USER MOD reduce.3.24.130724 H: found=0, std=0, add=682, rem=0, adj=15 USER MOD reduce.3.24.130724 removed 681 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 48 HIS : no HD1:sc= -0.304 K(o=-2,f=-3.3) USER MOD Set 1.2: A 51 MET CE :methyl 166:sc= -1.68 (180deg=-2.64!) USER MOD Set 2.1: A 35 HIS : no HD1:sc= -1.13 K(o=-1.2,f=-2.4!) USER MOD Set 2.2: A 36 ASN : amide:sc= -0.0319 K(o=-1.2,f=-3!) USER MOD Single : A 5 THR OG1 : rot -53:sc= -0.0539! USER MOD Single : A 10 LYS NZ :NH3+ -144:sc= -0.006 (180deg=-0.846) USER MOD Single : A 14 SER OG : rot -78:sc= 1.22 USER MOD Single : A 18 LYS NZ :NH3+ 149:sc= -1.1 (180deg=-1.73) USER MOD Single : A 23 SER OG : rot 93:sc= 0.121 USER MOD Single : A 24 TYR OH : rot 180:sc= 0 USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 LYS NZ :NH3+ -110:sc= -0.0539 (180deg=-1.07) USER MOD Single : A 32 GLN : amide:sc= -0.12 X(o=-0.12,f=-0.12) USER MOD Single : A 37 SER OG : rot -88:sc= -1.34! USER MOD Single : A 38 ASN : amide:sc= -2.07 K(o=-2.1,f=-4.8!) USER MOD Single : A 44 GLN : amide:sc= -1.9! K(o=-1.9!,f=-0.76) USER MOD Single : A 47 MET CE :methyl -172:sc= -0.222 (180deg=-0.253) USER MOD Single : A 57 TYR OH : rot 180:sc= 0 USER MOD Single : A 60 SER OG : rot 180:sc= 0 USER MOD Single : A 61 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 63 SER OG : rot -78:sc= 0.0507 USER MOD Single : A 64 SER OG : rot 180:sc= 0 USER MOD Single : A 68 ASN : amide:sc= -0.0934 K(o=-0.093,f=-2!) USER MOD Single : A 75 THR OG1 : rot 84:sc= 0.9 USER MOD Single : A 76 GLN : amide:sc= -0.196 K(o=-0.2,f=-0.95) USER MOD Single : A 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 27 N VAL A 3 -2.512 -14.719 13.531 1.00 0.00 N ATOM 28 CA VAL A 3 -2.227 -15.449 14.770 1.00 0.00 C ATOM 29 C VAL A 3 -1.458 -14.561 15.736 1.00 0.00 C ATOM 30 O VAL A 3 -0.486 -13.907 15.357 1.00 0.00 O ATOM 31 CB VAL A 3 -1.402 -16.703 14.466 1.00 0.00 C ATOM 32 CG1 VAL A 3 -0.144 -16.311 13.690 1.00 0.00 C ATOM 33 CG2 VAL A 3 -1.005 -17.392 15.775 1.00 0.00 C ATOM 0 HA VAL A 3 -3.173 -15.742 15.225 1.00 0.00 H new ATOM 0 HB VAL A 3 -1.999 -17.390 13.866 1.00 0.00 H new ATOM 0 HG11 VAL A 3 0.443 -17.204 13.474 1.00 0.00 H new ATOM 0 HG12 VAL A 3 -0.429 -15.829 12.755 1.00 0.00 H new ATOM 0 HG13 VAL A 3 0.452 -15.621 14.287 1.00 0.00 H new ATOM 0 HG21 VAL A 3 -0.418 -18.284 15.554 1.00 0.00 H new ATOM 0 HG22 VAL A 3 -0.411 -16.708 16.381 1.00 0.00 H new ATOM 0 HG23 VAL A 3 -1.903 -17.676 16.324 1.00 0.00 H new ATOM 43 N TRP A 4 -1.902 -14.542 16.990 1.00 0.00 N ATOM 44 CA TRP A 4 -1.255 -13.732 18.020 1.00 0.00 C ATOM 45 C TRP A 4 -0.564 -14.620 19.045 1.00 0.00 C ATOM 46 O TRP A 4 -1.213 -15.242 19.885 1.00 0.00 O ATOM 47 CB TRP A 4 -2.302 -12.869 18.718 1.00 0.00 C ATOM 48 CG TRP A 4 -3.166 -12.216 17.684 1.00 0.00 C ATOM 49 CD1 TRP A 4 -4.406 -12.631 17.334 1.00 0.00 C ATOM 50 CD2 TRP A 4 -2.878 -11.050 16.858 1.00 0.00 C ATOM 51 NE1 TRP A 4 -4.896 -11.796 16.346 1.00 0.00 N ATOM 52 CE2 TRP A 4 -3.992 -10.805 16.019 1.00 0.00 C ATOM 53 CE3 TRP A 4 -1.771 -10.188 16.756 1.00 0.00 C ATOM 54 CZ2 TRP A 4 -4.005 -9.745 15.111 1.00 0.00 C ATOM 55 CZ3 TRP A 4 -1.781 -9.120 15.843 1.00 0.00 C ATOM 56 CH2 TRP A 4 -2.896 -8.899 15.023 1.00 0.00 C ATOM 0 H TRP A 4 -2.706 -15.077 17.318 1.00 0.00 H new ATOM 0 HA TRP A 4 -0.506 -13.097 17.547 1.00 0.00 H new ATOM 0 HB2 TRP A 4 -2.910 -13.481 19.384 1.00 0.00 H new ATOM 0 HB3 TRP A 4 -1.816 -12.113 19.334 1.00 0.00 H new ATOM 0 HD1 TRP A 4 -4.928 -13.477 17.757 1.00 0.00 H new ATOM 0 HE1 TRP A 4 -5.813 -11.900 15.912 1.00 0.00 H new ATOM 0 HE3 TRP A 4 -0.907 -10.348 17.384 1.00 0.00 H new ATOM 0 HZ2 TRP A 4 -4.866 -9.580 14.481 1.00 0.00 H new ATOM 0 HZ3 TRP A 4 -0.925 -8.466 15.773 1.00 0.00 H new ATOM 0 HH2 TRP A 4 -2.898 -8.076 14.324 1.00 0.00 H new ATOM 67 N THR A 5 0.758 -14.653 18.980 1.00 0.00 N ATOM 68 CA THR A 5 1.544 -15.440 19.911 1.00 0.00 C ATOM 69 C THR A 5 3.024 -15.073 19.795 1.00 0.00 C ATOM 70 O THR A 5 3.878 -15.951 19.685 1.00 0.00 O ATOM 71 CB THR A 5 1.351 -16.940 19.635 1.00 0.00 C ATOM 72 OG1 THR A 5 0.003 -17.178 19.263 1.00 0.00 O ATOM 73 CG2 THR A 5 1.682 -17.746 20.894 1.00 0.00 C ATOM 0 H THR A 5 1.308 -14.142 18.290 1.00 0.00 H new ATOM 0 HA THR A 5 1.205 -15.222 20.924 1.00 0.00 H new ATOM 0 HB THR A 5 2.015 -17.247 18.827 1.00 0.00 H new ATOM 0 HG1 THR A 5 -0.595 -16.806 19.944 1.00 0.00 H new ATOM 0 HG21 THR A 5 1.544 -18.808 20.693 1.00 0.00 H new ATOM 0 HG22 THR A 5 2.717 -17.563 21.181 1.00 0.00 H new ATOM 0 HG23 THR A 5 1.021 -17.441 21.705 1.00 0.00 H new ATOM 81 N PRO A 6 3.341 -13.800 19.825 1.00 0.00 N ATOM 82 CA PRO A 6 4.749 -13.321 19.729 1.00 0.00 C ATOM 83 C PRO A 6 5.507 -13.512 21.048 1.00 0.00 C ATOM 84 O PRO A 6 4.947 -14.000 22.028 1.00 0.00 O ATOM 85 CB PRO A 6 4.596 -11.836 19.386 1.00 0.00 C ATOM 86 CG PRO A 6 3.299 -11.435 20.012 1.00 0.00 C ATOM 87 CD PRO A 6 2.394 -12.669 19.954 1.00 0.00 C ATOM 0 HA PRO A 6 5.329 -13.873 18.990 1.00 0.00 H new ATOM 0 HB2 PRO A 6 5.425 -11.250 19.783 1.00 0.00 H new ATOM 0 HB3 PRO A 6 4.581 -11.678 18.308 1.00 0.00 H new ATOM 0 HG2 PRO A 6 3.448 -11.110 21.042 1.00 0.00 H new ATOM 0 HG3 PRO A 6 2.851 -10.599 19.476 1.00 0.00 H new ATOM 0 HD2 PRO A 6 1.784 -12.759 20.853 1.00 0.00 H new ATOM 0 HD3 PRO A 6 1.709 -12.623 19.107 1.00 0.00 H new ATOM 95 N GLU A 7 6.775 -13.114 21.061 1.00 0.00 N ATOM 96 CA GLU A 7 7.602 -13.234 22.260 1.00 0.00 C ATOM 97 C GLU A 7 6.853 -12.715 23.484 1.00 0.00 C ATOM 98 O GLU A 7 7.252 -12.973 24.619 1.00 0.00 O ATOM 99 CB GLU A 7 8.896 -12.439 22.082 1.00 0.00 C ATOM 100 CG GLU A 7 9.749 -13.093 20.995 1.00 0.00 C ATOM 101 CD GLU A 7 11.001 -12.261 20.745 1.00 0.00 C ATOM 102 OE1 GLU A 7 11.144 -11.234 21.387 1.00 0.00 O ATOM 103 OE2 GLU A 7 11.800 -12.662 19.914 1.00 0.00 O ATOM 0 H GLU A 7 7.253 -12.706 20.257 1.00 0.00 H new ATOM 0 HA GLU A 7 7.837 -14.288 22.411 1.00 0.00 H new ATOM 0 HB2 GLU A 7 8.668 -11.408 21.810 1.00 0.00 H new ATOM 0 HB3 GLU A 7 9.448 -12.406 23.022 1.00 0.00 H new ATOM 0 HG2 GLU A 7 10.027 -14.102 21.298 1.00 0.00 H new ATOM 0 HG3 GLU A 7 9.173 -13.184 20.074 1.00 0.00 H new ATOM 110 N VAL A 8 5.779 -11.964 23.249 1.00 0.00 N ATOM 111 CA VAL A 8 5.004 -11.399 24.350 1.00 0.00 C ATOM 112 C VAL A 8 4.495 -12.515 25.249 1.00 0.00 C ATOM 113 O VAL A 8 4.644 -12.457 26.469 1.00 0.00 O ATOM 114 CB VAL A 8 3.805 -10.622 23.803 1.00 0.00 C ATOM 115 CG1 VAL A 8 3.010 -10.009 24.959 1.00 0.00 C ATOM 116 CG2 VAL A 8 4.292 -9.515 22.866 1.00 0.00 C ATOM 0 H VAL A 8 5.429 -11.735 22.319 1.00 0.00 H new ATOM 0 HA VAL A 8 5.647 -10.728 24.920 1.00 0.00 H new ATOM 0 HB VAL A 8 3.160 -11.304 23.249 1.00 0.00 H new ATOM 0 HG11 VAL A 8 2.158 -9.457 24.562 1.00 0.00 H new ATOM 0 HG12 VAL A 8 2.654 -10.802 25.617 1.00 0.00 H new ATOM 0 HG13 VAL A 8 3.651 -9.331 25.522 1.00 0.00 H new ATOM 0 HG21 VAL A 8 3.435 -8.964 22.478 1.00 0.00 H new ATOM 0 HG22 VAL A 8 4.944 -8.835 23.414 1.00 0.00 H new ATOM 0 HG23 VAL A 8 4.845 -9.957 22.037 1.00 0.00 H new ATOM 126 N LEU A 9 3.916 -13.544 24.640 1.00 0.00 N ATOM 127 CA LEU A 9 3.419 -14.676 25.407 1.00 0.00 C ATOM 128 C LEU A 9 4.586 -15.383 26.083 1.00 0.00 C ATOM 129 O LEU A 9 4.490 -15.797 27.235 1.00 0.00 O ATOM 130 CB LEU A 9 2.663 -15.656 24.502 1.00 0.00 C ATOM 131 CG LEU A 9 2.183 -16.873 25.315 1.00 0.00 C ATOM 132 CD1 LEU A 9 1.293 -16.422 26.487 1.00 0.00 C ATOM 133 CD2 LEU A 9 1.393 -17.806 24.392 1.00 0.00 C ATOM 0 H LEU A 9 3.781 -13.616 23.632 1.00 0.00 H new ATOM 0 HA LEU A 9 2.727 -14.310 26.165 1.00 0.00 H new ATOM 0 HB2 LEU A 9 1.809 -15.155 24.046 1.00 0.00 H new ATOM 0 HB3 LEU A 9 3.311 -15.985 23.690 1.00 0.00 H new ATOM 0 HG LEU A 9 3.048 -17.397 25.723 1.00 0.00 H new ATOM 0 HD11 LEU A 9 0.963 -17.295 27.050 1.00 0.00 H new ATOM 0 HD12 LEU A 9 1.861 -15.761 27.142 1.00 0.00 H new ATOM 0 HD13 LEU A 9 0.424 -15.890 26.100 1.00 0.00 H new ATOM 0 HD21 LEU A 9 1.048 -18.671 24.958 1.00 0.00 H new ATOM 0 HD22 LEU A 9 0.534 -17.273 23.985 1.00 0.00 H new ATOM 0 HD23 LEU A 9 2.034 -18.138 23.575 1.00 0.00 H new ATOM 145 N LYS A 10 5.689 -15.520 25.352 1.00 0.00 N ATOM 146 CA LYS A 10 6.872 -16.179 25.893 1.00 0.00 C ATOM 147 C LYS A 10 7.397 -15.424 27.105 1.00 0.00 C ATOM 148 O LYS A 10 7.673 -16.019 28.147 1.00 0.00 O ATOM 149 CB LYS A 10 7.960 -16.242 24.817 1.00 0.00 C ATOM 150 CG LYS A 10 9.212 -16.905 25.379 1.00 0.00 C ATOM 151 CD LYS A 10 10.232 -17.078 24.252 1.00 0.00 C ATOM 152 CE LYS A 10 11.593 -17.363 24.866 1.00 0.00 C ATOM 153 NZ LYS A 10 12.553 -17.786 23.810 1.00 0.00 N ATOM 0 H LYS A 10 5.788 -15.187 24.393 1.00 0.00 H new ATOM 0 HA LYS A 10 6.600 -17.189 26.201 1.00 0.00 H new ATOM 0 HB2 LYS A 10 7.598 -16.802 23.955 1.00 0.00 H new ATOM 0 HB3 LYS A 10 8.196 -15.237 24.468 1.00 0.00 H new ATOM 0 HG2 LYS A 10 9.634 -16.296 26.179 1.00 0.00 H new ATOM 0 HG3 LYS A 10 8.963 -17.873 25.813 1.00 0.00 H new ATOM 0 HD2 LYS A 10 9.935 -17.896 23.596 1.00 0.00 H new ATOM 0 HD3 LYS A 10 10.275 -16.177 23.640 1.00 0.00 H new ATOM 0 HE2 LYS A 10 11.966 -16.472 25.372 1.00 0.00 H new ATOM 0 HE3 LYS A 10 11.504 -18.144 25.621 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 13.194 -18.510 24.193 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 12.029 -18.179 23.002 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 13.108 -16.964 23.496 1.00 0.00 H new ATOM 167 N ALA A 11 7.534 -14.111 26.966 1.00 0.00 N ATOM 168 CA ALA A 11 8.026 -13.292 28.063 1.00 0.00 C ATOM 169 C ALA A 11 7.025 -13.282 29.208 1.00 0.00 C ATOM 170 O ALA A 11 7.401 -13.386 30.377 1.00 0.00 O ATOM 171 CB ALA A 11 8.261 -11.859 27.580 1.00 0.00 C ATOM 0 H ALA A 11 7.314 -13.596 26.113 1.00 0.00 H new ATOM 0 HA ALA A 11 8.966 -13.716 28.416 1.00 0.00 H new ATOM 0 HB1 ALA A 11 8.629 -11.252 28.407 1.00 0.00 H new ATOM 0 HB2 ALA A 11 8.997 -11.862 26.776 1.00 0.00 H new ATOM 0 HB3 ALA A 11 7.324 -11.441 27.212 1.00 0.00 H new ATOM 177 N ARG A 12 5.747 -13.149 28.868 1.00 0.00 N ATOM 178 CA ARG A 12 4.703 -13.120 29.880 1.00 0.00 C ATOM 179 C ARG A 12 4.615 -14.470 30.582 1.00 0.00 C ATOM 180 O ARG A 12 4.549 -14.542 31.810 1.00 0.00 O ATOM 181 CB ARG A 12 3.353 -12.788 29.228 1.00 0.00 C ATOM 182 CG ARG A 12 2.289 -12.518 30.310 1.00 0.00 C ATOM 183 CD ARG A 12 2.353 -11.048 30.746 1.00 0.00 C ATOM 184 NE ARG A 12 1.329 -10.770 31.744 1.00 0.00 N ATOM 185 CZ ARG A 12 1.324 -9.623 32.413 1.00 0.00 C ATOM 186 NH1 ARG A 12 2.245 -8.728 32.176 1.00 0.00 N ATOM 187 NH2 ARG A 12 0.401 -9.392 33.305 1.00 0.00 N ATOM 0 H ARG A 12 5.414 -13.061 27.908 1.00 0.00 H new ATOM 0 HA ARG A 12 4.947 -12.353 30.615 1.00 0.00 H new ATOM 0 HB2 ARG A 12 3.457 -11.914 28.585 1.00 0.00 H new ATOM 0 HB3 ARG A 12 3.035 -13.615 28.593 1.00 0.00 H new ATOM 0 HG2 ARG A 12 1.297 -12.749 29.923 1.00 0.00 H new ATOM 0 HG3 ARG A 12 2.456 -13.169 31.168 1.00 0.00 H new ATOM 0 HD2 ARG A 12 3.339 -10.826 31.155 1.00 0.00 H new ATOM 0 HD3 ARG A 12 2.213 -10.399 29.881 1.00 0.00 H new ATOM 0 HE ARG A 12 0.607 -11.465 31.931 1.00 0.00 H new ATOM 0 HH11 ARG A 12 2.966 -8.911 31.478 1.00 0.00 H new ATOM 0 HH12 ARG A 12 2.243 -7.846 32.689 1.00 0.00 H new ATOM 0 HH21 ARG A 12 -0.317 -10.093 33.489 1.00 0.00 H new ATOM 0 HH22 ARG A 12 0.397 -8.511 33.819 1.00 0.00 H new ATOM 201 N ALA A 13 4.619 -15.540 29.793 1.00 0.00 N ATOM 202 CA ALA A 13 4.544 -16.885 30.348 1.00 0.00 C ATOM 203 C ALA A 13 5.802 -17.198 31.142 1.00 0.00 C ATOM 204 O ALA A 13 5.738 -17.732 32.249 1.00 0.00 O ATOM 205 CB ALA A 13 4.383 -17.907 29.220 1.00 0.00 C ATOM 0 H ALA A 13 4.673 -15.502 28.775 1.00 0.00 H new ATOM 0 HA ALA A 13 3.681 -16.940 31.012 1.00 0.00 H new ATOM 0 HB1 ALA A 13 4.328 -18.910 29.643 1.00 0.00 H new ATOM 0 HB2 ALA A 13 3.469 -17.696 28.666 1.00 0.00 H new ATOM 0 HB3 ALA A 13 5.238 -17.844 28.547 1.00 0.00 H new ATOM 211 N SER A 14 6.949 -16.855 30.565 1.00 0.00 N ATOM 212 CA SER A 14 8.224 -17.094 31.224 1.00 0.00 C ATOM 213 C SER A 14 8.469 -16.051 32.308 1.00 0.00 C ATOM 214 O SER A 14 9.295 -16.256 33.194 1.00 0.00 O ATOM 215 CB SER A 14 9.359 -17.044 30.201 1.00 0.00 C ATOM 216 OG SER A 14 10.583 -17.365 30.847 1.00 0.00 O ATOM 0 H SER A 14 7.020 -16.414 29.648 1.00 0.00 H new ATOM 0 HA SER A 14 8.194 -18.082 31.684 1.00 0.00 H new ATOM 0 HB2 SER A 14 9.166 -17.747 29.391 1.00 0.00 H new ATOM 0 HB3 SER A 14 9.419 -16.052 29.754 1.00 0.00 H new ATOM 0 HG SER A 14 10.903 -16.586 31.348 1.00 0.00 H new ATOM 222 N VAL A 15 7.743 -14.935 32.217 1.00 0.00 N ATOM 223 CA VAL A 15 7.874 -13.843 33.184 1.00 0.00 C ATOM 224 C VAL A 15 9.246 -13.182 33.067 1.00 0.00 C ATOM 225 O VAL A 15 9.359 -11.957 33.086 1.00 0.00 O ATOM 226 CB VAL A 15 7.675 -14.363 34.609 1.00 0.00 C ATOM 227 CG1 VAL A 15 7.496 -13.181 35.564 1.00 0.00 C ATOM 228 CG2 VAL A 15 6.431 -15.253 34.655 1.00 0.00 C ATOM 0 H VAL A 15 7.057 -14.763 31.482 1.00 0.00 H new ATOM 0 HA VAL A 15 7.105 -13.103 32.963 1.00 0.00 H new ATOM 0 HB VAL A 15 8.548 -14.942 34.911 1.00 0.00 H new ATOM 0 HG11 VAL A 15 7.354 -13.552 36.579 1.00 0.00 H new ATOM 0 HG12 VAL A 15 8.383 -12.548 35.529 1.00 0.00 H new ATOM 0 HG13 VAL A 15 6.623 -12.600 35.265 1.00 0.00 H new ATOM 0 HG21 VAL A 15 6.287 -15.625 35.669 1.00 0.00 H new ATOM 0 HG22 VAL A 15 5.558 -14.674 34.353 1.00 0.00 H new ATOM 0 HG23 VAL A 15 6.561 -16.095 33.975 1.00 0.00 H new ATOM 238 N ILE A 16 10.288 -14.001 32.952 1.00 0.00 N ATOM 239 CA ILE A 16 11.656 -13.499 32.838 1.00 0.00 C ATOM 240 C ILE A 16 12.391 -14.212 31.713 1.00 0.00 C ATOM 241 O ILE A 16 12.011 -15.310 31.305 1.00 0.00 O ATOM 242 CB ILE A 16 12.403 -13.726 34.150 1.00 0.00 C ATOM 243 CG1 ILE A 16 11.742 -12.898 35.253 1.00 0.00 C ATOM 244 CG2 ILE A 16 13.865 -13.298 33.992 1.00 0.00 C ATOM 245 CD1 ILE A 16 12.308 -13.313 36.610 1.00 0.00 C ATOM 0 H ILE A 16 10.212 -15.018 32.935 1.00 0.00 H new ATOM 0 HA ILE A 16 11.615 -12.432 32.618 1.00 0.00 H new ATOM 0 HB ILE A 16 12.367 -14.783 34.413 1.00 0.00 H new ATOM 0 HG12 ILE A 16 11.920 -11.836 35.082 1.00 0.00 H new ATOM 0 HG13 ILE A 16 10.662 -13.047 35.237 1.00 0.00 H new ATOM 0 HG21 ILE A 16 14.395 -13.461 34.930 1.00 0.00 H new ATOM 0 HG22 ILE A 16 14.333 -13.887 33.203 1.00 0.00 H new ATOM 0 HG23 ILE A 16 13.908 -12.241 33.730 1.00 0.00 H new ATOM 0 HD11 ILE A 16 11.837 -12.723 37.396 1.00 0.00 H new ATOM 0 HD12 ILE A 16 12.107 -14.371 36.780 1.00 0.00 H new ATOM 0 HD13 ILE A 16 13.384 -13.142 36.623 1.00 0.00 H new ATOM 257 N GLY A 17 13.444 -13.579 31.218 1.00 0.00 N ATOM 258 CA GLY A 17 14.228 -14.160 30.140 1.00 0.00 C ATOM 259 C GLY A 17 14.857 -15.477 30.577 1.00 0.00 C ATOM 260 O GLY A 17 15.367 -15.599 31.691 1.00 0.00 O ATOM 0 H GLY A 17 13.773 -12.670 31.543 1.00 0.00 H new ATOM 0 HA2 GLY A 17 13.592 -14.326 29.271 1.00 0.00 H new ATOM 0 HA3 GLY A 17 15.008 -13.463 29.835 1.00 0.00 H new ATOM 264 N LYS A 18 14.814 -16.462 29.688 1.00 0.00 N ATOM 265 CA LYS A 18 15.378 -17.770 29.985 1.00 0.00 C ATOM 266 C LYS A 18 15.377 -18.644 28.732 1.00 0.00 C ATOM 267 O LYS A 18 14.497 -19.485 28.555 1.00 0.00 O ATOM 268 CB LYS A 18 14.559 -18.451 31.085 1.00 0.00 C ATOM 269 CG LYS A 18 15.225 -19.773 31.477 1.00 0.00 C ATOM 270 CD LYS A 18 14.651 -20.261 32.811 1.00 0.00 C ATOM 271 CE LYS A 18 13.131 -20.385 32.699 1.00 0.00 C ATOM 272 NZ LYS A 18 12.777 -21.010 31.393 1.00 0.00 N ATOM 0 H LYS A 18 14.397 -16.380 28.761 1.00 0.00 H new ATOM 0 HA LYS A 18 16.405 -17.639 30.325 1.00 0.00 H new ATOM 0 HB2 LYS A 18 14.485 -17.798 31.954 1.00 0.00 H new ATOM 0 HB3 LYS A 18 13.543 -18.634 30.736 1.00 0.00 H new ATOM 0 HG2 LYS A 18 15.057 -20.521 30.702 1.00 0.00 H new ATOM 0 HG3 LYS A 18 16.303 -19.638 31.561 1.00 0.00 H new ATOM 0 HD2 LYS A 18 15.086 -21.225 33.075 1.00 0.00 H new ATOM 0 HD3 LYS A 18 14.912 -19.564 33.608 1.00 0.00 H new ATOM 0 HE2 LYS A 18 12.743 -20.989 33.520 1.00 0.00 H new ATOM 0 HE3 LYS A 18 12.668 -19.401 32.781 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 11.901 -21.560 31.498 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 12.636 -20.267 30.679 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 13.547 -21.640 31.089 1.00 0.00 H new ATOM 286 N PRO A 19 16.341 -18.459 27.865 1.00 0.00 N ATOM 287 CA PRO A 19 16.441 -19.249 26.600 1.00 0.00 C ATOM 288 C PRO A 19 16.462 -20.754 26.868 1.00 0.00 C ATOM 289 O PRO A 19 17.239 -21.240 27.691 1.00 0.00 O ATOM 290 CB PRO A 19 17.771 -18.778 25.981 1.00 0.00 C ATOM 291 CG PRO A 19 18.034 -17.434 26.586 1.00 0.00 C ATOM 292 CD PRO A 19 17.425 -17.471 27.986 1.00 0.00 C ATOM 0 HA PRO A 19 15.585 -19.090 25.945 1.00 0.00 H new ATOM 0 HB2 PRO A 19 18.578 -19.475 26.206 1.00 0.00 H new ATOM 0 HB3 PRO A 19 17.699 -18.713 24.895 1.00 0.00 H new ATOM 0 HG2 PRO A 19 19.104 -17.230 26.632 1.00 0.00 H new ATOM 0 HG3 PRO A 19 17.584 -16.642 25.987 1.00 0.00 H new ATOM 0 HD2 PRO A 19 18.159 -17.770 28.735 1.00 0.00 H new ATOM 0 HD3 PRO A 19 17.045 -16.494 28.284 1.00 0.00 H new ATOM 300 N ILE A 20 15.599 -21.482 26.162 1.00 0.00 N ATOM 301 CA ILE A 20 15.513 -22.932 26.319 1.00 0.00 C ATOM 302 C ILE A 20 16.500 -23.630 25.387 1.00 0.00 C ATOM 303 O ILE A 20 17.074 -23.003 24.496 1.00 0.00 O ATOM 304 CB ILE A 20 14.078 -23.407 26.030 1.00 0.00 C ATOM 305 CG1 ILE A 20 13.902 -24.852 26.520 1.00 0.00 C ATOM 306 CG2 ILE A 20 13.803 -23.337 24.523 1.00 0.00 C ATOM 307 CD1 ILE A 20 12.412 -25.210 26.563 1.00 0.00 C ATOM 0 H ILE A 20 14.951 -21.093 25.477 1.00 0.00 H new ATOM 0 HA ILE A 20 15.770 -23.189 27.347 1.00 0.00 H new ATOM 0 HB ILE A 20 13.374 -22.761 26.554 1.00 0.00 H new ATOM 0 HG12 ILE A 20 14.431 -25.537 25.857 1.00 0.00 H new ATOM 0 HG13 ILE A 20 14.341 -24.965 27.511 1.00 0.00 H new ATOM 0 HG21 ILE A 20 12.786 -23.674 24.323 1.00 0.00 H new ATOM 0 HG22 ILE A 20 13.919 -22.309 24.179 1.00 0.00 H new ATOM 0 HG23 ILE A 20 14.508 -23.978 23.994 1.00 0.00 H new ATOM 0 HD11 ILE A 20 12.294 -26.236 26.911 1.00 0.00 H new ATOM 0 HD12 ILE A 20 11.895 -24.534 27.244 1.00 0.00 H new ATOM 0 HD13 ILE A 20 11.986 -25.115 25.564 1.00 0.00 H new ATOM 319 N GLY A 21 16.690 -24.930 25.595 1.00 0.00 N ATOM 320 CA GLY A 21 17.607 -25.699 24.762 1.00 0.00 C ATOM 321 C GLY A 21 17.377 -25.391 23.289 1.00 0.00 C ATOM 322 O GLY A 21 16.241 -25.207 22.854 1.00 0.00 O ATOM 0 H GLY A 21 16.226 -25.468 26.326 1.00 0.00 H new ATOM 0 HA2 GLY A 21 18.637 -25.464 25.032 1.00 0.00 H new ATOM 0 HA3 GLY A 21 17.465 -26.764 24.943 1.00 0.00 H new ATOM 326 N GLU A 22 18.465 -25.326 22.531 1.00 0.00 N ATOM 327 CA GLU A 22 18.379 -25.021 21.109 1.00 0.00 C ATOM 328 C GLU A 22 17.431 -25.986 20.404 1.00 0.00 C ATOM 329 O GLU A 22 16.565 -25.568 19.633 1.00 0.00 O ATOM 330 CB GLU A 22 19.766 -25.118 20.471 1.00 0.00 C ATOM 331 CG GLU A 22 20.718 -24.090 21.107 1.00 0.00 C ATOM 332 CD GLU A 22 21.311 -24.637 22.405 1.00 0.00 C ATOM 333 OE1 GLU A 22 20.927 -25.723 22.802 1.00 0.00 O ATOM 334 OE2 GLU A 22 22.160 -23.967 22.967 1.00 0.00 O ATOM 0 H GLU A 22 19.413 -25.480 22.876 1.00 0.00 H new ATOM 0 HA GLU A 22 17.994 -24.007 21.001 1.00 0.00 H new ATOM 0 HB2 GLU A 22 20.165 -26.124 20.603 1.00 0.00 H new ATOM 0 HB3 GLU A 22 19.694 -24.942 19.398 1.00 0.00 H new ATOM 0 HG2 GLU A 22 21.519 -23.847 20.409 1.00 0.00 H new ATOM 0 HG3 GLU A 22 20.180 -23.164 21.309 1.00 0.00 H new ATOM 341 N SER A 23 17.595 -27.276 20.671 1.00 0.00 N ATOM 342 CA SER A 23 16.739 -28.282 20.056 1.00 0.00 C ATOM 343 C SER A 23 15.288 -28.075 20.470 1.00 0.00 C ATOM 344 O SER A 23 14.375 -28.203 19.655 1.00 0.00 O ATOM 345 CB SER A 23 17.197 -29.677 20.472 1.00 0.00 C ATOM 346 OG SER A 23 17.145 -29.785 21.888 1.00 0.00 O ATOM 0 H SER A 23 18.305 -27.647 21.302 1.00 0.00 H new ATOM 0 HA SER A 23 16.812 -28.184 18.973 1.00 0.00 H new ATOM 0 HB2 SER A 23 16.559 -30.433 20.014 1.00 0.00 H new ATOM 0 HB3 SER A 23 18.212 -29.860 20.119 1.00 0.00 H new ATOM 0 HG SER A 23 16.281 -30.162 22.156 1.00 0.00 H new ATOM 352 N TYR A 24 15.084 -27.751 21.743 1.00 0.00 N ATOM 353 CA TYR A 24 13.739 -27.523 22.258 1.00 0.00 C ATOM 354 C TYR A 24 13.266 -26.113 21.922 1.00 0.00 C ATOM 355 O TYR A 24 12.091 -25.794 22.076 1.00 0.00 O ATOM 356 CB TYR A 24 13.715 -27.728 23.772 1.00 0.00 C ATOM 357 CG TYR A 24 13.950 -29.185 24.087 1.00 0.00 C ATOM 358 CD1 TYR A 24 12.880 -30.087 24.057 1.00 0.00 C ATOM 359 CD2 TYR A 24 15.234 -29.632 24.416 1.00 0.00 C ATOM 360 CE1 TYR A 24 13.096 -31.439 24.350 1.00 0.00 C ATOM 361 CE2 TYR A 24 15.450 -30.984 24.710 1.00 0.00 C ATOM 362 CZ TYR A 24 14.380 -31.886 24.680 1.00 0.00 C ATOM 363 OH TYR A 24 14.594 -33.217 24.970 1.00 0.00 O ATOM 0 H TYR A 24 15.827 -27.641 22.433 1.00 0.00 H new ATOM 0 HA TYR A 24 13.066 -28.239 21.787 1.00 0.00 H new ATOM 0 HB2 TYR A 24 14.482 -27.115 24.245 1.00 0.00 H new ATOM 0 HB3 TYR A 24 12.755 -27.407 24.178 1.00 0.00 H new ATOM 0 HD1 TYR A 24 11.888 -29.740 23.808 1.00 0.00 H new ATOM 0 HD2 TYR A 24 16.058 -28.935 24.443 1.00 0.00 H new ATOM 0 HE1 TYR A 24 12.272 -32.136 24.321 1.00 0.00 H new ATOM 0 HE2 TYR A 24 16.442 -31.331 24.960 1.00 0.00 H new ATOM 0 HH TYR A 24 15.541 -33.358 25.177 1.00 0.00 H new ATOM 373 N LYS A 25 14.189 -25.273 21.459 1.00 0.00 N ATOM 374 CA LYS A 25 13.854 -23.898 21.095 1.00 0.00 C ATOM 375 C LYS A 25 13.295 -23.855 19.675 1.00 0.00 C ATOM 376 O LYS A 25 12.827 -22.821 19.205 1.00 0.00 O ATOM 377 CB LYS A 25 15.107 -23.015 21.196 1.00 0.00 C ATOM 378 CG LYS A 25 14.748 -21.554 20.914 1.00 0.00 C ATOM 379 CD LYS A 25 15.966 -20.664 21.169 1.00 0.00 C ATOM 380 CE LYS A 25 15.587 -19.207 20.907 1.00 0.00 C ATOM 381 NZ LYS A 25 16.769 -18.335 21.148 1.00 0.00 N ATOM 0 H LYS A 25 15.170 -25.519 21.327 1.00 0.00 H new ATOM 0 HA LYS A 25 13.096 -23.521 21.782 1.00 0.00 H new ATOM 0 HB2 LYS A 25 15.544 -23.104 22.190 1.00 0.00 H new ATOM 0 HB3 LYS A 25 15.859 -23.356 20.485 1.00 0.00 H new ATOM 0 HG2 LYS A 25 14.415 -21.444 19.882 1.00 0.00 H new ATOM 0 HG3 LYS A 25 13.919 -21.244 21.551 1.00 0.00 H new ATOM 0 HD2 LYS A 25 16.310 -20.784 22.196 1.00 0.00 H new ATOM 0 HD3 LYS A 25 16.790 -20.960 20.520 1.00 0.00 H new ATOM 0 HE2 LYS A 25 15.239 -19.090 19.881 1.00 0.00 H new ATOM 0 HE3 LYS A 25 14.765 -18.911 21.559 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 16.511 -17.343 20.970 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 17.082 -18.439 22.134 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 17.541 -18.612 20.509 1.00 0.00 H new ATOM 395 N ARG A 26 13.335 -24.993 18.997 1.00 0.00 N ATOM 396 CA ARG A 26 12.835 -25.070 17.637 1.00 0.00 C ATOM 397 C ARG A 26 11.372 -24.667 17.590 1.00 0.00 C ATOM 398 O ARG A 26 10.942 -23.958 16.680 1.00 0.00 O ATOM 399 CB ARG A 26 13.004 -26.489 17.104 1.00 0.00 C ATOM 400 CG ARG A 26 12.565 -26.541 15.639 1.00 0.00 C ATOM 401 CD ARG A 26 12.862 -27.927 15.064 1.00 0.00 C ATOM 402 NE ARG A 26 14.303 -28.150 15.011 1.00 0.00 N ATOM 403 CZ ARG A 26 14.807 -29.292 14.551 1.00 0.00 C ATOM 404 NH1 ARG A 26 14.011 -30.233 14.125 1.00 0.00 N ATOM 405 NH2 ARG A 26 16.101 -29.469 14.524 1.00 0.00 N ATOM 0 H ARG A 26 13.706 -25.869 19.365 1.00 0.00 H new ATOM 0 HA ARG A 26 13.406 -24.383 17.012 1.00 0.00 H new ATOM 0 HB2 ARG A 26 14.045 -26.801 17.194 1.00 0.00 H new ATOM 0 HB3 ARG A 26 12.410 -27.185 17.697 1.00 0.00 H new ATOM 0 HG2 ARG A 26 11.500 -26.324 15.560 1.00 0.00 H new ATOM 0 HG3 ARG A 26 13.089 -25.778 15.064 1.00 0.00 H new ATOM 0 HD2 ARG A 26 12.390 -28.693 15.679 1.00 0.00 H new ATOM 0 HD3 ARG A 26 12.436 -28.014 14.065 1.00 0.00 H new ATOM 0 HE ARG A 26 14.935 -27.417 15.332 1.00 0.00 H new ATOM 0 HH11 ARG A 26 13.001 -30.094 14.144 1.00 0.00 H new ATOM 0 HH12 ARG A 26 14.399 -31.108 13.773 1.00 0.00 H new ATOM 0 HH21 ARG A 26 16.724 -28.732 14.855 1.00 0.00 H new ATOM 0 HH22 ARG A 26 16.489 -30.344 14.172 1.00 0.00 H new ATOM 419 N ILE A 27 10.606 -25.123 18.571 1.00 0.00 N ATOM 420 CA ILE A 27 9.191 -24.795 18.615 1.00 0.00 C ATOM 421 C ILE A 27 9.004 -23.283 18.724 1.00 0.00 C ATOM 422 O ILE A 27 8.250 -22.683 17.960 1.00 0.00 O ATOM 423 CB ILE A 27 8.535 -25.479 19.815 1.00 0.00 C ATOM 424 CG1 ILE A 27 7.055 -25.097 19.870 1.00 0.00 C ATOM 425 CG2 ILE A 27 9.227 -25.036 21.112 1.00 0.00 C ATOM 426 CD1 ILE A 27 6.335 -25.985 20.889 1.00 0.00 C ATOM 0 H ILE A 27 10.935 -25.712 19.336 1.00 0.00 H new ATOM 0 HA ILE A 27 8.721 -25.147 17.697 1.00 0.00 H new ATOM 0 HB ILE A 27 8.631 -26.560 19.710 1.00 0.00 H new ATOM 0 HG12 ILE A 27 6.949 -24.048 20.147 1.00 0.00 H new ATOM 0 HG13 ILE A 27 6.602 -25.214 18.886 1.00 0.00 H new ATOM 0 HG21 ILE A 27 8.754 -25.527 21.963 1.00 0.00 H new ATOM 0 HG22 ILE A 27 10.281 -25.311 21.074 1.00 0.00 H new ATOM 0 HG23 ILE A 27 9.137 -23.955 21.221 1.00 0.00 H new ATOM 0 HD11 ILE A 27 5.280 -25.713 20.928 1.00 0.00 H new ATOM 0 HD12 ILE A 27 6.429 -27.030 20.592 1.00 0.00 H new ATOM 0 HD13 ILE A 27 6.782 -25.846 21.873 1.00 0.00 H new ATOM 438 N LEU A 28 9.715 -22.680 19.670 1.00 0.00 N ATOM 439 CA LEU A 28 9.651 -21.234 19.872 1.00 0.00 C ATOM 440 C LEU A 28 10.209 -20.503 18.654 1.00 0.00 C ATOM 441 O LEU A 28 9.689 -19.462 18.250 1.00 0.00 O ATOM 442 CB LEU A 28 10.438 -20.838 21.136 1.00 0.00 C ATOM 443 CG LEU A 28 9.575 -21.038 22.394 1.00 0.00 C ATOM 444 CD1 LEU A 28 10.466 -20.920 23.637 1.00 0.00 C ATOM 445 CD2 LEU A 28 8.446 -19.982 22.452 1.00 0.00 C ATOM 0 H LEU A 28 10.342 -23.168 20.309 1.00 0.00 H new ATOM 0 HA LEU A 28 8.608 -20.947 20.003 1.00 0.00 H new ATOM 0 HB2 LEU A 28 11.344 -21.439 21.210 1.00 0.00 H new ATOM 0 HB3 LEU A 28 10.751 -19.796 21.065 1.00 0.00 H new ATOM 0 HG LEU A 28 9.117 -22.027 22.360 1.00 0.00 H new ATOM 0 HD11 LEU A 28 9.861 -21.061 24.533 1.00 0.00 H new ATOM 0 HD12 LEU A 28 11.244 -21.683 23.601 1.00 0.00 H new ATOM 0 HD13 LEU A 28 10.927 -19.933 23.662 1.00 0.00 H new ATOM 0 HD21 LEU A 28 7.846 -20.139 23.348 1.00 0.00 H new ATOM 0 HD22 LEU A 28 8.883 -18.984 22.478 1.00 0.00 H new ATOM 0 HD23 LEU A 28 7.812 -20.078 21.570 1.00 0.00 H new ATOM 457 N ALA A 29 11.275 -21.047 18.080 1.00 0.00 N ATOM 458 CA ALA A 29 11.899 -20.430 16.917 1.00 0.00 C ATOM 459 C ALA A 29 10.866 -20.193 15.824 1.00 0.00 C ATOM 460 O ALA A 29 10.903 -19.175 15.133 1.00 0.00 O ATOM 461 CB ALA A 29 13.008 -21.338 16.383 1.00 0.00 C ATOM 0 H ALA A 29 11.722 -21.907 18.398 1.00 0.00 H new ATOM 0 HA ALA A 29 12.324 -19.472 17.216 1.00 0.00 H new ATOM 0 HB1 ALA A 29 13.472 -20.873 15.513 1.00 0.00 H new ATOM 0 HB2 ALA A 29 13.759 -21.489 17.158 1.00 0.00 H new ATOM 0 HB3 ALA A 29 12.584 -22.300 16.097 1.00 0.00 H new ATOM 467 N LYS A 30 9.940 -21.131 15.677 1.00 0.00 N ATOM 468 CA LYS A 30 8.899 -21.003 14.668 1.00 0.00 C ATOM 469 C LYS A 30 7.887 -19.946 15.083 1.00 0.00 C ATOM 470 O LYS A 30 7.125 -19.445 14.259 1.00 0.00 O ATOM 471 CB LYS A 30 8.182 -22.337 14.465 1.00 0.00 C ATOM 472 CG LYS A 30 9.156 -23.344 13.856 1.00 0.00 C ATOM 473 CD LYS A 30 8.410 -24.617 13.447 1.00 0.00 C ATOM 474 CE LYS A 30 7.957 -25.391 14.690 1.00 0.00 C ATOM 475 NZ LYS A 30 7.543 -26.767 14.293 1.00 0.00 N ATOM 0 H LYS A 30 9.889 -21.981 16.238 1.00 0.00 H new ATOM 0 HA LYS A 30 9.370 -20.704 13.732 1.00 0.00 H new ATOM 0 HB2 LYS A 30 7.804 -22.709 15.417 1.00 0.00 H new ATOM 0 HB3 LYS A 30 7.321 -22.205 13.810 1.00 0.00 H new ATOM 0 HG2 LYS A 30 9.648 -22.906 12.987 1.00 0.00 H new ATOM 0 HG3 LYS A 30 9.938 -23.587 14.576 1.00 0.00 H new ATOM 0 HD2 LYS A 30 7.545 -24.359 12.836 1.00 0.00 H new ATOM 0 HD3 LYS A 30 9.057 -25.245 12.835 1.00 0.00 H new ATOM 0 HE2 LYS A 30 8.767 -25.439 15.417 1.00 0.00 H new ATOM 0 HE3 LYS A 30 7.127 -24.874 15.171 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 6.512 -26.861 14.391 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 7.814 -26.939 13.304 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 8.014 -27.462 14.907 1.00 0.00 H new ATOM 489 N LEU A 31 7.877 -19.614 16.367 1.00 0.00 N ATOM 490 CA LEU A 31 6.940 -18.623 16.873 1.00 0.00 C ATOM 491 C LEU A 31 7.143 -17.294 16.154 1.00 0.00 C ATOM 492 O LEU A 31 6.178 -16.629 15.777 1.00 0.00 O ATOM 493 CB LEU A 31 7.148 -18.436 18.382 1.00 0.00 C ATOM 494 CG LEU A 31 5.914 -17.769 19.014 1.00 0.00 C ATOM 495 CD1 LEU A 31 4.696 -18.717 18.965 1.00 0.00 C ATOM 496 CD2 LEU A 31 6.242 -17.408 20.470 1.00 0.00 C ATOM 0 H LEU A 31 8.500 -20.012 17.070 1.00 0.00 H new ATOM 0 HA LEU A 31 5.923 -18.971 16.691 1.00 0.00 H new ATOM 0 HB2 LEU A 31 7.329 -19.402 18.853 1.00 0.00 H new ATOM 0 HB3 LEU A 31 8.032 -17.824 18.561 1.00 0.00 H new ATOM 0 HG LEU A 31 5.662 -16.869 18.453 1.00 0.00 H new ATOM 0 HD11 LEU A 31 3.834 -18.226 19.417 1.00 0.00 H new ATOM 0 HD12 LEU A 31 4.470 -18.965 17.928 1.00 0.00 H new ATOM 0 HD13 LEU A 31 4.923 -19.630 19.515 1.00 0.00 H new ATOM 0 HD21 LEU A 31 5.376 -16.934 20.931 1.00 0.00 H new ATOM 0 HD22 LEU A 31 6.496 -18.313 21.021 1.00 0.00 H new ATOM 0 HD23 LEU A 31 7.087 -16.720 20.493 1.00 0.00 H new ATOM 508 N GLN A 32 8.400 -16.913 15.964 1.00 0.00 N ATOM 509 CA GLN A 32 8.713 -15.665 15.282 1.00 0.00 C ATOM 510 C GLN A 32 8.542 -15.814 13.772 1.00 0.00 C ATOM 511 O GLN A 32 8.032 -14.915 13.104 1.00 0.00 O ATOM 512 CB GLN A 32 10.152 -15.253 15.597 1.00 0.00 C ATOM 513 CG GLN A 32 10.397 -13.821 15.114 1.00 0.00 C ATOM 514 CD GLN A 32 9.691 -12.836 16.039 1.00 0.00 C ATOM 515 OE1 GLN A 32 8.713 -12.201 15.643 1.00 0.00 O ATOM 516 NE2 GLN A 32 10.133 -12.670 17.255 1.00 0.00 N ATOM 0 H GLN A 32 9.214 -17.446 16.270 1.00 0.00 H new ATOM 0 HA GLN A 32 8.025 -14.897 15.635 1.00 0.00 H new ATOM 0 HB2 GLN A 32 10.333 -15.321 16.670 1.00 0.00 H new ATOM 0 HB3 GLN A 32 10.850 -15.935 15.112 1.00 0.00 H new ATOM 0 HG2 GLN A 32 11.467 -13.612 15.094 1.00 0.00 H new ATOM 0 HG3 GLN A 32 10.030 -13.704 14.094 1.00 0.00 H new ATOM 0 HE21 GLN A 32 10.943 -13.198 17.580 1.00 0.00 H new ATOM 0 HE22 GLN A 32 9.668 -12.013 17.881 1.00 0.00 H new ATOM 525 N ARG A 33 8.984 -16.950 13.238 1.00 0.00 N ATOM 526 CA ARG A 33 8.885 -17.201 11.804 1.00 0.00 C ATOM 527 C ARG A 33 7.423 -17.242 11.372 1.00 0.00 C ATOM 528 O ARG A 33 7.065 -16.719 10.317 1.00 0.00 O ATOM 529 CB ARG A 33 9.560 -18.528 11.447 1.00 0.00 C ATOM 530 CG ARG A 33 9.568 -18.709 9.926 1.00 0.00 C ATOM 531 CD ARG A 33 10.201 -20.055 9.575 1.00 0.00 C ATOM 532 NE ARG A 33 11.606 -20.068 9.963 1.00 0.00 N ATOM 533 CZ ARG A 33 12.362 -21.142 9.765 1.00 0.00 C ATOM 534 NH1 ARG A 33 11.847 -22.211 9.221 1.00 0.00 N ATOM 535 NH2 ARG A 33 13.619 -21.130 10.115 1.00 0.00 N ATOM 0 H ARG A 33 9.411 -17.706 13.773 1.00 0.00 H new ATOM 0 HA ARG A 33 9.391 -16.390 11.280 1.00 0.00 H new ATOM 0 HB2 ARG A 33 10.580 -18.543 11.830 1.00 0.00 H new ATOM 0 HB3 ARG A 33 9.030 -19.355 11.919 1.00 0.00 H new ATOM 0 HG2 ARG A 33 8.550 -18.662 9.538 1.00 0.00 H new ATOM 0 HG3 ARG A 33 10.126 -17.899 9.456 1.00 0.00 H new ATOM 0 HD2 ARG A 33 9.669 -20.859 10.083 1.00 0.00 H new ATOM 0 HD3 ARG A 33 10.110 -20.240 8.505 1.00 0.00 H new ATOM 0 HE ARG A 33 12.015 -19.239 10.394 1.00 0.00 H new ATOM 0 HH11 ARG A 33 10.864 -22.221 8.948 1.00 0.00 H new ATOM 0 HH12 ARG A 33 12.427 -23.036 9.069 1.00 0.00 H new ATOM 0 HH21 ARG A 33 14.022 -20.295 10.541 1.00 0.00 H new ATOM 0 HH22 ARG A 33 14.199 -21.955 9.963 1.00 0.00 H new ATOM 549 N ILE A 34 6.585 -17.866 12.196 1.00 0.00 N ATOM 550 CA ILE A 34 5.163 -17.966 11.889 1.00 0.00 C ATOM 551 C ILE A 34 4.548 -16.576 11.808 1.00 0.00 C ATOM 552 O ILE A 34 3.758 -16.289 10.911 1.00 0.00 O ATOM 553 CB ILE A 34 4.449 -18.802 12.966 1.00 0.00 C ATOM 554 CG1 ILE A 34 4.856 -20.289 12.841 1.00 0.00 C ATOM 555 CG2 ILE A 34 2.927 -18.649 12.833 1.00 0.00 C ATOM 556 CD1 ILE A 34 3.974 -21.022 11.820 1.00 0.00 C ATOM 0 H ILE A 34 6.863 -18.306 13.073 1.00 0.00 H new ATOM 0 HA ILE A 34 5.042 -18.459 10.925 1.00 0.00 H new ATOM 0 HB ILE A 34 4.749 -18.441 13.950 1.00 0.00 H new ATOM 0 HG12 ILE A 34 5.901 -20.359 12.539 1.00 0.00 H new ATOM 0 HG13 ILE A 34 4.772 -20.775 13.813 1.00 0.00 H new ATOM 0 HG21 ILE A 34 2.433 -19.245 13.600 1.00 0.00 H new ATOM 0 HG22 ILE A 34 2.655 -17.601 12.956 1.00 0.00 H new ATOM 0 HG23 ILE A 34 2.612 -18.992 11.848 1.00 0.00 H new ATOM 0 HD11 ILE A 34 4.284 -22.065 11.754 1.00 0.00 H new ATOM 0 HD12 ILE A 34 2.932 -20.972 12.137 1.00 0.00 H new ATOM 0 HD13 ILE A 34 4.079 -20.550 10.843 1.00 0.00 H new ATOM 568 N HIS A 35 4.914 -15.713 12.745 1.00 0.00 N ATOM 569 CA HIS A 35 4.384 -14.360 12.746 1.00 0.00 C ATOM 570 C HIS A 35 4.685 -13.670 11.418 1.00 0.00 C ATOM 571 O HIS A 35 3.790 -13.118 10.779 1.00 0.00 O ATOM 572 CB HIS A 35 5.012 -13.565 13.891 1.00 0.00 C ATOM 573 CG HIS A 35 4.462 -12.170 13.892 1.00 0.00 C ATOM 574 ND1 HIS A 35 4.829 -11.235 12.938 1.00 0.00 N ATOM 575 CD2 HIS A 35 3.582 -11.530 14.727 1.00 0.00 C ATOM 576 CE1 HIS A 35 4.180 -10.092 13.219 1.00 0.00 C ATOM 577 NE2 HIS A 35 3.406 -10.217 14.301 1.00 0.00 N ATOM 0 H HIS A 35 5.565 -15.922 13.502 1.00 0.00 H new ATOM 0 HA HIS A 35 3.303 -14.405 12.881 1.00 0.00 H new ATOM 0 HB2 HIS A 35 4.801 -14.051 14.844 1.00 0.00 H new ATOM 0 HB3 HIS A 35 6.096 -13.540 13.779 1.00 0.00 H new ATOM 0 HD2 HIS A 35 3.100 -11.977 15.584 1.00 0.00 H new ATOM 0 HE1 HIS A 35 4.273 -9.184 12.641 1.00 0.00 H new ATOM 0 HE2 HIS A 35 2.813 -9.503 14.724 1.00 0.00 H new ATOM 585 N ASN A 36 5.947 -13.711 11.005 1.00 0.00 N ATOM 586 CA ASN A 36 6.346 -13.091 9.745 1.00 0.00 C ATOM 587 C ASN A 36 5.763 -13.848 8.552 1.00 0.00 C ATOM 588 O ASN A 36 5.296 -13.243 7.588 1.00 0.00 O ATOM 589 CB ASN A 36 7.870 -13.068 9.640 1.00 0.00 C ATOM 590 CG ASN A 36 8.443 -12.070 10.641 1.00 0.00 C ATOM 591 OD1 ASN A 36 7.720 -11.208 11.142 1.00 0.00 O ATOM 592 ND2 ASN A 36 9.705 -12.137 10.965 1.00 0.00 N ATOM 0 H ASN A 36 6.705 -14.162 11.517 1.00 0.00 H new ATOM 0 HA ASN A 36 5.960 -12.072 9.729 1.00 0.00 H new ATOM 0 HB2 ASN A 36 8.272 -14.063 9.834 1.00 0.00 H new ATOM 0 HB3 ASN A 36 8.170 -12.795 8.628 1.00 0.00 H new ATOM 0 HD21 ASN A 36 10.095 -11.474 11.635 1.00 0.00 H new ATOM 0 HD22 ASN A 36 10.301 -12.852 10.548 1.00 0.00 H new ATOM 599 N SER A 37 5.802 -15.179 8.625 1.00 0.00 N ATOM 600 CA SER A 37 5.287 -16.027 7.553 1.00 0.00 C ATOM 601 C SER A 37 3.816 -16.351 7.790 1.00 0.00 C ATOM 602 O SER A 37 3.271 -17.283 7.197 1.00 0.00 O ATOM 603 CB SER A 37 6.091 -17.328 7.490 1.00 0.00 C ATOM 604 OG SER A 37 5.597 -18.234 8.468 1.00 0.00 O ATOM 0 H SER A 37 6.186 -15.693 9.418 1.00 0.00 H new ATOM 0 HA SER A 37 5.384 -15.491 6.609 1.00 0.00 H new ATOM 0 HB2 SER A 37 6.013 -17.769 6.496 1.00 0.00 H new ATOM 0 HB3 SER A 37 7.147 -17.125 7.666 1.00 0.00 H new ATOM 0 HG SER A 37 6.055 -18.077 9.320 1.00 0.00 H new ATOM 610 N ASN A 38 3.183 -15.586 8.674 1.00 0.00 N ATOM 611 CA ASN A 38 1.780 -15.812 8.993 1.00 0.00 C ATOM 612 C ASN A 38 0.961 -16.007 7.727 1.00 0.00 C ATOM 613 O ASN A 38 0.912 -15.134 6.861 1.00 0.00 O ATOM 614 CB ASN A 38 1.223 -14.620 9.773 1.00 0.00 C ATOM 615 CG ASN A 38 -0.201 -14.916 10.225 1.00 0.00 C ATOM 616 OD1 ASN A 38 -0.520 -16.052 10.571 1.00 0.00 O ATOM 617 ND2 ASN A 38 -1.084 -13.954 10.240 1.00 0.00 N ATOM 0 H ASN A 38 3.615 -14.811 9.177 1.00 0.00 H new ATOM 0 HA ASN A 38 1.712 -16.715 9.600 1.00 0.00 H new ATOM 0 HB2 ASN A 38 1.853 -14.414 10.638 1.00 0.00 H new ATOM 0 HB3 ASN A 38 1.237 -13.727 9.148 1.00 0.00 H new ATOM 0 HD21 ASN A 38 -2.040 -14.144 10.539 1.00 0.00 H new ATOM 0 HD22 ASN A 38 -0.817 -13.012 9.953 1.00 0.00 H new ATOM 624 N ILE A 39 0.317 -17.165 7.629 1.00 0.00 N ATOM 625 CA ILE A 39 -0.504 -17.478 6.470 1.00 0.00 C ATOM 626 C ILE A 39 0.270 -17.220 5.184 1.00 0.00 C ATOM 627 O ILE A 39 -0.089 -16.342 4.400 1.00 0.00 O ATOM 628 CB ILE A 39 -1.772 -16.625 6.473 1.00 0.00 C ATOM 629 CG1 ILE A 39 -2.431 -16.699 7.842 1.00 0.00 C ATOM 630 CG2 ILE A 39 -2.747 -17.157 5.422 1.00 0.00 C ATOM 631 CD1 ILE A 39 -3.639 -15.765 7.877 1.00 0.00 C ATOM 0 H ILE A 39 0.349 -17.899 8.337 1.00 0.00 H new ATOM 0 HA ILE A 39 -0.776 -18.532 6.521 1.00 0.00 H new ATOM 0 HB ILE A 39 -1.511 -15.592 6.245 1.00 0.00 H new ATOM 0 HG12 ILE A 39 -2.743 -17.722 8.052 1.00 0.00 H new ATOM 0 HG13 ILE A 39 -1.718 -16.417 8.617 1.00 0.00 H new ATOM 0 HG21 ILE A 39 -3.652 -16.549 5.424 1.00 0.00 H new ATOM 0 HG22 ILE A 39 -2.281 -17.112 4.438 1.00 0.00 H new ATOM 0 HG23 ILE A 39 -3.004 -18.190 5.654 1.00 0.00 H new ATOM 0 HD11 ILE A 39 -4.111 -15.818 8.858 1.00 0.00 H new ATOM 0 HD12 ILE A 39 -3.314 -14.742 7.685 1.00 0.00 H new ATOM 0 HD13 ILE A 39 -4.355 -16.067 7.113 1.00 0.00 H new ATOM 643 N LEU A 40 1.336 -17.991 4.967 1.00 0.00 N ATOM 644 CA LEU A 40 2.159 -17.843 3.761 1.00 0.00 C ATOM 645 C LEU A 40 2.143 -19.134 2.958 1.00 0.00 C ATOM 646 O LEU A 40 2.376 -20.211 3.499 1.00 0.00 O ATOM 647 CB LEU A 40 3.601 -17.501 4.142 1.00 0.00 C ATOM 648 CG LEU A 40 4.422 -17.171 2.885 1.00 0.00 C ATOM 649 CD1 LEU A 40 3.878 -15.899 2.204 1.00 0.00 C ATOM 650 CD2 LEU A 40 5.888 -16.964 3.289 1.00 0.00 C ATOM 0 H LEU A 40 1.651 -18.721 5.606 1.00 0.00 H new ATOM 0 HA LEU A 40 1.746 -17.035 3.157 1.00 0.00 H new ATOM 0 HB2 LEU A 40 3.612 -16.652 4.825 1.00 0.00 H new ATOM 0 HB3 LEU A 40 4.053 -18.340 4.670 1.00 0.00 H new ATOM 0 HG LEU A 40 4.346 -17.996 2.177 1.00 0.00 H new ATOM 0 HD11 LEU A 40 4.471 -15.680 1.316 1.00 0.00 H new ATOM 0 HD12 LEU A 40 2.838 -16.056 1.917 1.00 0.00 H new ATOM 0 HD13 LEU A 40 3.940 -15.060 2.897 1.00 0.00 H new ATOM 0 HD21 LEU A 40 6.480 -16.729 2.404 1.00 0.00 H new ATOM 0 HD22 LEU A 40 5.957 -16.141 4.000 1.00 0.00 H new ATOM 0 HD23 LEU A 40 6.270 -17.875 3.750 1.00 0.00 H new ATOM 662 N ASP A 41 1.863 -19.015 1.663 1.00 0.00 N ATOM 663 CA ASP A 41 1.808 -20.180 0.783 1.00 0.00 C ATOM 664 C ASP A 41 2.901 -21.179 1.134 1.00 0.00 C ATOM 665 O ASP A 41 2.664 -22.386 1.177 1.00 0.00 O ATOM 666 CB ASP A 41 1.963 -19.736 -0.672 1.00 0.00 C ATOM 667 CG ASP A 41 0.721 -18.973 -1.123 1.00 0.00 C ATOM 668 OD1 ASP A 41 -0.252 -18.979 -0.388 1.00 0.00 O ATOM 669 OD2 ASP A 41 0.762 -18.392 -2.195 1.00 0.00 O ATOM 0 H ASP A 41 1.671 -18.127 1.200 1.00 0.00 H new ATOM 0 HA ASP A 41 0.842 -20.666 0.917 1.00 0.00 H new ATOM 0 HB2 ASP A 41 2.845 -19.104 -0.775 1.00 0.00 H new ATOM 0 HB3 ASP A 41 2.117 -20.605 -1.311 1.00 0.00 H new ATOM 674 N GLU A 42 4.096 -20.670 1.389 1.00 0.00 N ATOM 675 CA GLU A 42 5.212 -21.528 1.742 1.00 0.00 C ATOM 676 C GLU A 42 5.029 -22.106 3.144 1.00 0.00 C ATOM 677 O GLU A 42 5.372 -23.259 3.399 1.00 0.00 O ATOM 678 CB GLU A 42 6.514 -20.729 1.674 1.00 0.00 C ATOM 679 CG GLU A 42 7.698 -21.660 1.939 1.00 0.00 C ATOM 680 CD GLU A 42 9.009 -20.897 1.791 1.00 0.00 C ATOM 681 OE1 GLU A 42 8.958 -19.681 1.709 1.00 0.00 O ATOM 682 OE2 GLU A 42 10.046 -21.540 1.763 1.00 0.00 O ATOM 0 H GLU A 42 4.316 -19.674 1.358 1.00 0.00 H new ATOM 0 HA GLU A 42 5.254 -22.355 1.033 1.00 0.00 H new ATOM 0 HB2 GLU A 42 6.616 -20.263 0.694 1.00 0.00 H new ATOM 0 HB3 GLU A 42 6.498 -19.925 2.409 1.00 0.00 H new ATOM 0 HG2 GLU A 42 7.624 -22.079 2.943 1.00 0.00 H new ATOM 0 HG3 GLU A 42 7.675 -22.497 1.242 1.00 0.00 H new ATOM 689 N ARG A 43 4.500 -21.289 4.055 1.00 0.00 N ATOM 690 CA ARG A 43 4.287 -21.725 5.433 1.00 0.00 C ATOM 691 C ARG A 43 3.010 -22.550 5.556 1.00 0.00 C ATOM 692 O ARG A 43 2.845 -23.309 6.509 1.00 0.00 O ATOM 693 CB ARG A 43 4.206 -20.501 6.359 1.00 0.00 C ATOM 694 CG ARG A 43 4.357 -20.920 7.831 1.00 0.00 C ATOM 695 CD ARG A 43 5.830 -21.204 8.162 1.00 0.00 C ATOM 696 NE ARG A 43 6.691 -20.213 7.529 1.00 0.00 N ATOM 697 CZ ARG A 43 7.945 -20.486 7.198 1.00 0.00 C ATOM 698 NH1 ARG A 43 8.452 -21.660 7.461 1.00 0.00 N ATOM 699 NH2 ARG A 43 8.674 -19.576 6.612 1.00 0.00 N ATOM 0 H ARG A 43 4.213 -20.329 3.865 1.00 0.00 H new ATOM 0 HA ARG A 43 5.129 -22.352 5.727 1.00 0.00 H new ATOM 0 HB2 ARG A 43 4.988 -19.788 6.097 1.00 0.00 H new ATOM 0 HB3 ARG A 43 3.252 -19.994 6.216 1.00 0.00 H new ATOM 0 HG2 ARG A 43 3.978 -20.131 8.480 1.00 0.00 H new ATOM 0 HG3 ARG A 43 3.757 -21.809 8.026 1.00 0.00 H new ATOM 0 HD2 ARG A 43 5.977 -21.187 9.242 1.00 0.00 H new ATOM 0 HD3 ARG A 43 6.101 -22.203 7.819 1.00 0.00 H new ATOM 0 HE ARG A 43 6.318 -19.284 7.335 1.00 0.00 H new ATOM 0 HH11 ARG A 43 7.883 -22.370 7.922 1.00 0.00 H new ATOM 0 HH12 ARG A 43 9.417 -21.868 7.205 1.00 0.00 H new ATOM 0 HH21 ARG A 43 8.278 -18.658 6.410 1.00 0.00 H new ATOM 0 HH22 ARG A 43 9.639 -19.783 6.356 1.00 0.00 H new ATOM 713 N GLN A 44 2.108 -22.406 4.589 1.00 0.00 N ATOM 714 CA GLN A 44 0.854 -23.148 4.626 1.00 0.00 C ATOM 715 C GLN A 44 1.119 -24.626 4.889 1.00 0.00 C ATOM 716 O GLN A 44 0.448 -25.246 5.712 1.00 0.00 O ATOM 717 CB GLN A 44 0.103 -22.990 3.297 1.00 0.00 C ATOM 718 CG GLN A 44 -0.584 -21.622 3.241 1.00 0.00 C ATOM 719 CD GLN A 44 -1.384 -21.496 1.947 1.00 0.00 C ATOM 720 OE1 GLN A 44 -2.206 -20.589 1.809 1.00 0.00 O ATOM 721 NE2 GLN A 44 -1.192 -22.359 0.986 1.00 0.00 N ATOM 0 H GLN A 44 2.220 -21.792 3.782 1.00 0.00 H new ATOM 0 HA GLN A 44 0.242 -22.746 5.434 1.00 0.00 H new ATOM 0 HB2 GLN A 44 0.798 -23.091 2.463 1.00 0.00 H new ATOM 0 HB3 GLN A 44 -0.638 -23.782 3.192 1.00 0.00 H new ATOM 0 HG2 GLN A 44 -1.244 -21.501 4.100 1.00 0.00 H new ATOM 0 HG3 GLN A 44 0.161 -20.828 3.297 1.00 0.00 H new ATOM 0 HE21 GLN A 44 -0.511 -23.109 1.103 1.00 0.00 H new ATOM 0 HE22 GLN A 44 -1.723 -22.283 0.119 1.00 0.00 H new ATOM 730 N GLY A 45 2.104 -25.182 4.198 1.00 0.00 N ATOM 731 CA GLY A 45 2.446 -26.583 4.383 1.00 0.00 C ATOM 732 C GLY A 45 3.013 -26.814 5.777 1.00 0.00 C ATOM 733 O GLY A 45 2.805 -27.867 6.381 1.00 0.00 O ATOM 0 H GLY A 45 2.675 -24.689 3.511 1.00 0.00 H new ATOM 0 HA2 GLY A 45 1.561 -27.202 4.237 1.00 0.00 H new ATOM 0 HA3 GLY A 45 3.175 -26.888 3.632 1.00 0.00 H new ATOM 737 N LEU A 46 3.742 -25.823 6.275 1.00 0.00 N ATOM 738 CA LEU A 46 4.350 -25.926 7.590 1.00 0.00 C ATOM 739 C LEU A 46 3.268 -26.032 8.663 1.00 0.00 C ATOM 740 O LEU A 46 3.402 -26.779 9.629 1.00 0.00 O ATOM 741 CB LEU A 46 5.244 -24.697 7.847 1.00 0.00 C ATOM 742 CG LEU A 46 6.451 -25.072 8.730 1.00 0.00 C ATOM 743 CD1 LEU A 46 5.958 -25.722 10.030 1.00 0.00 C ATOM 744 CD2 LEU A 46 7.395 -26.038 7.971 1.00 0.00 C ATOM 0 H LEU A 46 3.924 -24.945 5.789 1.00 0.00 H new ATOM 0 HA LEU A 46 4.965 -26.825 7.631 1.00 0.00 H new ATOM 0 HB2 LEU A 46 5.594 -24.292 6.898 1.00 0.00 H new ATOM 0 HB3 LEU A 46 4.662 -23.914 8.333 1.00 0.00 H new ATOM 0 HG LEU A 46 7.008 -24.167 8.973 1.00 0.00 H new ATOM 0 HD11 LEU A 46 6.813 -25.986 10.652 1.00 0.00 H new ATOM 0 HD12 LEU A 46 5.320 -25.021 10.568 1.00 0.00 H new ATOM 0 HD13 LEU A 46 5.390 -26.622 9.794 1.00 0.00 H new ATOM 0 HD21 LEU A 46 8.242 -26.294 8.607 1.00 0.00 H new ATOM 0 HD22 LEU A 46 6.852 -26.946 7.708 1.00 0.00 H new ATOM 0 HD23 LEU A 46 7.756 -25.555 7.063 1.00 0.00 H new ATOM 756 N MET A 47 2.199 -25.263 8.487 1.00 0.00 N ATOM 757 CA MET A 47 1.106 -25.264 9.449 1.00 0.00 C ATOM 758 C MET A 47 0.618 -26.686 9.704 1.00 0.00 C ATOM 759 O MET A 47 0.336 -27.061 10.842 1.00 0.00 O ATOM 760 CB MET A 47 -0.051 -24.419 8.915 1.00 0.00 C ATOM 761 CG MET A 47 0.395 -22.959 8.801 1.00 0.00 C ATOM 762 SD MET A 47 -1.035 -21.926 8.398 1.00 0.00 S ATOM 763 CE MET A 47 -0.265 -20.330 8.756 1.00 0.00 C ATOM 0 H MET A 47 2.067 -24.636 7.693 1.00 0.00 H new ATOM 0 HA MET A 47 1.469 -24.842 10.386 1.00 0.00 H new ATOM 0 HB2 MET A 47 -0.368 -24.791 7.941 1.00 0.00 H new ATOM 0 HB3 MET A 47 -0.910 -24.497 9.581 1.00 0.00 H new ATOM 0 HG2 MET A 47 0.843 -22.630 9.738 1.00 0.00 H new ATOM 0 HG3 MET A 47 1.159 -22.859 8.030 1.00 0.00 H new ATOM 0 HE1 MET A 47 -1.019 -19.544 8.710 1.00 0.00 H new ATOM 0 HE2 MET A 47 0.175 -20.354 9.753 1.00 0.00 H new ATOM 0 HE3 MET A 47 0.514 -20.129 8.021 1.00 0.00 H new ATOM 773 N HIS A 48 0.523 -27.476 8.640 1.00 0.00 N ATOM 774 CA HIS A 48 0.069 -28.856 8.766 1.00 0.00 C ATOM 775 C HIS A 48 0.983 -29.641 9.699 1.00 0.00 C ATOM 776 O HIS A 48 0.517 -30.397 10.550 1.00 0.00 O ATOM 777 CB HIS A 48 0.048 -29.522 7.390 1.00 0.00 C ATOM 778 CG HIS A 48 -0.484 -30.921 7.521 1.00 0.00 C ATOM 779 ND1 HIS A 48 0.327 -31.989 7.871 1.00 0.00 N ATOM 780 CD2 HIS A 48 -1.742 -31.444 7.353 1.00 0.00 C ATOM 781 CE1 HIS A 48 -0.445 -33.091 7.904 1.00 0.00 C ATOM 782 NE2 HIS A 48 -1.715 -32.815 7.595 1.00 0.00 N ATOM 0 H HIS A 48 0.752 -27.188 7.689 1.00 0.00 H new ATOM 0 HA HIS A 48 -0.937 -28.851 9.185 1.00 0.00 H new ATOM 0 HB2 HIS A 48 -0.575 -28.947 6.705 1.00 0.00 H new ATOM 0 HB3 HIS A 48 1.053 -29.541 6.968 1.00 0.00 H new ATOM 0 HD2 HIS A 48 -2.619 -30.878 7.075 1.00 0.00 H new ATOM 0 HE1 HIS A 48 -0.082 -34.078 8.150 1.00 0.00 H new ATOM 0 HE2 HIS A 48 -2.497 -33.468 7.547 1.00 0.00 H new ATOM 790 N GLU A 49 2.289 -29.462 9.535 1.00 0.00 N ATOM 791 CA GLU A 49 3.257 -30.161 10.372 1.00 0.00 C ATOM 792 C GLU A 49 3.446 -29.440 11.700 1.00 0.00 C ATOM 793 O GLU A 49 3.882 -30.037 12.682 1.00 0.00 O ATOM 794 CB GLU A 49 4.602 -30.252 9.648 1.00 0.00 C ATOM 795 CG GLU A 49 4.459 -31.149 8.419 1.00 0.00 C ATOM 796 CD GLU A 49 4.200 -32.590 8.845 1.00 0.00 C ATOM 797 OE1 GLU A 49 4.513 -32.918 9.978 1.00 0.00 O ATOM 798 OE2 GLU A 49 3.689 -33.344 8.033 1.00 0.00 O ATOM 0 H GLU A 49 2.700 -28.844 8.836 1.00 0.00 H new ATOM 0 HA GLU A 49 2.876 -31.163 10.568 1.00 0.00 H new ATOM 0 HB2 GLU A 49 4.934 -29.258 9.349 1.00 0.00 H new ATOM 0 HB3 GLU A 49 5.362 -30.654 10.318 1.00 0.00 H new ATOM 0 HG2 GLU A 49 3.639 -30.794 7.794 1.00 0.00 H new ATOM 0 HG3 GLU A 49 5.365 -31.098 7.815 1.00 0.00 H new ATOM 805 N LEU A 50 3.125 -28.153 11.723 1.00 0.00 N ATOM 806 CA LEU A 50 3.283 -27.363 12.937 1.00 0.00 C ATOM 807 C LEU A 50 2.427 -27.925 14.063 1.00 0.00 C ATOM 808 O LEU A 50 2.881 -28.051 15.200 1.00 0.00 O ATOM 809 CB LEU A 50 2.871 -25.909 12.664 1.00 0.00 C ATOM 810 CG LEU A 50 3.488 -24.972 13.724 1.00 0.00 C ATOM 811 CD1 LEU A 50 4.893 -24.541 13.286 1.00 0.00 C ATOM 812 CD2 LEU A 50 2.605 -23.726 13.898 1.00 0.00 C ATOM 0 H LEU A 50 2.757 -27.638 10.923 1.00 0.00 H new ATOM 0 HA LEU A 50 4.330 -27.402 13.239 1.00 0.00 H new ATOM 0 HB2 LEU A 50 3.200 -25.611 11.669 1.00 0.00 H new ATOM 0 HB3 LEU A 50 1.785 -25.822 12.680 1.00 0.00 H new ATOM 0 HG LEU A 50 3.552 -25.507 14.672 1.00 0.00 H new ATOM 0 HD11 LEU A 50 5.322 -23.880 14.039 1.00 0.00 H new ATOM 0 HD12 LEU A 50 5.525 -25.422 13.174 1.00 0.00 H new ATOM 0 HD13 LEU A 50 4.832 -24.015 12.334 1.00 0.00 H new ATOM 0 HD21 LEU A 50 3.046 -23.069 14.648 1.00 0.00 H new ATOM 0 HD22 LEU A 50 2.533 -23.196 12.948 1.00 0.00 H new ATOM 0 HD23 LEU A 50 1.609 -24.028 14.222 1.00 0.00 H new ATOM 824 N MET A 51 1.186 -28.256 13.742 1.00 0.00 N ATOM 825 CA MET A 51 0.278 -28.796 14.738 1.00 0.00 C ATOM 826 C MET A 51 0.826 -30.109 15.289 1.00 0.00 C ATOM 827 O MET A 51 0.505 -30.506 16.409 1.00 0.00 O ATOM 828 CB MET A 51 -1.101 -29.025 14.119 1.00 0.00 C ATOM 829 CG MET A 51 -0.951 -29.735 12.770 1.00 0.00 C ATOM 830 SD MET A 51 -2.515 -30.539 12.335 1.00 0.00 S ATOM 831 CE MET A 51 -1.882 -31.622 11.028 1.00 0.00 C ATOM 0 H MET A 51 0.788 -28.161 12.808 1.00 0.00 H new ATOM 0 HA MET A 51 0.186 -28.081 15.555 1.00 0.00 H new ATOM 0 HB2 MET A 51 -1.716 -29.625 14.790 1.00 0.00 H new ATOM 0 HB3 MET A 51 -1.612 -28.072 13.984 1.00 0.00 H new ATOM 0 HG2 MET A 51 -0.671 -29.018 11.998 1.00 0.00 H new ATOM 0 HG3 MET A 51 -0.152 -30.474 12.823 1.00 0.00 H new ATOM 0 HE1 MET A 51 -2.628 -32.381 10.792 1.00 0.00 H new ATOM 0 HE2 MET A 51 -1.670 -31.031 10.137 1.00 0.00 H new ATOM 0 HE3 MET A 51 -0.967 -32.106 11.368 1.00 0.00 H new ATOM 841 N GLU A 52 1.657 -30.779 14.492 1.00 0.00 N ATOM 842 CA GLU A 52 2.250 -32.047 14.911 1.00 0.00 C ATOM 843 C GLU A 52 3.449 -31.799 15.818 1.00 0.00 C ATOM 844 O GLU A 52 3.513 -32.309 16.929 1.00 0.00 O ATOM 845 CB GLU A 52 2.707 -32.848 13.690 1.00 0.00 C ATOM 846 CG GLU A 52 3.034 -34.282 14.108 1.00 0.00 C ATOM 847 CD GLU A 52 1.749 -35.042 14.416 1.00 0.00 C ATOM 848 OE1 GLU A 52 0.686 -34.496 14.167 1.00 0.00 O ATOM 849 OE2 GLU A 52 1.845 -36.159 14.896 1.00 0.00 O ATOM 0 H GLU A 52 1.933 -30.468 13.561 1.00 0.00 H new ATOM 0 HA GLU A 52 1.493 -32.611 15.456 1.00 0.00 H new ATOM 0 HB2 GLU A 52 1.925 -32.850 12.931 1.00 0.00 H new ATOM 0 HB3 GLU A 52 3.584 -32.380 13.243 1.00 0.00 H new ATOM 0 HG2 GLU A 52 3.582 -34.786 13.312 1.00 0.00 H new ATOM 0 HG3 GLU A 52 3.681 -34.275 14.985 1.00 0.00 H new ATOM 856 N LEU A 53 4.398 -31.009 15.337 1.00 0.00 N ATOM 857 CA LEU A 53 5.590 -30.710 16.120 1.00 0.00 C ATOM 858 C LEU A 53 5.212 -29.995 17.412 1.00 0.00 C ATOM 859 O LEU A 53 5.814 -30.238 18.454 1.00 0.00 O ATOM 860 CB LEU A 53 6.564 -29.839 15.300 1.00 0.00 C ATOM 861 CG LEU A 53 7.488 -30.726 14.456 1.00 0.00 C ATOM 862 CD1 LEU A 53 6.659 -31.602 13.518 1.00 0.00 C ATOM 863 CD2 LEU A 53 8.423 -29.837 13.631 1.00 0.00 C ATOM 0 H LEU A 53 4.368 -30.567 14.418 1.00 0.00 H new ATOM 0 HA LEU A 53 6.083 -31.649 16.371 1.00 0.00 H new ATOM 0 HB2 LEU A 53 6.003 -29.166 14.652 1.00 0.00 H new ATOM 0 HB3 LEU A 53 7.158 -29.216 15.969 1.00 0.00 H new ATOM 0 HG LEU A 53 8.073 -31.367 15.116 1.00 0.00 H new ATOM 0 HD11 LEU A 53 7.324 -32.228 12.923 1.00 0.00 H new ATOM 0 HD12 LEU A 53 5.993 -32.235 14.105 1.00 0.00 H new ATOM 0 HD13 LEU A 53 6.068 -30.969 12.856 1.00 0.00 H new ATOM 0 HD21 LEU A 53 9.082 -30.462 13.029 1.00 0.00 H new ATOM 0 HD22 LEU A 53 7.832 -29.197 12.976 1.00 0.00 H new ATOM 0 HD23 LEU A 53 9.021 -29.218 14.300 1.00 0.00 H new ATOM 875 N ILE A 54 4.228 -29.111 17.343 1.00 0.00 N ATOM 876 CA ILE A 54 3.812 -28.377 18.526 1.00 0.00 C ATOM 877 C ILE A 54 3.323 -29.332 19.612 1.00 0.00 C ATOM 878 O ILE A 54 3.670 -29.180 20.779 1.00 0.00 O ATOM 879 CB ILE A 54 2.693 -27.390 18.162 1.00 0.00 C ATOM 880 CG1 ILE A 54 3.267 -26.237 17.308 1.00 0.00 C ATOM 881 CG2 ILE A 54 2.040 -26.837 19.438 1.00 0.00 C ATOM 882 CD1 ILE A 54 3.866 -25.130 18.191 1.00 0.00 C ATOM 0 H ILE A 54 3.710 -28.887 16.493 1.00 0.00 H new ATOM 0 HA ILE A 54 4.672 -27.827 18.909 1.00 0.00 H new ATOM 0 HB ILE A 54 1.932 -27.912 17.582 1.00 0.00 H new ATOM 0 HG12 ILE A 54 4.034 -26.625 16.638 1.00 0.00 H new ATOM 0 HG13 ILE A 54 2.479 -25.819 16.682 1.00 0.00 H new ATOM 0 HG21 ILE A 54 1.248 -26.138 19.168 1.00 0.00 H new ATOM 0 HG22 ILE A 54 1.617 -27.659 20.016 1.00 0.00 H new ATOM 0 HG23 ILE A 54 2.791 -26.321 20.037 1.00 0.00 H new ATOM 0 HD11 ILE A 54 4.261 -24.334 17.559 1.00 0.00 H new ATOM 0 HD12 ILE A 54 3.092 -24.725 18.843 1.00 0.00 H new ATOM 0 HD13 ILE A 54 4.671 -25.544 18.798 1.00 0.00 H new ATOM 894 N ASP A 55 2.517 -30.312 19.231 1.00 0.00 N ATOM 895 CA ASP A 55 1.993 -31.267 20.196 1.00 0.00 C ATOM 896 C ASP A 55 3.099 -32.166 20.725 1.00 0.00 C ATOM 897 O ASP A 55 3.186 -32.423 21.924 1.00 0.00 O ATOM 898 CB ASP A 55 0.904 -32.114 19.541 1.00 0.00 C ATOM 899 CG ASP A 55 0.332 -33.102 20.547 1.00 0.00 C ATOM 900 OD1 ASP A 55 0.013 -32.680 21.646 1.00 0.00 O ATOM 901 OD2 ASP A 55 0.219 -34.268 20.204 1.00 0.00 O ATOM 0 H ASP A 55 2.214 -30.466 18.269 1.00 0.00 H new ATOM 0 HA ASP A 55 1.571 -30.715 21.035 1.00 0.00 H new ATOM 0 HB2 ASP A 55 0.111 -31.470 19.161 1.00 0.00 H new ATOM 0 HB3 ASP A 55 1.315 -32.651 18.686 1.00 0.00 H new ATOM 906 N LEU A 56 3.940 -32.650 19.823 1.00 0.00 N ATOM 907 CA LEU A 56 5.032 -33.526 20.214 1.00 0.00 C ATOM 908 C LEU A 56 6.024 -32.798 21.125 1.00 0.00 C ATOM 909 O LEU A 56 6.469 -33.350 22.132 1.00 0.00 O ATOM 910 CB LEU A 56 5.744 -34.049 18.950 1.00 0.00 C ATOM 911 CG LEU A 56 5.091 -35.355 18.442 1.00 0.00 C ATOM 912 CD1 LEU A 56 5.473 -36.536 19.360 1.00 0.00 C ATOM 913 CD2 LEU A 56 3.560 -35.217 18.401 1.00 0.00 C ATOM 0 H LEU A 56 3.888 -32.453 18.824 1.00 0.00 H new ATOM 0 HA LEU A 56 4.624 -34.367 20.775 1.00 0.00 H new ATOM 0 HB2 LEU A 56 5.705 -33.291 18.167 1.00 0.00 H new ATOM 0 HB3 LEU A 56 6.797 -34.227 19.169 1.00 0.00 H new ATOM 0 HG LEU A 56 5.458 -35.546 17.433 1.00 0.00 H new ATOM 0 HD11 LEU A 56 5.007 -37.449 18.991 1.00 0.00 H new ATOM 0 HD12 LEU A 56 6.556 -36.658 19.364 1.00 0.00 H new ATOM 0 HD13 LEU A 56 5.126 -36.336 20.374 1.00 0.00 H new ATOM 0 HD21 LEU A 56 3.120 -36.147 18.041 1.00 0.00 H new ATOM 0 HD22 LEU A 56 3.187 -35.003 19.403 1.00 0.00 H new ATOM 0 HD23 LEU A 56 3.286 -34.403 17.730 1.00 0.00 H new ATOM 925 N TYR A 57 6.365 -31.568 20.770 1.00 0.00 N ATOM 926 CA TYR A 57 7.300 -30.790 21.575 1.00 0.00 C ATOM 927 C TYR A 57 6.651 -30.390 22.899 1.00 0.00 C ATOM 928 O TYR A 57 7.272 -30.482 23.957 1.00 0.00 O ATOM 929 CB TYR A 57 7.733 -29.542 20.794 1.00 0.00 C ATOM 930 CG TYR A 57 8.863 -29.895 19.845 1.00 0.00 C ATOM 931 CD1 TYR A 57 8.701 -30.920 18.900 1.00 0.00 C ATOM 932 CD2 TYR A 57 10.077 -29.201 19.917 1.00 0.00 C ATOM 933 CE1 TYR A 57 9.750 -31.244 18.031 1.00 0.00 C ATOM 934 CE2 TYR A 57 11.124 -29.525 19.048 1.00 0.00 C ATOM 935 CZ TYR A 57 10.962 -30.546 18.106 1.00 0.00 C ATOM 936 OH TYR A 57 11.998 -30.863 17.252 1.00 0.00 O ATOM 0 H TYR A 57 6.014 -31.090 19.940 1.00 0.00 H new ATOM 0 HA TYR A 57 8.179 -31.397 21.793 1.00 0.00 H new ATOM 0 HB2 TYR A 57 6.888 -29.141 20.234 1.00 0.00 H new ATOM 0 HB3 TYR A 57 8.056 -28.763 21.485 1.00 0.00 H new ATOM 0 HD1 TYR A 57 7.767 -31.459 18.843 1.00 0.00 H new ATOM 0 HD2 TYR A 57 10.205 -28.414 20.645 1.00 0.00 H new ATOM 0 HE1 TYR A 57 9.625 -32.032 17.303 1.00 0.00 H new ATOM 0 HE2 TYR A 57 12.058 -28.986 19.104 1.00 0.00 H new ATOM 0 HH TYR A 57 12.765 -30.282 17.438 1.00 0.00 H new ATOM 946 N GLU A 58 5.400 -29.954 22.829 1.00 0.00 N ATOM 947 CA GLU A 58 4.670 -29.547 24.026 1.00 0.00 C ATOM 948 C GLU A 58 4.523 -30.717 24.988 1.00 0.00 C ATOM 949 O GLU A 58 4.293 -30.527 26.173 1.00 0.00 O ATOM 950 CB GLU A 58 3.295 -28.991 23.656 1.00 0.00 C ATOM 951 CG GLU A 58 3.455 -27.576 23.091 1.00 0.00 C ATOM 952 CD GLU A 58 3.806 -26.606 24.216 1.00 0.00 C ATOM 953 OE1 GLU A 58 3.523 -26.926 25.360 1.00 0.00 O ATOM 954 OE2 GLU A 58 4.342 -25.552 23.917 1.00 0.00 O ATOM 0 H GLU A 58 4.870 -29.873 21.961 1.00 0.00 H new ATOM 0 HA GLU A 58 5.240 -28.761 24.520 1.00 0.00 H new ATOM 0 HB2 GLU A 58 2.815 -29.636 22.920 1.00 0.00 H new ATOM 0 HB3 GLU A 58 2.649 -28.973 24.534 1.00 0.00 H new ATOM 0 HG2 GLU A 58 4.237 -27.564 22.331 1.00 0.00 H new ATOM 0 HG3 GLU A 58 2.532 -27.263 22.603 1.00 0.00 H new ATOM 961 N GLU A 59 4.641 -31.924 24.466 1.00 0.00 N ATOM 962 CA GLU A 59 4.525 -33.123 25.288 1.00 0.00 C ATOM 963 C GLU A 59 5.874 -33.478 25.916 1.00 0.00 C ATOM 964 O GLU A 59 5.950 -34.322 26.810 1.00 0.00 O ATOM 965 CB GLU A 59 4.028 -34.290 24.429 1.00 0.00 C ATOM 966 CG GLU A 59 2.521 -34.158 24.185 1.00 0.00 C ATOM 967 CD GLU A 59 1.745 -34.584 25.426 1.00 0.00 C ATOM 968 OE1 GLU A 59 2.361 -35.096 26.346 1.00 0.00 O ATOM 969 OE2 GLU A 59 0.540 -34.394 25.436 1.00 0.00 O ATOM 0 H GLU A 59 4.817 -32.104 23.478 1.00 0.00 H new ATOM 0 HA GLU A 59 3.811 -32.930 26.089 1.00 0.00 H new ATOM 0 HB2 GLU A 59 4.559 -34.303 23.477 1.00 0.00 H new ATOM 0 HB3 GLU A 59 4.242 -35.236 24.927 1.00 0.00 H new ATOM 0 HG2 GLU A 59 2.276 -33.127 23.931 1.00 0.00 H new ATOM 0 HG3 GLU A 59 2.228 -34.774 23.335 1.00 0.00 H new ATOM 976 N SER A 60 6.950 -32.864 25.415 1.00 0.00 N ATOM 977 CA SER A 60 8.286 -33.174 25.924 1.00 0.00 C ATOM 978 C SER A 60 8.407 -32.926 27.431 1.00 0.00 C ATOM 979 O SER A 60 8.655 -33.855 28.195 1.00 0.00 O ATOM 980 CB SER A 60 9.305 -32.280 25.215 1.00 0.00 C ATOM 981 OG SER A 60 9.312 -32.565 23.823 1.00 0.00 O ATOM 0 H SER A 60 6.924 -32.164 24.673 1.00 0.00 H new ATOM 0 HA SER A 60 8.472 -34.231 25.734 1.00 0.00 H new ATOM 0 HB2 SER A 60 9.058 -31.231 25.379 1.00 0.00 H new ATOM 0 HB3 SER A 60 10.298 -32.443 25.633 1.00 0.00 H new ATOM 0 HG SER A 60 9.965 -31.988 23.374 1.00 0.00 H new ATOM 987 N GLN A 61 8.231 -31.668 27.849 1.00 0.00 N ATOM 988 CA GLN A 61 8.319 -31.298 29.281 1.00 0.00 C ATOM 989 C GLN A 61 6.968 -30.858 29.842 1.00 0.00 C ATOM 990 O GLN A 61 6.622 -31.186 30.977 1.00 0.00 O ATOM 991 CB GLN A 61 9.363 -30.186 29.505 1.00 0.00 C ATOM 992 CG GLN A 61 10.365 -30.191 28.355 1.00 0.00 C ATOM 993 CD GLN A 61 11.506 -29.241 28.674 1.00 0.00 C ATOM 994 OE1 GLN A 61 11.296 -28.032 28.775 1.00 0.00 O ATOM 995 NE2 GLN A 61 12.703 -29.718 28.847 1.00 0.00 N ATOM 0 H GLN A 61 8.027 -30.886 27.226 1.00 0.00 H new ATOM 0 HA GLN A 61 8.633 -32.194 29.816 1.00 0.00 H new ATOM 0 HB2 GLN A 61 8.869 -29.216 29.567 1.00 0.00 H new ATOM 0 HB3 GLN A 61 9.879 -30.342 30.452 1.00 0.00 H new ATOM 0 HG2 GLN A 61 10.750 -31.199 28.198 1.00 0.00 H new ATOM 0 HG3 GLN A 61 9.874 -29.889 27.430 1.00 0.00 H new ATOM 0 HE21 GLN A 61 12.870 -30.721 28.762 1.00 0.00 H new ATOM 0 HE22 GLN A 61 13.475 -29.090 29.068 1.00 0.00 H new ATOM 1004 N PRO A 62 6.202 -30.130 29.076 1.00 0.00 N ATOM 1005 CA PRO A 62 4.869 -29.646 29.510 1.00 0.00 C ATOM 1006 C PRO A 62 3.722 -30.493 28.959 1.00 0.00 C ATOM 1007 O PRO A 62 2.997 -30.097 28.046 1.00 0.00 O ATOM 1008 CB PRO A 62 4.838 -28.244 28.885 1.00 0.00 C ATOM 1009 CG PRO A 62 5.680 -28.339 27.635 1.00 0.00 C ATOM 1010 CD PRO A 62 6.541 -29.618 27.750 1.00 0.00 C ATOM 0 HA PRO A 62 4.738 -29.679 30.592 1.00 0.00 H new ATOM 0 HB2 PRO A 62 3.818 -27.943 28.648 1.00 0.00 H new ATOM 0 HB3 PRO A 62 5.239 -27.499 29.572 1.00 0.00 H new ATOM 0 HG2 PRO A 62 5.047 -28.382 26.749 1.00 0.00 H new ATOM 0 HG3 PRO A 62 6.314 -27.458 27.532 1.00 0.00 H new ATOM 0 HD2 PRO A 62 6.300 -30.337 26.967 1.00 0.00 H new ATOM 0 HD3 PRO A 62 7.605 -29.397 27.664 1.00 0.00 H new ATOM 1018 N SER A 63 3.565 -31.661 29.581 1.00 0.00 N ATOM 1019 CA SER A 63 2.504 -32.591 29.227 1.00 0.00 C ATOM 1020 C SER A 63 1.194 -32.174 29.892 1.00 0.00 C ATOM 1021 O SER A 63 0.126 -32.302 29.311 1.00 0.00 O ATOM 1022 CB SER A 63 2.886 -34.003 29.680 1.00 0.00 C ATOM 1023 OG SER A 63 4.048 -34.424 28.975 1.00 0.00 O ATOM 0 H SER A 63 4.167 -31.984 30.338 1.00 0.00 H new ATOM 0 HA SER A 63 2.370 -32.580 28.145 1.00 0.00 H new ATOM 0 HB2 SER A 63 3.074 -34.015 30.754 1.00 0.00 H new ATOM 0 HB3 SER A 63 2.063 -34.693 29.493 1.00 0.00 H new ATOM 0 HG SER A 63 3.798 -34.706 28.070 1.00 0.00 H new ATOM 1029 N SER A 64 1.281 -31.676 31.125 1.00 0.00 N ATOM 1030 CA SER A 64 0.087 -31.247 31.868 1.00 0.00 C ATOM 1031 C SER A 64 0.146 -29.753 32.173 1.00 0.00 C ATOM 1032 O SER A 64 -0.637 -29.242 32.973 1.00 0.00 O ATOM 1033 CB SER A 64 -0.025 -32.036 33.174 1.00 0.00 C ATOM 1034 OG SER A 64 -0.424 -33.368 32.881 1.00 0.00 O ATOM 0 H SER A 64 2.158 -31.558 31.632 1.00 0.00 H new ATOM 0 HA SER A 64 -0.790 -31.440 31.250 1.00 0.00 H new ATOM 0 HB2 SER A 64 0.932 -32.037 33.696 1.00 0.00 H new ATOM 0 HB3 SER A 64 -0.750 -31.564 33.837 1.00 0.00 H new ATOM 0 HG SER A 64 -0.496 -33.879 33.714 1.00 0.00 H new ATOM 1040 N GLU A 65 1.084 -29.054 31.533 1.00 0.00 N ATOM 1041 CA GLU A 65 1.240 -27.614 31.744 1.00 0.00 C ATOM 1042 C GLU A 65 0.484 -26.821 30.683 1.00 0.00 C ATOM 1043 O GLU A 65 -0.711 -26.560 30.825 1.00 0.00 O ATOM 1044 CB GLU A 65 2.722 -27.245 31.689 1.00 0.00 C ATOM 1045 CG GLU A 65 3.445 -27.843 32.894 1.00 0.00 C ATOM 1046 CD GLU A 65 4.938 -27.548 32.805 1.00 0.00 C ATOM 1047 OE1 GLU A 65 5.329 -26.841 31.891 1.00 0.00 O ATOM 1048 OE2 GLU A 65 5.668 -28.037 33.650 1.00 0.00 O ATOM 0 H GLU A 65 1.744 -29.458 30.868 1.00 0.00 H new ATOM 0 HA GLU A 65 0.829 -27.365 32.723 1.00 0.00 H new ATOM 0 HB2 GLU A 65 3.165 -27.617 30.765 1.00 0.00 H new ATOM 0 HB3 GLU A 65 2.837 -26.161 31.684 1.00 0.00 H new ATOM 0 HG2 GLU A 65 3.038 -27.427 33.816 1.00 0.00 H new ATOM 0 HG3 GLU A 65 3.280 -28.920 32.930 1.00 0.00 H new ATOM 1055 N ARG A 66 1.189 -26.436 29.624 1.00 0.00 N ATOM 1056 CA ARG A 66 0.576 -25.668 28.548 1.00 0.00 C ATOM 1057 C ARG A 66 -0.268 -26.564 27.650 1.00 0.00 C ATOM 1058 O ARG A 66 -1.097 -26.080 26.885 1.00 0.00 O ATOM 1059 CB ARG A 66 1.657 -24.974 27.718 1.00 0.00 C ATOM 1060 CG ARG A 66 2.309 -23.876 28.558 1.00 0.00 C ATOM 1061 CD ARG A 66 3.391 -23.177 27.735 1.00 0.00 C ATOM 1062 NE ARG A 66 4.494 -24.094 27.475 1.00 0.00 N ATOM 1063 CZ ARG A 66 5.453 -24.287 28.375 1.00 0.00 C ATOM 1064 NH1 ARG A 66 5.423 -23.640 29.509 1.00 0.00 N ATOM 1065 NH2 ARG A 66 6.425 -25.122 28.127 1.00 0.00 N ATOM 0 H ARG A 66 2.179 -26.642 29.489 1.00 0.00 H new ATOM 0 HA ARG A 66 -0.075 -24.917 28.995 1.00 0.00 H new ATOM 0 HB2 ARG A 66 2.407 -25.697 27.398 1.00 0.00 H new ATOM 0 HB3 ARG A 66 1.221 -24.547 26.815 1.00 0.00 H new ATOM 0 HG2 ARG A 66 1.558 -23.154 28.878 1.00 0.00 H new ATOM 0 HG3 ARG A 66 2.744 -24.304 29.461 1.00 0.00 H new ATOM 0 HD2 ARG A 66 2.971 -22.825 26.793 1.00 0.00 H new ATOM 0 HD3 ARG A 66 3.756 -22.300 28.270 1.00 0.00 H new ATOM 0 HE ARG A 66 4.530 -24.596 26.588 1.00 0.00 H new ATOM 0 HH11 ARG A 66 4.664 -22.987 29.704 1.00 0.00 H new ATOM 0 HH12 ARG A 66 6.159 -23.788 30.200 1.00 0.00 H new ATOM 0 HH21 ARG A 66 6.450 -25.628 27.241 1.00 0.00 H new ATOM 0 HH22 ARG A 66 7.160 -25.269 28.819 1.00 0.00 H new ATOM 1079 N LEU A 67 -0.061 -27.873 27.746 1.00 0.00 N ATOM 1080 CA LEU A 67 -0.818 -28.817 26.928 1.00 0.00 C ATOM 1081 C LEU A 67 -2.299 -28.444 26.933 1.00 0.00 C ATOM 1082 O LEU A 67 -3.067 -28.887 26.085 1.00 0.00 O ATOM 1083 CB LEU A 67 -0.637 -30.249 27.443 1.00 0.00 C ATOM 1084 CG LEU A 67 -1.126 -31.253 26.381 1.00 0.00 C ATOM 1085 CD1 LEU A 67 -0.188 -31.250 25.155 1.00 0.00 C ATOM 1086 CD2 LEU A 67 -1.176 -32.656 26.995 1.00 0.00 C ATOM 0 H LEU A 67 0.617 -28.303 28.375 1.00 0.00 H new ATOM 0 HA LEU A 67 -0.440 -28.767 25.907 1.00 0.00 H new ATOM 0 HB2 LEU A 67 0.413 -30.432 27.673 1.00 0.00 H new ATOM 0 HB3 LEU A 67 -1.195 -30.385 28.369 1.00 0.00 H new ATOM 0 HG LEU A 67 -2.123 -30.960 26.051 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -0.551 -31.966 24.417 1.00 0.00 H new ATOM 0 HD12 LEU A 67 -0.168 -30.253 24.714 1.00 0.00 H new ATOM 0 HD13 LEU A 67 0.819 -31.529 25.466 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -1.522 -33.369 26.246 1.00 0.00 H new ATOM 0 HD22 LEU A 67 -0.180 -32.940 27.334 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -1.862 -32.658 27.842 1.00 0.00 H new ATOM 1098 N ASN A 68 -2.704 -27.635 27.904 1.00 0.00 N ATOM 1099 CA ASN A 68 -4.095 -27.215 27.995 1.00 0.00 C ATOM 1100 C ASN A 68 -4.352 -26.010 27.083 1.00 0.00 C ATOM 1101 O ASN A 68 -5.345 -25.970 26.355 1.00 0.00 O ATOM 1102 CB ASN A 68 -4.427 -26.843 29.440 1.00 0.00 C ATOM 1103 CG ASN A 68 -5.937 -26.752 29.615 1.00 0.00 C ATOM 1104 OD1 ASN A 68 -6.688 -27.395 28.882 1.00 0.00 O ATOM 1105 ND2 ASN A 68 -6.429 -25.987 30.548 1.00 0.00 N ATOM 0 H ASN A 68 -2.096 -27.260 28.632 1.00 0.00 H new ATOM 0 HA ASN A 68 -4.731 -28.040 27.674 1.00 0.00 H new ATOM 0 HB2 ASN A 68 -4.017 -27.589 30.121 1.00 0.00 H new ATOM 0 HB3 ASN A 68 -3.964 -25.890 29.695 1.00 0.00 H new ATOM 0 HD21 ASN A 68 -7.439 -25.920 30.672 1.00 0.00 H new ATOM 0 HD22 ASN A 68 -5.804 -25.455 31.154 1.00 0.00 H new ATOM 1112 N ALA A 69 -3.452 -25.024 27.137 1.00 0.00 N ATOM 1113 CA ALA A 69 -3.586 -23.812 26.324 1.00 0.00 C ATOM 1114 C ALA A 69 -2.982 -24.005 24.933 1.00 0.00 C ATOM 1115 O ALA A 69 -3.469 -23.444 23.952 1.00 0.00 O ATOM 1116 CB ALA A 69 -2.883 -22.640 27.015 1.00 0.00 C ATOM 0 H ALA A 69 -2.625 -25.041 27.734 1.00 0.00 H new ATOM 0 HA ALA A 69 -4.650 -23.601 26.216 1.00 0.00 H new ATOM 0 HB1 ALA A 69 -2.987 -21.743 26.405 1.00 0.00 H new ATOM 0 HB2 ALA A 69 -3.335 -22.469 27.992 1.00 0.00 H new ATOM 0 HB3 ALA A 69 -1.826 -22.873 27.141 1.00 0.00 H new ATOM 1122 N PHE A 70 -1.917 -24.799 24.859 1.00 0.00 N ATOM 1123 CA PHE A 70 -1.246 -25.058 23.588 1.00 0.00 C ATOM 1124 C PHE A 70 -2.281 -25.305 22.491 1.00 0.00 C ATOM 1125 O PHE A 70 -2.002 -25.137 21.304 1.00 0.00 O ATOM 1126 CB PHE A 70 -0.306 -26.283 23.741 1.00 0.00 C ATOM 1127 CG PHE A 70 -1.020 -27.552 23.315 1.00 0.00 C ATOM 1128 CD1 PHE A 70 -2.265 -27.852 23.868 1.00 0.00 C ATOM 1129 CD2 PHE A 70 -0.456 -28.407 22.357 1.00 0.00 C ATOM 1130 CE1 PHE A 70 -2.952 -29.005 23.475 1.00 0.00 C ATOM 1131 CE2 PHE A 70 -1.142 -29.565 21.964 1.00 0.00 C ATOM 1132 CZ PHE A 70 -2.392 -29.861 22.523 1.00 0.00 C ATOM 0 H PHE A 70 -1.501 -25.273 25.661 1.00 0.00 H new ATOM 0 HA PHE A 70 -0.650 -24.190 23.306 1.00 0.00 H new ATOM 0 HB2 PHE A 70 0.589 -26.141 23.136 1.00 0.00 H new ATOM 0 HB3 PHE A 70 0.021 -26.372 24.777 1.00 0.00 H new ATOM 0 HD1 PHE A 70 -2.700 -27.191 24.603 1.00 0.00 H new ATOM 0 HD2 PHE A 70 0.505 -28.174 21.923 1.00 0.00 H new ATOM 0 HE1 PHE A 70 -3.915 -29.234 23.907 1.00 0.00 H new ATOM 0 HE2 PHE A 70 -0.707 -30.228 21.231 1.00 0.00 H new ATOM 0 HZ PHE A 70 -2.923 -30.751 22.218 1.00 0.00 H new ATOM 1142 N ARG A 71 -3.473 -25.714 22.909 1.00 0.00 N ATOM 1143 CA ARG A 71 -4.545 -25.994 21.973 1.00 0.00 C ATOM 1144 C ARG A 71 -4.980 -24.711 21.282 1.00 0.00 C ATOM 1145 O ARG A 71 -5.230 -24.696 20.079 1.00 0.00 O ATOM 1146 CB ARG A 71 -5.731 -26.624 22.700 1.00 0.00 C ATOM 1147 CG ARG A 71 -6.802 -27.018 21.681 1.00 0.00 C ATOM 1148 CD ARG A 71 -8.000 -27.631 22.404 1.00 0.00 C ATOM 1149 NE ARG A 71 -8.949 -28.162 21.431 1.00 0.00 N ATOM 1150 CZ ARG A 71 -9.852 -27.378 20.849 1.00 0.00 C ATOM 1151 NH1 ARG A 71 -9.905 -26.109 21.152 1.00 0.00 N ATOM 1152 NH2 ARG A 71 -10.683 -27.876 19.976 1.00 0.00 N ATOM 0 H ARG A 71 -3.717 -25.858 23.889 1.00 0.00 H new ATOM 0 HA ARG A 71 -4.181 -26.696 21.223 1.00 0.00 H new ATOM 0 HB2 ARG A 71 -5.405 -27.501 23.258 1.00 0.00 H new ATOM 0 HB3 ARG A 71 -6.143 -25.921 23.424 1.00 0.00 H new ATOM 0 HG2 ARG A 71 -7.117 -26.143 21.113 1.00 0.00 H new ATOM 0 HG3 ARG A 71 -6.392 -27.732 20.966 1.00 0.00 H new ATOM 0 HD2 ARG A 71 -7.666 -28.426 23.070 1.00 0.00 H new ATOM 0 HD3 ARG A 71 -8.485 -26.878 23.025 1.00 0.00 H new ATOM 0 HE ARG A 71 -8.919 -29.153 21.193 1.00 0.00 H new ATOM 0 HH11 ARG A 71 -9.254 -25.720 21.834 1.00 0.00 H new ATOM 0 HH12 ARG A 71 -10.597 -25.507 20.706 1.00 0.00 H new ATOM 0 HH21 ARG A 71 -10.641 -28.867 19.739 1.00 0.00 H new ATOM 0 HH22 ARG A 71 -11.375 -27.274 19.530 1.00 0.00 H new ATOM 1166 N GLU A 72 -5.065 -23.633 22.054 1.00 0.00 N ATOM 1167 CA GLU A 72 -5.467 -22.350 21.499 1.00 0.00 C ATOM 1168 C GLU A 72 -4.618 -22.031 20.280 1.00 0.00 C ATOM 1169 O GLU A 72 -5.138 -21.647 19.232 1.00 0.00 O ATOM 1170 CB GLU A 72 -5.292 -21.247 22.544 1.00 0.00 C ATOM 1171 CG GLU A 72 -6.301 -21.446 23.675 1.00 0.00 C ATOM 1172 CD GLU A 72 -6.077 -20.398 24.760 1.00 0.00 C ATOM 1173 OE1 GLU A 72 -5.239 -19.535 24.559 1.00 0.00 O ATOM 1174 OE2 GLU A 72 -6.751 -20.473 25.774 1.00 0.00 O ATOM 0 H GLU A 72 -4.863 -23.623 23.054 1.00 0.00 H new ATOM 0 HA GLU A 72 -6.516 -22.404 21.209 1.00 0.00 H new ATOM 0 HB2 GLU A 72 -4.277 -21.266 22.941 1.00 0.00 H new ATOM 0 HB3 GLU A 72 -5.435 -20.270 22.083 1.00 0.00 H new ATOM 0 HG2 GLU A 72 -7.316 -21.368 23.286 1.00 0.00 H new ATOM 0 HG3 GLU A 72 -6.196 -22.446 24.096 1.00 0.00 H new ATOM 1181 N LEU A 73 -3.307 -22.208 20.416 1.00 0.00 N ATOM 1182 CA LEU A 73 -2.406 -21.950 19.306 1.00 0.00 C ATOM 1183 C LEU A 73 -2.714 -22.901 18.160 1.00 0.00 C ATOM 1184 O LEU A 73 -2.773 -22.494 17.009 1.00 0.00 O ATOM 1185 CB LEU A 73 -0.943 -22.140 19.747 1.00 0.00 C ATOM 1186 CG LEU A 73 0.013 -21.943 18.554 1.00 0.00 C ATOM 1187 CD1 LEU A 73 -0.146 -20.531 17.968 1.00 0.00 C ATOM 1188 CD2 LEU A 73 1.459 -22.149 19.025 1.00 0.00 C ATOM 0 H LEU A 73 -2.853 -22.525 21.273 1.00 0.00 H new ATOM 0 HA LEU A 73 -2.548 -20.921 18.976 1.00 0.00 H new ATOM 0 HB2 LEU A 73 -0.700 -21.428 20.536 1.00 0.00 H new ATOM 0 HB3 LEU A 73 -0.810 -23.138 20.166 1.00 0.00 H new ATOM 0 HG LEU A 73 -0.229 -22.670 17.779 1.00 0.00 H new ATOM 0 HD11 LEU A 73 0.536 -20.407 17.127 1.00 0.00 H new ATOM 0 HD12 LEU A 73 -1.172 -20.392 17.627 1.00 0.00 H new ATOM 0 HD13 LEU A 73 0.085 -19.791 18.734 1.00 0.00 H new ATOM 0 HD21 LEU A 73 2.139 -22.011 18.184 1.00 0.00 H new ATOM 0 HD22 LEU A 73 1.694 -21.425 19.805 1.00 0.00 H new ATOM 0 HD23 LEU A 73 1.572 -23.158 19.421 1.00 0.00 H new ATOM 1200 N ARG A 74 -2.908 -24.172 18.482 1.00 0.00 N ATOM 1201 CA ARG A 74 -3.198 -25.167 17.459 1.00 0.00 C ATOM 1202 C ARG A 74 -4.523 -24.863 16.788 1.00 0.00 C ATOM 1203 O ARG A 74 -4.691 -25.086 15.590 1.00 0.00 O ATOM 1204 CB ARG A 74 -3.237 -26.569 18.068 1.00 0.00 C ATOM 1205 CG ARG A 74 -1.827 -26.973 18.499 1.00 0.00 C ATOM 1206 CD ARG A 74 -1.866 -28.360 19.139 1.00 0.00 C ATOM 1207 NE ARG A 74 -2.275 -29.356 18.155 1.00 0.00 N ATOM 1208 CZ ARG A 74 -2.698 -30.559 18.528 1.00 0.00 C ATOM 1209 NH1 ARG A 74 -2.757 -30.864 19.795 1.00 0.00 N ATOM 1210 NH2 ARG A 74 -3.056 -31.434 17.629 1.00 0.00 N ATOM 0 H ARG A 74 -2.870 -24.536 19.434 1.00 0.00 H new ATOM 0 HA ARG A 74 -2.404 -25.129 16.713 1.00 0.00 H new ATOM 0 HB2 ARG A 74 -3.911 -26.587 18.925 1.00 0.00 H new ATOM 0 HB3 ARG A 74 -3.626 -27.283 17.342 1.00 0.00 H new ATOM 0 HG2 ARG A 74 -1.159 -26.977 17.637 1.00 0.00 H new ATOM 0 HG3 ARG A 74 -1.429 -26.246 19.207 1.00 0.00 H new ATOM 0 HD2 ARG A 74 -0.883 -28.613 19.537 1.00 0.00 H new ATOM 0 HD3 ARG A 74 -2.560 -28.362 19.979 1.00 0.00 H new ATOM 0 HE ARG A 74 -2.236 -29.125 17.162 1.00 0.00 H new ATOM 0 HH11 ARG A 74 -2.479 -30.179 20.498 1.00 0.00 H new ATOM 0 HH12 ARG A 74 -3.082 -31.787 20.083 1.00 0.00 H new ATOM 0 HH21 ARG A 74 -3.011 -31.195 16.638 1.00 0.00 H new ATOM 0 HH22 ARG A 74 -3.381 -32.357 17.917 1.00 0.00 H new ATOM 1224 N THR A 75 -5.464 -24.360 17.569 1.00 0.00 N ATOM 1225 CA THR A 75 -6.773 -24.036 17.041 1.00 0.00 C ATOM 1226 C THR A 75 -6.664 -22.981 15.949 1.00 0.00 C ATOM 1227 O THR A 75 -7.265 -23.113 14.884 1.00 0.00 O ATOM 1228 CB THR A 75 -7.663 -23.518 18.158 1.00 0.00 C ATOM 1229 OG1 THR A 75 -7.545 -24.364 19.293 1.00 0.00 O ATOM 1230 CG2 THR A 75 -9.115 -23.500 17.688 1.00 0.00 C ATOM 0 H THR A 75 -5.345 -24.169 18.564 1.00 0.00 H new ATOM 0 HA THR A 75 -7.208 -24.940 16.614 1.00 0.00 H new ATOM 0 HB THR A 75 -7.354 -22.507 18.425 1.00 0.00 H new ATOM 0 HG1 THR A 75 -6.765 -24.096 19.821 1.00 0.00 H new ATOM 0 HG21 THR A 75 -9.753 -23.128 18.490 1.00 0.00 H new ATOM 0 HG22 THR A 75 -9.208 -22.849 16.819 1.00 0.00 H new ATOM 0 HG23 THR A 75 -9.423 -24.510 17.419 1.00 0.00 H new ATOM 1238 N GLN A 76 -5.891 -21.936 16.215 1.00 0.00 N ATOM 1239 CA GLN A 76 -5.720 -20.871 15.237 1.00 0.00 C ATOM 1240 C GLN A 76 -5.161 -21.444 13.943 1.00 0.00 C ATOM 1241 O GLN A 76 -5.690 -21.198 12.859 1.00 0.00 O ATOM 1242 CB GLN A 76 -4.765 -19.812 15.792 1.00 0.00 C ATOM 1243 CG GLN A 76 -4.701 -18.615 14.840 1.00 0.00 C ATOM 1244 CD GLN A 76 -6.049 -17.904 14.805 1.00 0.00 C ATOM 1245 OE1 GLN A 76 -6.698 -17.754 15.838 1.00 0.00 O ATOM 1246 NE2 GLN A 76 -6.509 -17.455 13.670 1.00 0.00 N ATOM 0 H GLN A 76 -5.379 -21.804 17.087 1.00 0.00 H new ATOM 0 HA GLN A 76 -6.687 -20.411 15.033 1.00 0.00 H new ATOM 0 HB2 GLN A 76 -5.102 -19.487 16.776 1.00 0.00 H new ATOM 0 HB3 GLN A 76 -3.770 -20.239 15.920 1.00 0.00 H new ATOM 0 HG2 GLN A 76 -3.924 -17.923 15.164 1.00 0.00 H new ATOM 0 HG3 GLN A 76 -4.431 -18.950 13.839 1.00 0.00 H new ATOM 0 HE21 GLN A 76 -5.968 -17.581 12.815 1.00 0.00 H new ATOM 0 HE22 GLN A 76 -7.410 -16.978 13.638 1.00 0.00 H new ATOM 1255 N LEU A 77 -4.093 -22.222 14.067 1.00 0.00 N ATOM 1256 CA LEU A 77 -3.476 -22.846 12.905 1.00 0.00 C ATOM 1257 C LEU A 77 -4.438 -23.844 12.272 1.00 0.00 C ATOM 1258 O LEU A 77 -4.537 -23.938 11.049 1.00 0.00 O ATOM 1259 CB LEU A 77 -2.178 -23.557 13.328 1.00 0.00 C ATOM 1260 CG LEU A 77 -1.011 -22.553 13.382 1.00 0.00 C ATOM 1261 CD1 LEU A 77 -0.621 -22.097 11.963 1.00 0.00 C ATOM 1262 CD2 LEU A 77 -1.414 -21.331 14.216 1.00 0.00 C ATOM 0 H LEU A 77 -3.639 -22.435 14.955 1.00 0.00 H new ATOM 0 HA LEU A 77 -3.239 -22.077 12.170 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -2.312 -24.022 14.305 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -1.947 -24.356 12.623 1.00 0.00 H new ATOM 0 HG LEU A 77 -0.154 -23.045 13.842 1.00 0.00 H new ATOM 0 HD11 LEU A 77 0.205 -21.388 12.023 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -0.315 -22.962 11.374 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -1.476 -21.618 11.487 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -0.585 -20.625 14.251 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -2.281 -20.851 13.762 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -1.663 -21.648 15.229 1.00 0.00 H new ATOM 1274 N GLU A 78 -5.139 -24.593 13.113 1.00 0.00 N ATOM 1275 CA GLU A 78 -6.083 -25.585 12.624 1.00 0.00 C ATOM 1276 C GLU A 78 -7.179 -24.911 11.807 1.00 0.00 C ATOM 1277 O GLU A 78 -7.492 -25.341 10.697 1.00 0.00 O ATOM 1278 CB GLU A 78 -6.707 -26.325 13.805 1.00 0.00 C ATOM 1279 CG GLU A 78 -7.575 -27.468 13.288 1.00 0.00 C ATOM 1280 CD GLU A 78 -8.197 -28.219 14.458 1.00 0.00 C ATOM 1281 OE1 GLU A 78 -8.121 -27.713 15.567 1.00 0.00 O ATOM 1282 OE2 GLU A 78 -8.740 -29.286 14.231 1.00 0.00 O ATOM 0 H GLU A 78 -5.072 -24.533 14.129 1.00 0.00 H new ATOM 0 HA GLU A 78 -5.553 -26.294 11.988 1.00 0.00 H new ATOM 0 HB2 GLU A 78 -5.926 -26.714 14.458 1.00 0.00 H new ATOM 0 HB3 GLU A 78 -7.308 -25.639 14.401 1.00 0.00 H new ATOM 0 HG2 GLU A 78 -8.358 -27.076 12.639 1.00 0.00 H new ATOM 0 HG3 GLU A 78 -6.973 -28.149 12.686 1.00 0.00 H new ATOM 1289 N LYS A 79 -7.748 -23.841 12.354 1.00 0.00 N ATOM 1290 CA LYS A 79 -8.792 -23.106 11.657 1.00 0.00 C ATOM 1291 C LYS A 79 -8.222 -22.448 10.414 1.00 0.00 C ATOM 1292 O LYS A 79 -8.847 -22.444 9.354 1.00 0.00 O ATOM 1293 CB LYS A 79 -9.396 -22.040 12.569 1.00 0.00 C ATOM 1294 CG LYS A 79 -10.194 -22.713 13.687 1.00 0.00 C ATOM 1295 CD LYS A 79 -10.951 -21.652 14.492 1.00 0.00 C ATOM 1296 CE LYS A 79 -9.967 -20.643 15.092 1.00 0.00 C ATOM 1297 NZ LYS A 79 -10.615 -19.941 16.238 1.00 0.00 N ATOM 0 H LYS A 79 -7.504 -23.467 13.271 1.00 0.00 H new ATOM 0 HA LYS A 79 -9.574 -23.808 11.369 1.00 0.00 H new ATOM 0 HB2 LYS A 79 -8.606 -21.421 12.994 1.00 0.00 H new ATOM 0 HB3 LYS A 79 -10.044 -21.379 11.993 1.00 0.00 H new ATOM 0 HG2 LYS A 79 -10.896 -23.432 13.264 1.00 0.00 H new ATOM 0 HG3 LYS A 79 -9.523 -23.270 14.341 1.00 0.00 H new ATOM 0 HD2 LYS A 79 -11.664 -21.137 13.849 1.00 0.00 H new ATOM 0 HD3 LYS A 79 -11.525 -22.129 15.287 1.00 0.00 H new ATOM 0 HE2 LYS A 79 -9.064 -21.154 15.427 1.00 0.00 H new ATOM 0 HE3 LYS A 79 -9.662 -19.921 14.334 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 -9.948 -19.255 16.647 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 -11.464 -19.442 15.904 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 -10.885 -20.636 16.963 1.00 0.00 H new ATOM 1311 N ALA A 80 -7.027 -21.887 10.556 1.00 0.00 N ATOM 1312 CA ALA A 80 -6.385 -21.224 9.435 1.00 0.00 C ATOM 1313 C ALA A 80 -6.188 -22.206 8.289 1.00 0.00 C ATOM 1314 O ALA A 80 -6.465 -21.890 7.136 1.00 0.00 O ATOM 1315 CB ALA A 80 -5.028 -20.651 9.849 1.00 0.00 C ATOM 0 H ALA A 80 -6.492 -21.879 11.424 1.00 0.00 H new ATOM 0 HA ALA A 80 -7.030 -20.407 9.110 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -4.565 -20.159 8.994 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -5.168 -19.927 10.652 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -4.383 -21.458 10.196 1.00 0.00 H new ATOM 1321 N LEU A 81 -5.703 -23.399 8.615 1.00 0.00 N ATOM 1322 CA LEU A 81 -5.475 -24.420 7.599 1.00 0.00 C ATOM 1323 C LEU A 81 -6.805 -24.824 6.966 1.00 0.00 C ATOM 1324 O LEU A 81 -6.908 -24.972 5.750 1.00 0.00 O ATOM 1325 CB LEU A 81 -4.795 -25.644 8.240 1.00 0.00 C ATOM 1326 CG LEU A 81 -3.988 -26.427 7.189 1.00 0.00 C ATOM 1327 CD1 LEU A 81 -3.253 -27.585 7.879 1.00 0.00 C ATOM 1328 CD2 LEU A 81 -4.918 -26.978 6.092 1.00 0.00 C ATOM 0 H LEU A 81 -5.462 -23.681 9.565 1.00 0.00 H new ATOM 0 HA LEU A 81 -4.824 -24.020 6.822 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -4.136 -25.320 9.046 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -5.548 -26.293 8.686 1.00 0.00 H new ATOM 0 HG LEU A 81 -3.266 -25.757 6.722 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -2.679 -28.144 7.140 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -2.578 -27.187 8.637 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -3.979 -28.247 8.351 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -4.329 -27.528 5.358 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -5.654 -27.645 6.540 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -5.430 -26.151 5.600 1.00 0.00 H new ATOM 1340 N GLY A 82 -7.825 -24.990 7.805 1.00 0.00 N ATOM 1341 CA GLY A 82 -9.147 -25.374 7.319 1.00 0.00 C ATOM 1342 C GLY A 82 -9.727 -24.287 6.423 1.00 0.00 C ATOM 1343 O GLY A 82 -10.522 -24.571 5.528 1.00 0.00 O ATOM 0 H GLY A 82 -7.763 -24.866 8.815 1.00 0.00 H new ATOM 0 HA2 GLY A 82 -9.079 -26.311 6.766 1.00 0.00 H new ATOM 0 HA3 GLY A 82 -9.813 -25.550 8.163 1.00 0.00 H new ATOM 1347 N LEU A 83 -9.318 -23.046 6.669 1.00 0.00 N ATOM 1348 CA LEU A 83 -9.794 -21.917 5.875 1.00 0.00 C ATOM 1349 C LEU A 83 -11.316 -21.840 5.922 1.00 0.00 C ATOM 1350 O LEU A 83 -11.930 -21.015 5.244 1.00 0.00 O ATOM 1351 CB LEU A 83 -9.326 -22.073 4.422 1.00 0.00 C ATOM 1352 CG LEU A 83 -7.791 -22.034 4.358 1.00 0.00 C ATOM 1353 CD1 LEU A 83 -7.328 -22.549 2.994 1.00 0.00 C ATOM 1354 CD2 LEU A 83 -7.276 -20.596 4.553 1.00 0.00 C ATOM 0 H LEU A 83 -8.661 -22.797 7.408 1.00 0.00 H new ATOM 0 HA LEU A 83 -9.384 -20.997 6.291 1.00 0.00 H new ATOM 0 HB2 LEU A 83 -9.692 -23.015 4.012 1.00 0.00 H new ATOM 0 HB3 LEU A 83 -9.744 -21.275 3.809 1.00 0.00 H new ATOM 0 HG LEU A 83 -7.393 -22.663 5.154 1.00 0.00 H new ATOM 0 HD11 LEU A 83 -6.239 -22.523 2.945 1.00 0.00 H new ATOM 0 HD12 LEU A 83 -7.673 -23.574 2.856 1.00 0.00 H new ATOM 0 HD13 LEU A 83 -7.742 -21.918 2.207 1.00 0.00 H new ATOM 0 HD21 LEU A 83 -6.187 -20.590 4.504 1.00 0.00 H new ATOM 0 HD22 LEU A 83 -7.678 -19.956 3.768 1.00 0.00 H new ATOM 0 HD23 LEU A 83 -7.598 -20.223 5.525 1.00 0.00 H new