USER MOD reduce.3.24.130724 H: found=0, std=0, add=1016, rem=0, adj=42 USER MOD reduce.3.24.130724 removed 1016 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 119 THR OG1 : rot 180:sc= 0 USER MOD Set 1.2: A 124 THR OG1 : rot 180:sc= 0 USER MOD Set 2.1: A 113 THR OG1 : rot -102:sc= 1.21 USER MOD Set 2.2: A 128 ASN : amide:sc= 1.03 K(o=2.2,f=1.7) USER MOD Set 3.1: A 51 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 3.2: A 82 SER OG : rot 4:sc= 0.819 USER MOD Set 3.3: A 94 GLN : amide:sc= 1.1 K(o=1.9,f=-6.9!) USER MOD Set 4.1: A 50 THR OG1 : rot -105:sc= 1.05 USER MOD Set 4.2: A 63 THR OG1 : rot 180:sc= 0.982 USER MOD Set 5.1: A 9 LYS NZ :NH3+ 160:sc= 0.912 (180deg=-0.132) USER MOD Set 5.2: A 37 THR OG1 : rot -80:sc= -0.259 USER MOD Set 5.3: A 39 THR OG1 : rot 120:sc= 2.06 USER MOD Single : A 7 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 SER OG : rot 180:sc= 0 USER MOD Single : A 13 SER OG : rot -122:sc= 0.935 USER MOD Single : A 14 HIS : no HE2:sc= 1.15 K(o=1.1,f=-5.2!) USER MOD Single : A 15 ASN : amide:sc= -0.213 K(o=-0.21,f=-3.6!) USER MOD Single : A 20 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 21 SER OG : rot -160:sc= 0.641 USER MOD Single : A 22 LYS NZ :NH3+ 155:sc= 0.793 (180deg=0.462) USER MOD Single : A 26 SER OG : rot 106:sc= 0.825 USER MOD Single : A 29 THR OG1 : rot -10:sc= 0.445 USER MOD Single : A 31 GLN : amide:sc= 0.414 X(o=0.41,f=-0.0051) USER MOD Single : A 34 ASN : amide:sc= 1.03 K(o=1,f=-4.3!) USER MOD Single : A 35 THR OG1 : rot 82:sc= 1.22 USER MOD Single : A 41 THR OG1 : rot 64:sc= 1.2 USER MOD Single : A 43 THR OG1 : rot -45:sc= 0.254 USER MOD Single : A 44 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 48 LYS NZ :NH3+ -110:sc= 0.79 (180deg=0.0139) USER MOD Single : A 49 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 53 THR OG1 : rot 180:sc= 0 USER MOD Single : A 55 SER OG : rot -26:sc= 1.02 USER MOD Single : A 56 THR OG1 : rot 180:sc= -0.24 USER MOD Single : A 58 LYS NZ :NH3+ -136:sc= 1.17 (180deg=-0.351!) USER MOD Single : A 59 ASN : amide:sc= 0.531 K(o=0.53,f=-0.98) USER MOD Single : A 61 SER OG : rot 180:sc= 0 USER MOD Single : A 65 LYS NZ :NH3+ -136:sc= 1.11 (180deg=-0.474!) USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 THR OG1 : rot 180:sc= 0.289 USER MOD Single : A 75 SER OG : rot -144:sc= 0.283 USER MOD Single : A 79 ASN : amide:sc= 0.829 K(o=0.83,f=-0.0095) USER MOD Single : A 81 LYS NZ :NH3+ -138:sc= 1.09 (180deg=-0.666!) USER MOD Single : A 86 LYS NZ :NH3+ -145:sc=-0.000784 (180deg=-0.892) USER MOD Single : A 87 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 88 SER OG : rot 180:sc= 0 USER MOD Single : A 90 SER OG : rot 180:sc= 0 USER MOD Single : A 91 LYS NZ :NH3+ 149:sc= 1.16 (180deg=0.975) USER MOD Single : A 93 THR OG1 : rot 3:sc= 0.726 USER MOD Single : A 95 THR OG1 : rot 170:sc= -0.028 USER MOD Single : A 96 GLN : amide:sc= 0.447 K(o=0.45,f=-3.4!) USER MOD Single : A 100 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 101 ASN : amide:sc= 0 X(o=0,f=-0.12) USER MOD Single : A 102 THR OG1 : rot 125:sc= 0.792 USER MOD Single : A 103 THR OG1 : rot -130:sc= 0.486 USER MOD Single : A 114 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 115 LYS NZ :NH3+ -136:sc= 2.35 (180deg=1.49) USER MOD Single : A 116 THR OG1 : rot 54:sc= 1.17 USER MOD Single : A 117 THR OG1 : rot 180:sc= -0.349 USER MOD Single : A 129 TYR OH : rot 180:sc= 0.895 USER MOD Single : A 130 LYS NZ :NH3+ 169:sc= 1.01 (180deg=0.518) USER MOD ----------------------------------------------------------------- ATOM 41 N PHE A 4 -2.480 -13.611 8.393 1.00 0.00 N ATOM 42 CA PHE A 4 -3.188 -12.374 7.996 1.00 0.00 C ATOM 43 C PHE A 4 -3.715 -12.343 6.511 1.00 0.00 C ATOM 44 O PHE A 4 -4.106 -11.268 6.050 1.00 0.00 O ATOM 45 CB PHE A 4 -2.235 -11.174 8.269 1.00 0.00 C ATOM 46 CG PHE A 4 -1.878 -10.934 9.747 1.00 0.00 C ATOM 47 CD1 PHE A 4 -0.763 -11.566 10.315 1.00 0.00 C ATOM 48 CD2 PHE A 4 -2.646 -10.078 10.549 1.00 0.00 C ATOM 49 CE1 PHE A 4 -0.422 -11.344 11.648 1.00 0.00 C ATOM 50 CE2 PHE A 4 -2.291 -9.842 11.881 1.00 0.00 C ATOM 51 CZ PHE A 4 -1.174 -10.469 12.425 1.00 0.00 C ATOM 0 HA PHE A 4 -4.097 -12.319 8.595 1.00 0.00 H new ATOM 0 HB2 PHE A 4 -1.312 -11.332 7.711 1.00 0.00 H new ATOM 0 HB3 PHE A 4 -2.696 -10.269 7.873 1.00 0.00 H new ATOM 0 HD1 PHE A 4 -0.162 -12.232 9.713 1.00 0.00 H new ATOM 0 HD2 PHE A 4 -3.519 -9.597 10.135 1.00 0.00 H new ATOM 0 HE1 PHE A 4 0.428 -11.852 12.079 1.00 0.00 H new ATOM 0 HE2 PHE A 4 -2.884 -9.173 12.487 1.00 0.00 H new ATOM 0 HZ PHE A 4 -0.891 -10.276 13.449 1.00 0.00 H new ATOM 61 N LEU A 5 -3.794 -13.476 5.786 1.00 0.00 N ATOM 62 CA LEU A 5 -4.308 -13.517 4.391 1.00 0.00 C ATOM 63 C LEU A 5 -5.843 -13.207 4.330 1.00 0.00 C ATOM 64 O LEU A 5 -6.664 -13.872 4.969 1.00 0.00 O ATOM 65 CB LEU A 5 -3.984 -14.891 3.755 1.00 0.00 C ATOM 66 CG LEU A 5 -2.480 -15.148 3.485 1.00 0.00 C ATOM 67 CD1 LEU A 5 -2.263 -16.628 3.126 1.00 0.00 C ATOM 68 CD2 LEU A 5 -1.905 -14.275 2.366 1.00 0.00 C ATOM 0 H LEU A 5 -3.506 -14.387 6.143 1.00 0.00 H new ATOM 0 HA LEU A 5 -3.808 -12.738 3.816 1.00 0.00 H new ATOM 0 HB2 LEU A 5 -4.359 -15.676 4.411 1.00 0.00 H new ATOM 0 HB3 LEU A 5 -4.527 -14.976 2.814 1.00 0.00 H new ATOM 0 HG LEU A 5 -1.953 -14.885 4.402 1.00 0.00 H new ATOM 0 HD11 LEU A 5 -1.204 -16.805 2.937 1.00 0.00 H new ATOM 0 HD12 LEU A 5 -2.594 -17.255 3.954 1.00 0.00 H new ATOM 0 HD13 LEU A 5 -2.837 -16.874 2.233 1.00 0.00 H new ATOM 0 HD21 LEU A 5 -0.849 -14.507 2.230 1.00 0.00 H new ATOM 0 HD22 LEU A 5 -2.442 -14.472 1.438 1.00 0.00 H new ATOM 0 HD23 LEU A 5 -2.014 -13.224 2.632 1.00 0.00 H new ATOM 80 N GLY A 6 -6.187 -12.132 3.621 1.00 0.00 N ATOM 81 CA GLY A 6 -7.426 -11.367 3.857 1.00 0.00 C ATOM 82 C GLY A 6 -7.199 -9.841 3.901 1.00 0.00 C ATOM 83 O GLY A 6 -6.075 -9.334 3.821 1.00 0.00 O ATOM 0 H GLY A 6 -5.616 -11.760 2.862 1.00 0.00 H new ATOM 0 HA2 GLY A 6 -8.144 -11.599 3.070 1.00 0.00 H new ATOM 0 HA3 GLY A 6 -7.870 -11.689 4.799 1.00 0.00 H new ATOM 87 N LYS A 7 -8.305 -9.100 4.029 1.00 0.00 N ATOM 88 CA LYS A 7 -8.269 -7.623 4.144 1.00 0.00 C ATOM 89 C LYS A 7 -8.354 -7.129 5.599 1.00 0.00 C ATOM 90 O LYS A 7 -9.249 -7.523 6.348 1.00 0.00 O ATOM 91 CB LYS A 7 -9.261 -6.924 3.192 1.00 0.00 C ATOM 92 CG LYS A 7 -10.779 -7.044 3.366 1.00 0.00 C ATOM 93 CD LYS A 7 -11.358 -8.382 2.874 1.00 0.00 C ATOM 94 CE LYS A 7 -12.892 -8.367 2.808 1.00 0.00 C ATOM 95 NZ LYS A 7 -13.368 -9.658 2.237 1.00 0.00 N ATOM 0 H LYS A 7 -9.245 -9.494 4.057 1.00 0.00 H new ATOM 0 HA LYS A 7 -7.280 -7.319 3.801 1.00 0.00 H new ATOM 0 HB2 LYS A 7 -9.025 -5.860 3.219 1.00 0.00 H new ATOM 0 HB3 LYS A 7 -9.032 -7.276 2.186 1.00 0.00 H new ATOM 0 HG2 LYS A 7 -11.025 -6.918 4.420 1.00 0.00 H new ATOM 0 HG3 LYS A 7 -11.262 -6.230 2.826 1.00 0.00 H new ATOM 0 HD2 LYS A 7 -10.957 -8.607 1.886 1.00 0.00 H new ATOM 0 HD3 LYS A 7 -11.033 -9.182 3.540 1.00 0.00 H new ATOM 0 HE2 LYS A 7 -13.310 -8.220 3.804 1.00 0.00 H new ATOM 0 HE3 LYS A 7 -13.234 -7.535 2.193 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 -14.407 -9.655 2.189 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 -12.978 -9.779 1.281 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 -13.052 -10.443 2.842 1.00 0.00 H new ATOM 109 N TRP A 8 -7.437 -6.229 5.981 1.00 0.00 N ATOM 110 CA TRP A 8 -7.540 -5.493 7.264 1.00 0.00 C ATOM 111 C TRP A 8 -7.767 -4.000 6.938 1.00 0.00 C ATOM 112 O TRP A 8 -6.907 -3.357 6.327 1.00 0.00 O ATOM 113 CB TRP A 8 -6.382 -5.826 8.219 1.00 0.00 C ATOM 114 CG TRP A 8 -4.918 -5.476 7.822 1.00 0.00 C ATOM 115 CD1 TRP A 8 -4.213 -4.295 8.163 1.00 0.00 C ATOM 116 CD2 TRP A 8 -3.963 -6.271 7.178 1.00 0.00 C ATOM 117 NE1 TRP A 8 -2.870 -4.323 7.764 1.00 0.00 N ATOM 118 CE2 TRP A 8 -2.735 -5.543 7.146 1.00 0.00 C ATOM 119 CE3 TRP A 8 -4.013 -7.599 6.668 1.00 0.00 C ATOM 120 CZ2 TRP A 8 -1.570 -6.134 6.591 1.00 0.00 C ATOM 121 CZ3 TRP A 8 -2.849 -8.155 6.150 1.00 0.00 C ATOM 122 CH2 TRP A 8 -1.642 -7.432 6.103 1.00 0.00 C ATOM 0 H TRP A 8 -6.615 -5.989 5.427 1.00 0.00 H new ATOM 0 HA TRP A 8 -8.403 -5.817 7.846 1.00 0.00 H new ATOM 0 HB2 TRP A 8 -6.589 -5.327 9.165 1.00 0.00 H new ATOM 0 HB3 TRP A 8 -6.418 -6.899 8.410 1.00 0.00 H new ATOM 0 HD1 TRP A 8 -4.664 -3.459 8.677 1.00 0.00 H new ATOM 0 HE1 TRP A 8 -2.158 -3.605 7.900 1.00 0.00 H new ATOM 0 HE3 TRP A 8 -4.935 -8.162 6.683 1.00 0.00 H new ATOM 0 HZ2 TRP A 8 -0.642 -5.583 6.549 1.00 0.00 H new ATOM 0 HZ3 TRP A 8 -2.871 -9.167 5.774 1.00 0.00 H new ATOM 0 HH2 TRP A 8 -0.761 -7.893 5.682 1.00 0.00 H new ATOM 133 N LYS A 9 -8.951 -3.466 7.278 1.00 0.00 N ATOM 134 CA LYS A 9 -9.372 -2.103 6.873 1.00 0.00 C ATOM 135 C LYS A 9 -9.685 -1.234 8.121 1.00 0.00 C ATOM 136 O LYS A 9 -10.173 -1.729 9.142 1.00 0.00 O ATOM 137 CB LYS A 9 -10.489 -2.205 5.820 1.00 0.00 C ATOM 138 CG LYS A 9 -11.855 -2.768 6.234 1.00 0.00 C ATOM 139 CD LYS A 9 -12.826 -2.859 5.035 1.00 0.00 C ATOM 140 CE LYS A 9 -13.333 -1.490 4.533 1.00 0.00 C ATOM 141 NZ LYS A 9 -13.110 -1.278 3.066 1.00 0.00 N ATOM 0 H LYS A 9 -9.645 -3.960 7.839 1.00 0.00 H new ATOM 0 HA LYS A 9 -8.562 -1.567 6.379 1.00 0.00 H new ATOM 0 HB2 LYS A 9 -10.654 -1.205 5.418 1.00 0.00 H new ATOM 0 HB3 LYS A 9 -10.114 -2.820 5.002 1.00 0.00 H new ATOM 0 HG2 LYS A 9 -11.723 -3.758 6.671 1.00 0.00 H new ATOM 0 HG3 LYS A 9 -12.290 -2.134 7.007 1.00 0.00 H new ATOM 0 HD2 LYS A 9 -12.326 -3.373 4.214 1.00 0.00 H new ATOM 0 HD3 LYS A 9 -13.682 -3.470 5.320 1.00 0.00 H new ATOM 0 HE2 LYS A 9 -14.398 -1.403 4.748 1.00 0.00 H new ATOM 0 HE3 LYS A 9 -12.830 -0.698 5.088 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 -13.747 -0.531 2.723 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 -12.123 -0.994 2.902 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 -13.306 -2.162 2.554 1.00 0.00 H new ATOM 155 N LEU A 10 -9.324 0.053 8.042 1.00 0.00 N ATOM 156 CA LEU A 10 -9.096 0.919 9.232 1.00 0.00 C ATOM 157 C LEU A 10 -10.305 1.064 10.202 1.00 0.00 C ATOM 158 O LEU A 10 -11.399 1.478 9.811 1.00 0.00 O ATOM 159 CB LEU A 10 -8.607 2.293 8.690 1.00 0.00 C ATOM 160 CG LEU A 10 -7.954 3.224 9.735 1.00 0.00 C ATOM 161 CD1 LEU A 10 -6.538 2.778 10.126 1.00 0.00 C ATOM 162 CD2 LEU A 10 -7.886 4.665 9.199 1.00 0.00 C ATOM 0 H LEU A 10 -9.179 0.535 7.155 1.00 0.00 H new ATOM 0 HA LEU A 10 -8.350 0.441 9.867 1.00 0.00 H new ATOM 0 HB2 LEU A 10 -7.889 2.114 7.889 1.00 0.00 H new ATOM 0 HB3 LEU A 10 -9.456 2.812 8.246 1.00 0.00 H new ATOM 0 HG LEU A 10 -8.582 3.174 10.625 1.00 0.00 H new ATOM 0 HD11 LEU A 10 -6.129 3.469 10.863 1.00 0.00 H new ATOM 0 HD12 LEU A 10 -6.577 1.775 10.552 1.00 0.00 H new ATOM 0 HD13 LEU A 10 -5.901 2.772 9.241 1.00 0.00 H new ATOM 0 HD21 LEU A 10 -7.423 5.310 9.946 1.00 0.00 H new ATOM 0 HD22 LEU A 10 -7.293 4.686 8.285 1.00 0.00 H new ATOM 0 HD23 LEU A 10 -8.894 5.022 8.986 1.00 0.00 H new ATOM 174 N SER A 11 -10.067 0.706 11.467 1.00 0.00 N ATOM 175 CA SER A 11 -11.046 0.861 12.562 1.00 0.00 C ATOM 176 C SER A 11 -11.057 2.266 13.232 1.00 0.00 C ATOM 177 O SER A 11 -12.142 2.752 13.555 1.00 0.00 O ATOM 178 CB SER A 11 -10.787 -0.265 13.595 1.00 0.00 C ATOM 179 OG SER A 11 -11.847 -0.350 14.547 1.00 0.00 O ATOM 0 H SER A 11 -9.183 0.296 11.769 1.00 0.00 H new ATOM 0 HA SER A 11 -12.043 0.775 12.131 1.00 0.00 H new ATOM 0 HB2 SER A 11 -10.683 -1.219 13.078 1.00 0.00 H new ATOM 0 HB3 SER A 11 -9.846 -0.078 14.112 1.00 0.00 H new ATOM 0 HG SER A 11 -11.657 -1.070 15.185 1.00 0.00 H new ATOM 185 N GLU A 12 -9.886 2.884 13.469 1.00 0.00 N ATOM 186 CA GLU A 12 -9.784 4.254 14.042 1.00 0.00 C ATOM 187 C GLU A 12 -8.534 5.024 13.510 1.00 0.00 C ATOM 188 O GLU A 12 -7.583 4.437 12.977 1.00 0.00 O ATOM 189 CB GLU A 12 -9.870 4.213 15.595 1.00 0.00 C ATOM 190 CG GLU A 12 -8.743 3.462 16.317 1.00 0.00 C ATOM 191 CD GLU A 12 -7.563 4.281 16.793 1.00 0.00 C ATOM 192 OE1 GLU A 12 -6.606 4.487 16.017 1.00 0.00 O ATOM 193 OE2 GLU A 12 -7.568 4.700 17.972 1.00 0.00 O ATOM 0 H GLU A 12 -8.981 2.456 13.272 1.00 0.00 H new ATOM 0 HA GLU A 12 -10.643 4.830 13.696 1.00 0.00 H new ATOM 0 HB2 GLU A 12 -9.890 5.238 15.964 1.00 0.00 H new ATOM 0 HB3 GLU A 12 -10.819 3.756 15.873 1.00 0.00 H new ATOM 0 HG2 GLU A 12 -9.173 2.955 17.181 1.00 0.00 H new ATOM 0 HG3 GLU A 12 -8.369 2.688 15.647 1.00 0.00 H new ATOM 200 N SER A 13 -8.546 6.356 13.684 1.00 0.00 N ATOM 201 CA SER A 13 -7.343 7.200 13.472 1.00 0.00 C ATOM 202 C SER A 13 -6.923 7.875 14.801 1.00 0.00 C ATOM 203 O SER A 13 -7.494 8.897 15.194 1.00 0.00 O ATOM 204 CB SER A 13 -7.666 8.247 12.375 1.00 0.00 C ATOM 205 OG SER A 13 -6.516 8.995 12.000 1.00 0.00 O ATOM 0 H SER A 13 -9.374 6.879 13.971 1.00 0.00 H new ATOM 0 HA SER A 13 -6.502 6.590 13.142 1.00 0.00 H new ATOM 0 HB2 SER A 13 -8.072 7.741 11.499 1.00 0.00 H new ATOM 0 HB3 SER A 13 -8.438 8.926 12.737 1.00 0.00 H new ATOM 0 HG SER A 13 -6.684 9.949 12.148 1.00 0.00 H new ATOM 211 N HIS A 14 -5.911 7.313 15.487 1.00 0.00 N ATOM 212 CA HIS A 14 -5.425 7.907 16.770 1.00 0.00 C ATOM 213 C HIS A 14 -4.567 9.194 16.583 1.00 0.00 C ATOM 214 O HIS A 14 -4.875 10.222 17.185 1.00 0.00 O ATOM 215 CB HIS A 14 -4.708 6.829 17.606 1.00 0.00 C ATOM 216 CG HIS A 14 -5.074 6.894 19.101 1.00 0.00 C ATOM 217 ND1 HIS A 14 -6.079 6.098 19.604 1.00 0.00 N ATOM 218 CD2 HIS A 14 -4.587 7.752 20.120 1.00 0.00 C ATOM 219 CE1 HIS A 14 -6.157 6.543 20.891 1.00 0.00 C ATOM 220 NE2 HIS A 14 -5.282 7.519 21.298 1.00 0.00 N ATOM 0 H HIS A 14 -5.417 6.470 15.194 1.00 0.00 H new ATOM 0 HA HIS A 14 -6.300 8.250 17.322 1.00 0.00 H new ATOM 0 HB2 HIS A 14 -4.963 5.844 17.216 1.00 0.00 H new ATOM 0 HB3 HIS A 14 -3.630 6.946 17.495 1.00 0.00 H new ATOM 0 HD1 HIS A 14 -6.621 5.370 19.138 1.00 0.00 H new ATOM 0 HD2 HIS A 14 -3.796 8.477 19.998 1.00 0.00 H new ATOM 0 HE1 HIS A 14 -6.889 6.137 21.573 1.00 0.00 H new ATOM 229 N ASN A 15 -3.526 9.134 15.731 1.00 0.00 N ATOM 230 CA ASN A 15 -3.117 10.329 14.934 1.00 0.00 C ATOM 231 C ASN A 15 -2.736 9.949 13.462 1.00 0.00 C ATOM 232 O ASN A 15 -1.759 10.477 12.918 1.00 0.00 O ATOM 233 CB ASN A 15 -2.012 11.078 15.716 1.00 0.00 C ATOM 234 CG ASN A 15 -1.635 12.478 15.245 1.00 0.00 C ATOM 235 OD1 ASN A 15 -0.473 12.781 15.010 1.00 0.00 O ATOM 236 ND2 ASN A 15 -2.546 13.415 15.121 1.00 0.00 N ATOM 0 H ASN A 15 -2.960 8.300 15.572 1.00 0.00 H new ATOM 0 HA ASN A 15 -3.956 11.014 14.811 1.00 0.00 H new ATOM 0 HB2 ASN A 15 -2.327 11.148 16.757 1.00 0.00 H new ATOM 0 HB3 ASN A 15 -1.112 10.464 15.696 1.00 0.00 H new ATOM 0 HD21 ASN A 15 -2.274 14.356 14.838 1.00 0.00 H new ATOM 0 HD22 ASN A 15 -3.526 13.202 15.308 1.00 0.00 H new ATOM 243 N PHE A 16 -3.515 9.080 12.770 1.00 0.00 N ATOM 244 CA PHE A 16 -3.325 8.818 11.311 1.00 0.00 C ATOM 245 C PHE A 16 -3.930 9.944 10.401 1.00 0.00 C ATOM 246 O PHE A 16 -4.833 9.751 9.582 1.00 0.00 O ATOM 247 CB PHE A 16 -3.841 7.387 11.034 1.00 0.00 C ATOM 248 CG PHE A 16 -3.481 6.845 9.646 1.00 0.00 C ATOM 249 CD1 PHE A 16 -2.143 6.562 9.326 1.00 0.00 C ATOM 250 CD2 PHE A 16 -4.472 6.622 8.679 1.00 0.00 C ATOM 251 CE1 PHE A 16 -1.808 6.057 8.067 1.00 0.00 C ATOM 252 CE2 PHE A 16 -4.136 6.118 7.423 1.00 0.00 C ATOM 253 CZ PHE A 16 -2.807 5.827 7.120 1.00 0.00 C ATOM 0 H PHE A 16 -4.278 8.549 13.191 1.00 0.00 H new ATOM 0 HA PHE A 16 -2.270 8.859 11.040 1.00 0.00 H new ATOM 0 HB2 PHE A 16 -3.436 6.714 11.790 1.00 0.00 H new ATOM 0 HB3 PHE A 16 -4.925 7.376 11.146 1.00 0.00 H new ATOM 0 HD1 PHE A 16 -1.368 6.736 10.058 1.00 0.00 H new ATOM 0 HD2 PHE A 16 -5.504 6.842 8.909 1.00 0.00 H new ATOM 0 HE1 PHE A 16 -0.777 5.845 7.827 1.00 0.00 H new ATOM 0 HE2 PHE A 16 -4.906 5.953 6.684 1.00 0.00 H new ATOM 0 HZ PHE A 16 -2.550 5.423 6.152 1.00 0.00 H new ATOM 263 N ASP A 17 -3.365 11.139 10.585 1.00 0.00 N ATOM 264 CA ASP A 17 -4.047 12.421 10.306 1.00 0.00 C ATOM 265 C ASP A 17 -2.990 13.558 10.169 1.00 0.00 C ATOM 266 O ASP A 17 -2.874 14.132 9.080 1.00 0.00 O ATOM 267 CB ASP A 17 -5.295 12.734 11.156 1.00 0.00 C ATOM 268 CG ASP A 17 -5.359 12.250 12.593 1.00 0.00 C ATOM 269 OD1 ASP A 17 -4.713 12.872 13.461 1.00 0.00 O ATOM 270 OD2 ASP A 17 -6.023 11.217 12.859 1.00 0.00 O ATOM 0 H ASP A 17 -2.414 11.254 10.934 1.00 0.00 H new ATOM 0 HA ASP A 17 -4.537 12.324 9.337 1.00 0.00 H new ATOM 0 HB2 ASP A 17 -5.418 13.817 11.170 1.00 0.00 H new ATOM 0 HB3 ASP A 17 -6.158 12.322 10.633 1.00 0.00 H new ATOM 275 N ALA A 18 -2.164 13.818 11.203 1.00 0.00 N ATOM 276 CA ALA A 18 -0.916 14.608 11.035 1.00 0.00 C ATOM 277 C ALA A 18 0.373 13.824 10.636 1.00 0.00 C ATOM 278 O ALA A 18 1.291 14.433 10.085 1.00 0.00 O ATOM 279 CB ALA A 18 -0.635 15.342 12.356 1.00 0.00 C ATOM 0 H ALA A 18 -2.332 13.498 12.157 1.00 0.00 H new ATOM 0 HA ALA A 18 -1.116 15.265 10.189 1.00 0.00 H new ATOM 0 HB1 ALA A 18 0.278 15.930 12.259 1.00 0.00 H new ATOM 0 HB2 ALA A 18 -1.470 16.003 12.590 1.00 0.00 H new ATOM 0 HB3 ALA A 18 -0.514 14.614 13.158 1.00 0.00 H new ATOM 285 N VAL A 19 0.444 12.514 10.897 1.00 0.00 N ATOM 286 CA VAL A 19 1.619 11.664 10.557 1.00 0.00 C ATOM 287 C VAL A 19 2.085 11.678 9.074 1.00 0.00 C ATOM 288 O VAL A 19 3.280 11.798 8.795 1.00 0.00 O ATOM 289 CB VAL A 19 1.351 10.240 11.131 1.00 0.00 C ATOM 290 CG1 VAL A 19 0.316 9.397 10.384 1.00 0.00 C ATOM 291 CG2 VAL A 19 2.656 9.467 11.305 1.00 0.00 C ATOM 0 H VAL A 19 -0.310 11.999 11.352 1.00 0.00 H new ATOM 0 HA VAL A 19 2.495 12.107 11.031 1.00 0.00 H new ATOM 0 HB VAL A 19 0.893 10.428 12.102 1.00 0.00 H new ATOM 0 HG11 VAL A 19 0.214 8.429 10.874 1.00 0.00 H new ATOM 0 HG12 VAL A 19 -0.645 9.911 10.391 1.00 0.00 H new ATOM 0 HG13 VAL A 19 0.641 9.250 9.354 1.00 0.00 H new ATOM 0 HG21 VAL A 19 2.442 8.477 11.707 1.00 0.00 H new ATOM 0 HG22 VAL A 19 3.151 9.367 10.339 1.00 0.00 H new ATOM 0 HG23 VAL A 19 3.308 10.004 11.993 1.00 0.00 H new ATOM 301 N MET A 20 1.111 11.606 8.158 1.00 0.00 N ATOM 302 CA MET A 20 1.351 11.813 6.718 1.00 0.00 C ATOM 303 C MET A 20 1.514 13.312 6.323 1.00 0.00 C ATOM 304 O MET A 20 2.373 13.612 5.501 1.00 0.00 O ATOM 305 CB MET A 20 0.252 11.087 5.906 1.00 0.00 C ATOM 306 CG MET A 20 0.636 9.665 5.461 1.00 0.00 C ATOM 307 SD MET A 20 0.895 8.585 6.876 1.00 0.00 S ATOM 308 CE MET A 20 1.554 7.128 6.048 1.00 0.00 C ATOM 0 H MET A 20 0.138 11.404 8.389 1.00 0.00 H new ATOM 0 HA MET A 20 2.316 11.371 6.469 1.00 0.00 H new ATOM 0 HB2 MET A 20 -0.655 11.035 6.508 1.00 0.00 H new ATOM 0 HB3 MET A 20 0.015 11.681 5.023 1.00 0.00 H new ATOM 0 HG2 MET A 20 -0.150 9.255 4.827 1.00 0.00 H new ATOM 0 HG3 MET A 20 1.544 9.703 4.859 1.00 0.00 H new ATOM 0 HE1 MET A 20 1.770 6.356 6.787 1.00 0.00 H new ATOM 0 HE2 MET A 20 0.821 6.752 5.334 1.00 0.00 H new ATOM 0 HE3 MET A 20 2.471 7.392 5.521 1.00 0.00 H new ATOM 318 N SER A 21 0.770 14.274 6.895 1.00 0.00 N ATOM 319 CA SER A 21 1.030 15.714 6.637 1.00 0.00 C ATOM 320 C SER A 21 2.409 16.288 7.117 1.00 0.00 C ATOM 321 O SER A 21 2.962 17.131 6.411 1.00 0.00 O ATOM 322 CB SER A 21 -0.134 16.530 7.234 1.00 0.00 C ATOM 323 OG SER A 21 -0.117 17.871 6.748 1.00 0.00 O ATOM 0 H SER A 21 -0.007 14.092 7.531 1.00 0.00 H new ATOM 0 HA SER A 21 1.094 15.807 5.553 1.00 0.00 H new ATOM 0 HB2 SER A 21 -1.083 16.058 6.978 1.00 0.00 H new ATOM 0 HB3 SER A 21 -0.062 16.532 8.322 1.00 0.00 H new ATOM 0 HG SER A 21 -0.636 18.444 7.351 1.00 0.00 H new ATOM 329 N LYS A 22 2.967 15.825 8.251 1.00 0.00 N ATOM 330 CA LYS A 22 4.407 16.033 8.600 1.00 0.00 C ATOM 331 C LYS A 22 5.442 15.488 7.565 1.00 0.00 C ATOM 332 O LYS A 22 6.404 16.179 7.224 1.00 0.00 O ATOM 333 CB LYS A 22 4.610 15.502 10.049 1.00 0.00 C ATOM 334 CG LYS A 22 6.080 15.375 10.492 1.00 0.00 C ATOM 335 CD LYS A 22 6.323 14.986 11.954 1.00 0.00 C ATOM 336 CE LYS A 22 6.081 16.098 12.980 1.00 0.00 C ATOM 337 NZ LYS A 22 6.452 15.630 14.348 1.00 0.00 N ATOM 0 H LYS A 22 2.447 15.299 8.954 1.00 0.00 H new ATOM 0 HA LYS A 22 4.625 17.100 8.555 1.00 0.00 H new ATOM 0 HB2 LYS A 22 4.093 16.168 10.740 1.00 0.00 H new ATOM 0 HB3 LYS A 22 4.135 14.525 10.132 1.00 0.00 H new ATOM 0 HG2 LYS A 22 6.565 14.634 9.857 1.00 0.00 H new ATOM 0 HG3 LYS A 22 6.576 16.328 10.306 1.00 0.00 H new ATOM 0 HD2 LYS A 22 5.678 14.142 12.199 1.00 0.00 H new ATOM 0 HD3 LYS A 22 7.352 14.641 12.054 1.00 0.00 H new ATOM 0 HE2 LYS A 22 6.668 16.978 12.718 1.00 0.00 H new ATOM 0 HE3 LYS A 22 5.033 16.397 12.962 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 6.694 16.449 14.942 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 5.649 15.121 14.770 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 7.272 14.993 14.287 1.00 0.00 H new ATOM 351 N LEU A 23 5.225 14.256 7.109 1.00 0.00 N ATOM 352 CA LEU A 23 5.920 13.680 5.936 1.00 0.00 C ATOM 353 C LEU A 23 5.802 14.518 4.611 1.00 0.00 C ATOM 354 O LEU A 23 6.819 14.726 3.946 1.00 0.00 O ATOM 355 CB LEU A 23 5.363 12.238 5.797 1.00 0.00 C ATOM 356 CG LEU A 23 6.180 11.348 4.842 1.00 0.00 C ATOM 357 CD1 LEU A 23 7.284 10.594 5.588 1.00 0.00 C ATOM 358 CD2 LEU A 23 5.249 10.375 4.110 1.00 0.00 C ATOM 0 H LEU A 23 4.558 13.616 7.540 1.00 0.00 H new ATOM 0 HA LEU A 23 6.997 13.688 6.103 1.00 0.00 H new ATOM 0 HB2 LEU A 23 5.338 11.771 6.782 1.00 0.00 H new ATOM 0 HB3 LEU A 23 4.334 12.288 5.441 1.00 0.00 H new ATOM 0 HG LEU A 23 6.666 11.989 4.107 1.00 0.00 H new ATOM 0 HD11 LEU A 23 7.841 9.975 4.885 1.00 0.00 H new ATOM 0 HD12 LEU A 23 7.960 11.309 6.057 1.00 0.00 H new ATOM 0 HD13 LEU A 23 6.838 9.960 6.354 1.00 0.00 H new ATOM 0 HD21 LEU A 23 5.834 9.749 3.436 1.00 0.00 H new ATOM 0 HD22 LEU A 23 4.736 9.745 4.837 1.00 0.00 H new ATOM 0 HD23 LEU A 23 4.514 10.938 3.535 1.00 0.00 H new ATOM 370 N GLY A 24 4.594 14.991 4.270 1.00 0.00 N ATOM 371 CA GLY A 24 4.371 15.927 3.149 1.00 0.00 C ATOM 372 C GLY A 24 3.342 15.439 2.121 1.00 0.00 C ATOM 373 O GLY A 24 3.703 15.128 0.983 1.00 0.00 O ATOM 0 H GLY A 24 3.739 14.736 4.764 1.00 0.00 H new ATOM 0 HA2 GLY A 24 4.042 16.885 3.550 1.00 0.00 H new ATOM 0 HA3 GLY A 24 5.320 16.103 2.642 1.00 0.00 H new ATOM 377 N VAL A 25 2.069 15.378 2.541 1.00 0.00 N ATOM 378 CA VAL A 25 0.994 14.697 1.761 1.00 0.00 C ATOM 379 C VAL A 25 -0.177 15.695 1.505 1.00 0.00 C ATOM 380 O VAL A 25 -0.613 16.423 2.404 1.00 0.00 O ATOM 381 CB VAL A 25 0.547 13.413 2.538 1.00 0.00 C ATOM 382 CG1 VAL A 25 -0.607 12.645 1.869 1.00 0.00 C ATOM 383 CG2 VAL A 25 1.713 12.398 2.667 1.00 0.00 C ATOM 0 H VAL A 25 1.747 15.789 3.417 1.00 0.00 H new ATOM 0 HA VAL A 25 1.356 14.381 0.783 1.00 0.00 H new ATOM 0 HB VAL A 25 0.219 13.793 3.505 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -0.857 11.770 2.468 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -1.480 13.294 1.792 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -0.303 12.327 0.872 1.00 0.00 H new ATOM 0 HG21 VAL A 25 1.371 11.518 3.211 1.00 0.00 H new ATOM 0 HG22 VAL A 25 2.049 12.102 1.673 1.00 0.00 H new ATOM 0 HG23 VAL A 25 2.539 12.860 3.207 1.00 0.00 H new ATOM 393 N SER A 26 -0.704 15.684 0.272 1.00 0.00 N ATOM 394 CA SER A 26 -1.716 16.661 -0.193 1.00 0.00 C ATOM 395 C SER A 26 -3.083 16.594 0.543 1.00 0.00 C ATOM 396 O SER A 26 -3.635 15.511 0.766 1.00 0.00 O ATOM 397 CB SER A 26 -1.967 16.439 -1.714 1.00 0.00 C ATOM 398 OG SER A 26 -0.791 16.661 -2.495 1.00 0.00 O ATOM 0 H SER A 26 -0.444 14.998 -0.437 1.00 0.00 H new ATOM 0 HA SER A 26 -1.300 17.644 0.027 1.00 0.00 H new ATOM 0 HB2 SER A 26 -2.322 15.421 -1.877 1.00 0.00 H new ATOM 0 HB3 SER A 26 -2.757 17.110 -2.052 1.00 0.00 H new ATOM 0 HG SER A 26 -0.433 15.801 -2.799 1.00 0.00 H new ATOM 404 N TRP A 27 -3.681 17.758 0.841 1.00 0.00 N ATOM 405 CA TRP A 27 -5.032 17.823 1.474 1.00 0.00 C ATOM 406 C TRP A 27 -6.246 17.656 0.492 1.00 0.00 C ATOM 407 O TRP A 27 -7.250 18.364 0.564 1.00 0.00 O ATOM 408 CB TRP A 27 -5.086 19.055 2.407 1.00 0.00 C ATOM 409 CG TRP A 27 -4.357 18.762 3.775 1.00 0.00 C ATOM 410 CD1 TRP A 27 -2.964 18.862 4.053 1.00 0.00 C ATOM 411 CD2 TRP A 27 -4.904 18.187 4.926 1.00 0.00 C ATOM 412 NE1 TRP A 27 -2.642 18.361 5.326 1.00 0.00 N ATOM 413 CE2 TRP A 27 -3.848 17.941 5.845 1.00 0.00 C ATOM 414 CE3 TRP A 27 -6.231 17.758 5.235 1.00 0.00 C ATOM 415 CZ2 TRP A 27 -4.114 17.257 7.068 1.00 0.00 C ATOM 416 CZ3 TRP A 27 -6.462 17.093 6.435 1.00 0.00 C ATOM 417 CH2 TRP A 27 -5.416 16.846 7.344 1.00 0.00 C ATOM 0 H TRP A 27 -3.262 18.670 0.659 1.00 0.00 H new ATOM 0 HA TRP A 27 -5.165 16.932 2.088 1.00 0.00 H new ATOM 0 HB2 TRP A 27 -4.617 19.908 1.916 1.00 0.00 H new ATOM 0 HB3 TRP A 27 -6.124 19.327 2.595 1.00 0.00 H new ATOM 0 HD1 TRP A 27 -2.240 19.274 3.366 1.00 0.00 H new ATOM 0 HE1 TRP A 27 -1.723 18.318 5.767 1.00 0.00 H new ATOM 0 HE3 TRP A 27 -7.042 17.947 4.548 1.00 0.00 H new ATOM 0 HZ2 TRP A 27 -3.317 17.061 7.770 1.00 0.00 H new ATOM 0 HZ3 TRP A 27 -7.461 16.760 6.673 1.00 0.00 H new ATOM 0 HH2 TRP A 27 -5.626 16.330 8.269 1.00 0.00 H new ATOM 428 N ALA A 28 -6.173 16.577 -0.298 1.00 0.00 N ATOM 429 CA ALA A 28 -7.331 15.852 -0.865 1.00 0.00 C ATOM 430 C ALA A 28 -7.276 14.332 -0.470 1.00 0.00 C ATOM 431 O ALA A 28 -8.246 13.816 0.088 1.00 0.00 O ATOM 432 CB ALA A 28 -7.371 16.081 -2.377 1.00 0.00 C ATOM 0 H ALA A 28 -5.280 16.167 -0.572 1.00 0.00 H new ATOM 0 HA ALA A 28 -8.262 16.237 -0.449 1.00 0.00 H new ATOM 0 HB1 ALA A 28 -8.222 15.550 -2.803 1.00 0.00 H new ATOM 0 HB2 ALA A 28 -7.470 17.147 -2.581 1.00 0.00 H new ATOM 0 HB3 ALA A 28 -6.450 15.709 -2.826 1.00 0.00 H new ATOM 438 N THR A 29 -6.125 13.648 -0.656 1.00 0.00 N ATOM 439 CA THR A 29 -5.835 12.346 0.011 1.00 0.00 C ATOM 440 C THR A 29 -5.900 12.315 1.574 1.00 0.00 C ATOM 441 O THR A 29 -6.334 11.306 2.135 1.00 0.00 O ATOM 442 CB THR A 29 -4.429 11.783 -0.377 1.00 0.00 C ATOM 443 OG1 THR A 29 -3.392 12.700 -0.047 1.00 0.00 O ATOM 444 CG2 THR A 29 -4.239 11.425 -1.834 1.00 0.00 C ATOM 0 H THR A 29 -5.374 13.973 -1.265 1.00 0.00 H new ATOM 0 HA THR A 29 -6.656 11.736 -0.365 1.00 0.00 H new ATOM 0 HB THR A 29 -4.375 10.862 0.203 1.00 0.00 H new ATOM 0 HG1 THR A 29 -3.786 13.558 0.215 1.00 0.00 H new ATOM 0 HG21 THR A 29 -3.229 11.046 -1.987 1.00 0.00 H new ATOM 0 HG22 THR A 29 -4.961 10.659 -2.118 1.00 0.00 H new ATOM 0 HG23 THR A 29 -4.390 12.312 -2.449 1.00 0.00 H new ATOM 452 N ARG A 30 -5.515 13.407 2.247 1.00 0.00 N ATOM 453 CA ARG A 30 -5.668 13.533 3.713 1.00 0.00 C ATOM 454 C ARG A 30 -7.123 13.777 4.251 1.00 0.00 C ATOM 455 O ARG A 30 -7.308 13.906 5.462 1.00 0.00 O ATOM 456 CB ARG A 30 -4.677 14.604 4.220 1.00 0.00 C ATOM 457 CG ARG A 30 -3.196 14.192 4.249 1.00 0.00 C ATOM 458 CD ARG A 30 -2.707 13.535 5.544 1.00 0.00 C ATOM 459 NE ARG A 30 -3.133 12.120 5.727 1.00 0.00 N ATOM 460 CZ ARG A 30 -4.146 11.719 6.491 1.00 0.00 C ATOM 461 NH1 ARG A 30 -5.079 12.524 6.917 1.00 0.00 N ATOM 462 NH2 ARG A 30 -4.225 10.464 6.821 1.00 0.00 N ATOM 0 H ARG A 30 -5.093 14.222 1.803 1.00 0.00 H new ATOM 0 HA ARG A 30 -5.434 12.551 4.125 1.00 0.00 H new ATOM 0 HB2 ARG A 30 -4.775 15.488 3.591 1.00 0.00 H new ATOM 0 HB3 ARG A 30 -4.972 14.896 5.228 1.00 0.00 H new ATOM 0 HG2 ARG A 30 -3.015 13.503 3.424 1.00 0.00 H new ATOM 0 HG3 ARG A 30 -2.589 15.078 4.063 1.00 0.00 H new ATOM 0 HD2 ARG A 30 -1.618 13.578 5.567 1.00 0.00 H new ATOM 0 HD3 ARG A 30 -3.067 14.120 6.390 1.00 0.00 H new ATOM 0 HE ARG A 30 -2.607 11.402 5.228 1.00 0.00 H new ATOM 0 HH11 ARG A 30 -5.053 13.512 6.666 1.00 0.00 H new ATOM 0 HH12 ARG A 30 -5.835 12.165 7.501 1.00 0.00 H new ATOM 0 HH21 ARG A 30 -3.518 9.805 6.495 1.00 0.00 H new ATOM 0 HH22 ARG A 30 -4.994 10.138 7.406 1.00 0.00 H new ATOM 476 N GLN A 31 -8.138 13.737 3.377 1.00 0.00 N ATOM 477 CA GLN A 31 -9.518 13.395 3.773 1.00 0.00 C ATOM 478 C GLN A 31 -9.743 11.842 3.787 1.00 0.00 C ATOM 479 O GLN A 31 -10.152 11.309 4.819 1.00 0.00 O ATOM 480 CB GLN A 31 -10.522 14.086 2.818 1.00 0.00 C ATOM 481 CG GLN A 31 -10.766 15.589 3.047 1.00 0.00 C ATOM 482 CD GLN A 31 -9.924 16.527 2.200 1.00 0.00 C ATOM 483 OE1 GLN A 31 -10.324 16.973 1.132 1.00 0.00 O ATOM 484 NE2 GLN A 31 -8.734 16.861 2.632 1.00 0.00 N ATOM 0 H GLN A 31 -8.031 13.938 2.383 1.00 0.00 H new ATOM 0 HA GLN A 31 -9.684 13.756 4.788 1.00 0.00 H new ATOM 0 HB2 GLN A 31 -10.169 13.950 1.796 1.00 0.00 H new ATOM 0 HB3 GLN A 31 -11.479 13.569 2.897 1.00 0.00 H new ATOM 0 HG2 GLN A 31 -11.818 15.801 2.856 1.00 0.00 H new ATOM 0 HG3 GLN A 31 -10.582 15.813 4.098 1.00 0.00 H new ATOM 0 HE21 GLN A 31 -8.393 16.494 3.520 1.00 0.00 H new ATOM 0 HE22 GLN A 31 -8.148 17.488 2.080 1.00 0.00 H new ATOM 493 N ILE A 32 -9.473 11.153 2.664 1.00 0.00 N ATOM 494 CA ILE A 32 -9.764 9.700 2.481 1.00 0.00 C ATOM 495 C ILE A 32 -8.875 8.757 3.339 1.00 0.00 C ATOM 496 O ILE A 32 -9.395 7.748 3.819 1.00 0.00 O ATOM 497 CB ILE A 32 -9.798 9.404 0.941 1.00 0.00 C ATOM 498 CG1 ILE A 32 -11.211 9.680 0.329 1.00 0.00 C ATOM 499 CG2 ILE A 32 -9.441 7.955 0.532 1.00 0.00 C ATOM 500 CD1 ILE A 32 -11.607 11.148 0.241 1.00 0.00 C ATOM 0 H ILE A 32 -9.043 11.583 1.845 1.00 0.00 H new ATOM 0 HA ILE A 32 -10.748 9.465 2.887 1.00 0.00 H new ATOM 0 HB ILE A 32 -9.031 10.077 0.557 1.00 0.00 H new ATOM 0 HG12 ILE A 32 -11.245 9.251 -0.672 1.00 0.00 H new ATOM 0 HG13 ILE A 32 -11.956 9.155 0.926 1.00 0.00 H new ATOM 0 HG21 ILE A 32 -9.495 7.859 -0.552 1.00 0.00 H new ATOM 0 HG22 ILE A 32 -8.431 7.721 0.867 1.00 0.00 H new ATOM 0 HG23 ILE A 32 -10.146 7.263 0.993 1.00 0.00 H new ATOM 0 HD11 ILE A 32 -12.602 11.231 -0.197 1.00 0.00 H new ATOM 0 HD12 ILE A 32 -11.613 11.584 1.240 1.00 0.00 H new ATOM 0 HD13 ILE A 32 -10.890 11.681 -0.384 1.00 0.00 H new ATOM 512 N GLY A 33 -7.592 9.093 3.567 1.00 0.00 N ATOM 513 CA GLY A 33 -6.742 8.392 4.568 1.00 0.00 C ATOM 514 C GLY A 33 -7.363 8.058 5.946 1.00 0.00 C ATOM 515 O GLY A 33 -7.292 6.906 6.377 1.00 0.00 O ATOM 0 H GLY A 33 -7.113 9.847 3.074 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -6.401 7.458 4.121 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -5.857 9.004 4.741 1.00 0.00 H new ATOM 519 N ASN A 34 -8.011 9.038 6.586 1.00 0.00 N ATOM 520 CA ASN A 34 -8.900 8.811 7.751 1.00 0.00 C ATOM 521 C ASN A 34 -10.435 8.994 7.485 1.00 0.00 C ATOM 522 O ASN A 34 -11.142 9.570 8.315 1.00 0.00 O ATOM 523 CB ASN A 34 -8.322 9.659 8.907 1.00 0.00 C ATOM 524 CG ASN A 34 -8.284 11.172 8.752 1.00 0.00 C ATOM 525 OD1 ASN A 34 -7.297 11.736 8.291 1.00 0.00 O ATOM 526 ND2 ASN A 34 -9.334 11.873 9.100 1.00 0.00 N ATOM 0 H ASN A 34 -7.939 10.019 6.316 1.00 0.00 H new ATOM 0 HA ASN A 34 -8.893 7.754 8.019 1.00 0.00 H new ATOM 0 HB2 ASN A 34 -8.898 9.433 9.804 1.00 0.00 H new ATOM 0 HB3 ASN A 34 -7.302 9.319 9.089 1.00 0.00 H new ATOM 0 HD21 ASN A 34 -9.331 12.887 8.988 1.00 0.00 H new ATOM 0 HD22 ASN A 34 -10.155 11.405 9.483 1.00 0.00 H new ATOM 533 N THR A 35 -10.952 8.455 6.369 1.00 0.00 N ATOM 534 CA THR A 35 -12.399 8.520 6.011 1.00 0.00 C ATOM 535 C THR A 35 -12.763 7.218 5.247 1.00 0.00 C ATOM 536 O THR A 35 -13.427 6.353 5.824 1.00 0.00 O ATOM 537 CB THR A 35 -12.761 9.828 5.258 1.00 0.00 C ATOM 538 OG1 THR A 35 -12.400 10.984 6.013 1.00 0.00 O ATOM 539 CG2 THR A 35 -14.231 9.994 4.907 1.00 0.00 C ATOM 0 H THR A 35 -10.386 7.958 5.681 1.00 0.00 H new ATOM 0 HA THR A 35 -13.012 8.568 6.911 1.00 0.00 H new ATOM 0 HB THR A 35 -12.193 9.738 4.332 1.00 0.00 H new ATOM 0 HG1 THR A 35 -11.447 11.175 5.884 1.00 0.00 H new ATOM 0 HG21 THR A 35 -14.376 10.939 4.384 1.00 0.00 H new ATOM 0 HG22 THR A 35 -14.547 9.172 4.265 1.00 0.00 H new ATOM 0 HG23 THR A 35 -14.826 9.990 5.820 1.00 0.00 H new ATOM 547 N VAL A 36 -12.343 7.065 3.978 1.00 0.00 N ATOM 548 CA VAL A 36 -12.689 5.882 3.159 1.00 0.00 C ATOM 549 C VAL A 36 -11.431 4.969 3.120 1.00 0.00 C ATOM 550 O VAL A 36 -10.446 5.233 2.425 1.00 0.00 O ATOM 551 CB VAL A 36 -13.209 6.262 1.740 1.00 0.00 C ATOM 552 CG1 VAL A 36 -13.844 5.014 1.082 1.00 0.00 C ATOM 553 CG2 VAL A 36 -14.264 7.387 1.760 1.00 0.00 C ATOM 0 H VAL A 36 -11.761 7.748 3.493 1.00 0.00 H new ATOM 0 HA VAL A 36 -13.524 5.345 3.609 1.00 0.00 H new ATOM 0 HB VAL A 36 -12.349 6.625 1.177 1.00 0.00 H new ATOM 0 HG11 VAL A 36 -14.210 5.273 0.089 1.00 0.00 H new ATOM 0 HG12 VAL A 36 -13.096 4.226 0.999 1.00 0.00 H new ATOM 0 HG13 VAL A 36 -14.674 4.663 1.694 1.00 0.00 H new ATOM 0 HG21 VAL A 36 -14.584 7.603 0.741 1.00 0.00 H new ATOM 0 HG22 VAL A 36 -15.123 7.070 2.351 1.00 0.00 H new ATOM 0 HG23 VAL A 36 -13.831 8.284 2.202 1.00 0.00 H new ATOM 563 N THR A 37 -11.491 3.921 3.935 1.00 0.00 N ATOM 564 CA THR A 37 -10.302 3.302 4.558 1.00 0.00 C ATOM 565 C THR A 37 -9.114 2.852 3.645 1.00 0.00 C ATOM 566 O THR A 37 -9.394 2.353 2.547 1.00 0.00 O ATOM 567 CB THR A 37 -10.778 2.022 5.342 1.00 0.00 C ATOM 568 OG1 THR A 37 -11.166 0.984 4.441 1.00 0.00 O ATOM 569 CG2 THR A 37 -11.932 2.242 6.321 1.00 0.00 C ATOM 0 H THR A 37 -12.367 3.466 4.190 1.00 0.00 H new ATOM 0 HA THR A 37 -9.890 4.112 5.160 1.00 0.00 H new ATOM 0 HB THR A 37 -9.904 1.744 5.932 1.00 0.00 H new ATOM 0 HG1 THR A 37 -12.073 1.158 4.113 1.00 0.00 H new ATOM 0 HG21 THR A 37 -12.181 1.299 6.807 1.00 0.00 H new ATOM 0 HG22 THR A 37 -11.636 2.972 7.075 1.00 0.00 H new ATOM 0 HG23 THR A 37 -12.803 2.612 5.780 1.00 0.00 H new ATOM 577 N PRO A 38 -7.828 2.837 4.097 1.00 0.00 N ATOM 578 CA PRO A 38 -6.778 1.938 3.511 1.00 0.00 C ATOM 579 C PRO A 38 -7.115 0.432 3.635 1.00 0.00 C ATOM 580 O PRO A 38 -6.818 -0.228 4.634 1.00 0.00 O ATOM 581 CB PRO A 38 -5.488 2.384 4.247 1.00 0.00 C ATOM 582 CG PRO A 38 -5.970 3.035 5.558 1.00 0.00 C ATOM 583 CD PRO A 38 -7.317 3.680 5.199 1.00 0.00 C ATOM 0 HA PRO A 38 -6.681 2.037 2.430 1.00 0.00 H new ATOM 0 HB2 PRO A 38 -4.836 1.534 4.447 1.00 0.00 H new ATOM 0 HB3 PRO A 38 -4.916 3.090 3.645 1.00 0.00 H new ATOM 0 HG2 PRO A 38 -6.084 2.294 6.350 1.00 0.00 H new ATOM 0 HG3 PRO A 38 -5.258 3.778 5.917 1.00 0.00 H new ATOM 0 HD2 PRO A 38 -7.999 3.683 6.050 1.00 0.00 H new ATOM 0 HD3 PRO A 38 -7.193 4.717 4.886 1.00 0.00 H new ATOM 591 N THR A 39 -7.773 -0.097 2.591 1.00 0.00 N ATOM 592 CA THR A 39 -8.292 -1.495 2.599 1.00 0.00 C ATOM 593 C THR A 39 -7.204 -2.484 2.069 1.00 0.00 C ATOM 594 O THR A 39 -7.280 -3.017 0.955 1.00 0.00 O ATOM 595 CB THR A 39 -9.587 -1.530 1.743 1.00 0.00 C ATOM 596 OG1 THR A 39 -10.524 -0.490 2.070 1.00 0.00 O ATOM 597 CG2 THR A 39 -10.337 -2.854 1.745 1.00 0.00 C ATOM 0 H THR A 39 -7.963 0.412 1.728 1.00 0.00 H new ATOM 0 HA THR A 39 -8.530 -1.815 3.614 1.00 0.00 H new ATOM 0 HB THR A 39 -9.188 -1.371 0.741 1.00 0.00 H new ATOM 0 HG1 THR A 39 -10.676 0.073 1.282 1.00 0.00 H new ATOM 0 HG21 THR A 39 -11.224 -2.770 1.117 1.00 0.00 H new ATOM 0 HG22 THR A 39 -9.690 -3.640 1.355 1.00 0.00 H new ATOM 0 HG23 THR A 39 -10.635 -3.102 2.764 1.00 0.00 H new ATOM 605 N VAL A 40 -6.183 -2.723 2.895 1.00 0.00 N ATOM 606 CA VAL A 40 -4.946 -3.430 2.474 1.00 0.00 C ATOM 607 C VAL A 40 -5.191 -4.969 2.453 1.00 0.00 C ATOM 608 O VAL A 40 -5.288 -5.641 3.485 1.00 0.00 O ATOM 609 CB VAL A 40 -3.693 -2.988 3.288 1.00 0.00 C ATOM 610 CG1 VAL A 40 -3.207 -1.579 2.871 1.00 0.00 C ATOM 611 CG2 VAL A 40 -3.840 -3.006 4.813 1.00 0.00 C ATOM 0 H VAL A 40 -6.179 -2.437 3.874 1.00 0.00 H new ATOM 0 HA VAL A 40 -4.707 -3.136 1.452 1.00 0.00 H new ATOM 0 HB VAL A 40 -2.962 -3.755 3.034 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -2.332 -1.307 3.461 1.00 0.00 H new ATOM 0 HG12 VAL A 40 -2.944 -1.583 1.813 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -4.002 -0.854 3.045 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -2.907 -2.680 5.272 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -4.645 -2.333 5.109 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -4.073 -4.018 5.144 1.00 0.00 H new ATOM 621 N THR A 41 -5.399 -5.470 1.229 1.00 0.00 N ATOM 622 CA THR A 41 -6.062 -6.781 0.985 1.00 0.00 C ATOM 623 C THR A 41 -5.002 -7.833 0.596 1.00 0.00 C ATOM 624 O THR A 41 -4.659 -7.994 -0.574 1.00 0.00 O ATOM 625 CB THR A 41 -7.187 -6.538 -0.050 1.00 0.00 C ATOM 626 OG1 THR A 41 -8.130 -5.583 0.445 1.00 0.00 O ATOM 627 CG2 THR A 41 -7.995 -7.767 -0.443 1.00 0.00 C ATOM 0 H THR A 41 -5.118 -4.989 0.375 1.00 0.00 H new ATOM 0 HA THR A 41 -6.537 -7.198 1.873 1.00 0.00 H new ATOM 0 HB THR A 41 -6.647 -6.192 -0.932 1.00 0.00 H new ATOM 0 HG1 THR A 41 -7.687 -4.717 0.564 1.00 0.00 H new ATOM 0 HG21 THR A 41 -8.755 -7.485 -1.172 1.00 0.00 H new ATOM 0 HG22 THR A 41 -7.332 -8.514 -0.880 1.00 0.00 H new ATOM 0 HG23 THR A 41 -8.477 -8.184 0.441 1.00 0.00 H new ATOM 635 N PHE A 42 -4.461 -8.509 1.609 1.00 0.00 N ATOM 636 CA PHE A 42 -3.200 -9.282 1.521 1.00 0.00 C ATOM 637 C PHE A 42 -3.462 -10.739 1.115 1.00 0.00 C ATOM 638 O PHE A 42 -4.103 -11.495 1.845 1.00 0.00 O ATOM 639 CB PHE A 42 -2.584 -9.150 2.930 1.00 0.00 C ATOM 640 CG PHE A 42 -1.193 -9.742 3.156 1.00 0.00 C ATOM 641 CD1 PHE A 42 -0.081 -9.259 2.454 1.00 0.00 C ATOM 642 CD2 PHE A 42 -0.997 -10.737 4.127 1.00 0.00 C ATOM 643 CE1 PHE A 42 1.195 -9.760 2.716 1.00 0.00 C ATOM 644 CE2 PHE A 42 0.280 -11.227 4.397 1.00 0.00 C ATOM 645 CZ PHE A 42 1.376 -10.738 3.691 1.00 0.00 C ATOM 0 H PHE A 42 -4.887 -8.542 2.535 1.00 0.00 H new ATOM 0 HA PHE A 42 -2.523 -8.910 0.752 1.00 0.00 H new ATOM 0 HB2 PHE A 42 -2.542 -8.090 3.179 1.00 0.00 H new ATOM 0 HB3 PHE A 42 -3.267 -9.617 3.640 1.00 0.00 H new ATOM 0 HD1 PHE A 42 -0.212 -8.493 1.704 1.00 0.00 H new ATOM 0 HD2 PHE A 42 -1.845 -11.127 4.671 1.00 0.00 H new ATOM 0 HE1 PHE A 42 2.044 -9.388 2.161 1.00 0.00 H new ATOM 0 HE2 PHE A 42 0.419 -11.985 5.153 1.00 0.00 H new ATOM 0 HZ PHE A 42 2.366 -11.117 3.899 1.00 0.00 H new ATOM 655 N THR A 43 -3.004 -11.102 -0.083 1.00 0.00 N ATOM 656 CA THR A 43 -3.483 -12.333 -0.759 1.00 0.00 C ATOM 657 C THR A 43 -2.314 -13.036 -1.510 1.00 0.00 C ATOM 658 O THR A 43 -1.565 -12.387 -2.241 1.00 0.00 O ATOM 659 CB THR A 43 -4.632 -11.997 -1.766 1.00 0.00 C ATOM 660 OG1 THR A 43 -4.180 -11.143 -2.816 1.00 0.00 O ATOM 661 CG2 THR A 43 -5.846 -11.311 -1.138 1.00 0.00 C ATOM 0 H THR A 43 -2.308 -10.575 -0.611 1.00 0.00 H new ATOM 0 HA THR A 43 -3.869 -13.008 0.005 1.00 0.00 H new ATOM 0 HB THR A 43 -4.935 -12.975 -2.140 1.00 0.00 H new ATOM 0 HG1 THR A 43 -3.640 -10.417 -2.438 1.00 0.00 H new ATOM 0 HG21 THR A 43 -6.592 -11.115 -1.908 1.00 0.00 H new ATOM 0 HG22 THR A 43 -6.275 -11.959 -0.373 1.00 0.00 H new ATOM 0 HG23 THR A 43 -5.537 -10.369 -0.684 1.00 0.00 H new ATOM 669 N MET A 44 -2.159 -14.355 -1.348 1.00 0.00 N ATOM 670 CA MET A 44 -1.028 -15.108 -1.961 1.00 0.00 C ATOM 671 C MET A 44 -1.200 -15.372 -3.485 1.00 0.00 C ATOM 672 O MET A 44 -1.938 -16.273 -3.896 1.00 0.00 O ATOM 673 CB MET A 44 -0.688 -16.367 -1.128 1.00 0.00 C ATOM 674 CG MET A 44 -1.764 -17.440 -0.944 1.00 0.00 C ATOM 675 SD MET A 44 -1.084 -18.745 0.101 1.00 0.00 S ATOM 676 CE MET A 44 -2.537 -19.796 0.261 1.00 0.00 C ATOM 0 H MET A 44 -2.795 -14.934 -0.800 1.00 0.00 H new ATOM 0 HA MET A 44 -0.151 -14.462 -1.921 1.00 0.00 H new ATOM 0 HB2 MET A 44 0.178 -16.843 -1.587 1.00 0.00 H new ATOM 0 HB3 MET A 44 -0.380 -16.034 -0.137 1.00 0.00 H new ATOM 0 HG2 MET A 44 -2.655 -17.011 -0.485 1.00 0.00 H new ATOM 0 HG3 MET A 44 -2.066 -17.845 -1.910 1.00 0.00 H new ATOM 0 HE1 MET A 44 -2.295 -20.659 0.881 1.00 0.00 H new ATOM 0 HE2 MET A 44 -3.346 -19.231 0.725 1.00 0.00 H new ATOM 0 HE3 MET A 44 -2.851 -20.135 -0.726 1.00 0.00 H new ATOM 686 N ASP A 45 -0.507 -14.583 -4.323 1.00 0.00 N ATOM 687 CA ASP A 45 -0.578 -14.714 -5.805 1.00 0.00 C ATOM 688 C ASP A 45 0.519 -15.688 -6.333 1.00 0.00 C ATOM 689 O ASP A 45 1.593 -15.284 -6.793 1.00 0.00 O ATOM 690 CB ASP A 45 -0.503 -13.272 -6.356 1.00 0.00 C ATOM 691 CG ASP A 45 -0.851 -13.128 -7.833 1.00 0.00 C ATOM 692 OD1 ASP A 45 -1.912 -13.635 -8.258 1.00 0.00 O ATOM 693 OD2 ASP A 45 -0.077 -12.482 -8.571 1.00 0.00 O ATOM 0 H ASP A 45 0.115 -13.840 -4.005 1.00 0.00 H new ATOM 0 HA ASP A 45 -1.504 -15.173 -6.152 1.00 0.00 H new ATOM 0 HB2 ASP A 45 -1.178 -12.642 -5.776 1.00 0.00 H new ATOM 0 HB3 ASP A 45 0.505 -12.890 -6.197 1.00 0.00 H new ATOM 698 N GLY A 46 0.236 -17.000 -6.224 1.00 0.00 N ATOM 699 CA GLY A 46 1.139 -18.068 -6.707 1.00 0.00 C ATOM 700 C GLY A 46 2.381 -18.354 -5.841 1.00 0.00 C ATOM 701 O GLY A 46 2.442 -19.360 -5.134 1.00 0.00 O ATOM 0 H GLY A 46 -0.623 -17.351 -5.800 1.00 0.00 H new ATOM 0 HA2 GLY A 46 0.563 -18.989 -6.795 1.00 0.00 H new ATOM 0 HA3 GLY A 46 1.474 -17.805 -7.710 1.00 0.00 H new ATOM 705 N ASP A 47 3.352 -17.449 -5.954 1.00 0.00 N ATOM 706 CA ASP A 47 4.578 -17.433 -5.116 1.00 0.00 C ATOM 707 C ASP A 47 4.406 -16.549 -3.841 1.00 0.00 C ATOM 708 O ASP A 47 4.682 -17.000 -2.727 1.00 0.00 O ATOM 709 CB ASP A 47 5.710 -16.975 -6.072 1.00 0.00 C ATOM 710 CG ASP A 47 7.090 -16.783 -5.461 1.00 0.00 C ATOM 711 OD1 ASP A 47 7.708 -17.778 -5.028 1.00 0.00 O ATOM 712 OD2 ASP A 47 7.569 -15.627 -5.423 1.00 0.00 O ATOM 0 H ASP A 47 3.321 -16.691 -6.636 1.00 0.00 H new ATOM 0 HA ASP A 47 4.815 -18.411 -4.698 1.00 0.00 H new ATOM 0 HB2 ASP A 47 5.793 -17.707 -6.875 1.00 0.00 H new ATOM 0 HB3 ASP A 47 5.407 -16.033 -6.530 1.00 0.00 H new ATOM 717 N LYS A 48 4.003 -15.284 -4.027 1.00 0.00 N ATOM 718 CA LYS A 48 4.217 -14.207 -3.040 1.00 0.00 C ATOM 719 C LYS A 48 2.984 -13.277 -2.908 1.00 0.00 C ATOM 720 O LYS A 48 2.058 -13.257 -3.727 1.00 0.00 O ATOM 721 CB LYS A 48 5.546 -13.509 -3.390 1.00 0.00 C ATOM 722 CG LYS A 48 5.651 -12.757 -4.720 1.00 0.00 C ATOM 723 CD LYS A 48 7.048 -12.128 -4.898 1.00 0.00 C ATOM 724 CE LYS A 48 7.427 -11.907 -6.369 1.00 0.00 C ATOM 725 NZ LYS A 48 7.921 -13.164 -6.977 1.00 0.00 N ATOM 0 H LYS A 48 3.517 -14.974 -4.869 1.00 0.00 H new ATOM 0 HA LYS A 48 4.314 -14.609 -2.032 1.00 0.00 H new ATOM 0 HB2 LYS A 48 5.769 -12.802 -2.591 1.00 0.00 H new ATOM 0 HB3 LYS A 48 6.331 -14.265 -3.374 1.00 0.00 H new ATOM 0 HG2 LYS A 48 5.450 -13.441 -5.544 1.00 0.00 H new ATOM 0 HG3 LYS A 48 4.891 -11.977 -4.761 1.00 0.00 H new ATOM 0 HD2 LYS A 48 7.079 -11.173 -4.374 1.00 0.00 H new ATOM 0 HD3 LYS A 48 7.792 -12.773 -4.430 1.00 0.00 H new ATOM 0 HE2 LYS A 48 6.560 -11.545 -6.923 1.00 0.00 H new ATOM 0 HE3 LYS A 48 8.195 -11.137 -6.440 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 8.942 -13.085 -7.157 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 7.745 -13.957 -6.327 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 7.423 -13.335 -7.874 1.00 0.00 H new ATOM 738 N MET A 49 2.937 -12.544 -1.794 1.00 0.00 N ATOM 739 CA MET A 49 1.681 -11.945 -1.298 1.00 0.00 C ATOM 740 C MET A 49 1.424 -10.522 -1.874 1.00 0.00 C ATOM 741 O MET A 49 2.326 -9.693 -2.015 1.00 0.00 O ATOM 742 CB MET A 49 1.660 -11.942 0.242 1.00 0.00 C ATOM 743 CG MET A 49 1.553 -13.317 0.919 1.00 0.00 C ATOM 744 SD MET A 49 3.040 -14.314 0.733 1.00 0.00 S ATOM 745 CE MET A 49 4.112 -13.588 1.987 1.00 0.00 C ATOM 0 H MET A 49 3.751 -12.347 -1.212 1.00 0.00 H new ATOM 0 HA MET A 49 0.862 -12.568 -1.657 1.00 0.00 H new ATOM 0 HB2 MET A 49 2.568 -11.455 0.597 1.00 0.00 H new ATOM 0 HB3 MET A 49 0.820 -11.331 0.573 1.00 0.00 H new ATOM 0 HG2 MET A 49 1.347 -13.178 1.980 1.00 0.00 H new ATOM 0 HG3 MET A 49 0.705 -13.858 0.498 1.00 0.00 H new ATOM 0 HE1 MET A 49 5.072 -14.105 1.989 1.00 0.00 H new ATOM 0 HE2 MET A 49 4.269 -12.532 1.765 1.00 0.00 H new ATOM 0 HE3 MET A 49 3.645 -13.687 2.967 1.00 0.00 H new ATOM 755 N THR A 50 0.163 -10.269 -2.225 1.00 0.00 N ATOM 756 CA THR A 50 -0.252 -9.062 -2.969 1.00 0.00 C ATOM 757 C THR A 50 -1.283 -8.302 -2.111 1.00 0.00 C ATOM 758 O THR A 50 -2.363 -8.835 -1.824 1.00 0.00 O ATOM 759 CB THR A 50 -0.820 -9.481 -4.356 1.00 0.00 C ATOM 760 OG1 THR A 50 0.153 -10.228 -5.083 1.00 0.00 O ATOM 761 CG2 THR A 50 -1.195 -8.302 -5.247 1.00 0.00 C ATOM 0 H THR A 50 -0.611 -10.896 -2.003 1.00 0.00 H new ATOM 0 HA THR A 50 0.591 -8.398 -3.158 1.00 0.00 H new ATOM 0 HB THR A 50 -1.715 -10.060 -4.129 1.00 0.00 H new ATOM 0 HG1 THR A 50 0.531 -9.669 -5.794 1.00 0.00 H new ATOM 0 HG21 THR A 50 -1.583 -8.672 -6.196 1.00 0.00 H new ATOM 0 HG22 THR A 50 -1.958 -7.701 -4.753 1.00 0.00 H new ATOM 0 HG23 THR A 50 -0.312 -7.689 -5.430 1.00 0.00 H new ATOM 769 N MET A 51 -0.959 -7.048 -1.752 1.00 0.00 N ATOM 770 CA MET A 51 -1.955 -6.109 -1.196 1.00 0.00 C ATOM 771 C MET A 51 -2.813 -5.492 -2.338 1.00 0.00 C ATOM 772 O MET A 51 -2.355 -4.638 -3.104 1.00 0.00 O ATOM 773 CB MET A 51 -1.302 -4.988 -0.357 1.00 0.00 C ATOM 774 CG MET A 51 -0.980 -5.396 1.084 1.00 0.00 C ATOM 775 SD MET A 51 -0.165 -4.017 1.909 1.00 0.00 S ATOM 776 CE MET A 51 -0.077 -4.688 3.575 1.00 0.00 C ATOM 0 H MET A 51 -0.019 -6.660 -1.835 1.00 0.00 H new ATOM 0 HA MET A 51 -2.598 -6.682 -0.528 1.00 0.00 H new ATOM 0 HB2 MET A 51 -0.382 -4.670 -0.848 1.00 0.00 H new ATOM 0 HB3 MET A 51 -1.969 -4.126 -0.339 1.00 0.00 H new ATOM 0 HG2 MET A 51 -1.894 -5.666 1.613 1.00 0.00 H new ATOM 0 HG3 MET A 51 -0.336 -6.275 1.092 1.00 0.00 H new ATOM 0 HE1 MET A 51 0.403 -3.965 4.234 1.00 0.00 H new ATOM 0 HE2 MET A 51 -1.084 -4.896 3.937 1.00 0.00 H new ATOM 0 HE3 MET A 51 0.503 -5.611 3.565 1.00 0.00 H new ATOM 786 N LEU A 52 -4.074 -5.920 -2.396 1.00 0.00 N ATOM 787 CA LEU A 52 -5.064 -5.418 -3.381 1.00 0.00 C ATOM 788 C LEU A 52 -5.812 -4.184 -2.773 1.00 0.00 C ATOM 789 O LEU A 52 -6.998 -4.228 -2.437 1.00 0.00 O ATOM 790 CB LEU A 52 -6.007 -6.585 -3.801 1.00 0.00 C ATOM 791 CG LEU A 52 -5.309 -7.874 -4.304 1.00 0.00 C ATOM 792 CD1 LEU A 52 -6.264 -9.068 -4.357 1.00 0.00 C ATOM 793 CD2 LEU A 52 -4.653 -7.666 -5.667 1.00 0.00 C ATOM 0 H LEU A 52 -4.450 -6.627 -1.764 1.00 0.00 H new ATOM 0 HA LEU A 52 -4.579 -5.069 -4.293 1.00 0.00 H new ATOM 0 HB2 LEU A 52 -6.634 -6.844 -2.948 1.00 0.00 H new ATOM 0 HB3 LEU A 52 -6.671 -6.225 -4.587 1.00 0.00 H new ATOM 0 HG LEU A 52 -4.530 -8.100 -3.576 1.00 0.00 H new ATOM 0 HD11 LEU A 52 -5.728 -9.947 -4.715 1.00 0.00 H new ATOM 0 HD12 LEU A 52 -6.657 -9.264 -3.359 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -7.089 -8.845 -5.034 1.00 0.00 H new ATOM 0 HD21 LEU A 52 -4.174 -8.592 -5.986 1.00 0.00 H new ATOM 0 HD22 LEU A 52 -5.411 -7.380 -6.396 1.00 0.00 H new ATOM 0 HD23 LEU A 52 -3.904 -6.877 -5.594 1.00 0.00 H new ATOM 805 N THR A 53 -5.052 -3.097 -2.582 1.00 0.00 N ATOM 806 CA THR A 53 -5.441 -1.951 -1.724 1.00 0.00 C ATOM 807 C THR A 53 -6.606 -1.139 -2.324 1.00 0.00 C ATOM 808 O THR A 53 -6.545 -0.701 -3.469 1.00 0.00 O ATOM 809 CB THR A 53 -4.171 -1.076 -1.519 1.00 0.00 C ATOM 810 OG1 THR A 53 -3.147 -1.820 -0.863 1.00 0.00 O ATOM 811 CG2 THR A 53 -4.404 0.163 -0.662 1.00 0.00 C ATOM 0 H THR A 53 -4.138 -2.980 -3.020 1.00 0.00 H new ATOM 0 HA THR A 53 -5.811 -2.314 -0.765 1.00 0.00 H new ATOM 0 HB THR A 53 -3.887 -0.769 -2.526 1.00 0.00 H new ATOM 0 HG1 THR A 53 -2.356 -1.254 -0.745 1.00 0.00 H new ATOM 0 HG21 THR A 53 -3.472 0.720 -0.566 1.00 0.00 H new ATOM 0 HG22 THR A 53 -5.157 0.795 -1.133 1.00 0.00 H new ATOM 0 HG23 THR A 53 -4.750 -0.138 0.327 1.00 0.00 H new ATOM 819 N GLU A 54 -7.661 -0.953 -1.533 1.00 0.00 N ATOM 820 CA GLU A 54 -8.980 -0.518 -2.057 1.00 0.00 C ATOM 821 C GLU A 54 -9.482 0.702 -1.229 1.00 0.00 C ATOM 822 O GLU A 54 -10.191 0.603 -0.220 1.00 0.00 O ATOM 823 CB GLU A 54 -9.824 -1.812 -2.044 1.00 0.00 C ATOM 824 CG GLU A 54 -11.235 -1.793 -2.624 1.00 0.00 C ATOM 825 CD GLU A 54 -12.284 -1.012 -1.860 1.00 0.00 C ATOM 826 OE1 GLU A 54 -12.664 -1.422 -0.737 1.00 0.00 O ATOM 827 OE2 GLU A 54 -12.732 0.029 -2.388 1.00 0.00 O ATOM 0 H GLU A 54 -7.641 -1.094 -0.523 1.00 0.00 H new ATOM 0 HA GLU A 54 -9.003 -0.123 -3.073 1.00 0.00 H new ATOM 0 HB2 GLU A 54 -9.260 -2.575 -2.580 1.00 0.00 H new ATOM 0 HB3 GLU A 54 -9.901 -2.142 -1.008 1.00 0.00 H new ATOM 0 HG2 GLU A 54 -11.180 -1.387 -3.634 1.00 0.00 H new ATOM 0 HG3 GLU A 54 -11.578 -2.824 -2.713 1.00 0.00 H new ATOM 834 N SER A 55 -9.058 1.890 -1.656 1.00 0.00 N ATOM 835 CA SER A 55 -9.544 3.182 -1.103 1.00 0.00 C ATOM 836 C SER A 55 -10.132 4.064 -2.250 1.00 0.00 C ATOM 837 O SER A 55 -9.791 3.872 -3.421 1.00 0.00 O ATOM 838 CB SER A 55 -8.350 3.924 -0.445 1.00 0.00 C ATOM 839 OG SER A 55 -7.840 3.223 0.681 1.00 0.00 O ATOM 0 H SER A 55 -8.366 1.999 -2.397 1.00 0.00 H new ATOM 0 HA SER A 55 -10.323 2.994 -0.364 1.00 0.00 H new ATOM 0 HB2 SER A 55 -7.556 4.055 -1.180 1.00 0.00 H new ATOM 0 HB3 SER A 55 -8.668 4.920 -0.138 1.00 0.00 H new ATOM 0 HG SER A 55 -8.550 2.671 1.072 1.00 0.00 H new ATOM 845 N THR A 56 -10.945 5.092 -1.956 1.00 0.00 N ATOM 846 CA THR A 56 -11.437 6.036 -3.031 1.00 0.00 C ATOM 847 C THR A 56 -10.324 6.804 -3.832 1.00 0.00 C ATOM 848 O THR A 56 -10.455 6.963 -5.045 1.00 0.00 O ATOM 849 CB THR A 56 -12.531 6.957 -2.437 1.00 0.00 C ATOM 850 OG1 THR A 56 -13.659 6.175 -2.071 1.00 0.00 O ATOM 851 CG2 THR A 56 -13.098 8.029 -3.359 1.00 0.00 C ATOM 0 H THR A 56 -11.281 5.306 -1.017 1.00 0.00 H new ATOM 0 HA THR A 56 -11.876 5.419 -3.815 1.00 0.00 H new ATOM 0 HB THR A 56 -12.014 7.453 -1.615 1.00 0.00 H new ATOM 0 HG1 THR A 56 -14.352 6.756 -1.693 1.00 0.00 H new ATOM 0 HG21 THR A 56 -13.854 8.605 -2.825 1.00 0.00 H new ATOM 0 HG22 THR A 56 -12.296 8.693 -3.682 1.00 0.00 H new ATOM 0 HG23 THR A 56 -13.551 7.557 -4.231 1.00 0.00 H new ATOM 859 N PHE A 57 -9.257 7.241 -3.158 1.00 0.00 N ATOM 860 CA PHE A 57 -8.059 7.832 -3.809 1.00 0.00 C ATOM 861 C PHE A 57 -6.936 6.801 -4.154 1.00 0.00 C ATOM 862 O PHE A 57 -6.256 6.996 -5.162 1.00 0.00 O ATOM 863 CB PHE A 57 -7.536 8.977 -2.896 1.00 0.00 C ATOM 864 CG PHE A 57 -8.181 10.357 -3.175 1.00 0.00 C ATOM 865 CD1 PHE A 57 -9.545 10.579 -2.924 1.00 0.00 C ATOM 866 CD2 PHE A 57 -7.421 11.424 -3.679 1.00 0.00 C ATOM 867 CE1 PHE A 57 -10.131 11.821 -3.176 1.00 0.00 C ATOM 868 CE2 PHE A 57 -8.004 12.670 -3.925 1.00 0.00 C ATOM 869 CZ PHE A 57 -9.358 12.865 -3.672 1.00 0.00 C ATOM 0 H PHE A 57 -9.188 7.200 -2.141 1.00 0.00 H new ATOM 0 HA PHE A 57 -8.360 8.220 -4.782 1.00 0.00 H new ATOM 0 HB2 PHE A 57 -7.717 8.708 -1.855 1.00 0.00 H new ATOM 0 HB3 PHE A 57 -6.456 9.061 -3.021 1.00 0.00 H new ATOM 0 HD1 PHE A 57 -10.150 9.776 -2.530 1.00 0.00 H new ATOM 0 HD2 PHE A 57 -6.370 11.280 -3.880 1.00 0.00 H new ATOM 0 HE1 PHE A 57 -11.184 11.971 -2.986 1.00 0.00 H new ATOM 0 HE2 PHE A 57 -7.404 13.481 -4.311 1.00 0.00 H new ATOM 0 HZ PHE A 57 -9.809 13.828 -3.861 1.00 0.00 H new ATOM 879 N LYS A 58 -6.730 5.740 -3.353 1.00 0.00 N ATOM 880 CA LYS A 58 -5.757 4.668 -3.692 1.00 0.00 C ATOM 881 C LYS A 58 -6.465 3.282 -3.854 1.00 0.00 C ATOM 882 O LYS A 58 -6.348 2.399 -3.000 1.00 0.00 O ATOM 883 CB LYS A 58 -4.614 4.603 -2.643 1.00 0.00 C ATOM 884 CG LYS A 58 -3.730 5.861 -2.579 1.00 0.00 C ATOM 885 CD LYS A 58 -2.400 5.659 -1.838 1.00 0.00 C ATOM 886 CE LYS A 58 -2.526 5.272 -0.361 1.00 0.00 C ATOM 887 NZ LYS A 58 -1.157 5.104 0.200 1.00 0.00 N ATOM 0 H LYS A 58 -7.218 5.596 -2.469 1.00 0.00 H new ATOM 0 HA LYS A 58 -5.311 4.917 -4.655 1.00 0.00 H new ATOM 0 HB2 LYS A 58 -5.051 4.432 -1.659 1.00 0.00 H new ATOM 0 HB3 LYS A 58 -3.983 3.743 -2.866 1.00 0.00 H new ATOM 0 HG2 LYS A 58 -3.520 6.196 -3.595 1.00 0.00 H new ATOM 0 HG3 LYS A 58 -4.288 6.659 -2.089 1.00 0.00 H new ATOM 0 HD2 LYS A 58 -1.830 4.885 -2.352 1.00 0.00 H new ATOM 0 HD3 LYS A 58 -1.821 6.580 -1.907 1.00 0.00 H new ATOM 0 HE2 LYS A 58 -3.069 6.042 0.188 1.00 0.00 H new ATOM 0 HE3 LYS A 58 -3.094 4.347 -0.258 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 -1.125 4.245 0.785 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 -0.471 5.019 -0.577 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 -0.917 5.930 0.784 1.00 0.00 H new ATOM 901 N ASN A 59 -7.163 3.094 -4.982 1.00 0.00 N ATOM 902 CA ASN A 59 -7.732 1.768 -5.369 1.00 0.00 C ATOM 903 C ASN A 59 -6.755 1.095 -6.387 1.00 0.00 C ATOM 904 O ASN A 59 -6.840 1.316 -7.599 1.00 0.00 O ATOM 905 CB ASN A 59 -9.169 1.976 -5.909 1.00 0.00 C ATOM 906 CG ASN A 59 -10.191 0.977 -5.375 1.00 0.00 C ATOM 907 OD1 ASN A 59 -10.193 -0.196 -5.727 1.00 0.00 O ATOM 908 ND2 ASN A 59 -11.070 1.409 -4.499 1.00 0.00 N ATOM 0 H ASN A 59 -7.355 3.837 -5.653 1.00 0.00 H new ATOM 0 HA ASN A 59 -7.822 1.090 -4.520 1.00 0.00 H new ATOM 0 HB2 ASN A 59 -9.497 2.984 -5.656 1.00 0.00 H new ATOM 0 HB3 ASN A 59 -9.149 1.911 -6.997 1.00 0.00 H new ATOM 0 HD21 ASN A 59 -11.759 0.766 -4.108 1.00 0.00 H new ATOM 0 HD22 ASN A 59 -11.063 2.387 -4.210 1.00 0.00 H new ATOM 915 N LEU A 60 -5.762 0.357 -5.867 1.00 0.00 N ATOM 916 CA LEU A 60 -4.576 -0.090 -6.641 1.00 0.00 C ATOM 917 C LEU A 60 -3.870 -1.326 -6.012 1.00 0.00 C ATOM 918 O LEU A 60 -3.755 -1.431 -4.791 1.00 0.00 O ATOM 919 CB LEU A 60 -3.591 1.095 -6.883 1.00 0.00 C ATOM 920 CG LEU A 60 -3.046 1.816 -5.623 1.00 0.00 C ATOM 921 CD1 LEU A 60 -1.712 1.234 -5.133 1.00 0.00 C ATOM 922 CD2 LEU A 60 -2.843 3.314 -5.908 1.00 0.00 C ATOM 0 H LEU A 60 -5.752 0.048 -4.895 1.00 0.00 H new ATOM 0 HA LEU A 60 -4.938 -0.426 -7.613 1.00 0.00 H new ATOM 0 HB2 LEU A 60 -2.742 0.720 -7.455 1.00 0.00 H new ATOM 0 HB3 LEU A 60 -4.094 1.834 -7.507 1.00 0.00 H new ATOM 0 HG LEU A 60 -3.792 1.667 -4.843 1.00 0.00 H new ATOM 0 HD11 LEU A 60 -1.380 1.779 -4.249 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -1.844 0.182 -4.882 1.00 0.00 H new ATOM 0 HD13 LEU A 60 -0.963 1.328 -5.919 1.00 0.00 H new ATOM 0 HD21 LEU A 60 -2.460 3.806 -5.014 1.00 0.00 H new ATOM 0 HD22 LEU A 60 -2.129 3.436 -6.723 1.00 0.00 H new ATOM 0 HD23 LEU A 60 -3.795 3.763 -6.190 1.00 0.00 H new ATOM 934 N SER A 61 -3.352 -2.245 -6.839 1.00 0.00 N ATOM 935 CA SER A 61 -2.674 -3.476 -6.353 1.00 0.00 C ATOM 936 C SER A 61 -1.117 -3.429 -6.373 1.00 0.00 C ATOM 937 O SER A 61 -0.508 -2.854 -7.280 1.00 0.00 O ATOM 938 CB SER A 61 -3.171 -4.676 -7.210 1.00 0.00 C ATOM 939 OG SER A 61 -2.919 -4.511 -8.607 1.00 0.00 O ATOM 0 H SER A 61 -3.385 -2.167 -7.855 1.00 0.00 H new ATOM 0 HA SER A 61 -2.939 -3.579 -5.301 1.00 0.00 H new ATOM 0 HB2 SER A 61 -2.684 -5.588 -6.864 1.00 0.00 H new ATOM 0 HB3 SER A 61 -4.242 -4.808 -7.053 1.00 0.00 H new ATOM 0 HG SER A 61 -3.250 -5.294 -9.094 1.00 0.00 H new ATOM 945 N VAL A 62 -0.483 -4.088 -5.387 1.00 0.00 N ATOM 946 CA VAL A 62 0.994 -4.162 -5.273 1.00 0.00 C ATOM 947 C VAL A 62 1.443 -5.586 -4.776 1.00 0.00 C ATOM 948 O VAL A 62 0.993 -6.053 -3.726 1.00 0.00 O ATOM 949 CB VAL A 62 1.608 -3.054 -4.373 1.00 0.00 C ATOM 950 CG1 VAL A 62 1.701 -1.700 -5.098 1.00 0.00 C ATOM 951 CG2 VAL A 62 0.946 -2.859 -3.009 1.00 0.00 C ATOM 0 H VAL A 62 -0.975 -4.586 -4.645 1.00 0.00 H new ATOM 0 HA VAL A 62 1.381 -3.988 -6.277 1.00 0.00 H new ATOM 0 HB VAL A 62 2.607 -3.437 -4.167 1.00 0.00 H new ATOM 0 HG11 VAL A 62 2.136 -0.958 -4.429 1.00 0.00 H new ATOM 0 HG12 VAL A 62 2.329 -1.803 -5.983 1.00 0.00 H new ATOM 0 HG13 VAL A 62 0.703 -1.378 -5.397 1.00 0.00 H new ATOM 0 HG21 VAL A 62 1.456 -2.062 -2.468 1.00 0.00 H new ATOM 0 HG22 VAL A 62 -0.101 -2.591 -3.148 1.00 0.00 H new ATOM 0 HG23 VAL A 62 1.011 -3.785 -2.437 1.00 0.00 H new ATOM 961 N THR A 63 2.346 -6.233 -5.528 1.00 0.00 N ATOM 962 CA THR A 63 2.865 -7.599 -5.204 1.00 0.00 C ATOM 963 C THR A 63 4.302 -7.531 -4.598 1.00 0.00 C ATOM 964 O THR A 63 5.141 -6.714 -4.988 1.00 0.00 O ATOM 965 CB THR A 63 2.796 -8.534 -6.449 1.00 0.00 C ATOM 966 OG1 THR A 63 1.461 -8.640 -6.931 1.00 0.00 O ATOM 967 CG2 THR A 63 3.220 -9.974 -6.172 1.00 0.00 C ATOM 0 H THR A 63 2.745 -5.837 -6.379 1.00 0.00 H new ATOM 0 HA THR A 63 2.220 -8.033 -4.440 1.00 0.00 H new ATOM 0 HB THR A 63 3.479 -8.070 -7.161 1.00 0.00 H new ATOM 0 HG1 THR A 63 1.441 -9.230 -7.713 1.00 0.00 H new ATOM 0 HG21 THR A 63 3.143 -10.559 -7.089 1.00 0.00 H new ATOM 0 HG22 THR A 63 4.251 -9.988 -5.818 1.00 0.00 H new ATOM 0 HG23 THR A 63 2.569 -10.405 -5.411 1.00 0.00 H new ATOM 975 N PHE A 64 4.550 -8.413 -3.621 1.00 0.00 N ATOM 976 CA PHE A 64 5.766 -8.389 -2.771 1.00 0.00 C ATOM 977 C PHE A 64 5.975 -9.720 -1.981 1.00 0.00 C ATOM 978 O PHE A 64 5.068 -10.543 -1.834 1.00 0.00 O ATOM 979 CB PHE A 64 5.758 -7.150 -1.833 1.00 0.00 C ATOM 980 CG PHE A 64 4.651 -7.070 -0.777 1.00 0.00 C ATOM 981 CD1 PHE A 64 3.410 -6.501 -1.096 1.00 0.00 C ATOM 982 CD2 PHE A 64 4.869 -7.524 0.533 1.00 0.00 C ATOM 983 CE1 PHE A 64 2.413 -6.387 -0.131 1.00 0.00 C ATOM 984 CE2 PHE A 64 3.876 -7.394 1.504 1.00 0.00 C ATOM 985 CZ PHE A 64 2.649 -6.822 1.170 1.00 0.00 C ATOM 0 H PHE A 64 3.911 -9.174 -3.390 1.00 0.00 H new ATOM 0 HA PHE A 64 6.624 -8.301 -3.437 1.00 0.00 H new ATOM 0 HB2 PHE A 64 6.718 -7.112 -1.318 1.00 0.00 H new ATOM 0 HB3 PHE A 64 5.695 -6.257 -2.455 1.00 0.00 H new ATOM 0 HD1 PHE A 64 3.226 -6.148 -2.100 1.00 0.00 H new ATOM 0 HD2 PHE A 64 5.814 -7.978 0.792 1.00 0.00 H new ATOM 0 HE1 PHE A 64 1.456 -5.961 -0.392 1.00 0.00 H new ATOM 0 HE2 PHE A 64 4.057 -7.736 2.512 1.00 0.00 H new ATOM 0 HZ PHE A 64 1.881 -6.716 1.922 1.00 0.00 H new ATOM 995 N LYS A 65 7.174 -9.894 -1.409 1.00 0.00 N ATOM 996 CA LYS A 65 7.400 -10.902 -0.332 1.00 0.00 C ATOM 997 C LYS A 65 7.940 -10.260 0.974 1.00 0.00 C ATOM 998 O LYS A 65 8.220 -9.057 1.037 1.00 0.00 O ATOM 999 CB LYS A 65 8.199 -12.099 -0.899 1.00 0.00 C ATOM 1000 CG LYS A 65 9.727 -11.978 -1.004 1.00 0.00 C ATOM 1001 CD LYS A 65 10.320 -13.279 -1.585 1.00 0.00 C ATOM 1002 CE LYS A 65 11.856 -13.356 -1.571 1.00 0.00 C ATOM 1003 NZ LYS A 65 12.459 -12.382 -2.518 1.00 0.00 N ATOM 0 H LYS A 65 8.005 -9.360 -1.663 1.00 0.00 H new ATOM 0 HA LYS A 65 6.450 -11.322 -0.003 1.00 0.00 H new ATOM 0 HB2 LYS A 65 7.977 -12.968 -0.280 1.00 0.00 H new ATOM 0 HB3 LYS A 65 7.814 -12.312 -1.896 1.00 0.00 H new ATOM 0 HG2 LYS A 65 9.990 -11.133 -1.640 1.00 0.00 H new ATOM 0 HG3 LYS A 65 10.153 -11.782 -0.020 1.00 0.00 H new ATOM 0 HD2 LYS A 65 9.924 -14.124 -1.022 1.00 0.00 H new ATOM 0 HD3 LYS A 65 9.975 -13.391 -2.613 1.00 0.00 H new ATOM 0 HE2 LYS A 65 12.222 -13.160 -0.563 1.00 0.00 H new ATOM 0 HE3 LYS A 65 12.173 -14.365 -1.834 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 13.225 -12.843 -3.049 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 11.731 -12.046 -3.181 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 12.843 -11.574 -1.987 1.00 0.00 H new ATOM 1017 N PHE A 66 8.131 -11.076 2.025 1.00 0.00 N ATOM 1018 CA PHE A 66 8.946 -10.681 3.204 1.00 0.00 C ATOM 1019 C PHE A 66 10.478 -10.560 2.898 1.00 0.00 C ATOM 1020 O PHE A 66 11.298 -11.413 3.235 1.00 0.00 O ATOM 1021 CB PHE A 66 8.565 -11.503 4.452 1.00 0.00 C ATOM 1022 CG PHE A 66 8.610 -13.032 4.417 1.00 0.00 C ATOM 1023 CD1 PHE A 66 9.781 -13.731 4.752 1.00 0.00 C ATOM 1024 CD2 PHE A 66 7.455 -13.766 4.104 1.00 0.00 C ATOM 1025 CE1 PHE A 66 9.804 -15.127 4.746 1.00 0.00 C ATOM 1026 CE2 PHE A 66 7.477 -15.162 4.101 1.00 0.00 C ATOM 1027 CZ PHE A 66 8.652 -15.840 4.419 1.00 0.00 C ATOM 0 H PHE A 66 7.735 -12.014 2.089 1.00 0.00 H new ATOM 0 HA PHE A 66 8.686 -9.654 3.459 1.00 0.00 H new ATOM 0 HB2 PHE A 66 9.219 -11.180 5.262 1.00 0.00 H new ATOM 0 HB3 PHE A 66 7.550 -11.217 4.728 1.00 0.00 H new ATOM 0 HD1 PHE A 66 10.673 -13.183 5.017 1.00 0.00 H new ATOM 0 HD2 PHE A 66 6.540 -13.245 3.863 1.00 0.00 H new ATOM 0 HE1 PHE A 66 10.713 -15.654 4.994 1.00 0.00 H new ATOM 0 HE2 PHE A 66 6.584 -15.716 3.852 1.00 0.00 H new ATOM 0 HZ PHE A 66 8.670 -16.920 4.412 1.00 0.00 H new ATOM 1037 N GLY A 67 10.817 -9.454 2.229 1.00 0.00 N ATOM 1038 CA GLY A 67 12.204 -9.056 1.939 1.00 0.00 C ATOM 1039 C GLY A 67 12.301 -7.675 1.256 1.00 0.00 C ATOM 1040 O GLY A 67 12.928 -6.757 1.789 1.00 0.00 O ATOM 0 H GLY A 67 10.126 -8.797 1.866 1.00 0.00 H new ATOM 0 HA2 GLY A 67 12.773 -9.037 2.868 1.00 0.00 H new ATOM 0 HA3 GLY A 67 12.666 -9.807 1.297 1.00 0.00 H new ATOM 1044 N GLU A 68 11.697 -7.562 0.068 1.00 0.00 N ATOM 1045 CA GLU A 68 11.902 -6.417 -0.847 1.00 0.00 C ATOM 1046 C GLU A 68 11.178 -5.091 -0.428 1.00 0.00 C ATOM 1047 O GLU A 68 10.124 -5.092 0.218 1.00 0.00 O ATOM 1048 CB GLU A 68 11.411 -6.825 -2.274 1.00 0.00 C ATOM 1049 CG GLU A 68 12.262 -7.864 -3.024 1.00 0.00 C ATOM 1050 CD GLU A 68 11.943 -9.318 -2.752 1.00 0.00 C ATOM 1051 OE1 GLU A 68 12.373 -9.868 -1.713 1.00 0.00 O ATOM 1052 OE2 GLU A 68 11.305 -9.971 -3.601 1.00 0.00 O ATOM 0 H GLU A 68 11.048 -8.261 -0.294 1.00 0.00 H new ATOM 0 HA GLU A 68 12.969 -6.197 -0.815 1.00 0.00 H new ATOM 0 HB2 GLU A 68 10.397 -7.214 -2.187 1.00 0.00 H new ATOM 0 HB3 GLU A 68 11.355 -5.924 -2.886 1.00 0.00 H new ATOM 0 HG2 GLU A 68 12.155 -7.685 -4.094 1.00 0.00 H new ATOM 0 HG3 GLU A 68 13.309 -7.692 -2.775 1.00 0.00 H new ATOM 1059 N GLU A 69 11.743 -3.964 -0.889 1.00 0.00 N ATOM 1060 CA GLU A 69 11.092 -2.635 -0.808 1.00 0.00 C ATOM 1061 C GLU A 69 9.981 -2.464 -1.896 1.00 0.00 C ATOM 1062 O GLU A 69 10.278 -2.187 -3.063 1.00 0.00 O ATOM 1063 CB GLU A 69 12.168 -1.527 -0.965 1.00 0.00 C ATOM 1064 CG GLU A 69 13.014 -1.269 0.291 1.00 0.00 C ATOM 1065 CD GLU A 69 13.996 -0.122 0.117 1.00 0.00 C ATOM 1066 OE1 GLU A 69 15.071 -0.331 -0.482 1.00 0.00 O ATOM 1067 OE2 GLU A 69 13.692 0.998 0.579 1.00 0.00 O ATOM 0 H GLU A 69 12.663 -3.942 -1.329 1.00 0.00 H new ATOM 0 HA GLU A 69 10.609 -2.551 0.166 1.00 0.00 H new ATOM 0 HB2 GLU A 69 12.833 -1.799 -1.784 1.00 0.00 H new ATOM 0 HB3 GLU A 69 11.674 -0.598 -1.251 1.00 0.00 H new ATOM 0 HG2 GLU A 69 12.353 -1.051 1.130 1.00 0.00 H new ATOM 0 HG3 GLU A 69 13.563 -2.175 0.546 1.00 0.00 H new ATOM 1074 N PHE A 70 8.703 -2.623 -1.510 1.00 0.00 N ATOM 1075 CA PHE A 70 7.579 -2.598 -2.489 1.00 0.00 C ATOM 1076 C PHE A 70 7.016 -1.174 -2.734 1.00 0.00 C ATOM 1077 O PHE A 70 6.419 -0.591 -1.825 1.00 0.00 O ATOM 1078 CB PHE A 70 6.517 -3.660 -2.129 1.00 0.00 C ATOM 1079 CG PHE A 70 5.534 -3.418 -0.981 1.00 0.00 C ATOM 1080 CD1 PHE A 70 4.318 -2.749 -1.205 1.00 0.00 C ATOM 1081 CD2 PHE A 70 5.797 -3.920 0.300 1.00 0.00 C ATOM 1082 CE1 PHE A 70 3.400 -2.574 -0.168 1.00 0.00 C ATOM 1083 CE2 PHE A 70 4.866 -3.764 1.329 1.00 0.00 C ATOM 1084 CZ PHE A 70 3.672 -3.089 1.095 1.00 0.00 C ATOM 0 H PHE A 70 8.415 -2.769 -0.542 1.00 0.00 H new ATOM 0 HA PHE A 70 7.974 -2.883 -3.464 1.00 0.00 H new ATOM 0 HB2 PHE A 70 5.925 -3.840 -3.026 1.00 0.00 H new ATOM 0 HB3 PHE A 70 7.049 -4.585 -1.907 1.00 0.00 H new ATOM 0 HD1 PHE A 70 4.092 -2.367 -2.189 1.00 0.00 H new ATOM 0 HD2 PHE A 70 6.728 -4.432 0.494 1.00 0.00 H new ATOM 0 HE1 PHE A 70 2.479 -2.039 -0.346 1.00 0.00 H new ATOM 0 HE2 PHE A 70 5.073 -4.168 2.309 1.00 0.00 H new ATOM 0 HZ PHE A 70 2.956 -2.965 1.894 1.00 0.00 H new ATOM 1094 N ASP A 71 7.180 -0.614 -3.945 1.00 0.00 N ATOM 1095 CA ASP A 71 6.660 0.745 -4.270 1.00 0.00 C ATOM 1096 C ASP A 71 5.102 0.796 -4.453 1.00 0.00 C ATOM 1097 O ASP A 71 4.545 0.084 -5.295 1.00 0.00 O ATOM 1098 CB ASP A 71 7.335 1.306 -5.541 1.00 0.00 C ATOM 1099 CG ASP A 71 8.743 1.836 -5.351 1.00 0.00 C ATOM 1100 OD1 ASP A 71 9.706 1.041 -5.370 1.00 0.00 O ATOM 1101 OD2 ASP A 71 8.922 3.062 -5.155 1.00 0.00 O ATOM 0 H ASP A 71 7.664 -1.071 -4.718 1.00 0.00 H new ATOM 0 HA ASP A 71 6.908 1.362 -3.406 1.00 0.00 H new ATOM 0 HB2 ASP A 71 7.360 0.520 -6.296 1.00 0.00 H new ATOM 0 HB3 ASP A 71 6.713 2.109 -5.938 1.00 0.00 H new ATOM 1106 N GLU A 72 4.435 1.690 -3.711 1.00 0.00 N ATOM 1107 CA GLU A 72 3.020 2.070 -3.964 1.00 0.00 C ATOM 1108 C GLU A 72 2.949 3.560 -4.417 1.00 0.00 C ATOM 1109 O GLU A 72 3.526 4.452 -3.782 1.00 0.00 O ATOM 1110 CB GLU A 72 2.103 1.737 -2.762 1.00 0.00 C ATOM 1111 CG GLU A 72 2.327 2.494 -1.441 1.00 0.00 C ATOM 1112 CD GLU A 72 1.096 3.178 -0.873 1.00 0.00 C ATOM 1113 OE1 GLU A 72 0.570 4.122 -1.504 1.00 0.00 O ATOM 1114 OE2 GLU A 72 0.639 2.820 0.232 1.00 0.00 O ATOM 0 H GLU A 72 4.852 2.175 -2.917 1.00 0.00 H new ATOM 0 HA GLU A 72 2.629 1.465 -4.782 1.00 0.00 H new ATOM 0 HB2 GLU A 72 1.072 1.909 -3.073 1.00 0.00 H new ATOM 0 HB3 GLU A 72 2.200 0.671 -2.555 1.00 0.00 H new ATOM 0 HG2 GLU A 72 2.709 1.793 -0.699 1.00 0.00 H new ATOM 0 HG3 GLU A 72 3.101 3.245 -1.598 1.00 0.00 H new ATOM 1121 N LYS A 73 2.274 3.818 -5.548 1.00 0.00 N ATOM 1122 CA LYS A 73 2.199 5.178 -6.144 1.00 0.00 C ATOM 1123 C LYS A 73 0.863 5.877 -5.792 1.00 0.00 C ATOM 1124 O LYS A 73 -0.226 5.380 -6.099 1.00 0.00 O ATOM 1125 CB LYS A 73 2.441 5.048 -7.668 1.00 0.00 C ATOM 1126 CG LYS A 73 2.704 6.382 -8.399 1.00 0.00 C ATOM 1127 CD LYS A 73 1.715 6.722 -9.529 1.00 0.00 C ATOM 1128 CE LYS A 73 0.317 7.117 -9.033 1.00 0.00 C ATOM 1129 NZ LYS A 73 -0.534 7.531 -10.182 1.00 0.00 N ATOM 0 H LYS A 73 1.768 3.106 -6.076 1.00 0.00 H new ATOM 0 HA LYS A 73 2.972 5.822 -5.725 1.00 0.00 H new ATOM 0 HB2 LYS A 73 3.292 4.387 -7.831 1.00 0.00 H new ATOM 0 HB3 LYS A 73 1.573 4.568 -8.120 1.00 0.00 H new ATOM 0 HG2 LYS A 73 2.683 7.189 -7.666 1.00 0.00 H new ATOM 0 HG3 LYS A 73 3.711 6.356 -8.816 1.00 0.00 H new ATOM 0 HD2 LYS A 73 2.124 7.540 -10.123 1.00 0.00 H new ATOM 0 HD3 LYS A 73 1.625 5.861 -10.191 1.00 0.00 H new ATOM 0 HE2 LYS A 73 -0.144 6.277 -8.513 1.00 0.00 H new ATOM 0 HE3 LYS A 73 0.394 7.933 -8.315 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 -1.478 7.797 -9.837 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 -0.099 8.345 -10.661 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 -0.620 6.741 -10.853 1.00 0.00 H new ATOM 1143 N THR A 74 0.958 7.059 -5.178 1.00 0.00 N ATOM 1144 CA THR A 74 -0.204 7.712 -4.520 1.00 0.00 C ATOM 1145 C THR A 74 -0.967 8.695 -5.462 1.00 0.00 C ATOM 1146 O THR A 74 -0.376 9.309 -6.356 1.00 0.00 O ATOM 1147 CB THR A 74 0.279 8.455 -3.222 1.00 0.00 C ATOM 1148 OG1 THR A 74 1.103 9.576 -3.526 1.00 0.00 O ATOM 1149 CG2 THR A 74 1.070 7.583 -2.246 1.00 0.00 C ATOM 0 H THR A 74 1.824 7.594 -5.116 1.00 0.00 H new ATOM 0 HA THR A 74 -0.914 6.927 -4.259 1.00 0.00 H new ATOM 0 HB THR A 74 -0.654 8.758 -2.747 1.00 0.00 H new ATOM 0 HG1 THR A 74 1.382 10.012 -2.694 1.00 0.00 H new ATOM 0 HG21 THR A 74 1.362 8.178 -1.381 1.00 0.00 H new ATOM 0 HG22 THR A 74 0.450 6.748 -1.919 1.00 0.00 H new ATOM 0 HG23 THR A 74 1.962 7.200 -2.741 1.00 0.00 H new ATOM 1157 N SER A 75 -2.269 8.911 -5.209 1.00 0.00 N ATOM 1158 CA SER A 75 -3.026 10.040 -5.827 1.00 0.00 C ATOM 1159 C SER A 75 -2.602 11.505 -5.449 1.00 0.00 C ATOM 1160 O SER A 75 -2.913 12.425 -6.206 1.00 0.00 O ATOM 1161 CB SER A 75 -4.528 9.820 -5.567 1.00 0.00 C ATOM 1162 OG SER A 75 -5.316 10.800 -6.246 1.00 0.00 O ATOM 0 H SER A 75 -2.827 8.328 -4.585 1.00 0.00 H new ATOM 0 HA SER A 75 -2.771 9.997 -6.886 1.00 0.00 H new ATOM 0 HB2 SER A 75 -4.816 8.823 -5.900 1.00 0.00 H new ATOM 0 HB3 SER A 75 -4.726 9.868 -4.496 1.00 0.00 H new ATOM 0 HG SER A 75 -6.094 11.032 -5.697 1.00 0.00 H new ATOM 1168 N ASP A 76 -1.900 11.695 -4.328 1.00 0.00 N ATOM 1169 CA ASP A 76 -1.007 12.864 -4.085 1.00 0.00 C ATOM 1170 C ASP A 76 0.155 13.038 -5.123 1.00 0.00 C ATOM 1171 O ASP A 76 0.383 14.148 -5.608 1.00 0.00 O ATOM 1172 CB ASP A 76 -0.558 12.644 -2.621 1.00 0.00 C ATOM 1173 CG ASP A 76 0.523 13.521 -2.030 1.00 0.00 C ATOM 1174 OD1 ASP A 76 0.564 14.748 -2.278 1.00 0.00 O ATOM 1175 OD2 ASP A 76 1.355 12.983 -1.273 1.00 0.00 O ATOM 0 H ASP A 76 -1.927 11.041 -3.546 1.00 0.00 H new ATOM 0 HA ASP A 76 -1.513 13.819 -4.227 1.00 0.00 H new ATOM 0 HB2 ASP A 76 -1.441 12.746 -1.990 1.00 0.00 H new ATOM 0 HB3 ASP A 76 -0.222 11.611 -2.535 1.00 0.00 H new ATOM 1180 N GLY A 77 0.869 11.951 -5.438 1.00 0.00 N ATOM 1181 CA GLY A 77 1.913 11.912 -6.479 1.00 0.00 C ATOM 1182 C GLY A 77 3.304 11.538 -5.948 1.00 0.00 C ATOM 1183 O GLY A 77 4.240 12.326 -6.101 1.00 0.00 O ATOM 0 H GLY A 77 0.738 11.054 -4.970 1.00 0.00 H new ATOM 0 HA2 GLY A 77 1.622 11.194 -7.246 1.00 0.00 H new ATOM 0 HA3 GLY A 77 1.969 12.888 -6.961 1.00 0.00 H new ATOM 1187 N ARG A 78 3.421 10.358 -5.327 1.00 0.00 N ATOM 1188 CA ARG A 78 4.643 9.906 -4.639 1.00 0.00 C ATOM 1189 C ARG A 78 4.701 8.346 -4.840 1.00 0.00 C ATOM 1190 O ARG A 78 3.799 7.640 -4.378 1.00 0.00 O ATOM 1191 CB ARG A 78 4.622 10.167 -3.102 1.00 0.00 C ATOM 1192 CG ARG A 78 4.234 11.542 -2.550 1.00 0.00 C ATOM 1193 CD ARG A 78 5.228 12.695 -2.765 1.00 0.00 C ATOM 1194 NE ARG A 78 4.673 13.726 -3.681 1.00 0.00 N ATOM 1195 CZ ARG A 78 3.711 14.585 -3.353 1.00 0.00 C ATOM 1196 NH1 ARG A 78 3.432 14.939 -2.125 1.00 0.00 N ATOM 1197 NH2 ARG A 78 2.972 15.073 -4.302 1.00 0.00 N ATOM 0 H ARG A 78 2.661 9.679 -5.286 1.00 0.00 H new ATOM 0 HA ARG A 78 5.492 10.451 -5.051 1.00 0.00 H new ATOM 0 HB2 ARG A 78 3.939 9.440 -2.662 1.00 0.00 H new ATOM 0 HB3 ARG A 78 5.618 9.938 -2.724 1.00 0.00 H new ATOM 0 HG2 ARG A 78 3.283 11.829 -2.998 1.00 0.00 H new ATOM 0 HG3 ARG A 78 4.063 11.439 -1.478 1.00 0.00 H new ATOM 0 HD2 ARG A 78 5.471 13.152 -1.806 1.00 0.00 H new ATOM 0 HD3 ARG A 78 6.158 12.303 -3.176 1.00 0.00 H new ATOM 0 HE ARG A 78 5.056 13.779 -4.625 1.00 0.00 H new ATOM 0 HH11 ARG A 78 3.967 14.550 -1.348 1.00 0.00 H new ATOM 0 HH12 ARG A 78 2.680 15.604 -1.944 1.00 0.00 H new ATOM 0 HH21 ARG A 78 3.136 14.796 -5.270 1.00 0.00 H new ATOM 0 HH22 ARG A 78 2.227 15.734 -4.080 1.00 0.00 H new ATOM 1211 N ASN A 79 5.752 7.812 -5.471 1.00 0.00 N ATOM 1212 CA ASN A 79 6.098 6.368 -5.334 1.00 0.00 C ATOM 1213 C ASN A 79 6.843 6.112 -3.996 1.00 0.00 C ATOM 1214 O ASN A 79 7.985 6.553 -3.827 1.00 0.00 O ATOM 1215 CB ASN A 79 6.796 5.803 -6.587 1.00 0.00 C ATOM 1216 CG ASN A 79 8.190 6.297 -6.922 1.00 0.00 C ATOM 1217 OD1 ASN A 79 8.378 7.407 -7.407 1.00 0.00 O ATOM 1218 ND2 ASN A 79 9.210 5.505 -6.688 1.00 0.00 N ATOM 0 H ASN A 79 6.380 8.339 -6.078 1.00 0.00 H new ATOM 0 HA ASN A 79 5.174 5.792 -5.277 1.00 0.00 H new ATOM 0 HB2 ASN A 79 6.845 4.719 -6.479 1.00 0.00 H new ATOM 0 HB3 ASN A 79 6.156 6.009 -7.445 1.00 0.00 H new ATOM 0 HD21 ASN A 79 10.157 5.814 -6.910 1.00 0.00 H new ATOM 0 HD22 ASN A 79 9.056 4.581 -6.284 1.00 0.00 H new ATOM 1225 N VAL A 80 6.171 5.473 -3.031 1.00 0.00 N ATOM 1226 CA VAL A 80 6.737 5.263 -1.672 1.00 0.00 C ATOM 1227 C VAL A 80 6.877 3.745 -1.436 1.00 0.00 C ATOM 1228 O VAL A 80 5.948 2.966 -1.673 1.00 0.00 O ATOM 1229 CB VAL A 80 5.969 5.967 -0.516 1.00 0.00 C ATOM 1230 CG1 VAL A 80 5.848 7.487 -0.762 1.00 0.00 C ATOM 1231 CG2 VAL A 80 4.568 5.439 -0.174 1.00 0.00 C ATOM 0 H VAL A 80 5.234 5.089 -3.155 1.00 0.00 H new ATOM 0 HA VAL A 80 7.712 5.749 -1.650 1.00 0.00 H new ATOM 0 HB VAL A 80 6.597 5.730 0.343 1.00 0.00 H new ATOM 0 HG11 VAL A 80 5.306 7.947 0.064 1.00 0.00 H new ATOM 0 HG12 VAL A 80 6.844 7.925 -0.832 1.00 0.00 H new ATOM 0 HG13 VAL A 80 5.308 7.663 -1.692 1.00 0.00 H new ATOM 0 HG21 VAL A 80 4.151 6.020 0.648 1.00 0.00 H new ATOM 0 HG22 VAL A 80 3.922 5.530 -1.047 1.00 0.00 H new ATOM 0 HG23 VAL A 80 4.636 4.392 0.120 1.00 0.00 H new ATOM 1241 N LYS A 81 8.063 3.343 -0.986 1.00 0.00 N ATOM 1242 CA LYS A 81 8.424 1.908 -0.885 1.00 0.00 C ATOM 1243 C LYS A 81 8.322 1.388 0.557 1.00 0.00 C ATOM 1244 O LYS A 81 7.890 2.104 1.468 1.00 0.00 O ATOM 1245 CB LYS A 81 9.696 1.666 -1.718 1.00 0.00 C ATOM 1246 CG LYS A 81 11.006 2.227 -1.182 1.00 0.00 C ATOM 1247 CD LYS A 81 12.168 2.215 -2.182 1.00 0.00 C ATOM 1248 CE LYS A 81 12.197 3.347 -3.220 1.00 0.00 C ATOM 1249 NZ LYS A 81 11.543 2.956 -4.498 1.00 0.00 N ATOM 0 H LYS A 81 8.799 3.981 -0.683 1.00 0.00 H new ATOM 0 HA LYS A 81 7.696 1.243 -1.349 1.00 0.00 H new ATOM 0 HB2 LYS A 81 9.817 0.590 -1.842 1.00 0.00 H new ATOM 0 HB3 LYS A 81 9.532 2.085 -2.711 1.00 0.00 H new ATOM 0 HG2 LYS A 81 10.838 3.253 -0.854 1.00 0.00 H new ATOM 0 HG3 LYS A 81 11.297 1.654 -0.302 1.00 0.00 H new ATOM 0 HD2 LYS A 81 13.101 2.245 -1.620 1.00 0.00 H new ATOM 0 HD3 LYS A 81 12.148 1.265 -2.715 1.00 0.00 H new ATOM 0 HE2 LYS A 81 11.696 4.225 -2.812 1.00 0.00 H new ATOM 0 HE3 LYS A 81 13.231 3.632 -3.415 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 12.111 3.301 -5.298 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 11.469 1.920 -4.547 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 10.592 3.374 -4.543 1.00 0.00 H new ATOM 1263 N SER A 82 8.550 0.089 0.772 1.00 0.00 N ATOM 1264 CA SER A 82 8.238 -0.552 2.079 1.00 0.00 C ATOM 1265 C SER A 82 9.058 -1.841 2.309 1.00 0.00 C ATOM 1266 O SER A 82 8.758 -2.879 1.716 1.00 0.00 O ATOM 1267 CB SER A 82 6.716 -0.817 2.169 1.00 0.00 C ATOM 1268 OG SER A 82 6.005 0.401 2.370 1.00 0.00 O ATOM 0 H SER A 82 8.944 -0.543 0.075 1.00 0.00 H new ATOM 0 HA SER A 82 8.527 0.132 2.877 1.00 0.00 H new ATOM 0 HB2 SER A 82 6.371 -1.299 1.254 1.00 0.00 H new ATOM 0 HB3 SER A 82 6.509 -1.505 2.989 1.00 0.00 H new ATOM 0 HG SER A 82 6.633 1.153 2.350 1.00 0.00 H new ATOM 1274 N VAL A 83 10.079 -1.772 3.180 1.00 0.00 N ATOM 1275 CA VAL A 83 10.949 -2.940 3.512 1.00 0.00 C ATOM 1276 C VAL A 83 10.263 -3.894 4.527 1.00 0.00 C ATOM 1277 O VAL A 83 9.919 -3.495 5.644 1.00 0.00 O ATOM 1278 CB VAL A 83 12.362 -2.448 3.948 1.00 0.00 C ATOM 1279 CG1 VAL A 83 12.474 -1.730 5.293 1.00 0.00 C ATOM 1280 CG2 VAL A 83 13.403 -3.576 3.873 1.00 0.00 C ATOM 0 H VAL A 83 10.333 -0.918 3.676 1.00 0.00 H new ATOM 0 HA VAL A 83 11.097 -3.547 2.619 1.00 0.00 H new ATOM 0 HB VAL A 83 12.571 -1.672 3.211 1.00 0.00 H new ATOM 0 HG11 VAL A 83 13.511 -1.444 5.468 1.00 0.00 H new ATOM 0 HG12 VAL A 83 11.849 -0.837 5.282 1.00 0.00 H new ATOM 0 HG13 VAL A 83 12.142 -2.396 6.090 1.00 0.00 H new ATOM 0 HG21 VAL A 83 14.376 -3.195 4.184 1.00 0.00 H new ATOM 0 HG22 VAL A 83 13.105 -4.391 4.532 1.00 0.00 H new ATOM 0 HG23 VAL A 83 13.468 -3.943 2.849 1.00 0.00 H new ATOM 1290 N VAL A 84 10.041 -5.145 4.120 1.00 0.00 N ATOM 1291 CA VAL A 84 9.149 -6.077 4.851 1.00 0.00 C ATOM 1292 C VAL A 84 10.013 -7.178 5.528 1.00 0.00 C ATOM 1293 O VAL A 84 10.719 -7.915 4.836 1.00 0.00 O ATOM 1294 CB VAL A 84 8.124 -6.738 3.862 1.00 0.00 C ATOM 1295 CG1 VAL A 84 7.037 -7.540 4.615 1.00 0.00 C ATOM 1296 CG2 VAL A 84 7.394 -5.752 2.934 1.00 0.00 C ATOM 0 H VAL A 84 10.465 -5.548 3.284 1.00 0.00 H new ATOM 0 HA VAL A 84 8.593 -5.525 5.609 1.00 0.00 H new ATOM 0 HB VAL A 84 8.750 -7.386 3.249 1.00 0.00 H new ATOM 0 HG11 VAL A 84 6.347 -7.982 3.896 1.00 0.00 H new ATOM 0 HG12 VAL A 84 7.508 -8.331 5.199 1.00 0.00 H new ATOM 0 HG13 VAL A 84 6.489 -6.874 5.281 1.00 0.00 H new ATOM 0 HG21 VAL A 84 6.708 -6.300 2.288 1.00 0.00 H new ATOM 0 HG22 VAL A 84 6.833 -5.035 3.534 1.00 0.00 H new ATOM 0 HG23 VAL A 84 8.123 -5.221 2.322 1.00 0.00 H new ATOM 1306 N GLU A 85 9.874 -7.359 6.851 1.00 0.00 N ATOM 1307 CA GLU A 85 10.257 -8.647 7.493 1.00 0.00 C ATOM 1308 C GLU A 85 9.471 -8.879 8.819 1.00 0.00 C ATOM 1309 O GLU A 85 9.185 -7.982 9.620 1.00 0.00 O ATOM 1310 CB GLU A 85 11.788 -8.824 7.645 1.00 0.00 C ATOM 1311 CG GLU A 85 12.270 -10.220 8.110 1.00 0.00 C ATOM 1312 CD GLU A 85 11.803 -11.436 7.313 1.00 0.00 C ATOM 1313 OE1 GLU A 85 10.641 -11.873 7.494 1.00 0.00 O ATOM 1314 OE2 GLU A 85 12.602 -11.986 6.532 1.00 0.00 O ATOM 0 H GLU A 85 9.509 -6.655 7.492 1.00 0.00 H new ATOM 0 HA GLU A 85 9.957 -9.441 6.810 1.00 0.00 H new ATOM 0 HB2 GLU A 85 12.256 -8.602 6.686 1.00 0.00 H new ATOM 0 HB3 GLU A 85 12.150 -8.082 8.356 1.00 0.00 H new ATOM 0 HG2 GLU A 85 13.360 -10.216 8.107 1.00 0.00 H new ATOM 0 HG3 GLU A 85 11.954 -10.356 9.144 1.00 0.00 H new ATOM 1321 N LYS A 86 9.127 -10.152 8.985 1.00 0.00 N ATOM 1322 CA LYS A 86 8.447 -10.721 10.158 1.00 0.00 C ATOM 1323 C LYS A 86 9.374 -10.864 11.391 1.00 0.00 C ATOM 1324 O LYS A 86 10.482 -11.400 11.298 1.00 0.00 O ATOM 1325 CB LYS A 86 7.991 -12.101 9.604 1.00 0.00 C ATOM 1326 CG LYS A 86 7.122 -12.961 10.516 1.00 0.00 C ATOM 1327 CD LYS A 86 6.496 -14.172 9.808 1.00 0.00 C ATOM 1328 CE LYS A 86 7.440 -15.274 9.291 1.00 0.00 C ATOM 1329 NZ LYS A 86 8.129 -14.918 8.009 1.00 0.00 N ATOM 0 H LYS A 86 9.322 -10.856 8.273 1.00 0.00 H new ATOM 0 HA LYS A 86 7.638 -10.096 10.536 1.00 0.00 H new ATOM 0 HB2 LYS A 86 7.443 -11.930 8.677 1.00 0.00 H new ATOM 0 HB3 LYS A 86 8.882 -12.674 9.346 1.00 0.00 H new ATOM 0 HG2 LYS A 86 7.725 -13.312 11.353 1.00 0.00 H new ATOM 0 HG3 LYS A 86 6.326 -12.344 10.933 1.00 0.00 H new ATOM 0 HD2 LYS A 86 5.790 -14.634 10.498 1.00 0.00 H new ATOM 0 HD3 LYS A 86 5.919 -13.802 8.961 1.00 0.00 H new ATOM 0 HE2 LYS A 86 8.192 -15.484 10.052 1.00 0.00 H new ATOM 0 HE3 LYS A 86 6.869 -16.191 9.145 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 8.240 -15.772 7.426 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 7.560 -14.218 7.492 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 9.066 -14.517 8.218 1.00 0.00 H new ATOM 1343 N ASN A 87 8.883 -10.429 12.554 1.00 0.00 N ATOM 1344 CA ASN A 87 9.550 -10.724 13.865 1.00 0.00 C ATOM 1345 C ASN A 87 8.952 -12.018 14.497 1.00 0.00 C ATOM 1346 O ASN A 87 9.675 -13.001 14.664 1.00 0.00 O ATOM 1347 CB ASN A 87 9.477 -9.434 14.709 1.00 0.00 C ATOM 1348 CG ASN A 87 10.073 -9.494 16.104 1.00 0.00 C ATOM 1349 OD1 ASN A 87 9.361 -9.566 17.099 1.00 0.00 O ATOM 1350 ND2 ASN A 87 11.376 -9.446 16.239 1.00 0.00 N ATOM 0 H ASN A 87 8.032 -9.873 12.635 1.00 0.00 H new ATOM 0 HA ASN A 87 10.608 -10.969 13.770 1.00 0.00 H new ATOM 0 HB2 ASN A 87 9.980 -8.639 14.159 1.00 0.00 H new ATOM 0 HB3 ASN A 87 8.430 -9.146 14.799 1.00 0.00 H new ATOM 0 HD21 ASN A 87 11.794 -9.469 17.169 1.00 0.00 H new ATOM 0 HD22 ASN A 87 11.972 -9.386 15.414 1.00 0.00 H new ATOM 1357 N SER A 88 7.644 -12.022 14.789 1.00 0.00 N ATOM 1358 CA SER A 88 6.862 -13.271 14.976 1.00 0.00 C ATOM 1359 C SER A 88 5.728 -13.366 13.903 1.00 0.00 C ATOM 1360 O SER A 88 5.377 -12.385 13.238 1.00 0.00 O ATOM 1361 CB SER A 88 6.305 -13.238 16.422 1.00 0.00 C ATOM 1362 OG SER A 88 5.637 -14.456 16.747 1.00 0.00 O ATOM 0 H SER A 88 7.094 -11.171 14.903 1.00 0.00 H new ATOM 0 HA SER A 88 7.480 -14.159 14.842 1.00 0.00 H new ATOM 0 HB2 SER A 88 7.121 -13.069 17.125 1.00 0.00 H new ATOM 0 HB3 SER A 88 5.614 -12.402 16.529 1.00 0.00 H new ATOM 0 HG SER A 88 5.297 -14.408 17.665 1.00 0.00 H new ATOM 1368 N GLU A 89 5.076 -14.533 13.804 1.00 0.00 N ATOM 1369 CA GLU A 89 3.779 -14.668 13.047 1.00 0.00 C ATOM 1370 C GLU A 89 2.517 -13.913 13.630 1.00 0.00 C ATOM 1371 O GLU A 89 1.433 -13.959 13.046 1.00 0.00 O ATOM 1372 CB GLU A 89 3.600 -16.189 12.845 1.00 0.00 C ATOM 1373 CG GLU A 89 2.463 -16.672 11.935 1.00 0.00 C ATOM 1374 CD GLU A 89 2.438 -16.256 10.475 1.00 0.00 C ATOM 1375 OE1 GLU A 89 3.465 -15.832 9.902 1.00 0.00 O ATOM 1376 OE2 GLU A 89 1.347 -16.389 9.872 1.00 0.00 O ATOM 0 H GLU A 89 5.404 -15.401 14.227 1.00 0.00 H new ATOM 0 HA GLU A 89 3.847 -14.133 12.100 1.00 0.00 H new ATOM 0 HB2 GLU A 89 4.535 -16.584 12.448 1.00 0.00 H new ATOM 0 HB3 GLU A 89 3.455 -16.640 13.827 1.00 0.00 H new ATOM 0 HG2 GLU A 89 2.465 -17.762 11.963 1.00 0.00 H new ATOM 0 HG3 GLU A 89 1.525 -16.343 12.383 1.00 0.00 H new ATOM 1383 N SER A 90 2.705 -13.120 14.696 1.00 0.00 N ATOM 1384 CA SER A 90 1.825 -11.982 15.049 1.00 0.00 C ATOM 1385 C SER A 90 2.547 -10.611 15.323 1.00 0.00 C ATOM 1386 O SER A 90 2.007 -9.762 16.039 1.00 0.00 O ATOM 1387 CB SER A 90 0.914 -12.425 16.222 1.00 0.00 C ATOM 1388 OG SER A 90 1.650 -12.647 17.427 1.00 0.00 O ATOM 0 H SER A 90 3.479 -13.248 15.348 1.00 0.00 H new ATOM 0 HA SER A 90 1.231 -11.749 14.165 1.00 0.00 H new ATOM 0 HB2 SER A 90 0.155 -11.662 16.398 1.00 0.00 H new ATOM 0 HB3 SER A 90 0.389 -13.339 15.946 1.00 0.00 H new ATOM 0 HG SER A 90 1.036 -12.923 18.139 1.00 0.00 H new ATOM 1394 N LYS A 91 3.724 -10.355 14.719 1.00 0.00 N ATOM 1395 CA LYS A 91 4.488 -9.099 14.913 1.00 0.00 C ATOM 1396 C LYS A 91 5.415 -8.947 13.668 1.00 0.00 C ATOM 1397 O LYS A 91 6.412 -9.655 13.549 1.00 0.00 O ATOM 1398 CB LYS A 91 5.280 -9.178 16.242 1.00 0.00 C ATOM 1399 CG LYS A 91 6.042 -7.909 16.667 1.00 0.00 C ATOM 1400 CD LYS A 91 5.125 -6.763 17.129 1.00 0.00 C ATOM 1401 CE LYS A 91 5.929 -5.612 17.754 1.00 0.00 C ATOM 1402 NZ LYS A 91 4.992 -4.559 18.229 1.00 0.00 N ATOM 0 H LYS A 91 4.175 -11.011 14.082 1.00 0.00 H new ATOM 0 HA LYS A 91 3.843 -8.224 14.991 1.00 0.00 H new ATOM 0 HB2 LYS A 91 4.584 -9.440 17.039 1.00 0.00 H new ATOM 0 HB3 LYS A 91 5.997 -9.995 16.163 1.00 0.00 H new ATOM 0 HG2 LYS A 91 6.729 -8.162 17.475 1.00 0.00 H new ATOM 0 HG3 LYS A 91 6.648 -7.563 15.830 1.00 0.00 H new ATOM 0 HD2 LYS A 91 4.553 -6.389 16.280 1.00 0.00 H new ATOM 0 HD3 LYS A 91 4.406 -7.142 17.855 1.00 0.00 H new ATOM 0 HE2 LYS A 91 6.530 -5.982 18.585 1.00 0.00 H new ATOM 0 HE3 LYS A 91 6.620 -5.196 17.021 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 5.398 -4.081 19.059 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 4.837 -3.864 17.471 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 4.084 -4.994 18.490 1.00 0.00 H new ATOM 1416 N LEU A 92 5.077 -8.052 12.743 1.00 0.00 N ATOM 1417 CA LEU A 92 5.932 -7.718 11.558 1.00 0.00 C ATOM 1418 C LEU A 92 6.475 -6.264 11.662 1.00 0.00 C ATOM 1419 O LEU A 92 6.217 -5.532 12.625 1.00 0.00 O ATOM 1420 CB LEU A 92 5.063 -8.108 10.326 1.00 0.00 C ATOM 1421 CG LEU A 92 5.775 -8.137 8.966 1.00 0.00 C ATOM 1422 CD1 LEU A 92 5.394 -9.364 8.124 1.00 0.00 C ATOM 1423 CD2 LEU A 92 5.545 -6.880 8.134 1.00 0.00 C ATOM 0 H LEU A 92 4.204 -7.525 12.775 1.00 0.00 H new ATOM 0 HA LEU A 92 6.867 -8.272 11.478 1.00 0.00 H new ATOM 0 HB2 LEU A 92 4.636 -9.094 10.508 1.00 0.00 H new ATOM 0 HB3 LEU A 92 4.231 -7.407 10.260 1.00 0.00 H new ATOM 0 HG LEU A 92 6.833 -8.192 9.221 1.00 0.00 H new ATOM 0 HD11 LEU A 92 5.927 -9.333 7.174 1.00 0.00 H new ATOM 0 HD12 LEU A 92 5.665 -10.273 8.662 1.00 0.00 H new ATOM 0 HD13 LEU A 92 4.320 -9.359 7.938 1.00 0.00 H new ATOM 0 HD21 LEU A 92 6.077 -6.968 7.187 1.00 0.00 H new ATOM 0 HD22 LEU A 92 4.479 -6.761 7.942 1.00 0.00 H new ATOM 0 HD23 LEU A 92 5.915 -6.011 8.678 1.00 0.00 H new ATOM 1435 N THR A 93 7.332 -5.837 10.731 1.00 0.00 N ATOM 1436 CA THR A 93 7.818 -4.425 10.651 1.00 0.00 C ATOM 1437 C THR A 93 8.025 -4.085 9.152 1.00 0.00 C ATOM 1438 O THR A 93 9.076 -4.337 8.559 1.00 0.00 O ATOM 1439 CB THR A 93 9.038 -4.261 11.579 1.00 0.00 C ATOM 1440 OG1 THR A 93 8.594 -4.390 12.929 1.00 0.00 O ATOM 1441 CG2 THR A 93 9.775 -2.932 11.489 1.00 0.00 C ATOM 0 H THR A 93 7.717 -6.444 10.007 1.00 0.00 H new ATOM 0 HA THR A 93 7.104 -3.689 11.021 1.00 0.00 H new ATOM 0 HB THR A 93 9.740 -5.029 11.255 1.00 0.00 H new ATOM 0 HG1 THR A 93 7.635 -4.593 12.940 1.00 0.00 H new ATOM 0 HG21 THR A 93 10.613 -2.933 12.186 1.00 0.00 H new ATOM 0 HG22 THR A 93 10.147 -2.790 10.474 1.00 0.00 H new ATOM 0 HG23 THR A 93 9.093 -2.120 11.742 1.00 0.00 H new ATOM 1449 N GLN A 94 6.966 -3.524 8.557 1.00 0.00 N ATOM 1450 CA GLN A 94 6.919 -3.153 7.120 1.00 0.00 C ATOM 1451 C GLN A 94 7.324 -1.662 6.903 1.00 0.00 C ATOM 1452 O GLN A 94 6.482 -0.816 6.589 1.00 0.00 O ATOM 1453 CB GLN A 94 5.462 -3.457 6.678 1.00 0.00 C ATOM 1454 CG GLN A 94 5.183 -3.327 5.169 1.00 0.00 C ATOM 1455 CD GLN A 94 3.865 -2.631 4.853 1.00 0.00 C ATOM 1456 OE1 GLN A 94 2.791 -3.210 4.999 1.00 0.00 O ATOM 1457 NE2 GLN A 94 3.884 -1.387 4.444 1.00 0.00 N ATOM 0 H GLN A 94 6.103 -3.309 9.057 1.00 0.00 H new ATOM 0 HA GLN A 94 7.633 -3.716 6.519 1.00 0.00 H new ATOM 0 HB2 GLN A 94 5.211 -4.471 6.990 1.00 0.00 H new ATOM 0 HB3 GLN A 94 4.791 -2.784 7.212 1.00 0.00 H new ATOM 0 HG2 GLN A 94 5.998 -2.773 4.703 1.00 0.00 H new ATOM 0 HG3 GLN A 94 5.176 -4.321 4.722 1.00 0.00 H new ATOM 0 HE21 GLN A 94 4.774 -0.904 4.322 1.00 0.00 H new ATOM 0 HE22 GLN A 94 3.009 -0.901 4.248 1.00 0.00 H new ATOM 1466 N THR A 95 8.612 -1.341 7.081 1.00 0.00 N ATOM 1467 CA THR A 95 9.074 0.066 7.269 1.00 0.00 C ATOM 1468 C THR A 95 8.973 0.885 5.961 1.00 0.00 C ATOM 1469 O THR A 95 9.606 0.552 4.957 1.00 0.00 O ATOM 1470 CB THR A 95 10.490 0.080 7.899 1.00 0.00 C ATOM 1471 OG1 THR A 95 10.499 -0.732 9.075 1.00 0.00 O ATOM 1472 CG2 THR A 95 10.960 1.482 8.286 1.00 0.00 C ATOM 0 H THR A 95 9.365 -2.029 7.101 1.00 0.00 H new ATOM 0 HA THR A 95 8.406 0.567 7.970 1.00 0.00 H new ATOM 0 HB THR A 95 11.170 -0.306 7.140 1.00 0.00 H new ATOM 0 HG1 THR A 95 11.422 -0.854 9.381 1.00 0.00 H new ATOM 0 HG21 THR A 95 11.958 1.424 8.721 1.00 0.00 H new ATOM 0 HG22 THR A 95 10.987 2.114 7.399 1.00 0.00 H new ATOM 0 HG23 THR A 95 10.271 1.909 9.014 1.00 0.00 H new ATOM 1480 N GLN A 96 8.134 1.930 5.987 1.00 0.00 N ATOM 1481 CA GLN A 96 7.754 2.683 4.770 1.00 0.00 C ATOM 1482 C GLN A 96 8.875 3.707 4.404 1.00 0.00 C ATOM 1483 O GLN A 96 9.257 4.559 5.210 1.00 0.00 O ATOM 1484 CB GLN A 96 6.377 3.360 5.003 1.00 0.00 C ATOM 1485 CG GLN A 96 5.153 2.414 4.967 1.00 0.00 C ATOM 1486 CD GLN A 96 3.825 3.058 5.371 1.00 0.00 C ATOM 1487 OE1 GLN A 96 3.174 2.690 6.350 1.00 0.00 O ATOM 1488 NE2 GLN A 96 3.345 4.016 4.613 1.00 0.00 N ATOM 0 H GLN A 96 7.700 2.280 6.841 1.00 0.00 H new ATOM 0 HA GLN A 96 7.653 2.010 3.919 1.00 0.00 H new ATOM 0 HB2 GLN A 96 6.398 3.862 5.971 1.00 0.00 H new ATOM 0 HB3 GLN A 96 6.239 4.132 4.246 1.00 0.00 H new ATOM 0 HG2 GLN A 96 5.053 2.013 3.959 1.00 0.00 H new ATOM 0 HG3 GLN A 96 5.346 1.570 5.629 1.00 0.00 H new ATOM 0 HE21 GLN A 96 3.870 4.333 3.798 1.00 0.00 H new ATOM 0 HE22 GLN A 96 2.447 4.443 4.839 1.00 0.00 H new ATOM 1497 N VAL A 97 9.451 3.575 3.207 1.00 0.00 N ATOM 1498 CA VAL A 97 10.616 4.392 2.781 1.00 0.00 C ATOM 1499 C VAL A 97 10.065 5.417 1.741 1.00 0.00 C ATOM 1500 O VAL A 97 9.906 5.147 0.546 1.00 0.00 O ATOM 1501 CB VAL A 97 11.768 3.474 2.297 1.00 0.00 C ATOM 1502 CG1 VAL A 97 12.986 4.306 1.850 1.00 0.00 C ATOM 1503 CG2 VAL A 97 12.282 2.501 3.388 1.00 0.00 C ATOM 0 H VAL A 97 9.135 2.908 2.503 1.00 0.00 H new ATOM 0 HA VAL A 97 11.077 4.959 3.590 1.00 0.00 H new ATOM 0 HB VAL A 97 11.338 2.903 1.474 1.00 0.00 H new ATOM 0 HG11 VAL A 97 13.780 3.638 1.515 1.00 0.00 H new ATOM 0 HG12 VAL A 97 12.696 4.964 1.031 1.00 0.00 H new ATOM 0 HG13 VAL A 97 13.345 4.905 2.687 1.00 0.00 H new ATOM 0 HG21 VAL A 97 13.087 1.890 2.980 1.00 0.00 H new ATOM 0 HG22 VAL A 97 12.655 3.072 4.238 1.00 0.00 H new ATOM 0 HG23 VAL A 97 11.466 1.856 3.714 1.00 0.00 H new ATOM 1513 N ASP A 98 9.755 6.593 2.274 1.00 0.00 N ATOM 1514 CA ASP A 98 9.075 7.691 1.560 1.00 0.00 C ATOM 1515 C ASP A 98 10.102 8.808 1.145 1.00 0.00 C ATOM 1516 O ASP A 98 11.235 8.801 1.647 1.00 0.00 O ATOM 1517 CB ASP A 98 8.071 8.233 2.617 1.00 0.00 C ATOM 1518 CG ASP A 98 6.939 7.289 3.023 1.00 0.00 C ATOM 1519 OD1 ASP A 98 7.169 6.457 3.928 1.00 0.00 O ATOM 1520 OD2 ASP A 98 5.816 7.397 2.497 1.00 0.00 O ATOM 0 H ASP A 98 9.972 6.826 3.243 1.00 0.00 H new ATOM 0 HA ASP A 98 8.594 7.368 0.636 1.00 0.00 H new ATOM 0 HB2 ASP A 98 8.630 8.502 3.513 1.00 0.00 H new ATOM 0 HB3 ASP A 98 7.629 9.151 2.230 1.00 0.00 H new ATOM 1525 N PRO A 99 9.777 9.856 0.339 1.00 0.00 N ATOM 1526 CA PRO A 99 10.691 11.047 0.173 1.00 0.00 C ATOM 1527 C PRO A 99 11.051 11.903 1.431 1.00 0.00 C ATOM 1528 O PRO A 99 11.963 12.728 1.354 1.00 0.00 O ATOM 1529 CB PRO A 99 9.976 11.860 -0.934 1.00 0.00 C ATOM 1530 CG PRO A 99 8.485 11.482 -0.789 1.00 0.00 C ATOM 1531 CD PRO A 99 8.521 9.988 -0.419 1.00 0.00 C ATOM 0 HA PRO A 99 11.698 10.705 -0.067 1.00 0.00 H new ATOM 0 HB2 PRO A 99 10.129 12.931 -0.801 1.00 0.00 H new ATOM 0 HB3 PRO A 99 10.356 11.604 -1.923 1.00 0.00 H new ATOM 0 HG2 PRO A 99 7.995 12.074 -0.016 1.00 0.00 H new ATOM 0 HG3 PRO A 99 7.937 11.652 -1.716 1.00 0.00 H new ATOM 0 HD2 PRO A 99 7.657 9.701 0.181 1.00 0.00 H new ATOM 0 HD3 PRO A 99 8.518 9.354 -1.306 1.00 0.00 H new ATOM 1539 N LYS A 100 10.387 11.665 2.572 1.00 0.00 N ATOM 1540 CA LYS A 100 10.894 12.069 3.910 1.00 0.00 C ATOM 1541 C LYS A 100 11.391 10.886 4.841 1.00 0.00 C ATOM 1542 O LYS A 100 11.892 11.181 5.926 1.00 0.00 O ATOM 1543 CB LYS A 100 9.769 12.878 4.625 1.00 0.00 C ATOM 1544 CG LYS A 100 10.132 14.331 4.989 1.00 0.00 C ATOM 1545 CD LYS A 100 11.098 14.418 6.183 1.00 0.00 C ATOM 1546 CE LYS A 100 11.399 15.851 6.653 1.00 0.00 C ATOM 1547 NZ LYS A 100 12.291 16.566 5.694 1.00 0.00 N ATOM 0 H LYS A 100 9.485 11.189 2.603 1.00 0.00 H new ATOM 0 HA LYS A 100 11.789 12.666 3.736 1.00 0.00 H new ATOM 0 HB2 LYS A 100 8.889 12.891 3.982 1.00 0.00 H new ATOM 0 HB3 LYS A 100 9.489 12.351 5.537 1.00 0.00 H new ATOM 0 HG2 LYS A 100 10.585 14.816 4.124 1.00 0.00 H new ATOM 0 HG3 LYS A 100 9.221 14.882 5.223 1.00 0.00 H new ATOM 0 HD2 LYS A 100 10.677 13.856 7.017 1.00 0.00 H new ATOM 0 HD3 LYS A 100 12.036 13.933 5.912 1.00 0.00 H new ATOM 0 HE2 LYS A 100 10.465 16.402 6.763 1.00 0.00 H new ATOM 0 HE3 LYS A 100 11.869 15.821 7.636 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 12.474 17.529 6.042 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 13.191 16.052 5.608 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 11.831 16.616 4.763 1.00 0.00 H new ATOM 1561 N ASN A 101 11.231 9.608 4.444 1.00 0.00 N ATOM 1562 CA ASN A 101 11.426 8.410 5.303 1.00 0.00 C ATOM 1563 C ASN A 101 10.427 8.319 6.496 1.00 0.00 C ATOM 1564 O ASN A 101 10.545 9.060 7.476 1.00 0.00 O ATOM 1565 CB ASN A 101 12.909 8.203 5.697 1.00 0.00 C ATOM 1566 CG ASN A 101 13.225 6.778 6.139 1.00 0.00 C ATOM 1567 OD1 ASN A 101 13.469 5.891 5.330 1.00 0.00 O ATOM 1568 ND2 ASN A 101 13.197 6.498 7.420 1.00 0.00 N ATOM 0 H ASN A 101 10.955 9.368 3.492 1.00 0.00 H new ATOM 0 HA ASN A 101 11.166 7.551 4.684 1.00 0.00 H new ATOM 0 HB2 ASN A 101 13.542 8.461 4.848 1.00 0.00 H new ATOM 0 HB3 ASN A 101 13.162 8.890 6.504 1.00 0.00 H new ATOM 0 HD21 ASN A 101 13.378 5.546 7.738 1.00 0.00 H new ATOM 0 HD22 ASN A 101 12.994 7.232 8.098 1.00 0.00 H new ATOM 1575 N THR A 102 9.490 7.364 6.443 1.00 0.00 N ATOM 1576 CA THR A 102 8.605 7.045 7.599 1.00 0.00 C ATOM 1577 C THR A 102 9.364 6.097 8.588 1.00 0.00 C ATOM 1578 O THR A 102 9.937 5.075 8.194 1.00 0.00 O ATOM 1579 CB THR A 102 7.298 6.398 7.072 1.00 0.00 C ATOM 1580 OG1 THR A 102 6.661 7.197 6.086 1.00 0.00 O ATOM 1581 CG2 THR A 102 6.219 6.198 8.115 1.00 0.00 C ATOM 0 H THR A 102 9.316 6.792 5.617 1.00 0.00 H new ATOM 0 HA THR A 102 8.341 7.952 8.142 1.00 0.00 H new ATOM 0 HB THR A 102 7.658 5.441 6.694 1.00 0.00 H new ATOM 0 HG1 THR A 102 6.520 6.665 5.275 1.00 0.00 H new ATOM 0 HG21 THR A 102 5.345 5.740 7.651 1.00 0.00 H new ATOM 0 HG22 THR A 102 6.593 5.547 8.905 1.00 0.00 H new ATOM 0 HG23 THR A 102 5.941 7.162 8.540 1.00 0.00 H new ATOM 1589 N THR A 103 9.387 6.458 9.872 1.00 0.00 N ATOM 1590 CA THR A 103 10.202 5.750 10.899 1.00 0.00 C ATOM 1591 C THR A 103 9.532 4.418 11.368 1.00 0.00 C ATOM 1592 O THR A 103 8.316 4.374 11.552 1.00 0.00 O ATOM 1593 CB THR A 103 10.457 6.766 12.045 1.00 0.00 C ATOM 1594 OG1 THR A 103 11.125 7.933 11.567 1.00 0.00 O ATOM 1595 CG2 THR A 103 11.322 6.254 13.180 1.00 0.00 C ATOM 0 H THR A 103 8.850 7.242 10.242 1.00 0.00 H new ATOM 0 HA THR A 103 11.157 5.423 10.488 1.00 0.00 H new ATOM 0 HB THR A 103 9.452 6.966 12.418 1.00 0.00 H new ATOM 0 HG1 THR A 103 11.898 8.124 12.138 1.00 0.00 H new ATOM 0 HG21 THR A 103 11.441 7.037 13.929 1.00 0.00 H new ATOM 0 HG22 THR A 103 10.847 5.385 13.636 1.00 0.00 H new ATOM 0 HG23 THR A 103 12.301 5.971 12.793 1.00 0.00 H new ATOM 1603 N VAL A 104 10.345 3.357 11.546 1.00 0.00 N ATOM 1604 CA VAL A 104 9.911 1.945 11.773 1.00 0.00 C ATOM 1605 C VAL A 104 8.431 1.631 12.139 1.00 0.00 C ATOM 1606 O VAL A 104 8.028 1.698 13.305 1.00 0.00 O ATOM 1607 CB VAL A 104 10.874 1.135 12.710 1.00 0.00 C ATOM 1608 CG1 VAL A 104 12.250 0.862 12.068 1.00 0.00 C ATOM 1609 CG2 VAL A 104 11.088 1.717 14.115 1.00 0.00 C ATOM 0 H VAL A 104 11.360 3.453 11.537 1.00 0.00 H new ATOM 0 HA VAL A 104 9.982 1.601 10.741 1.00 0.00 H new ATOM 0 HB VAL A 104 10.330 0.199 12.838 1.00 0.00 H new ATOM 0 HG11 VAL A 104 12.871 0.299 12.764 1.00 0.00 H new ATOM 0 HG12 VAL A 104 12.116 0.286 11.153 1.00 0.00 H new ATOM 0 HG13 VAL A 104 12.736 1.809 11.833 1.00 0.00 H new ATOM 0 HG21 VAL A 104 11.770 1.077 14.674 1.00 0.00 H new ATOM 0 HG22 VAL A 104 11.514 2.717 14.034 1.00 0.00 H new ATOM 0 HG23 VAL A 104 10.132 1.771 14.636 1.00 0.00 H new ATOM 1619 N ILE A 105 7.625 1.262 11.133 1.00 0.00 N ATOM 1620 CA ILE A 105 6.173 1.041 11.327 1.00 0.00 C ATOM 1621 C ILE A 105 5.999 -0.466 11.664 1.00 0.00 C ATOM 1622 O ILE A 105 5.783 -1.342 10.825 1.00 0.00 O ATOM 1623 CB ILE A 105 5.307 1.652 10.182 1.00 0.00 C ATOM 1624 CG1 ILE A 105 5.232 0.928 8.830 1.00 0.00 C ATOM 1625 CG2 ILE A 105 5.732 3.118 9.863 1.00 0.00 C ATOM 1626 CD1 ILE A 105 4.160 -0.152 8.714 1.00 0.00 C ATOM 0 H ILE A 105 7.947 1.109 10.177 1.00 0.00 H new ATOM 0 HA ILE A 105 5.766 1.599 12.170 1.00 0.00 H new ATOM 0 HB ILE A 105 4.317 1.554 10.628 1.00 0.00 H new ATOM 0 HG12 ILE A 105 5.059 1.670 8.051 1.00 0.00 H new ATOM 0 HG13 ILE A 105 6.202 0.474 8.628 1.00 0.00 H new ATOM 0 HG21 ILE A 105 5.108 3.511 9.061 1.00 0.00 H new ATOM 0 HG22 ILE A 105 5.610 3.734 10.754 1.00 0.00 H new ATOM 0 HG23 ILE A 105 6.776 3.134 9.551 1.00 0.00 H new ATOM 0 HD11 ILE A 105 4.197 -0.596 7.719 1.00 0.00 H new ATOM 0 HD12 ILE A 105 4.338 -0.924 9.463 1.00 0.00 H new ATOM 0 HD13 ILE A 105 3.178 0.291 8.877 1.00 0.00 H new ATOM 1638 N VAL A 106 6.177 -0.779 12.949 1.00 0.00 N ATOM 1639 CA VAL A 106 5.873 -2.129 13.506 1.00 0.00 C ATOM 1640 C VAL A 106 4.368 -2.558 13.246 1.00 0.00 C ATOM 1641 O VAL A 106 3.492 -1.698 13.134 1.00 0.00 O ATOM 1642 CB VAL A 106 6.200 -2.207 15.037 1.00 0.00 C ATOM 1643 CG1 VAL A 106 7.709 -2.151 15.345 1.00 0.00 C ATOM 1644 CG2 VAL A 106 5.502 -1.132 15.893 1.00 0.00 C ATOM 0 H VAL A 106 6.533 -0.120 13.641 1.00 0.00 H new ATOM 0 HA VAL A 106 6.517 -2.832 12.978 1.00 0.00 H new ATOM 0 HB VAL A 106 5.804 -3.184 15.313 1.00 0.00 H new ATOM 0 HG11 VAL A 106 7.863 -2.210 16.422 1.00 0.00 H new ATOM 0 HG12 VAL A 106 8.211 -2.989 14.861 1.00 0.00 H new ATOM 0 HG13 VAL A 106 8.122 -1.215 14.970 1.00 0.00 H new ATOM 0 HG21 VAL A 106 5.784 -1.260 16.938 1.00 0.00 H new ATOM 0 HG22 VAL A 106 5.807 -0.142 15.553 1.00 0.00 H new ATOM 0 HG23 VAL A 106 4.421 -1.233 15.794 1.00 0.00 H new ATOM 1654 N ARG A 107 4.089 -3.856 13.101 1.00 0.00 N ATOM 1655 CA ARG A 107 2.740 -4.358 12.711 1.00 0.00 C ATOM 1656 C ARG A 107 2.299 -5.501 13.695 1.00 0.00 C ATOM 1657 O ARG A 107 2.678 -6.661 13.513 1.00 0.00 O ATOM 1658 CB ARG A 107 2.774 -4.905 11.253 1.00 0.00 C ATOM 1659 CG ARG A 107 3.036 -3.899 10.119 1.00 0.00 C ATOM 1660 CD ARG A 107 1.872 -3.707 9.128 1.00 0.00 C ATOM 1661 NE ARG A 107 2.146 -4.218 7.756 1.00 0.00 N ATOM 1662 CZ ARG A 107 2.107 -5.489 7.368 1.00 0.00 C ATOM 1663 NH1 ARG A 107 1.893 -6.491 8.177 1.00 0.00 N ATOM 1664 NH2 ARG A 107 2.304 -5.749 6.110 1.00 0.00 N ATOM 0 H ARG A 107 4.777 -4.595 13.246 1.00 0.00 H new ATOM 0 HA ARG A 107 2.025 -3.537 12.764 1.00 0.00 H new ATOM 0 HB2 ARG A 107 3.543 -5.676 11.202 1.00 0.00 H new ATOM 0 HB3 ARG A 107 1.819 -5.393 11.055 1.00 0.00 H new ATOM 0 HG2 ARG A 107 3.278 -2.933 10.561 1.00 0.00 H new ATOM 0 HG3 ARG A 107 3.915 -4.224 9.563 1.00 0.00 H new ATOM 0 HD2 ARG A 107 0.989 -4.210 9.521 1.00 0.00 H new ATOM 0 HD3 ARG A 107 1.633 -2.645 9.067 1.00 0.00 H new ATOM 0 HE ARG A 107 2.387 -3.526 7.046 1.00 0.00 H new ATOM 0 HH11 ARG A 107 1.743 -6.321 9.171 1.00 0.00 H new ATOM 0 HH12 ARG A 107 1.875 -7.444 7.815 1.00 0.00 H new ATOM 0 HH21 ARG A 107 2.482 -4.989 5.454 1.00 0.00 H new ATOM 0 HH22 ARG A 107 2.281 -6.713 5.779 1.00 0.00 H new ATOM 1678 N GLU A 108 1.510 -5.158 14.715 1.00 0.00 N ATOM 1679 CA GLU A 108 1.033 -6.127 15.760 1.00 0.00 C ATOM 1680 C GLU A 108 -0.486 -6.470 15.571 1.00 0.00 C ATOM 1681 O GLU A 108 -1.118 -6.066 14.593 1.00 0.00 O ATOM 1682 CB GLU A 108 1.378 -5.412 17.096 1.00 0.00 C ATOM 1683 CG GLU A 108 1.330 -6.259 18.380 1.00 0.00 C ATOM 1684 CD GLU A 108 1.846 -5.491 19.587 1.00 0.00 C ATOM 1685 OE1 GLU A 108 3.082 -5.387 19.743 1.00 0.00 O ATOM 1686 OE2 GLU A 108 1.021 -4.972 20.368 1.00 0.00 O ATOM 0 H GLU A 108 1.172 -4.206 14.859 1.00 0.00 H new ATOM 0 HA GLU A 108 1.507 -7.107 15.712 1.00 0.00 H new ATOM 0 HB2 GLU A 108 2.380 -4.992 17.006 1.00 0.00 H new ATOM 0 HB3 GLU A 108 0.691 -4.574 17.218 1.00 0.00 H new ATOM 0 HG2 GLU A 108 0.305 -6.580 18.565 1.00 0.00 H new ATOM 0 HG3 GLU A 108 1.926 -7.161 18.242 1.00 0.00 H new ATOM 1693 N VAL A 109 -1.091 -7.230 16.492 1.00 0.00 N ATOM 1694 CA VAL A 109 -2.567 -7.474 16.518 1.00 0.00 C ATOM 1695 C VAL A 109 -3.075 -7.661 17.975 1.00 0.00 C ATOM 1696 O VAL A 109 -2.536 -8.481 18.724 1.00 0.00 O ATOM 1697 CB VAL A 109 -2.985 -8.634 15.563 1.00 0.00 C ATOM 1698 CG1 VAL A 109 -2.416 -10.011 15.923 1.00 0.00 C ATOM 1699 CG2 VAL A 109 -4.499 -8.742 15.362 1.00 0.00 C ATOM 0 H VAL A 109 -0.587 -7.699 17.245 1.00 0.00 H new ATOM 0 HA VAL A 109 -3.063 -6.585 16.128 1.00 0.00 H new ATOM 0 HB VAL A 109 -2.525 -8.338 14.620 1.00 0.00 H new ATOM 0 HG11 VAL A 109 -2.764 -10.749 15.200 1.00 0.00 H new ATOM 0 HG12 VAL A 109 -1.327 -9.971 15.905 1.00 0.00 H new ATOM 0 HG13 VAL A 109 -2.752 -10.294 16.921 1.00 0.00 H new ATOM 0 HG21 VAL A 109 -4.718 -9.569 14.687 1.00 0.00 H new ATOM 0 HG22 VAL A 109 -4.982 -8.920 16.323 1.00 0.00 H new ATOM 0 HG23 VAL A 109 -4.876 -7.814 14.933 1.00 0.00 H new ATOM 1709 N ASP A 110 -4.175 -6.978 18.323 1.00 0.00 N ATOM 1710 CA ASP A 110 -4.972 -7.312 19.538 1.00 0.00 C ATOM 1711 C ASP A 110 -6.244 -8.156 19.157 1.00 0.00 C ATOM 1712 O ASP A 110 -7.386 -7.702 19.256 1.00 0.00 O ATOM 1713 CB ASP A 110 -5.283 -5.995 20.278 1.00 0.00 C ATOM 1714 CG ASP A 110 -4.242 -5.501 21.281 1.00 0.00 C ATOM 1715 OD1 ASP A 110 -3.149 -6.091 21.440 1.00 0.00 O ATOM 1716 OD2 ASP A 110 -4.475 -4.421 21.862 1.00 0.00 O ATOM 0 H ASP A 110 -4.542 -6.190 17.789 1.00 0.00 H new ATOM 0 HA ASP A 110 -4.411 -7.951 20.219 1.00 0.00 H new ATOM 0 HB2 ASP A 110 -5.432 -5.214 19.532 1.00 0.00 H new ATOM 0 HB3 ASP A 110 -6.229 -6.118 20.805 1.00 0.00 H new ATOM 1721 N GLY A 111 -6.031 -9.411 18.718 1.00 0.00 N ATOM 1722 CA GLY A 111 -7.130 -10.314 18.300 1.00 0.00 C ATOM 1723 C GLY A 111 -7.582 -10.133 16.841 1.00 0.00 C ATOM 1724 O GLY A 111 -6.935 -10.654 15.926 1.00 0.00 O ATOM 0 H GLY A 111 -5.103 -9.828 18.642 1.00 0.00 H new ATOM 0 HA2 GLY A 111 -6.810 -11.346 18.443 1.00 0.00 H new ATOM 0 HA3 GLY A 111 -7.986 -10.152 18.955 1.00 0.00 H new ATOM 1728 N ASP A 112 -8.664 -9.378 16.627 1.00 0.00 N ATOM 1729 CA ASP A 112 -9.069 -8.906 15.269 1.00 0.00 C ATOM 1730 C ASP A 112 -8.746 -7.405 14.920 1.00 0.00 C ATOM 1731 O ASP A 112 -9.271 -6.889 13.931 1.00 0.00 O ATOM 1732 CB ASP A 112 -10.551 -9.296 15.025 1.00 0.00 C ATOM 1733 CG ASP A 112 -11.603 -8.363 15.606 1.00 0.00 C ATOM 1734 OD1 ASP A 112 -11.602 -8.104 16.826 1.00 0.00 O ATOM 1735 OD2 ASP A 112 -12.377 -7.766 14.822 1.00 0.00 O ATOM 0 H ASP A 112 -9.289 -9.071 17.373 1.00 0.00 H new ATOM 0 HA ASP A 112 -8.426 -9.424 14.557 1.00 0.00 H new ATOM 0 HB2 ASP A 112 -10.713 -9.365 13.949 1.00 0.00 H new ATOM 0 HB3 ASP A 112 -10.714 -10.292 15.436 1.00 0.00 H new ATOM 1740 N THR A 113 -7.879 -6.733 15.690 1.00 0.00 N ATOM 1741 CA THR A 113 -7.567 -5.294 15.515 1.00 0.00 C ATOM 1742 C THR A 113 -6.046 -5.167 15.320 1.00 0.00 C ATOM 1743 O THR A 113 -5.256 -5.090 16.266 1.00 0.00 O ATOM 1744 CB THR A 113 -8.226 -4.404 16.586 1.00 0.00 C ATOM 1745 OG1 THR A 113 -8.113 -3.041 16.190 1.00 0.00 O ATOM 1746 CG2 THR A 113 -7.788 -4.488 18.032 1.00 0.00 C ATOM 0 H THR A 113 -7.368 -7.168 16.458 1.00 0.00 H new ATOM 0 HA THR A 113 -8.027 -4.887 14.614 1.00 0.00 H new ATOM 0 HB THR A 113 -9.235 -4.815 16.608 1.00 0.00 H new ATOM 0 HG1 THR A 113 -7.386 -2.614 16.689 1.00 0.00 H new ATOM 0 HG21 THR A 113 -8.369 -3.785 18.629 1.00 0.00 H new ATOM 0 HG22 THR A 113 -7.950 -5.500 18.403 1.00 0.00 H new ATOM 0 HG23 THR A 113 -6.729 -4.239 18.107 1.00 0.00 H new ATOM 1754 N MET A 114 -5.654 -5.228 14.039 1.00 0.00 N ATOM 1755 CA MET A 114 -4.242 -5.171 13.608 1.00 0.00 C ATOM 1756 C MET A 114 -3.617 -3.773 13.880 1.00 0.00 C ATOM 1757 O MET A 114 -3.901 -2.788 13.198 1.00 0.00 O ATOM 1758 CB MET A 114 -4.146 -5.651 12.144 1.00 0.00 C ATOM 1759 CG MET A 114 -2.703 -5.948 11.718 1.00 0.00 C ATOM 1760 SD MET A 114 -2.688 -6.809 10.148 1.00 0.00 S ATOM 1761 CE MET A 114 -0.915 -7.064 10.004 1.00 0.00 C ATOM 0 H MET A 114 -6.310 -5.319 13.264 1.00 0.00 H new ATOM 0 HA MET A 114 -3.633 -5.851 14.204 1.00 0.00 H new ATOM 0 HB2 MET A 114 -4.751 -6.549 12.019 1.00 0.00 H new ATOM 0 HB3 MET A 114 -4.566 -4.890 11.487 1.00 0.00 H new ATOM 0 HG2 MET A 114 -2.141 -5.018 11.636 1.00 0.00 H new ATOM 0 HG3 MET A 114 -2.209 -6.553 12.478 1.00 0.00 H new ATOM 0 HE1 MET A 114 -0.698 -7.593 9.076 1.00 0.00 H new ATOM 0 HE2 MET A 114 -0.408 -6.099 9.998 1.00 0.00 H new ATOM 0 HE3 MET A 114 -0.562 -7.654 10.850 1.00 0.00 H new ATOM 1771 N LYS A 115 -2.824 -3.745 14.950 1.00 0.00 N ATOM 1772 CA LYS A 115 -2.269 -2.523 15.570 1.00 0.00 C ATOM 1773 C LYS A 115 -0.868 -2.205 14.980 1.00 0.00 C ATOM 1774 O LYS A 115 0.148 -2.730 15.446 1.00 0.00 O ATOM 1775 CB LYS A 115 -2.228 -2.906 17.074 1.00 0.00 C ATOM 1776 CG LYS A 115 -1.724 -1.834 18.058 1.00 0.00 C ATOM 1777 CD LYS A 115 -1.082 -2.455 19.320 1.00 0.00 C ATOM 1778 CE LYS A 115 -2.040 -3.304 20.159 1.00 0.00 C ATOM 1779 NZ LYS A 115 -1.324 -4.130 21.166 1.00 0.00 N ATOM 0 H LYS A 115 -2.535 -4.596 15.432 1.00 0.00 H new ATOM 0 HA LYS A 115 -2.847 -1.616 15.393 1.00 0.00 H new ATOM 0 HB2 LYS A 115 -3.234 -3.196 17.377 1.00 0.00 H new ATOM 0 HB3 LYS A 115 -1.596 -3.788 17.181 1.00 0.00 H new ATOM 0 HG2 LYS A 115 -0.994 -1.198 17.557 1.00 0.00 H new ATOM 0 HG3 LYS A 115 -2.556 -1.194 18.353 1.00 0.00 H new ATOM 0 HD2 LYS A 115 -0.237 -3.073 19.017 1.00 0.00 H new ATOM 0 HD3 LYS A 115 -0.684 -1.654 19.943 1.00 0.00 H new ATOM 0 HE2 LYS A 115 -2.751 -2.652 20.666 1.00 0.00 H new ATOM 0 HE3 LYS A 115 -2.617 -3.955 19.502 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 -1.720 -5.092 21.171 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 -0.313 -4.173 20.925 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 -1.437 -3.704 22.108 1.00 0.00 H new ATOM 1793 N THR A 116 -0.809 -1.349 13.954 1.00 0.00 N ATOM 1794 CA THR A 116 0.468 -0.966 13.302 1.00 0.00 C ATOM 1795 C THR A 116 0.831 0.503 13.619 1.00 0.00 C ATOM 1796 O THR A 116 0.266 1.461 13.088 1.00 0.00 O ATOM 1797 CB THR A 116 0.530 -1.363 11.810 1.00 0.00 C ATOM 1798 OG1 THR A 116 1.826 -1.055 11.297 1.00 0.00 O ATOM 1799 CG2 THR A 116 -0.478 -0.752 10.860 1.00 0.00 C ATOM 0 H THR A 116 -1.631 -0.901 13.549 1.00 0.00 H new ATOM 0 HA THR A 116 1.269 -1.561 13.741 1.00 0.00 H new ATOM 0 HB THR A 116 0.285 -2.425 11.836 1.00 0.00 H new ATOM 0 HG1 THR A 116 2.509 -1.479 11.857 1.00 0.00 H new ATOM 0 HG21 THR A 116 -0.304 -1.129 9.852 1.00 0.00 H new ATOM 0 HG22 THR A 116 -1.486 -1.019 11.178 1.00 0.00 H new ATOM 0 HG23 THR A 116 -0.371 0.333 10.865 1.00 0.00 H new ATOM 1807 N THR A 117 1.803 0.662 14.512 1.00 0.00 N ATOM 1808 CA THR A 117 2.218 1.970 15.054 1.00 0.00 C ATOM 1809 C THR A 117 3.084 2.759 14.033 1.00 0.00 C ATOM 1810 O THR A 117 4.265 2.442 13.854 1.00 0.00 O ATOM 1811 CB THR A 117 3.056 1.659 16.346 1.00 0.00 C ATOM 1812 OG1 THR A 117 2.452 0.699 17.212 1.00 0.00 O ATOM 1813 CG2 THR A 117 3.321 2.885 17.198 1.00 0.00 C ATOM 0 H THR A 117 2.338 -0.120 14.891 1.00 0.00 H new ATOM 0 HA THR A 117 1.348 2.590 15.271 1.00 0.00 H new ATOM 0 HB THR A 117 3.984 1.263 15.935 1.00 0.00 H new ATOM 0 HG1 THR A 117 3.028 0.554 17.992 1.00 0.00 H new ATOM 0 HG21 THR A 117 3.904 2.600 18.074 1.00 0.00 H new ATOM 0 HG22 THR A 117 3.877 3.620 16.615 1.00 0.00 H new ATOM 0 HG23 THR A 117 2.373 3.318 17.518 1.00 0.00 H new ATOM 1821 N VAL A 118 2.528 3.792 13.379 1.00 0.00 N ATOM 1822 CA VAL A 118 3.332 4.652 12.469 1.00 0.00 C ATOM 1823 C VAL A 118 3.947 5.842 13.221 1.00 0.00 C ATOM 1824 O VAL A 118 3.264 6.823 13.514 1.00 0.00 O ATOM 1825 CB VAL A 118 2.555 5.006 11.174 1.00 0.00 C ATOM 1826 CG1 VAL A 118 1.270 5.807 11.348 1.00 0.00 C ATOM 1827 CG2 VAL A 118 3.421 5.784 10.160 1.00 0.00 C ATOM 0 H VAL A 118 1.546 4.056 13.455 1.00 0.00 H new ATOM 0 HA VAL A 118 4.190 4.083 12.112 1.00 0.00 H new ATOM 0 HB VAL A 118 2.284 4.014 10.812 1.00 0.00 H new ATOM 0 HG11 VAL A 118 0.821 5.991 10.372 1.00 0.00 H new ATOM 0 HG12 VAL A 118 0.572 5.245 11.969 1.00 0.00 H new ATOM 0 HG13 VAL A 118 1.497 6.759 11.828 1.00 0.00 H new ATOM 0 HG21 VAL A 118 2.830 6.007 9.272 1.00 0.00 H new ATOM 0 HG22 VAL A 118 3.762 6.715 10.612 1.00 0.00 H new ATOM 0 HG23 VAL A 118 4.284 5.180 9.879 1.00 0.00 H new ATOM 1837 N THR A 119 5.248 5.782 13.502 1.00 0.00 N ATOM 1838 CA THR A 119 6.008 6.988 13.951 1.00 0.00 C ATOM 1839 C THR A 119 6.851 7.598 12.806 1.00 0.00 C ATOM 1840 O THR A 119 7.178 6.922 11.829 1.00 0.00 O ATOM 1841 CB THR A 119 6.803 6.646 15.234 1.00 0.00 C ATOM 1842 OG1 THR A 119 7.495 7.797 15.719 1.00 0.00 O ATOM 1843 CG2 THR A 119 7.800 5.500 15.101 1.00 0.00 C ATOM 0 H THR A 119 5.807 4.932 13.434 1.00 0.00 H new ATOM 0 HA THR A 119 5.315 7.786 14.217 1.00 0.00 H new ATOM 0 HB THR A 119 6.041 6.310 15.937 1.00 0.00 H new ATOM 0 HG1 THR A 119 7.991 7.563 16.531 1.00 0.00 H new ATOM 0 HG21 THR A 119 8.303 5.343 16.055 1.00 0.00 H new ATOM 0 HG22 THR A 119 7.272 4.590 14.814 1.00 0.00 H new ATOM 0 HG23 THR A 119 8.538 5.747 14.338 1.00 0.00 H new ATOM 1851 N VAL A 120 7.167 8.901 12.895 1.00 0.00 N ATOM 1852 CA VAL A 120 7.976 9.607 11.841 1.00 0.00 C ATOM 1853 C VAL A 120 8.892 10.636 12.550 1.00 0.00 C ATOM 1854 O VAL A 120 8.557 11.821 12.659 1.00 0.00 O ATOM 1855 CB VAL A 120 7.098 10.273 10.728 1.00 0.00 C ATOM 1856 CG1 VAL A 120 7.967 10.725 9.540 1.00 0.00 C ATOM 1857 CG2 VAL A 120 6.000 9.326 10.232 1.00 0.00 C ATOM 0 H VAL A 120 6.885 9.498 13.673 1.00 0.00 H new ATOM 0 HA VAL A 120 8.578 8.870 11.309 1.00 0.00 H new ATOM 0 HB VAL A 120 6.623 11.146 11.176 1.00 0.00 H new ATOM 0 HG11 VAL A 120 7.334 11.184 8.780 1.00 0.00 H new ATOM 0 HG12 VAL A 120 8.705 11.449 9.884 1.00 0.00 H new ATOM 0 HG13 VAL A 120 8.478 9.862 9.113 1.00 0.00 H new ATOM 0 HG21 VAL A 120 5.412 9.823 9.461 1.00 0.00 H new ATOM 0 HG22 VAL A 120 6.455 8.426 9.818 1.00 0.00 H new ATOM 0 HG23 VAL A 120 5.351 9.054 11.064 1.00 0.00 H new ATOM 1867 N GLY A 121 9.990 10.139 13.139 1.00 0.00 N ATOM 1868 CA GLY A 121 10.726 10.864 14.197 1.00 0.00 C ATOM 1869 C GLY A 121 9.992 11.038 15.550 1.00 0.00 C ATOM 1870 O GLY A 121 10.485 10.616 16.595 1.00 0.00 O ATOM 0 H GLY A 121 10.393 9.233 12.902 1.00 0.00 H new ATOM 0 HA2 GLY A 121 11.664 10.340 14.382 1.00 0.00 H new ATOM 0 HA3 GLY A 121 10.983 11.853 13.818 1.00 0.00 H new ATOM 1874 N ASP A 122 8.839 11.710 15.480 1.00 0.00 N ATOM 1875 CA ASP A 122 8.102 12.241 16.644 1.00 0.00 C ATOM 1876 C ASP A 122 6.563 12.351 16.361 1.00 0.00 C ATOM 1877 O ASP A 122 6.000 13.450 16.286 1.00 0.00 O ATOM 1878 CB ASP A 122 8.768 13.551 17.150 1.00 0.00 C ATOM 1879 CG ASP A 122 8.679 14.793 16.264 1.00 0.00 C ATOM 1880 OD1 ASP A 122 8.869 14.704 15.028 1.00 0.00 O ATOM 1881 OD2 ASP A 122 8.294 15.867 16.769 1.00 0.00 O ATOM 0 H ASP A 122 8.376 11.908 14.593 1.00 0.00 H new ATOM 0 HA ASP A 122 8.171 11.532 17.469 1.00 0.00 H new ATOM 0 HB2 ASP A 122 8.327 13.798 18.116 1.00 0.00 H new ATOM 0 HB3 ASP A 122 9.823 13.342 17.326 1.00 0.00 H new ATOM 1886 N VAL A 123 5.865 11.209 16.199 1.00 0.00 N ATOM 1887 CA VAL A 123 4.373 11.194 16.076 1.00 0.00 C ATOM 1888 C VAL A 123 3.785 9.977 16.862 1.00 0.00 C ATOM 1889 O VAL A 123 3.041 10.179 17.822 1.00 0.00 O ATOM 1890 CB VAL A 123 3.860 11.269 14.595 1.00 0.00 C ATOM 1891 CG1 VAL A 123 2.314 11.295 14.534 1.00 0.00 C ATOM 1892 CG2 VAL A 123 4.332 12.537 13.856 1.00 0.00 C ATOM 0 H VAL A 123 6.296 10.286 16.149 1.00 0.00 H new ATOM 0 HA VAL A 123 4.000 12.111 16.533 1.00 0.00 H new ATOM 0 HB VAL A 123 4.271 10.380 14.117 1.00 0.00 H new ATOM 0 HG11 VAL A 123 1.992 11.347 13.494 1.00 0.00 H new ATOM 0 HG12 VAL A 123 1.917 10.389 14.992 1.00 0.00 H new ATOM 0 HG13 VAL A 123 1.943 12.167 15.073 1.00 0.00 H new ATOM 0 HG21 VAL A 123 3.944 12.530 12.837 1.00 0.00 H new ATOM 0 HG22 VAL A 123 3.964 13.420 14.378 1.00 0.00 H new ATOM 0 HG23 VAL A 123 5.421 12.558 13.830 1.00 0.00 H new ATOM 1902 N THR A 124 4.088 8.746 16.416 1.00 0.00 N ATOM 1903 CA THR A 124 3.506 7.479 16.950 1.00 0.00 C ATOM 1904 C THR A 124 1.958 7.384 16.792 1.00 0.00 C ATOM 1905 O THR A 124 1.216 7.599 17.755 1.00 0.00 O ATOM 1906 CB THR A 124 4.040 7.195 18.383 1.00 0.00 C ATOM 1907 OG1 THR A 124 5.466 7.248 18.411 1.00 0.00 O ATOM 1908 CG2 THR A 124 3.673 5.846 18.980 1.00 0.00 C ATOM 0 H THR A 124 4.755 8.589 15.661 1.00 0.00 H new ATOM 0 HA THR A 124 3.858 6.659 16.324 1.00 0.00 H new ATOM 0 HB THR A 124 3.558 7.972 18.976 1.00 0.00 H new ATOM 0 HG1 THR A 124 5.782 7.068 19.321 1.00 0.00 H new ATOM 0 HG21 THR A 124 4.100 5.762 19.979 1.00 0.00 H new ATOM 0 HG22 THR A 124 2.588 5.758 19.040 1.00 0.00 H new ATOM 0 HG23 THR A 124 4.067 5.049 18.349 1.00 0.00 H new ATOM 1916 N ALA A 125 1.466 7.039 15.585 1.00 0.00 N ATOM 1917 CA ALA A 125 0.015 6.873 15.349 1.00 0.00 C ATOM 1918 C ALA A 125 -0.366 5.375 15.384 1.00 0.00 C ATOM 1919 O ALA A 125 -0.016 4.602 14.485 1.00 0.00 O ATOM 1920 CB ALA A 125 -0.429 7.550 14.051 1.00 0.00 C ATOM 0 H ALA A 125 2.046 6.871 14.763 1.00 0.00 H new ATOM 0 HA ALA A 125 -0.522 7.374 16.155 1.00 0.00 H new ATOM 0 HB1 ALA A 125 -1.501 7.406 13.913 1.00 0.00 H new ATOM 0 HB2 ALA A 125 -0.210 8.617 14.104 1.00 0.00 H new ATOM 0 HB3 ALA A 125 0.107 7.111 13.210 1.00 0.00 H new ATOM 1926 N ILE A 126 -1.080 4.985 16.445 1.00 0.00 N ATOM 1927 CA ILE A 126 -1.406 3.561 16.740 1.00 0.00 C ATOM 1928 C ILE A 126 -2.538 3.012 15.836 1.00 0.00 C ATOM 1929 O ILE A 126 -3.700 2.929 16.242 1.00 0.00 O ATOM 1930 CB ILE A 126 -1.567 3.442 18.295 1.00 0.00 C ATOM 1931 CG1 ILE A 126 -1.500 1.989 18.828 1.00 0.00 C ATOM 1932 CG2 ILE A 126 -2.788 4.137 18.923 1.00 0.00 C ATOM 1933 CD1 ILE A 126 -0.088 1.419 18.742 1.00 0.00 C ATOM 0 H ILE A 126 -1.455 5.639 17.132 1.00 0.00 H new ATOM 0 HA ILE A 126 -0.604 2.876 16.466 1.00 0.00 H new ATOM 0 HB ILE A 126 -0.688 3.999 18.620 1.00 0.00 H new ATOM 0 HG12 ILE A 126 -1.839 1.966 19.864 1.00 0.00 H new ATOM 0 HG13 ILE A 126 -2.181 1.360 18.255 1.00 0.00 H new ATOM 0 HG21 ILE A 126 -2.782 3.979 20.001 1.00 0.00 H new ATOM 0 HG22 ILE A 126 -2.746 5.206 18.713 1.00 0.00 H new ATOM 0 HG23 ILE A 126 -3.702 3.719 18.500 1.00 0.00 H new ATOM 0 HD11 ILE A 126 -0.084 0.399 19.125 1.00 0.00 H new ATOM 0 HD12 ILE A 126 0.241 1.418 17.703 1.00 0.00 H new ATOM 0 HD13 ILE A 126 0.589 2.033 19.336 1.00 0.00 H new ATOM 1945 N ARG A 127 -2.199 2.655 14.575 1.00 0.00 N ATOM 1946 CA ARG A 127 -3.221 2.384 13.534 1.00 0.00 C ATOM 1947 C ARG A 127 -3.919 1.013 13.771 1.00 0.00 C ATOM 1948 O ARG A 127 -3.283 -0.036 13.661 1.00 0.00 O ATOM 1949 CB ARG A 127 -2.648 2.328 12.093 1.00 0.00 C ATOM 1950 CG ARG A 127 -2.099 3.611 11.488 1.00 0.00 C ATOM 1951 CD ARG A 127 -0.912 3.423 10.529 1.00 0.00 C ATOM 1952 NE ARG A 127 -1.135 2.631 9.298 1.00 0.00 N ATOM 1953 CZ ARG A 127 -0.190 2.359 8.389 1.00 0.00 C ATOM 1954 NH1 ARG A 127 1.049 2.783 8.464 1.00 0.00 N ATOM 1955 NH2 ARG A 127 -0.516 1.635 7.363 1.00 0.00 N ATOM 0 H ARG A 127 -1.236 2.548 14.255 1.00 0.00 H new ATOM 0 HA ARG A 127 -3.915 3.220 13.619 1.00 0.00 H new ATOM 0 HB2 ARG A 127 -1.850 1.586 12.081 1.00 0.00 H new ATOM 0 HB3 ARG A 127 -3.436 1.960 11.435 1.00 0.00 H new ATOM 0 HG2 ARG A 127 -2.903 4.115 10.952 1.00 0.00 H new ATOM 0 HG3 ARG A 127 -1.791 4.273 12.297 1.00 0.00 H new ATOM 0 HD2 ARG A 127 -0.562 4.412 10.232 1.00 0.00 H new ATOM 0 HD3 ARG A 127 -0.102 2.953 11.087 1.00 0.00 H new ATOM 0 HE ARG A 127 -2.073 2.267 9.131 1.00 0.00 H new ATOM 0 HH11 ARG A 127 1.344 3.359 9.252 1.00 0.00 H new ATOM 0 HH12 ARG A 127 1.717 2.537 7.734 1.00 0.00 H new ATOM 0 HH21 ARG A 127 -1.471 1.290 7.265 1.00 0.00 H new ATOM 0 HH22 ARG A 127 0.182 1.411 6.654 1.00 0.00 H new ATOM 1969 N ASN A 128 -5.213 1.048 14.058 1.00 0.00 N ATOM 1970 CA ASN A 128 -6.004 -0.173 14.332 1.00 0.00 C ATOM 1971 C ASN A 128 -6.904 -0.486 13.107 1.00 0.00 C ATOM 1972 O ASN A 128 -7.581 0.397 12.575 1.00 0.00 O ATOM 1973 CB ASN A 128 -6.806 0.095 15.625 1.00 0.00 C ATOM 1974 CG ASN A 128 -6.116 -0.428 16.879 1.00 0.00 C ATOM 1975 OD1 ASN A 128 -6.274 -1.586 17.256 1.00 0.00 O ATOM 1976 ND2 ASN A 128 -5.332 0.381 17.551 1.00 0.00 N ATOM 0 H ASN A 128 -5.754 1.911 14.111 1.00 0.00 H new ATOM 0 HA ASN A 128 -5.380 -1.054 14.484 1.00 0.00 H new ATOM 0 HB2 ASN A 128 -6.968 1.168 15.728 1.00 0.00 H new ATOM 0 HB3 ASN A 128 -7.788 -0.369 15.538 1.00 0.00 H new ATOM 0 HD21 ASN A 128 -4.853 0.048 18.388 1.00 0.00 H new ATOM 0 HD22 ASN A 128 -5.202 1.343 17.237 1.00 0.00 H new ATOM 1983 N TYR A 129 -6.879 -1.744 12.662 1.00 0.00 N ATOM 1984 CA TYR A 129 -7.541 -2.181 11.412 1.00 0.00 C ATOM 1985 C TYR A 129 -8.306 -3.528 11.668 1.00 0.00 C ATOM 1986 O TYR A 129 -7.745 -4.482 12.216 1.00 0.00 O ATOM 1987 CB TYR A 129 -6.480 -2.468 10.329 1.00 0.00 C ATOM 1988 CG TYR A 129 -5.722 -1.307 9.683 1.00 0.00 C ATOM 1989 CD1 TYR A 129 -4.553 -0.786 10.258 1.00 0.00 C ATOM 1990 CD2 TYR A 129 -6.041 -0.929 8.375 1.00 0.00 C ATOM 1991 CE1 TYR A 129 -3.739 0.092 9.535 1.00 0.00 C ATOM 1992 CE2 TYR A 129 -5.231 -0.051 7.660 1.00 0.00 C ATOM 1993 CZ TYR A 129 -4.087 0.471 8.242 1.00 0.00 C ATOM 1994 OH TYR A 129 -3.323 1.350 7.537 1.00 0.00 O ATOM 0 H TYR A 129 -6.399 -2.498 13.154 1.00 0.00 H new ATOM 0 HA TYR A 129 -8.222 -1.393 11.091 1.00 0.00 H new ATOM 0 HB2 TYR A 129 -5.739 -3.136 10.768 1.00 0.00 H new ATOM 0 HB3 TYR A 129 -6.973 -3.020 9.529 1.00 0.00 H new ATOM 0 HD1 TYR A 129 -4.280 -1.065 11.265 1.00 0.00 H new ATOM 0 HD2 TYR A 129 -6.932 -1.325 7.911 1.00 0.00 H new ATOM 0 HE1 TYR A 129 -2.835 0.478 9.983 1.00 0.00 H new ATOM 0 HE2 TYR A 129 -5.495 0.224 6.649 1.00 0.00 H new ATOM 0 HH TYR A 129 -3.722 1.494 6.653 1.00 0.00 H new ATOM 2004 N LYS A 130 -9.560 -3.623 11.216 1.00 0.00 N ATOM 2005 CA LYS A 130 -10.411 -4.814 11.497 1.00 0.00 C ATOM 2006 C LYS A 130 -10.091 -5.988 10.519 1.00 0.00 C ATOM 2007 O LYS A 130 -10.221 -5.822 9.304 1.00 0.00 O ATOM 2008 CB LYS A 130 -11.904 -4.398 11.437 1.00 0.00 C ATOM 2009 CG LYS A 130 -12.775 -4.867 12.622 1.00 0.00 C ATOM 2010 CD LYS A 130 -12.774 -3.922 13.838 1.00 0.00 C ATOM 2011 CE LYS A 130 -11.767 -4.231 14.957 1.00 0.00 C ATOM 2012 NZ LYS A 130 -12.250 -5.339 15.831 1.00 0.00 N ATOM 0 H LYS A 130 -10.018 -2.903 10.657 1.00 0.00 H new ATOM 0 HA LYS A 130 -10.192 -5.184 12.499 1.00 0.00 H new ATOM 0 HB2 LYS A 130 -11.958 -3.311 11.378 1.00 0.00 H new ATOM 0 HB3 LYS A 130 -12.335 -4.789 10.515 1.00 0.00 H new ATOM 0 HG2 LYS A 130 -13.801 -4.988 12.275 1.00 0.00 H new ATOM 0 HG3 LYS A 130 -12.429 -5.849 12.943 1.00 0.00 H new ATOM 0 HD2 LYS A 130 -12.585 -2.910 13.481 1.00 0.00 H new ATOM 0 HD3 LYS A 130 -13.774 -3.925 14.271 1.00 0.00 H new ATOM 0 HE2 LYS A 130 -10.806 -4.503 14.520 1.00 0.00 H new ATOM 0 HE3 LYS A 130 -11.602 -3.337 15.558 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 -11.479 -5.650 16.456 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 -13.048 -5.004 16.407 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 -12.560 -6.137 15.240 1.00 0.00 H new ATOM 2026 N ARG A 131 -9.671 -7.145 11.053 1.00 0.00 N ATOM 2027 CA ARG A 131 -9.253 -8.314 10.233 1.00 0.00 C ATOM 2028 C ARG A 131 -10.460 -9.091 9.629 1.00 0.00 C ATOM 2029 O ARG A 131 -11.286 -9.648 10.359 1.00 0.00 O ATOM 2030 CB ARG A 131 -8.408 -9.295 11.097 1.00 0.00 C ATOM 2031 CG ARG A 131 -6.953 -8.848 11.305 1.00 0.00 C ATOM 2032 CD ARG A 131 -6.175 -9.723 12.301 1.00 0.00 C ATOM 2033 NE ARG A 131 -5.861 -11.079 11.783 1.00 0.00 N ATOM 2034 CZ ARG A 131 -5.559 -12.141 12.532 1.00 0.00 C ATOM 2035 NH1 ARG A 131 -5.661 -12.181 13.837 1.00 0.00 N ATOM 2036 NH2 ARG A 131 -5.144 -13.222 11.942 1.00 0.00 N ATOM 0 H ARG A 131 -9.608 -7.306 12.058 1.00 0.00 H new ATOM 0 HA ARG A 131 -8.663 -7.919 9.406 1.00 0.00 H new ATOM 0 HB2 ARG A 131 -8.885 -9.409 12.070 1.00 0.00 H new ATOM 0 HB3 ARG A 131 -8.412 -10.276 10.623 1.00 0.00 H new ATOM 0 HG2 ARG A 131 -6.438 -8.860 10.345 1.00 0.00 H new ATOM 0 HG3 ARG A 131 -6.946 -7.817 11.658 1.00 0.00 H new ATOM 0 HD2 ARG A 131 -5.245 -9.220 12.564 1.00 0.00 H new ATOM 0 HD3 ARG A 131 -6.756 -9.819 13.218 1.00 0.00 H new ATOM 0 HE ARG A 131 -5.878 -11.209 10.771 1.00 0.00 H new ATOM 0 HH11 ARG A 131 -5.991 -11.362 14.348 1.00 0.00 H new ATOM 0 HH12 ARG A 131 -5.411 -13.031 14.342 1.00 0.00 H new ATOM 0 HH21 ARG A 131 -5.055 -13.246 10.926 1.00 0.00 H new ATOM 0 HH22 ARG A 131 -4.907 -14.046 12.495 1.00 0.00 H new ATOM 2050 N LEU A 132 -10.519 -9.134 8.294 1.00 0.00 N ATOM 2051 CA LEU A 132 -11.682 -9.674 7.559 1.00 0.00 C ATOM 2052 C LEU A 132 -11.234 -10.751 6.515 1.00 0.00 C ATOM 2053 O LEU A 132 -10.309 -10.538 5.721 1.00 0.00 O ATOM 2054 CB LEU A 132 -12.411 -8.541 6.791 1.00 0.00 C ATOM 2055 CG LEU A 132 -12.945 -7.346 7.601 1.00 0.00 C ATOM 2056 CD1 LEU A 132 -13.682 -6.398 6.641 1.00 0.00 C ATOM 2057 CD2 LEU A 132 -13.870 -7.721 8.758 1.00 0.00 C ATOM 0 H LEU A 132 -9.769 -8.799 7.689 1.00 0.00 H new ATOM 0 HA LEU A 132 -12.349 -10.125 8.294 1.00 0.00 H new ATOM 0 HB2 LEU A 132 -11.725 -8.154 6.037 1.00 0.00 H new ATOM 0 HB3 LEU A 132 -13.252 -8.986 6.259 1.00 0.00 H new ATOM 0 HG LEU A 132 -12.079 -6.871 8.063 1.00 0.00 H new ATOM 0 HD11 LEU A 132 -14.068 -5.544 7.198 1.00 0.00 H new ATOM 0 HD12 LEU A 132 -12.992 -6.049 5.873 1.00 0.00 H new ATOM 0 HD13 LEU A 132 -14.510 -6.928 6.170 1.00 0.00 H new ATOM 0 HD21 LEU A 132 -14.196 -6.816 9.271 1.00 0.00 H new ATOM 0 HD22 LEU A 132 -14.739 -8.253 8.371 1.00 0.00 H new ATOM 0 HD23 LEU A 132 -13.335 -8.362 9.459 1.00 0.00 H new