.00 H new ATOM 0 HA VAL A 43 -2.870 -11.500 -4.899 1.00 0.00 H new ATOM 0 HB VAL A 43 -1.968 -9.659 -2.693 1.00 0.00 H new ATOM 0 HG11 VAL A 43 -3.860 -10.599 -1.417 1.00 0.00 H new ATOM 0 HG12 VAL A 43 -4.405 -9.695 -2.850 1.00 0.00 H new ATOM 0 HG13 VAL A 43 -4.397 -11.474 -2.871 1.00 0.00 H new ATOM 0 HG21 VAL A 43 -1.674 -11.750 -1.412 1.00 0.00 H new ATOM 0 HG22 VAL A 43 -2.087 -12.690 -2.866 1.00 0.00 H new ATOM 0 HG23 VAL A 43 -0.616 -11.690 -2.842 1.00 0.00 H new ATOM 640 N LEU A 44 -4.538 -9.766 -5.448 1.00 0.00 N ATOM 641 CA LEU A 44 -5.462 -8.799 -6.015 1.00 0.00 C ATOM 642 C LEU A 44 -5.386 -7.497 -5.215 1.00 0.00 C ATOM 643 O LEU A 44 -5.047 -7.510 -4.032 1.00 0.00 O ATOM 644 CB LEU A 44 -6.872 -9.389 -6.097 1.00 0.00 C ATOM 645 CG LEU A 44 -7.030 -10.627 -6.981 1.00 0.00 C ATOM 646 CD1 LEU A 44 -8.487 -11.094 -7.015 1.00 0.00 C ATOM 647 CD2 LEU A 44 -6.477 -10.373 -8.385 1.00 0.00 C ATOM 0 H LEU A 44 -4.933 -10.694 -5.295 1.00 0.00 H new ATOM 0 HA LEU A 44 -5.181 -8.560 -7.041 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -7.197 -9.643 -5.088 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -7.547 -8.616 -6.464 1.00 0.00 H new ATOM 0 HG LEU A 44 -6.443 -11.435 -6.545 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -8.572 -11.976 -7.650 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -8.813 -11.342 -6.005 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -9.115 -10.297 -7.414 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -6.602 -11.269 -8.993 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -7.017 -9.545 -8.844 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -5.418 -10.124 -8.319 1.00 0.00 H new ATOM 659 N PRO A 45 -5.714 -6.375 -5.910 1.00 0.00 N ATOM 660 CA PRO A 45 -5.686 -5.068 -5.277 1.00 0.00 C ATOM 661 C PRO A 45 -6.885 -4.883 -4.345 1.00 0.00 C ATOM 662 O PRO A 45 -6.786 -4.200 -3.328 1.00 0.00 O ATOM 663 CB PRO A 45 -5.669 -4.074 -6.427 1.00 0.00 C ATOM 664 CG PRO A 45 -6.155 -4.840 -7.647 1.00 0.00 C ATOM 665 CD PRO A 45 -6.119 -6.322 -7.311 1.00 0.00 C ATOM 0 HA PRO A 45 -4.815 -4.931 -4.636 1.00 0.00 H new ATOM 0 HB2 PRO A 45 -6.316 -3.223 -6.217 1.00 0.00 H new ATOM 0 HB3 PRO A 45 -4.666 -3.680 -6.588 1.00 0.00 H new ATOM 0 HG2 PRO A 45 -7.167 -4.533 -7.912 1.00 0.00 H new ATOM 0 HG3 PRO A 45 -5.521 -4.628 -8.508 1.00 0.00 H new ATOM 0 HD2 PRO A 45 -7.094 -6.785 -7.459 1.00 0.00 H new ATOM 0 HD3 PRO A 45 -5.413 -6.855 -7.948 1.00 0.00 H new ATOM 673 N GLU A 46 -7.991 -5.505 -4.727 1.00 0.00 N ATOM 674 CA GLU A 46 -9.209 -5.419 -3.939 1.00 0.00 C ATOM 675 C GLU A 46 -9.067 -6.234 -2.652 1.00 0.00 C ATOM 676 O GLU A 46 -9.472 -5.785 -1.581 1.00 0.00 O ATOM 677 CB GLU A 46 -10.421 -5.880 -4.750 1.00 0.00 C ATOM 678 CG GLU A 46 -10.360 -7.385 -5.020 1.00 0.00 C ATOM 679 CD GLU A 46 -11.421 -7.802 -6.040 1.00 0.00 C ATOM 680 OE1 GLU A 46 -12.612 -7.553 -5.755 1.00 0.00 O ATOM 681 OE2 GLU A 46 -11.017 -8.362 -7.082 1.00 0.00 O ATOM 0 H GLU A 46 -8.069 -6.071 -5.572 1.00 0.00 H new ATOM 0 HA GLU A 46 -9.371 -4.375 -3.669 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -11.337 -5.641 -4.210 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -10.458 -5.339 -5.695 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -9.370 -7.652 -5.390 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -10.511 -7.932 -4.089 1.00 0.00 H new ATOM 688 N ARG A 47 -8.492 -7.418 -2.800 1.00 0.00 N ATOM 689 CA ARG A 47 -8.292 -8.301 -1.663 1.00 0.00 C ATOM 690 C ARG A 47 -7.183 -7.759 -0.759 1.00 0.00 C ATOM 691 O ARG A 47 -7.272 -7.854 0.464 1.00 0.00 O ATOM 692 CB ARG A 47 -7.922 -9.713 -2.121 1.00 0.00 C ATOM 693 CG ARG A 47 -9.068 -10.351 -2.910 1.00 0.00 C ATOM 694 CD ARG A 47 -9.530 -11.652 -2.250 1.00 0.00 C ATOM 695 NE ARG A 47 -11.009 -11.688 -2.184 1.00 0.00 N ATOM 696 CZ ARG A 47 -11.705 -12.499 -1.376 1.00 0.00 C ATOM 697 NH1 ARG A 47 -11.062 -13.347 -0.562 1.00 0.00 N ATOM 698 NH2 ARG A 47 -13.044 -12.463 -1.383 1.00 0.00 N ATOM 0 H ARG A 47 -8.158 -7.787 -3.690 1.00 0.00 H new ATOM 0 HA ARG A 47 -9.229 -8.345 -1.108 1.00 0.00 H new ATOM 0 HB2 ARG A 47 -7.026 -9.675 -2.740 1.00 0.00 H new ATOM 0 HB3 ARG A 47 -7.685 -10.330 -1.254 1.00 0.00 H new ATOM 0 HG2 ARG A 47 -9.904 -9.654 -2.972 1.00 0.00 H new ATOM 0 HG3 ARG A 47 -8.744 -10.552 -3.931 1.00 0.00 H new ATOM 0 HD2 ARG A 47 -9.162 -12.508 -2.816 1.00 0.00 H new ATOM 0 HD3 ARG A 47 -9.111 -11.730 -1.247 1.00 0.00 H new ATOM 0 HE ARG A 47 -11.530 -11.056 -2.792 1.00 0.00 H new ATOM 0 HH11 ARG A 47 -10.042 -13.375 -0.557 1.00 0.00 H new ATOM 0 HH12 ARG A 47 -11.592 -13.964 0.053 1.00 0.00 H new ATOM 0 HH21 ARG A 47 -13.534 -11.818 -2.003 1.00 0.00 H new ATOM 0 HH22 ARG A 47 -13.574 -13.080 -0.768 1.00 0.00 H new ATOM 712 N GLN A 48 -6.163 -7.202 -1.396 1.00 0.00 N ATOM 713 CA GLN A 48 -5.038 -6.644 -0.664 1.00 0.00 C ATOM 714 C GLN A 48 -5.535 -5.712 0.443 1.00 0.00 C ATOM 715 O GLN A 48 -6.060 -4.635 0.163 1.00 0.00 O ATOM 716 CB GLN A 48 -4.079 -5.914 -1.606 1.00 0.00 C ATOM 717 CG GLN A 48 -2.920 -6.824 -2.021 1.00 0.00 C ATOM 718 CD GLN A 48 -1.778 -6.011 -2.633 1.00 0.00 C ATOM 719 OE1 GLN A 48 -0.643 -6.051 -2.185 1.00 0.00 O ATOM 720 NE2 GLN A 48 -2.138 -5.273 -3.679 1.00 0.00 N ATOM 0 H GLN A 48 -6.092 -7.125 -2.411 1.00 0.00 H new ATOM 0 HA GLN A 48 -4.487 -7.464 -0.202 1.00 0.00 H new ATOM 0 HB2 GLN A 48 -4.618 -5.579 -2.492 1.00 0.00 H new ATOM 0 HB3 GLN A 48 -3.689 -5.023 -1.115 1.00 0.00 H new ATOM 0 HG2 GLN A 48 -2.556 -7.374 -1.153 1.00 0.00 H new ATOM 0 HG3 GLN A 48 -3.272 -7.562 -2.741 1.00 0.00 H new ATOM 0 HE21 GLN A 48 -3.105 -5.285 -4.003 1.00 0.00 H new ATOM 0 HE22 GLN A 48 -1.447 -4.695 -4.157 1.00 0.00 H new ATOM 729 N LYS A 49 -5.351 -6.160 1.676 1.00 0.00 N ATOM 730 CA LYS A 49 -5.773 -5.379 2.826 1.00 0.00 C ATOM 731 C LYS A 49 -4.601 -4.529 3.319 1.00 0.00 C ATOM 732 O LYS A 49 -3.521 -5.052 3.590 1.00 0.00 O ATOM 733 CB LYS A 49 -6.367 -6.289 3.903 1.00 0.00 C ATOM 734 CG LYS A 49 -7.615 -5.660 4.526 1.00 0.00 C ATOM 735 CD LYS A 49 -7.361 -5.266 5.983 1.00 0.00 C ATOM 736 CE LYS A 49 -6.329 -4.140 6.074 1.00 0.00 C ATOM 737 NZ LYS A 49 -4.999 -4.684 6.427 1.00 0.00 N ATOM 0 H LYS A 49 -4.915 -7.054 1.904 1.00 0.00 H new ATOM 0 HA LYS A 49 -6.571 -4.691 2.546 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -6.621 -7.255 3.468 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -5.623 -6.474 4.678 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -7.908 -4.780 3.953 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -8.446 -6.364 4.475 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -8.295 -4.946 6.445 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -7.009 -6.133 6.542 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -6.272 -3.613 5.122 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -6.641 -3.412 6.823 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -4.371 -3.907 6.716 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -5.097 -5.359 7.212 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -4.592 -5.169 5.602 1.00 0.00 H new ATOM 751 N LEU A 50 -4.852 -3.232 3.419 1.00 0.00 N ATOM 752 CA LEU A 50 -3.831 -2.304 3.874 1.00 0.00 C ATOM 753 C LEU A 50 -4.070 -1.972 5.348 1.00 0.00 C ATOM 754 O LEU A 50 -5.213 -1.817 5.776 1.00 0.00 O ATOM 755 CB LEU A 50 -3.782 -1.073 2.967 1.00 0.00 C ATOM 756 CG LEU A 50 -3.545 -1.345 1.480 1.00 0.00 C ATOM 757 CD1 LEU A 50 -3.142 -0.065 0.746 1.00 0.00 C ATOM 758 CD2 LEU A 50 -2.521 -2.464 1.284 1.00 0.00 C ATOM 0 H LEU A 50 -5.749 -2.802 3.192 1.00 0.00 H new ATOM 0 HA LEU A 50 -2.844 -2.761 3.805 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -4.722 -0.531 3.072 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -2.992 -0.413 3.326 1.00 0.00 H new ATOM 0 HG LEU A 50 -4.483 -1.686 1.042 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -2.980 -0.286 -0.309 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -3.936 0.676 0.843 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -2.223 0.329 1.180 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -2.371 -2.637 0.218 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -1.575 -2.175 1.741 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -2.887 -3.378 1.752 1.00 0.00 H new ATOM 770 N LEU A 51 -2.973 -1.872 6.085 1.00 0.00 N ATOM 771 CA LEU A 51 -3.049 -1.561 7.502 1.00 0.00 C ATOM 772 C LEU A 51 -2.161 -0.352 7.803 1.00 0.00 C ATOM 773 O LEU A 51 -0.941 -0.423 7.662 1.00 0.00 O ATOM 774 CB LEU A 51 -2.711 -2.796 8.340 1.00 0.00 C ATOM 775 CG LEU A 51 -3.638 -3.077 9.525 1.00 0.00 C ATOM 776 CD1 LEU A 51 -5.051 -3.418 9.046 1.00 0.00 C ATOM 777 CD2 LEU A 51 -3.059 -4.168 10.427 1.00 0.00 C ATOM 0 H LEU A 51 -2.027 -2.001 5.727 1.00 0.00 H new ATOM 0 HA LEU A 51 -4.067 -1.286 7.778 1.00 0.00 H new ATOM 0 HB2 LEU A 51 -2.717 -3.667 7.685 1.00 0.00 H new ATOM 0 HB3 LEU A 51 -1.694 -2.687 8.717 1.00 0.00 H new ATOM 0 HG LEU A 51 -3.712 -2.170 10.125 1.00 0.00 H new ATOM 0 HD11 LEU A 51 -5.690 -3.613 9.907 1.00 0.00 H new ATOM 0 HD12 LEU A 51 -5.455 -2.580 8.477 1.00 0.00 H new ATOM 0 HD13 LEU A 51 -5.016 -4.304 8.412 1.00 0.00 H new ATOM 0 HD21 LEU A 51 -3.737 -4.348 11.261 1.00 0.00 H new ATOM 0 HD22 LEU A 51 -2.936 -5.087 9.854 1.00 0.00 H new ATOM 0 HD23 LEU A 51 -2.090 -3.847 10.810 1.00 0.00 H new ATOM 789 N GLY A 52 -2.808 0.730 8.211 1.00 0.00 N ATOM 790 CA GLY A 52 -2.092 1.953 8.533 1.00 0.00 C ATOM 791 C GLY A 52 -2.658 3.141 7.752 1.00 0.00 C ATOM 792 O GLY A 52 -2.884 4.209 8.318 1.00 0.00 O ATOM 0 H GLY A 52 -3.820 0.785 8.326 1.00 0.00 H new ATOM 0 HA2 GLY A 52 -2.163 2.149 9.603 1.00 0.00 H new ATOM 0 HA3 GLY A 52 -1.034 1.831 8.301 1.00 0.00 H new ATOM 796 N LEU A 53 -2.870 2.914 6.464 1.00 0.00 N ATOM 797 CA LEU A 53 -3.405 3.952 5.600 1.00 0.00 C ATOM 798 C LEU A 53 -4.933 3.903 5.636 1.00 0.00 C ATOM 799 O LEU A 53 -5.547 3.065 4.977 1.00 0.00 O ATOM 800 CB LEU A 53 -2.819 3.831 4.191 1.00 0.00 C ATOM 801 CG LEU A 53 -1.863 4.946 3.764 1.00 0.00 C ATOM 802 CD1 LEU A 53 -0.570 4.368 3.185 1.00 0.00 C ATOM 803 CD2 LEU A 53 -2.545 5.912 2.793 1.00 0.00 C ATOM 0 H LEU A 53 -2.681 2.027 5.998 1.00 0.00 H new ATOM 0 HA LEU A 53 -3.109 4.937 5.960 1.00 0.00 H new ATOM 0 HB2 LEU A 53 -2.291 2.880 4.119 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -3.643 3.793 3.478 1.00 0.00 H new ATOM 0 HG LEU A 53 -1.591 5.520 4.650 1.00 0.00 H new ATOM 0 HD11 LEU A 53 0.092 5.182 2.889 1.00 0.00 H new ATOM 0 HD12 LEU A 53 -0.076 3.754 3.939 1.00 0.00 H new ATOM 0 HD13 LEU A 53 -0.803 3.755 2.314 1.00 0.00 H new ATOM 0 HD21 LEU A 53 -1.843 6.695 2.505 1.00 0.00 H new ATOM 0 HD22 LEU A 53 -2.866 5.368 1.905 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -3.412 6.362 3.276 1.00 0.00 H new ATOM 815 N LYS A 54 -5.504 4.812 6.414 1.00 0.00 N ATOM 816 CA LYS A 54 -6.950 4.883 6.545 1.00 0.00 C ATOM 817 C LYS A 54 -7.391 6.347 6.498 1.00 0.00 C ATOM 818 O LYS A 54 -6.565 7.251 6.614 1.00 0.00 O ATOM 819 CB LYS A 54 -7.410 4.141 7.802 1.00 0.00 C ATOM 820 CG LYS A 54 -7.729 2.678 7.489 1.00 0.00 C ATOM 821 CD LYS A 54 -8.105 1.915 8.761 1.00 0.00 C ATOM 822 CE LYS A 54 -6.872 1.661 9.631 1.00 0.00 C ATOM 823 NZ LYS A 54 -6.073 0.542 9.084 1.00 0.00 N ATOM 0 H LYS A 54 -4.992 5.505 6.960 1.00 0.00 H new ATOM 0 HA LYS A 54 -7.434 4.378 5.709 1.00 0.00 H new ATOM 0 HB2 LYS A 54 -6.632 4.192 8.564 1.00 0.00 H new ATOM 0 HB3 LYS A 54 -8.293 4.629 8.214 1.00 0.00 H new ATOM 0 HG2 LYS A 54 -8.550 2.626 6.773 1.00 0.00 H new ATOM 0 HG3 LYS A 54 -6.866 2.206 7.019 1.00 0.00 H new ATOM 0 HD2 LYS A 54 -8.843 2.484 9.326 1.00 0.00 H new ATOM 0 HD3 LYS A 54 -8.570 0.965 8.496 1.00 0.00 H new ATOM 0 HE2 LYS A 54 -6.261 2.563 9.678 1.00 0.00 H new ATOM 0 HE3 LYS A 54 -7.180 1.431 10.651 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 -5.259 0.361 9.705 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 -6.664 -0.312 9.030 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 -5.734 0.790 8.132 1.00 0.00 H new ATOM 837 N VAL A 55 -8.691 6.535 6.329 1.00 0.00 N ATOM 838 CA VAL A 55 -9.252 7.874 6.266 1.00 0.00 C ATOM 839 C VAL A 55 -10.570 7.908 7.042 1.00 0.00 C ATOM 840 O VAL A 55 -11.599 7.455 6.543 1.00 0.00 O ATOM 841 CB VAL A 55 -9.405 8.309 4.807 1.00 0.00 C ATOM 842 CG1 VAL A 55 -10.218 9.601 4.703 1.00 0.00 C ATOM 843 CG2 VAL A 55 -8.040 8.464 4.134 1.00 0.00 C ATOM 0 H VAL A 55 -9.373 5.782 6.234 1.00 0.00 H new ATOM 0 HA VAL A 55 -8.580 8.592 6.736 1.00 0.00 H new ATOM 0 HB VAL A 55 -9.950 7.526 4.280 1.00 0.00 H new ATOM 0 HG11 VAL A 55 -10.312 9.888 3.656 1.00 0.00 H new ATOM 0 HG12 VAL A 55 -11.210 9.442 5.126 1.00 0.00 H new ATOM 0 HG13 VAL A 55 -9.712 10.395 5.253 1.00 0.00 H new ATOM 0 HG21 VAL A 55 -8.178 8.774 3.098 1.00 0.00 H new ATOM 0 HG22 VAL A 55 -7.457 9.217 4.663 1.00 0.00 H new ATOM 0 HG23 VAL A 55 -7.511 7.511 4.160 1.00 0.00 H new ATOM 853 N LYS A 56 -10.495 8.448 8.249 1.00 0.00 N ATOM 854 CA LYS A 56 -11.670 8.546 9.099 1.00 0.00 C ATOM 855 C LYS A 56 -12.501 7.269 8.963 1.00 0.00 C ATOM 856 O LYS A 56 -13.712 7.331 8.759 1.00 0.00 O ATOM 857 CB LYS A 56 -12.451 9.824 8.787 1.00 0.00 C ATOM 858 CG LYS A 56 -13.054 9.769 7.382 1.00 0.00 C ATOM 859 CD LYS A 56 -14.322 10.621 7.296 1.00 0.00 C ATOM 860 CE LYS A 56 -14.502 11.194 5.888 1.00 0.00 C ATOM 861 NZ LYS A 56 -13.844 12.515 5.778 1.00 0.00 N ATOM 0 H LYS A 56 -9.639 8.822 8.659 1.00 0.00 H new ATOM 0 HA LYS A 56 -11.377 8.626 10.146 1.00 0.00 H new ATOM 0 HB2 LYS A 56 -13.245 9.958 9.522 1.00 0.00 H new ATOM 0 HB3 LYS A 56 -11.791 10.687 8.870 1.00 0.00 H new ATOM 0 HG2 LYS A 56 -12.323 10.123 6.655 1.00 0.00 H new ATOM 0 HG3 LYS A 56 -13.287 8.736 7.123 1.00 0.00 H new ATOM 0 HD2 LYS A 56 -15.190 10.016 7.560 1.00 0.00 H new ATOM 0 HD3 LYS A 56 -14.268 11.434 8.020 1.00 0.00 H new ATOM 0 HE2 LYS A 56 -14.080 10.508 5.153 1.00 0.00 H new ATOM 0 HE3 LYS A 56 -15.564 11.290 5.661 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 -13.976 12.889 4.817 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 -14.266 13.171 6.466 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 -12.828 12.414 5.974 1.00 0.00 H new ATOM 875 N GLY A 57 -11.817 6.140 9.081 1.00 0.00 N ATOM 876 CA GLY A 57 -12.476 4.850 8.974 1.00 0.00 C ATOM 877 C GLY A 57 -11.981 4.081 7.748 1.00 0.00 C ATOM 878 O GLY A 57 -11.091 3.239 7.856 1.00 0.00 O ATOM 0 H GLY A 57 -10.812 6.092 9.250 1.00 0.00 H new ATOM 0 HA2 GLY A 57 -12.288 4.266 9.875 1.00 0.00 H new ATOM 0 HA3 GLY A 57 -13.554 4.993 8.907 1.00 0.00 H new ATOM 882 N LYS A 58 -12.579 4.399 6.609 1.00 0.00 N ATOM 883 CA LYS A 58 -12.210 3.748 5.363 1.00 0.00 C ATOM 884 C LYS A 58 -10.960 4.421 4.793 1.00 0.00 C ATOM 885 O LYS A 58 -10.705 5.594 5.059 1.00 0.00 O ATOM 886 CB LYS A 58 -13.395 3.732 4.395 1.00 0.00 C ATOM 887 CG LYS A 58 -14.513 2.825 4.914 1.00 0.00 C ATOM 888 CD LYS A 58 -15.789 3.002 4.088 1.00 0.00 C ATOM 889 CE LYS A 58 -16.767 1.851 4.336 1.00 0.00 C ATOM 890 NZ LYS A 58 -17.508 2.065 5.599 1.00 0.00 N ATOM 0 H LYS A 58 -13.316 5.099 6.523 1.00 0.00 H new ATOM 0 HA LYS A 58 -11.958 2.702 5.539 1.00 0.00 H new ATOM 0 HB2 LYS A 58 -13.775 4.745 4.263 1.00 0.00 H new ATOM 0 HB3 LYS A 58 -13.065 3.385 3.416 1.00 0.00 H new ATOM 0 HG2 LYS A 58 -14.191 1.785 4.874 1.00 0.00 H new ATOM 0 HG3 LYS A 58 -14.717 3.055 5.960 1.00 0.00 H new ATOM 0 HD2 LYS A 58 -16.264 3.949 4.344 1.00 0.00 H new ATOM 0 HD3 LYS A 58 -15.537 3.048 3.028 1.00 0.00 H new ATOM 0 HE2 LYS A 58 -17.468 1.776 3.504 1.00 0.00 H new ATOM 0 HE3 LYS A 58 -16.223 0.907 4.382 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 -18.167 1.276 5.753 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 -16.836 2.114 6.391 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 -18.042 2.956 5.542 1.00 0.00 H new ATOM 904 N PRO A 59 -10.192 3.628 3.997 1.00 0.00 N ATOM 905 CA PRO A 59 -8.975 4.134 3.387 1.00 0.00 C ATOM 906 C PRO A 59 -9.295 5.061 2.213 1.00 0.00 C ATOM 907 O PRO A 59 -10.385 4.998 1.647 1.00 0.00 O ATOM 908 CB PRO A 59 -8.198 2.895 2.972 1.00 0.00 C ATOM 909 CG PRO A 59 -9.209 1.760 2.941 1.00 0.00 C ATOM 910 CD PRO A 59 -10.462 2.233 3.660 1.00 0.00 C ATOM 0 HA PRO A 59 -8.386 4.747 4.069 1.00 0.00 H new ATOM 0 HB2 PRO A 59 -7.736 3.033 1.995 1.00 0.00 H new ATOM 0 HB3 PRO A 59 -7.395 2.683 3.678 1.00 0.00 H new ATOM 0 HG2 PRO A 59 -9.441 1.483 1.913 1.00 0.00 H new ATOM 0 HG3 PRO A 59 -8.802 0.873 3.426 1.00 0.00 H new ATOM 0 HD2 PRO A 59 -11.342 2.143 3.023 1.00 0.00 H new ATOM 0 HD3 PRO A 59 -10.653 1.640 4.554 1.00 0.00 H new ATOM 918 N ALA A 60 -8.324 5.900 1.881 1.00 0.00 N ATOM 919 CA ALA A 60 -8.489 6.839 0.784 1.00 0.00 C ATOM 920 C ALA A 60 -9.043 6.099 -0.435 1.00 0.00 C ATOM 921 O ALA A 60 -8.919 4.880 -0.535 1.00 0.00 O ATOM 922 CB ALA A 60 -7.152 7.523 0.493 1.00 0.00 C ATOM 0 H ALA A 60 -7.421 5.949 2.352 1.00 0.00 H new ATOM 0 HA ALA A 60 -9.203 7.619 1.049 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -7.275 8.227 -0.330 1.00 0.00 H new ATOM 0 HB2 ALA A 60 -6.816 8.058 1.381 1.00 0.00 H new ATOM 0 HB3 ALA A 60 -6.411 6.772 0.220 1.00 0.00 H new ATOM 928 N GLU A 61 -9.642 6.869 -1.332 1.00 0.00 N ATOM 929 CA GLU A 61 -10.216 6.302 -2.541 1.00 0.00 C ATOM 930 C GLU A 61 -9.108 5.799 -3.468 1.00 0.00 C ATOM 931 O GLU A 61 -7.928 5.876 -3.131 1.00 0.00 O ATOM 932 CB GLU A 61 -11.108 7.320 -3.253 1.00 0.00 C ATOM 933 CG GLU A 61 -12.397 7.565 -2.467 1.00 0.00 C ATOM 934 CD GLU A 61 -13.599 7.686 -3.407 1.00 0.00 C ATOM 935 OE1 GLU A 61 -13.865 6.693 -4.117 1.00 0.00 O ATOM 936 OE2 GLU A 61 -14.223 8.769 -3.394 1.00 0.00 O ATOM 0 H GLU A 61 -9.742 7.880 -1.246 1.00 0.00 H new ATOM 0 HA GLU A 61 -10.841 5.454 -2.261 1.00 0.00 H new ATOM 0 HB2 GLU A 61 -10.568 8.259 -3.375 1.00 0.00 H new ATOM 0 HB3 GLU A 61 -11.351 6.960 -4.253 1.00 0.00 H new ATOM 0 HG2 GLU A 61 -12.560 6.747 -1.766 1.00 0.00 H new ATOM 0 HG3 GLU A 61 -12.299 8.476 -1.877 1.00 0.00 H new ATOM 943 N ASN A 62 -9.528 5.295 -4.620 1.00 0.00 N ATOM 944 CA ASN A 62 -8.586 4.780 -5.599 1.00 0.00 C ATOM 945 C ASN A 62 -8.082 5.932 -6.471 1.00 0.00 C ATOM 946 O ASN A 62 -6.889 6.021 -6.758 1.00 0.00 O ATOM 947 CB ASN A 62 -9.252 3.750 -6.514 1.00 0.00 C ATOM 948 CG ASN A 62 -9.604 2.477 -5.742 1.00 0.00 C ATOM 949 OD1 ASN A 62 -9.048 2.179 -4.698 1.00 0.00 O ATOM 950 ND2 ASN A 62 -10.557 1.745 -6.313 1.00 0.00 N ATOM 0 H ASN A 62 -10.508 5.233 -4.897 1.00 0.00 H new ATOM 0 HA ASN A 62 -7.764 4.307 -5.061 1.00 0.00 H new ATOM 0 HB2 ASN A 62 -10.155 4.176 -6.950 1.00 0.00 H new ATOM 0 HB3 ASN A 62 -8.584 3.506 -7.340 1.00 0.00 H new ATOM 0 HD21 ASN A 62 -10.864 0.876 -5.876 1.00 0.00 H new ATOM 0 HD22 ASN A 62 -10.981 2.053 -7.188 1.00 0.00 H new ATOM 957 N ASP A 63 -9.015 6.784 -6.867 1.00 0.00 N ATOM 958 CA ASP A 63 -8.680 7.926 -7.700 1.00 0.00 C ATOM 959 C ASP A 63 -8.280 9.103 -6.808 1.00 0.00 C ATOM 960 O ASP A 63 -8.743 10.225 -7.010 1.00 0.00 O ATOM 961 CB ASP A 63 -9.878 8.361 -8.547 1.00 0.00 C ATOM 962 CG ASP A 63 -9.523 8.981 -9.900 1.00 0.00 C ATOM 963 OD1 ASP A 63 -8.536 8.504 -10.501 1.00 0.00 O ATOM 964 OD2 ASP A 63 -10.246 9.917 -10.302 1.00 0.00 O ATOM 0 H ASP A 63 -10.003 6.707 -6.627 1.00 0.00 H new ATOM 0 HA ASP A 63 -7.861 7.635 -8.357 1.00 0.00 H new ATOM 0 HB2 ASP A 63 -10.517 7.494 -8.718 1.00 0.00 H new ATOM 0 HB3 ASP A 63 -10.464 9.082 -7.977 1.00 0.00 H new ATOM 969 N VAL A 64 -7.425 8.807 -5.840 1.00 0.00 N ATOM 970 CA VAL A 64 -6.958 9.827 -4.917 1.00 0.00 C ATOM 971 C VAL A 64 -5.452 10.024 -5.100 1.00 0.00 C ATOM 972 O VAL A 64 -4.738 9.086 -5.452 1.00 0.00 O ATOM 973 CB VAL A 64 -7.341 9.450 -3.484 1.00 0.00 C ATOM 974 CG1 VAL A 64 -6.318 9.989 -2.483 1.00 0.00 C ATOM 975 CG2 VAL A 64 -8.750 9.942 -3.146 1.00 0.00 C ATOM 0 H VAL A 64 -7.044 7.875 -5.675 1.00 0.00 H new ATOM 0 HA VAL A 64 -7.439 10.782 -5.128 1.00 0.00 H new ATOM 0 HB VAL A 64 -7.339 8.362 -3.412 1.00 0.00 H new ATOM 0 HG11 VAL A 64 -6.614 9.707 -1.473 1.00 0.00 H new ATOM 0 HG12 VAL A 64 -5.337 9.569 -2.704 1.00 0.00 H new ATOM 0 HG13 VAL A 64 -6.273 11.075 -2.558 1.00 0.00 H new ATOM 0 HG21 VAL A 64 -8.998 9.661 -2.122 1.00 0.00 H new ATOM 0 HG22 VAL A 64 -8.790 11.027 -3.245 1.00 0.00 H new ATOM 0 HG23 VAL A 64 -9.467 9.489 -3.830 1.00 0.00 H new ATOM 985 N LYS A 65 -5.013 11.249 -4.854 1.00 0.00 N ATOM 986 CA LYS A 65 -3.605 11.581 -4.988 1.00 0.00 C ATOM 987 C LYS A 65 -2.888 11.286 -3.669 1.00 0.00 C ATOM 988 O LYS A 65 -3.133 11.950 -2.663 1.00 0.00 O ATOM 989 CB LYS A 65 -3.438 13.024 -5.469 1.00 0.00 C ATOM 990 CG LYS A 65 -3.145 13.071 -6.970 1.00 0.00 C ATOM 991 CD LYS A 65 -1.729 13.585 -7.237 1.00 0.00 C ATOM 992 CE LYS A 65 -1.759 14.855 -8.090 1.00 0.00 C ATOM 993 NZ LYS A 65 -0.461 15.563 -8.010 1.00 0.00 N ATOM 0 H LYS A 65 -5.608 12.025 -4.562 1.00 0.00 H new ATOM 0 HA LYS A 65 -3.138 10.959 -5.751 1.00 0.00 H new ATOM 0 HB2 LYS A 65 -4.344 13.590 -5.254 1.00 0.00 H new ATOM 0 HB3 LYS A 65 -2.626 13.502 -4.921 1.00 0.00 H new ATOM 0 HG2 LYS A 65 -3.261 12.075 -7.398 1.00 0.00 H new ATOM 0 HG3 LYS A 65 -3.870 13.717 -7.465 1.00 0.00 H new ATOM 0 HD2 LYS A 65 -1.228 13.790 -6.291 1.00 0.00 H new ATOM 0 HD3 LYS A 65 -1.148 12.815 -7.745 1.00 0.00 H new ATOM 0 HE2 LYS A 65 -1.977 14.599 -9.127 1.00 0.00 H new ATOM 0 HE3 LYS A 65 -2.560 15.511 -7.748 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 -0.609 16.579 -8.178 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 -0.048 15.425 -7.066 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 0.187 15.183 -8.730 1.00 0.00 H new ATOM 1007 N LEU A 66 -2.017 10.289 -3.716 1.00 0.00 N ATOM 1008 CA LEU A 66 -1.263 9.897 -2.537 1.00 0.00 C ATOM 1009 C LEU A 66 -0.627 11.139 -1.908 1.00 0.00 C ATOM 1010 O LEU A 66 -0.360 11.164 -0.708 1.00 0.00 O ATOM 1011 CB LEU A 66 -0.256 8.800 -2.885 1.00 0.00 C ATOM 1012 CG LEU A 66 -0.846 7.490 -3.412 1.00 0.00 C ATOM 1013 CD1 LEU A 66 -0.049 6.972 -4.611 1.00 0.00 C ATOM 1014 CD2 LEU A 66 -0.948 6.447 -2.297 1.00 0.00 C ATOM 0 H LEU A 66 -1.816 9.741 -4.552 1.00 0.00 H new ATOM 0 HA LEU A 66 -1.925 9.463 -1.788 1.00 0.00 H new ATOM 0 HB2 LEU A 66 0.434 9.191 -3.633 1.00 0.00 H new ATOM 0 HB3 LEU A 66 0.332 8.578 -1.994 1.00 0.00 H new ATOM 0 HG LEU A 66 -1.859 7.688 -3.761 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -0.490 6.040 -4.966 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -0.073 7.712 -5.411 1.00 0.00 H new ATOM 0 HD13 LEU A 66 0.984 6.794 -4.312 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -1.370 5.526 -2.698 1.00 0.00 H new ATOM 0 HD22 LEU A 66 0.045 6.246 -1.895 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -1.591 6.825 -1.503 1.00 0.00 H new ATOM 1026 N GLY A 67 -0.402 12.139 -2.748 1.00 0.00 N ATOM 1027 CA GLY A 67 0.198 13.380 -2.290 1.00 0.00 C ATOM 1028 C GLY A 67 -0.813 14.223 -1.511 1.00 0.00 C ATOM 1029 O GLY A 67 -0.482 14.797 -0.475 1.00 0.00 O ATOM 0 H GLY A 67 -0.625 12.115 -3.743 1.00 0.00 H new ATOM 0 HA2 GLY A 67 1.058 13.160 -1.657 1.00 0.00 H new ATOM 0 HA3 GLY A 67 0.567 13.947 -3.145 1.00 0.00 H new ATOM 1033 N ALA A 68 -2.027 14.272 -2.040 1.00 0.00 N ATOM 1034 CA ALA A 68 -3.089 15.035 -1.408 1.00 0.00 C ATOM 1035 C ALA A 68 -3.171 14.658 0.073 1.00 0.00 C ATOM 1036 O ALA A 68 -3.559 15.477 0.905 1.00 0.00 O ATOM 1037 CB ALA A 68 -4.406 14.786 -2.146 1.00 0.00 C ATOM 0 H ALA A 68 -2.298 13.795 -2.900 1.00 0.00 H new ATOM 0 HA ALA A 68 -2.880 16.103 -1.465 1.00 0.00 H new ATOM 0 HB1 ALA A 68 -5.203 15.359 -1.672 1.00 0.00 H new ATOM 0 HB2 ALA A 68 -4.305 15.097 -3.186 1.00 0.00 H new ATOM 0 HB3 ALA A 68 -4.650 13.724 -2.107 1.00 0.00 H new ATOM 1043 N LEU A 69 -2.798 13.419 0.356 1.00 0.00 N ATOM 1044 CA LEU A 69 -2.824 12.923 1.722 1.00 0.00 C ATOM 1045 C LEU A 69 -1.591 13.436 2.469 1.00 0.00 C ATOM 1046 O LEU A 69 -1.642 13.663 3.677 1.00 0.00 O ATOM 1047 CB LEU A 69 -2.963 11.400 1.737 1.00 0.00 C ATOM 1048 CG LEU A 69 -4.393 10.856 1.704 1.00 0.00 C ATOM 1049 CD1 LEU A 69 -5.245 11.490 2.806 1.00 0.00 C ATOM 1050 CD2 LEU A 69 -5.017 11.039 0.319 1.00 0.00 C ATOM 0 H LEU A 69 -2.476 12.743 -0.337 1.00 0.00 H new ATOM 0 HA LEU A 69 -3.699 13.304 2.249 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -2.423 10.997 0.880 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -2.471 11.019 2.632 1.00 0.00 H new ATOM 0 HG LEU A 69 -4.357 9.785 1.901 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -6.257 11.087 2.761 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -4.808 11.265 3.779 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -5.278 12.570 2.664 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -6.033 10.644 0.323 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -5.041 12.099 0.068 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -4.422 10.504 -0.422 1.00 0.00 H new ATOM 1062 N LYS A 70 -0.511 13.603 1.719 1.00 0.00 N ATOM 1063 CA LYS A 70 0.733 14.084 2.296 1.00 0.00 C ATOM 1064 C LYS A 70 1.077 13.246 3.528 1.00 0.00 C ATOM 1065 O LYS A 70 1.169 13.772 4.636 1.00 0.00 O ATOM 1066 CB LYS A 70 0.647 15.586 2.578 1.00 0.00 C ATOM 1067 CG LYS A 70 1.360 16.389 1.488 1.00 0.00 C ATOM 1068 CD LYS A 70 2.877 16.212 1.580 1.00 0.00 C ATOM 1069 CE LYS A 70 3.543 17.471 2.138 1.00 0.00 C ATOM 1070 NZ LYS A 70 4.975 17.220 2.417 1.00 0.00 N ATOM 0 H LYS A 70 -0.472 13.414 0.717 1.00 0.00 H new ATOM 0 HA LYS A 70 1.553 13.962 1.589 1.00 0.00 H new ATOM 0 HB2 LYS A 70 -0.398 15.890 2.634 1.00 0.00 H new ATOM 0 HB3 LYS A 70 1.095 15.804 3.547 1.00 0.00 H new ATOM 0 HG2 LYS A 70 1.012 16.066 0.507 1.00 0.00 H new ATOM 0 HG3 LYS A 70 1.107 17.445 1.585 1.00 0.00 H new ATOM 0 HD2 LYS A 70 3.109 15.360 2.219 1.00 0.00 H new ATOM 0 HD3 LYS A 70 3.281 15.990 0.592 1.00 0.00 H new ATOM 0 HE2 LYS A 70 3.443 18.289 1.424 1.00 0.00 H new ATOM 0 HE3 LYS A 70 3.037 17.782 3.052 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 5.412 18.085 2.795 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 5.064 16.454 3.115 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 5.457 16.945 1.537 1.00 0.00 H new ATOM 1084 N LEU A 71 1.258 11.954 3.294 1.00 0.00 N ATOM 1085 CA LEU A 71 1.590 11.038 4.372 1.00 0.00 C ATOM 1086 C LEU A 71 3.081 11.153 4.693 1.00 0.00 C ATOM 1087 O LEU A 71 3.792 11.948 4.079 1.00 0.00 O ATOM 1088 CB LEU A 71 1.145 9.616 4.022 1.00 0.00 C ATOM 1089 CG LEU A 71 -0.332 9.446 3.658 1.00 0.00 C ATOM 1090 CD1 LEU A 71 -0.492 8.573 2.412 1.00 0.00 C ATOM 1091 CD2 LEU A 71 -1.130 8.904 4.845 1.00 0.00 C ATOM 0 H LEU A 71 1.181 11.520 2.374 1.00 0.00 H new ATOM 0 HA LEU A 71 1.047 11.304 5.279 1.00 0.00 H new ATOM 0 HB2 LEU A 71 1.748 9.263 3.185 1.00 0.00 H new ATOM 0 HB3 LEU A 71 1.367 8.968 4.870 1.00 0.00 H new ATOM 0 HG LEU A 71 -0.740 10.428 3.418 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -1.551 8.468 2.175 1.00 0.00 H new ATOM 0 HD12 LEU A 71 0.023 9.039 1.572 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -0.063 7.589 2.600 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -2.176 8.793 4.560 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -0.729 7.934 5.141 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -1.054 9.598 5.682 1.00 0.00 H new ATOM 1103 N LYS A 72 3.512 10.349 5.653 1.00 0.00 N ATOM 1104 CA LYS A 72 4.906 10.351 6.063 1.00 0.00 C ATOM 1105 C LYS A 72 5.728 9.537 5.062 1.00 0.00 C ATOM 1106 O LYS A 72 5.186 8.698 4.344 1.00 0.00 O ATOM 1107 CB LYS A 72 5.040 9.867 7.508 1.00 0.00 C ATOM 1108 CG LYS A 72 4.426 10.873 8.483 1.00 0.00 C ATOM 1109 CD LYS A 72 4.715 10.478 9.933 1.00 0.00 C ATOM 1110 CE LYS A 72 5.975 11.174 10.451 1.00 0.00 C ATOM 1111 NZ LYS A 72 6.422 10.560 11.721 1.00 0.00 N ATOM 0 H LYS A 72 2.920 9.691 6.160 1.00 0.00 H new ATOM 0 HA LYS A 72 5.305 11.365 6.053 1.00 0.00 H new ATOM 0 HB2 LYS A 72 4.547 8.901 7.619 1.00 0.00 H new ATOM 0 HB3 LYS A 72 6.092 9.718 7.749 1.00 0.00 H new ATOM 0 HG2 LYS A 72 4.827 11.867 8.286 1.00 0.00 H new ATOM 0 HG3 LYS A 72 3.349 10.927 8.325 1.00 0.00 H new ATOM 0 HD2 LYS A 72 3.865 10.742 10.562 1.00 0.00 H new ATOM 0 HD3 LYS A 72 4.838 9.397 10.001 1.00 0.00 H new ATOM 0 HE2 LYS A 72 6.768 11.103 9.707 1.00 0.00 H new ATOM 0 HE3 LYS A 72 5.775 12.235 10.604 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 7.278 11.045 12.058 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 5.670 10.650 12.434 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 6.633 9.554 11.565 1.00 0.00 H new ATOM 1125 N PRO A 73 7.058 9.819 5.047 1.00 0.00 N ATOM 1126 CA PRO A 73 7.961 9.123 4.146 1.00 0.00 C ATOM 1127 C PRO A 73 8.234 7.699 4.636 1.00 0.00 C ATOM 1128 O PRO A 73 8.151 7.424 5.832 1.00 0.00 O ATOM 1129 CB PRO A 73 9.212 9.985 4.099 1.00 0.00 C ATOM 1130 CG PRO A 73 9.147 10.881 5.325 1.00 0.00 C ATOM 1131 CD PRO A 73 7.736 10.806 5.883 1.00 0.00 C ATOM 0 HA PRO A 73 7.544 8.996 3.147 1.00 0.00 H new ATOM 0 HB2 PRO A 73 10.111 9.369 4.113 1.00 0.00 H new ATOM 0 HB3 PRO A 73 9.245 10.577 3.184 1.00 0.00 H new ATOM 0 HG2 PRO A 73 9.871 10.557 6.073 1.00 0.00 H new ATOM 0 HG3 PRO A 73 9.399 11.908 5.061 1.00 0.00 H new ATOM 0 HD2 PRO A 73 7.740 10.502 6.930 1.00 0.00 H new ATOM 0 HD3 PRO A 73 7.239 11.775 5.834 1.00 0.00 H new ATOM 1139 N ASN A 74 8.554 6.832 3.687 1.00 0.00 N ATOM 1140 CA ASN A 74 8.840 5.444 4.007 1.00 0.00 C ATOM 1141 C ASN A 74 7.835 4.948 5.048 1.00 0.00 C ATOM 1142 O ASN A 74 8.209 4.266 6.002 1.00 0.00 O ATOM 1143 CB ASN A 74 10.244 5.292 4.595 1.00 0.00 C ATOM 1144 CG ASN A 74 10.573 6.453 5.536 1.00 0.00 C ATOM 1145 OD1 ASN A 74 10.868 7.560 5.119 1.00 0.00 O ATOM 1146 ND2 ASN A 74 10.505 6.138 6.827 1.00 0.00 N ATOM 0 H ASN A 74 8.622 7.064 2.696 1.00 0.00 H new ATOM 0 HA ASN A 74 8.770 4.864 3.086 1.00 0.00 H new ATOM 0 HB2 ASN A 74 10.315 4.349 5.137 1.00 0.00 H new ATOM 0 HB3 ASN A 74 10.977 5.253 3.789 1.00 0.00 H new ATOM 0 HD21 ASN A 74 10.706 6.844 7.535 1.00 0.00 H new ATOM 0 HD22 ASN A 74 10.252 5.191 7.108 1.00 0.00 H new ATOM 1153 N THR A 75 6.579 5.309 4.830 1.00 0.00 N ATOM 1154 CA THR A 75 5.517 4.909 5.738 1.00 0.00 C ATOM 1155 C THR A 75 5.376 3.385 5.756 1.00 0.00 C ATOM 1156 O THR A 75 4.800 2.801 4.840 1.00 0.00 O ATOM 1157 CB THR A 75 4.237 5.632 5.316 1.00 0.00 C ATOM 1158 OG1 THR A 75 4.347 6.916 5.925 1.00 0.00 O ATOM 1159 CG2 THR A 75 2.984 5.025 5.952 1.00 0.00 C ATOM 0 H THR A 75 6.273 5.874 4.038 1.00 0.00 H new ATOM 0 HA THR A 75 5.746 5.195 6.765 1.00 0.00 H new ATOM 0 HB THR A 75 4.144 5.601 4.230 1.00 0.00 H new ATOM 0 HG1 THR A 75 4.281 7.611 5.237 1.00 0.00 H new ATOM 0 HG21 THR A 75 2.104 5.575 5.619 1.00 0.00 H new ATOM 0 HG22 THR A 75 2.893 3.981 5.653 1.00 0.00 H new ATOM 0 HG23 THR A 75 3.061 5.086 7.038 1.00 0.00 H new ATOM 1167 N LYS A 76 5.913 2.786 6.809 1.00 0.00 N ATOM 1168 CA LYS A 76 5.855 1.342 6.958 1.00 0.00 C ATOM 1169 C LYS A 76 4.427 0.928 7.320 1.00 0.00 C ATOM 1170 O LYS A 76 4.034 0.995 8.483 1.00 0.00 O ATOM 1171 CB LYS A 76 6.907 0.864 7.961 1.00 0.00 C ATOM 1172 CG LYS A 76 8.303 1.343 7.561 1.00 0.00 C ATOM 1173 CD LYS A 76 9.161 1.625 8.796 1.00 0.00 C ATOM 1174 CE LYS A 76 8.793 2.970 9.424 1.00 0.00 C ATOM 1175 NZ LYS A 76 9.864 3.427 10.337 1.00 0.00 N ATOM 0 H LYS A 76 6.390 3.274 7.567 1.00 0.00 H new ATOM 0 HA LYS A 76 6.100 0.852 6.016 1.00 0.00 H new ATOM 0 HB2 LYS A 76 6.662 1.236 8.956 1.00 0.00 H new ATOM 0 HB3 LYS A 76 6.894 -0.225 8.016 1.00 0.00 H new ATOM 0 HG2 LYS A 76 8.787 0.587 6.942 1.00 0.00 H new ATOM 0 HG3 LYS A 76 8.222 2.246 6.956 1.00 0.00 H new ATOM 0 HD2 LYS A 76 9.024 0.829 9.528 1.00 0.00 H new ATOM 0 HD3 LYS A 76 10.215 1.626 8.518 1.00 0.00 H new ATOM 0 HE2 LYS A 76 8.633 3.712 8.641 1.00 0.00 H new ATOM 0 HE3 LYS A 76 7.855 2.878 9.972 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 9.598 4.341 10.754 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 9.997 2.726 11.094 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 10.751 3.535 9.805 1.00 0.00 H new ATOM 1189 N ILE A 77 3.689 0.510 6.301 1.00 0.00 N ATOM 1190 CA ILE A 77 2.314 0.086 6.498 1.00 0.00 C ATOM 1191 C ILE A 77 2.246 -1.442 6.461 1.00 0.00 C ATOM 1192 O ILE A 77 3.099 -2.091 5.858 1.00 0.00 O ATOM 1193 CB ILE A 77 1.393 0.767 5.483 1.00 0.00 C ATOM 1194 CG1 ILE A 77 1.668 0.260 4.066 1.00 0.00 C ATOM 1195 CG2 ILE A 77 1.503 2.290 5.579 1.00 0.00 C ATOM 1196 CD1 ILE A 77 0.698 -0.861 3.687 1.00 0.00 C ATOM 0 H ILE A 77 4.018 0.456 5.337 1.00 0.00 H new ATOM 0 HA ILE A 77 1.956 0.398 7.479 1.00 0.00 H new ATOM 0 HB ILE A 77 0.363 0.503 5.725 1.00 0.00 H new ATOM 0 HG12 ILE A 77 1.574 1.082 3.357 1.00 0.00 H new ATOM 0 HG13 ILE A 77 2.693 -0.103 3.998 1.00 0.00 H new ATOM 0 HG21 ILE A 77 0.839 2.750 4.847 1.00 0.00 H new ATOM 0 HG22 ILE A 77 1.219 2.613 6.581 1.00 0.00 H new ATOM 0 HG23 ILE A 77 2.530 2.594 5.378 1.00 0.00 H new ATOM 0 HD11 ILE A 77 0.915 -1.203 2.675 1.00 0.00 H new ATOM 0 HD12 ILE A 77 0.812 -1.692 4.383 1.00 0.00 H new ATOM 0 HD13 ILE A 77 -0.325 -0.488 3.732 1.00 0.00 H new ATOM 1208 N MET A 78 1.223 -1.973 7.114 1.00 0.00 N ATOM 1209 CA MET A 78 1.032 -3.412 7.164 1.00 0.00 C ATOM 1210 C MET A 78 0.107 -3.882 6.039 1.00 0.00 C ATOM 1211 O MET A 78 -0.644 -3.088 5.475 1.00 0.00 O ATOM 1212 CB MET A 78 0.431 -3.802 8.516 1.00 0.00 C ATOM 1213 CG MET A 78 1.356 -4.755 9.274 1.00 0.00 C ATOM 1214 SD MET A 78 1.554 -4.203 10.960 1.00 0.00 S ATOM 1215 CE MET A 78 3.227 -3.584 10.889 1.00 0.00 C ATOM 0 H MET A 78 0.517 -1.432 7.613 1.00 0.00 H new ATOM 0 HA MET A 78 2.002 -3.892 7.036 1.00 0.00 H new ATOM 0 HB2 MET A 78 0.258 -2.906 9.113 1.00 0.00 H new ATOM 0 HB3 MET A 78 -0.539 -4.276 8.364 1.00 0.00 H new ATOM 0 HG2 MET A 78 0.943 -5.764 9.259 1.00 0.00 H new ATOM 0 HG3 MET A 78 2.327 -4.801 8.781 1.00 0.00 H new ATOM 0 HE1 MET A 78 3.514 -3.198 11.867 1.00 0.00 H new ATOM 0 HE2 MET A 78 3.902 -4.391 10.605 1.00 0.00 H new ATOM 0 HE3 MET A 78 3.288 -2.784 10.151 1.00 0.00 H new ATOM 1225 N MET A 79 0.192 -5.172 5.747 1.00 0.00 N ATOM 1226 CA MET A 79 -0.628 -5.757 4.700 1.00 0.00 C ATOM 1227 C MET A 79 -1.272 -7.062 5.172 1.00 0.00 C ATOM 1228 O MET A 79 -0.680 -7.803 5.955 1.00 0.00 O ATOM 1229 CB MET A 79 0.236 -6.031 3.467 1.00 0.00 C ATOM 1230 CG MET A 79 -0.620 -6.098 2.201 1.00 0.00 C ATOM 1231 SD MET A 79 0.341 -6.757 0.849 1.00 0.00 S ATOM 1232 CE MET A 79 -0.325 -8.411 0.774 1.00 0.00 C ATOM 0 H MET A 79 0.816 -5.828 6.217 1.00 0.00 H new ATOM 0 HA MET A 79 -1.421 -5.052 4.450 1.00 0.00 H new ATOM 0 HB2 MET A 79 0.986 -5.247 3.362 1.00 0.00 H new ATOM 0 HB3 MET A 79 0.774 -6.970 3.597 1.00 0.00 H new ATOM 0 HG2 MET A 79 -1.494 -6.725 2.376 1.00 0.00 H new ATOM 0 HG3 MET A 79 -0.986 -5.103 1.947 1.00 0.00 H new ATOM 0 HE1 MET A 79 0.367 -9.058 0.235 1.00 0.00 H new ATOM 0 HE2 MET A 79 -0.466 -8.793 1.785 1.00 0.00 H new ATOM 0 HE3 MET A 79 -1.284 -8.394 0.256 1.00 0.00 H new ATOM 1242 N MET A 80 -2.478 -7.302 4.677 1.00 0.00 N ATOM 1243 CA MET A 80 -3.209 -8.505 5.039 1.00 0.00 C ATOM 1244 C MET A 80 -3.975 -9.063 3.838 1.00 0.00 C ATOM 1245 O MET A 80 -4.646 -8.319 3.125 1.00 0.00 O ATOM 1246 CB MET A 80 -4.191 -8.185 6.168 1.00 0.00 C ATOM 1247 CG MET A 80 -3.600 -8.554 7.530 1.00 0.00 C ATOM 1248 SD MET A 80 -4.598 -9.812 8.309 1.00 0.00 S ATOM 1249 CE MET A 80 -5.813 -8.785 9.119 1.00 0.00 C ATOM 0 H MET A 80 -2.967 -6.684 4.029 1.00 0.00 H new ATOM 0 HA MET A 80 -2.493 -9.257 5.371 1.00 0.00 H new ATOM 0 HB2 MET A 80 -4.438 -7.123 6.150 1.00 0.00 H new ATOM 0 HB3 MET A 80 -5.121 -8.731 6.011 1.00 0.00 H new ATOM 0 HG2 MET A 80 -2.578 -8.913 7.407 1.00 0.00 H new ATOM 0 HG3 MET A 80 -3.552 -7.670 8.166 1.00 0.00 H new ATOM 0 HE1 MET A 80 -6.521 -9.415 9.657 1.00 0.00 H new ATOM 0 HE2 MET A 80 -5.315 -8.117 9.821 1.00 0.00 H new ATOM 0 HE3 MET A 80 -6.346 -8.195 8.373 1.00 0.00 H new ATOM 1259 N GLY A 81 -3.849 -10.369 3.652 1.00 0.00 N ATOM 1260 CA GLY A 81 -4.521 -11.035 2.549 1.00 0.00 C ATOM 1261 C GLY A 81 -3.896 -12.404 2.273 1.00 0.00 C ATOM 1262 O GLY A 81 -3.356 -13.038 3.178 1.00 0.00 O ATOM 0 H GLY A 81 -3.292 -10.983 4.246 1.00 0.00 H new ATOM 0 HA2 GLY A 81 -5.579 -11.155 2.782 1.00 0.00 H new ATOM 0 HA3 GLY A 81 -4.460 -10.416 1.654 1.00 0.00 H new ATOM 1266 N THR A 82 -3.990 -12.820 1.019 1.00 0.00 N ATOM 1267 CA THR A 82 -3.441 -14.102 0.612 1.00 0.00 C ATOM 1268 C THR A 82 -3.554 -14.275 -0.904 1.00 0.00 C ATOM 1269 O THR A 82 -4.364 -13.611 -1.549 1.00 0.00 O ATOM 1270 CB THR A 82 -4.160 -15.197 1.403 1.00 0.00 C ATOM 1271 OG1 THR A 82 -3.488 -16.396 1.026 1.00 0.00 O ATOM 1272 CG2 THR A 82 -5.599 -15.412 0.931 1.00 0.00 C ATOM 0 H THR A 82 -4.439 -12.291 0.271 1.00 0.00 H new ATOM 0 HA THR A 82 -2.376 -14.164 0.836 1.00 0.00 H new ATOM 0 HB THR A 82 -4.161 -14.938 2.462 1.00 0.00 H new ATOM 0 HG1 THR A 82 -2.964 -16.730 1.784 1.00 0.00 H new ATOM 0 HG21 THR A 82 -6.063 -16.199 1.525 1.00 0.00 H new ATOM 0 HG22 THR A 82 -6.163 -14.487 1.050 1.00 0.00 H new ATOM 0 HG23 THR A 82 -5.598 -15.703 -0.119 1.00 0.00 H new ATOM 1280 N ARG A 83 -2.730 -15.169 -1.429 1.00 0.00 N ATOM 1281 CA ARG A 83 -2.727 -15.437 -2.857 1.00 0.00 C ATOM 1282 C ARG A 83 -3.965 -16.247 -3.247 1.00 0.00 C ATOM 1283 O ARG A 83 -4.456 -17.056 -2.461 1.00 0.00 O ATOM 1284 CB ARG A 83 -1.472 -16.207 -3.271 1.00 0.00 C ATOM 1285 CG ARG A 83 -1.450 -17.601 -2.640 1.00 0.00 C ATOM 1286 CD ARG A 83 -0.106 -18.291 -2.880 1.00 0.00 C ATOM 1287 NE ARG A 83 0.940 -17.669 -2.036 1.00 0.00 N ATOM 1288 CZ ARG A 83 1.104 -17.926 -0.732 1.00 0.00 C ATOM 1289 NH1 ARG A 83 0.293 -18.795 -0.113 1.00 0.00 N ATOM 1290 NH2 ARG A 83 2.080 -17.315 -0.046 1.00 0.00 N ATOM 0 H ARG A 83 -2.059 -15.718 -0.891 1.00 0.00 H new ATOM 0 HA ARG A 83 -2.738 -14.478 -3.374 1.00 0.00 H new ATOM 0 HB2 ARG A 83 -1.437 -16.295 -4.357 1.00 0.00 H new ATOM 0 HB3 ARG A 83 -0.584 -15.652 -2.967 1.00 0.00 H new ATOM 0 HG2 ARG A 83 -1.636 -17.522 -1.569 1.00 0.00 H new ATOM 0 HG3 ARG A 83 -2.254 -18.206 -3.059 1.00 0.00 H new ATOM 0 HD2 ARG A 83 -0.187 -19.353 -2.650 1.00 0.00 H new ATOM 0 HD3 ARG A 83 0.170 -18.213 -3.932 1.00 0.00 H new ATOM 0 HE ARG A 83 1.575 -17.003 -2.476 1.00 0.00 H new ATOM 0 HH11 ARG A 83 -0.449 -19.261 -0.635 1.00 0.00 H new ATOM 0 HH12 ARG A 83 0.418 -18.991 0.880 1.00 0.00 H new ATOM 0 HH21 ARG A 83 2.698 -16.654 -0.517 1.00 0.00 H new ATOM 0 HH22 ARG A 83 2.205 -17.511 0.947 1.00 0.00 H new ATOM 1304 N GLU A 84 -4.435 -16.001 -4.462 1.00 0.00 N ATOM 1305 CA GLU A 84 -5.607 -16.697 -4.966 1.00 0.00 C ATOM 1306 C GLU A 84 -6.879 -16.113 -4.347 1.00 0.00 C ATOM 1307 O GLU A 84 -6.820 -15.437 -3.322 1.00 0.00 O ATOM 1308 CB GLU A 84 -5.508 -18.201 -4.699 1.00 0.00 C ATOM 1309 CG GLU A 84 -5.608 -18.996 -6.003 1.00 0.00 C ATOM 1310 CD GLU A 84 -4.227 -19.464 -6.466 1.00 0.00 C ATOM 1311 OE1 GLU A 84 -3.701 -20.401 -5.828 1.00 0.00 O ATOM 1312 OE2 GLU A 84 -3.728 -18.874 -7.449 1.00 0.00 O ATOM 0 H GLU A 84 -4.025 -15.330 -5.112 1.00 0.00 H new ATOM 0 HA GLU A 84 -5.654 -16.555 -6.046 1.00 0.00 H new ATOM 0 HB2 GLU A 84 -4.563 -18.425 -4.204 1.00 0.00 H new ATOM 0 HB3 GLU A 84 -6.304 -18.507 -4.020 1.00 0.00 H new ATOM 0 HG2 GLU A 84 -6.259 -19.858 -5.859 1.00 0.00 H new ATOM 0 HG3 GLU A 84 -6.065 -18.378 -6.776 1.00 0.00 H new ATOM 1319 N SER A 85 -7.998 -16.396 -4.997 1.00 0.00 N ATOM 1320 CA SER A 85 -9.282 -15.907 -4.524 1.00 0.00 C ATOM 1321 C SER A 85 -9.846 -16.858 -3.466 1.00 0.00 C ATOM 1322 O SER A 85 -10.370 -17.920 -3.797 1.00 0.00 O ATOM 1323 CB SER A 85 -10.272 -15.751 -5.680 1.00 0.00 C ATOM 1324 OG SER A 85 -11.072 -14.580 -5.543 1.00 0.00 O ATOM 0 H SER A 85 -8.042 -16.958 -5.847 1.00 0.00 H new ATOM 0 HA SER A 85 -9.131 -14.925 -4.077 1.00 0.00 H new ATOM 0 HB2 SER A 85 -9.726 -15.709 -6.622 1.00 0.00 H new ATOM 0 HB3 SER A 85 -10.918 -16.628 -5.725 1.00 0.00 H new ATOM 0 HG SER A 85 -11.690 -14.515 -6.301 1.00 0.00 H new ATOM 1330 N GLY A 86 -9.720 -16.441 -2.215 1.00 0.00 N ATOM 1331 CA GLY A 86 -10.211 -17.242 -1.106 1.00 0.00 C ATOM 1332 C GLY A 86 -9.248 -17.184 0.081 1.00 0.00 C ATOM 1333 O GLY A 86 -8.059 -16.919 -0.091 1.00 0.00 O ATOM 0 H GLY A 86 -9.285 -15.559 -1.944 1.00 0.00 H new ATOM 0 HA2 GLY A 86 -11.193 -16.882 -0.800 1.00 0.00 H new ATOM 0 HA3 GLY A 86 -10.336 -18.276 -1.427 1.00 0.00 H new ATOM 1337 N PRO A 87 -9.811 -17.442 1.292 1.00 0.00 N ATOM 1338 CA PRO A 87 -9.016 -17.421 2.508 1.00 0.00 C ATOM 1339 C PRO A 87 -8.139 -18.671 2.610 1.00 0.00 C ATOM 1340 O PRO A 87 -8.518 -19.647 3.256 1.00 0.00 O ATOM 1341 CB PRO A 87 -10.027 -17.310 3.637 1.00 0.00 C ATOM 1342 CG PRO A 87 -11.360 -17.739 3.047 1.00 0.00 C ATOM 1343 CD PRO A 87 -11.216 -17.759 1.534 1.00 0.00 C ATOM 0 HA PRO A 87 -8.314 -16.588 2.538 1.00 0.00 H new ATOM 0 HB2 PRO A 87 -9.748 -17.948 4.475 1.00 0.00 H new ATOM 0 HB3 PRO A 87 -10.078 -16.289 4.016 1.00 0.00 H new ATOM 0 HG2 PRO A 87 -11.641 -18.725 3.417 1.00 0.00 H new ATOM 0 HG3 PRO A 87 -12.149 -17.049 3.346 1.00 0.00 H new ATOM 0 HD2 PRO A 87 -11.478 -18.734 1.124 1.00 0.00 H new ATOM 0 HD3 PRO A 87 -11.874 -17.028 1.064 1.00 0.00 H new ATOM 1351 N SER A 88 -6.985 -18.600 1.964 1.00 0.00 N ATOM 1352 CA SER A 88 -6.051 -19.713 1.975 1.00 0.00 C ATOM 1353 C SER A 88 -5.846 -20.210 3.408 1.00 0.00 C ATOM 1354 O SER A 88 -6.110 -21.373 3.709 1.00 0.00 O ATOM 1355 CB SER A 88 -4.711 -19.315 1.354 1.00 0.00 C ATOM 1356 OG SER A 88 -3.753 -20.366 1.432 1.00 0.00 O ATOM 0 H SER A 88 -6.675 -17.789 1.429 1.00 0.00 H new ATOM 0 HA SER A 88 -6.473 -20.519 1.374 1.00 0.00 H new ATOM 0 HB2 SER A 88 -4.863 -19.040 0.310 1.00 0.00 H new ATOM 0 HB3 SER A 88 -4.323 -18.433 1.863 1.00 0.00 H new ATOM 0 HG SER A 88 -2.912 -20.073 1.023 1.00 0.00 H new ATOM 1362 N SER A 89 -5.376 -19.304 4.252 1.00 0.00 N ATOM 1363 CA SER A 89 -5.132 -19.635 5.646 1.00 0.00 C ATOM 1364 C SER A 89 -4.047 -20.710 5.746 1.00 0.00 C ATOM 1365 O SER A 89 -4.037 -21.661 4.966 1.00 0.00 O ATOM 1366 CB SER A 89 -6.414 -20.109 6.332 1.00 0.00 C ATOM 1367 OG SER A 89 -7.120 -19.035 6.947 1.00 0.00 O ATOM 0 H SER A 89 -5.157 -18.341 3.998 1.00 0.00 H new ATOM 0 HA SER A 89 -4.791 -18.735 6.157 1.00 0.00 H new ATOM 0 HB2 SER A 89 -7.059 -20.594 5.599 1.00 0.00 H new ATOM 0 HB3 SER A 89 -6.167 -20.858 7.084 1.00 0.00 H new ATOM 0 HG SER A 89 -7.933 -19.379 7.372 1.00 0.00 H new ATOM 1373 N GLY A 90 -3.161 -20.522 6.712 1.00 0.00 N ATOM 1374 CA GLY A 90 -2.075 -21.464 6.925 1.00 0.00 C ATOM 1375 C GLY A 90 -0.869 -20.775 7.568 1.00 0.00 C ATOM 1376 O GLY A 90 0.255 -20.908 7.087 1.00 0.00 O ATOM 0 H GLY A 90 -3.172 -19.731 7.356 1.00 0.00 H new ATOM 0 HA2 GLY A 90 -2.416 -22.279 7.564 1.00 0.00 H new ATOM 0 HA3 GLY A 90 -1.781 -21.906 5.973 1.00 0.00 H new TER 1380 GLY A 90