USER MOD reduce.3.24.130724 H: found=0, std=0, add=1106, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 1106 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 108 SER OG : rot 180:sc= 1.11 USER MOD Set 1.2: A 124 THR OG1 : rot -99:sc= 1.23 USER MOD Set 2.1: A 95 CYS SG : rot -167:sc= -1.98 USER MOD Set 2.2: A 97 GLN : amide:sc= -1.37 K(o=-3.4,f=-4.4) USER MOD Set 3.1: A 89 SER OG : rot 110:sc= -0.806 USER MOD Set 3.2: A 92 LYS NZ :NH3+ -127:sc= 0.0959 (180deg=0) USER MOD Set 4.1: A 75 THR OG1 : rot 119:sc= 1.18 USER MOD Set 4.2: A 81 CYS SG : rot 180:sc= -2.4 USER MOD Set 5.1: A 56 THR OG1 : rot 97:sc= 0.0212 USER MOD Set 5.2: A 57 THR OG1 : rot 180:sc= -0.555 USER MOD Set 6.1: A 2 ASN : amide:sc= -0.149 K(o=-2.4,f=-3.8) USER MOD Set 6.2: A 91 ASN : amide:sc= -2.21 K(o=-2.4,f=-9.9!) USER MOD Single : A 4 SER OG : rot -7:sc= 1.04 USER MOD Single : A 6 ASN : amide:sc= -1.74 K(o=-1.7,f=-2.9) USER MOD Single : A 8 LYS NZ :NH3+ -177:sc= -0.646 (180deg=-0.647) USER MOD Single : A 12 SER OG : rot 180:sc= -1.12 USER MOD Single : A 14 ASN : amide:sc= -0.946 K(o=-0.95,f=-0.35) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 ASN : amide:sc= -0.413 K(o=-0.41,f=-2.9!) USER MOD Single : A 27 MET CE :methyl 136:sc= -0.0597 (180deg=-0.789) USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 SER OG : rot 13:sc= 0.717 USER MOD Single : A 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 45 GLN : amide:sc= -3.96 K(o=-4,f=-2.8!) USER MOD Single : A 49 THR OG1 : rot 180:sc= 0 USER MOD Single : A 51 TYR OH : rot -30:sc= -3.69 USER MOD Single : A 53 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 THR OG1 : rot 180:sc=-0.00121 USER MOD Single : A 55 SER OG : rot 180:sc= 0 USER MOD Single : A 60 THR OG1 : rot -25:sc= -0.468 USER MOD Single : A 61 THR OG1 : rot 180:sc= -0.355 USER MOD Single : A 64 ASN : amide:sc= -1.53! K(o=-1.5!,f=0.052) USER MOD Single : A 66 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 GLN : amide:sc= -0.0302 X(o=-0.03,f=0) USER MOD Single : A 82 LYS NZ :NH3+ -160:sc= 0 (180deg=-0.103) USER MOD Single : A 83 SER OG : rot 124:sc= 0.508 USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 93 MET CE :methyl 142:sc= -3.87 (180deg=-4.11!) USER MOD Single : A 98 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 101 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 106 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 107 THR OG1 : rot 180:sc= -0.0269 USER MOD Single : A 110 THR OG1 : rot 10:sc= 1.05 USER MOD Single : A 114 THR OG1 : rot 109:sc= 0.722 USER MOD Single : A 115 ASN : amide:sc= -0.396 K(o=-0.4,f=-3.8!) USER MOD Single : A 122 THR OG1 : rot -150:sc= -4! USER MOD Single : A 123 MET CE :methyl -143:sc= -0.638 (180deg=-2.54!) USER MOD Single : A 130 CYS SG : rot 180:sc= 0 USER MOD Single : A 131 THR OG1 : rot 180:sc= -0.618 USER MOD Single : A 134 TYR OH : rot 180:sc= -0.815 USER MOD ----------------------------------------------------------------- ATOM 1 N PRO A 1 -15.690 0.297 10.356 1.00 0.00 N ATOM 2 CA PRO A 1 -14.267 0.245 9.879 1.00 0.00 C ATOM 3 C PRO A 1 -13.876 1.542 9.149 1.00 0.00 C ATOM 4 O PRO A 1 -12.719 1.901 9.132 1.00 0.00 O ATOM 5 CB PRO A 1 -14.131 -0.934 8.911 1.00 0.00 C ATOM 6 CG PRO A 1 -15.509 -1.576 8.791 1.00 0.00 C ATOM 7 CD PRO A 1 -16.486 -0.702 9.579 1.00 0.00 C ATOM 0 H2 PRO A 1 -16.073 1.233 10.227 1.00 0.00 H new ATOM 0 H3 PRO A 1 -15.738 0.090 11.354 1.00 0.00 H new ATOM 0 HA PRO A 1 -13.608 0.128 10.739 1.00 0.00 H new ATOM 0 HB2 PRO A 1 -13.778 -0.594 7.937 1.00 0.00 H new ATOM 0 HB3 PRO A 1 -13.401 -1.654 9.281 1.00 0.00 H new ATOM 0 HG2 PRO A 1 -15.811 -1.645 7.746 1.00 0.00 H new ATOM 0 HG3 PRO A 1 -15.496 -2.591 9.187 1.00 0.00 H new ATOM 0 HD2 PRO A 1 -17.176 -0.197 8.903 1.00 0.00 H new ATOM 0 HD3 PRO A 1 -17.089 -1.314 10.250 1.00 0.00 H new ATOM 17 N ASN A 2 -14.819 2.221 8.518 1.00 0.00 N ATOM 18 CA ASN A 2 -14.490 3.473 7.759 1.00 0.00 C ATOM 19 C ASN A 2 -13.758 3.073 6.473 1.00 0.00 C ATOM 20 O ASN A 2 -14.111 2.080 5.877 1.00 0.00 O ATOM 21 CB ASN A 2 -13.695 4.455 8.647 1.00 0.00 C ATOM 22 CG ASN A 2 -14.554 4.855 9.848 1.00 0.00 C ATOM 23 OD1 ASN A 2 -14.150 4.687 10.981 1.00 0.00 O ATOM 24 ND2 ASN A 2 -15.732 5.381 9.647 1.00 0.00 N ATOM 0 H ASN A 2 -15.804 1.956 8.499 1.00 0.00 H new ATOM 0 HA ASN A 2 -15.395 4.011 7.476 1.00 0.00 H new ATOM 0 HB2 ASN A 2 -12.769 3.990 8.986 1.00 0.00 H new ATOM 0 HB3 ASN A 2 -13.416 5.339 8.073 1.00 0.00 H new ATOM 0 HD21 ASN A 2 -16.312 5.651 10.441 1.00 0.00 H new ATOM 0 HD22 ASN A 2 -16.072 5.522 8.696 1.00 0.00 H new ATOM 31 N PHE A 3 -12.779 3.827 6.038 1.00 0.00 N ATOM 32 CA PHE A 3 -12.019 3.527 4.764 1.00 0.00 C ATOM 33 C PHE A 3 -12.806 4.013 3.530 1.00 0.00 C ATOM 34 O PHE A 3 -12.253 4.647 2.652 1.00 0.00 O ATOM 35 CB PHE A 3 -11.721 2.028 4.572 1.00 0.00 C ATOM 36 CG PHE A 3 -10.866 1.481 5.692 1.00 0.00 C ATOM 37 CD1 PHE A 3 -11.456 1.033 6.879 1.00 0.00 C ATOM 38 CD2 PHE A 3 -9.479 1.376 5.523 1.00 0.00 C ATOM 39 CE1 PHE A 3 -10.682 0.481 7.881 1.00 0.00 C ATOM 40 CE2 PHE A 3 -8.695 0.829 6.542 1.00 0.00 C ATOM 41 CZ PHE A 3 -9.306 0.374 7.726 1.00 0.00 C ATOM 0 H PHE A 3 -12.459 4.666 6.522 1.00 0.00 H new ATOM 0 HA PHE A 3 -11.072 4.059 4.860 1.00 0.00 H new ATOM 0 HB2 PHE A 3 -12.658 1.474 4.525 1.00 0.00 H new ATOM 0 HB3 PHE A 3 -11.213 1.877 3.619 1.00 0.00 H new ATOM 0 HD1 PHE A 3 -12.524 1.119 7.013 1.00 0.00 H new ATOM 0 HD2 PHE A 3 -9.017 1.717 4.608 1.00 0.00 H new ATOM 0 HE1 PHE A 3 -11.149 0.131 8.790 1.00 0.00 H new ATOM 0 HE2 PHE A 3 -7.624 0.755 6.422 1.00 0.00 H new ATOM 0 HZ PHE A 3 -8.705 -0.058 8.513 1.00 0.00 H new ATOM 51 N SER A 4 -14.083 3.702 3.439 1.00 0.00 N ATOM 52 CA SER A 4 -14.899 4.117 2.254 1.00 0.00 C ATOM 53 C SER A 4 -14.734 5.618 1.974 1.00 0.00 C ATOM 54 O SER A 4 -15.094 6.448 2.789 1.00 0.00 O ATOM 55 CB SER A 4 -16.375 3.815 2.535 1.00 0.00 C ATOM 56 OG SER A 4 -16.937 4.852 3.333 1.00 0.00 O ATOM 0 H SER A 4 -14.596 3.173 4.144 1.00 0.00 H new ATOM 0 HA SER A 4 -14.556 3.562 1.380 1.00 0.00 H new ATOM 0 HB2 SER A 4 -16.923 3.728 1.597 1.00 0.00 H new ATOM 0 HB3 SER A 4 -16.468 2.858 3.048 1.00 0.00 H new ATOM 0 HG SER A 4 -16.228 5.465 3.619 1.00 0.00 H new ATOM 62 N GLY A 5 -14.203 5.970 0.829 1.00 0.00 N ATOM 63 CA GLY A 5 -14.028 7.415 0.499 1.00 0.00 C ATOM 64 C GLY A 5 -12.775 7.603 -0.341 1.00 0.00 C ATOM 65 O GLY A 5 -11.838 6.833 -0.262 1.00 0.00 O ATOM 0 H GLY A 5 -13.884 5.319 0.111 1.00 0.00 H new ATOM 0 HA2 GLY A 5 -14.899 7.782 -0.044 1.00 0.00 H new ATOM 0 HA3 GLY A 5 -13.954 8.000 1.415 1.00 0.00 H new ATOM 69 N ASN A 6 -12.747 8.644 -1.117 1.00 0.00 N ATOM 70 CA ASN A 6 -11.550 8.932 -1.947 1.00 0.00 C ATOM 71 C ASN A 6 -10.501 9.497 -1.012 1.00 0.00 C ATOM 72 O ASN A 6 -10.841 10.022 0.034 1.00 0.00 O ATOM 73 CB ASN A 6 -11.894 9.953 -3.035 1.00 0.00 C ATOM 74 CG ASN A 6 -10.676 10.170 -3.934 1.00 0.00 C ATOM 75 OD1 ASN A 6 -9.735 10.839 -3.552 1.00 0.00 O ATOM 76 ND2 ASN A 6 -10.652 9.631 -5.122 1.00 0.00 N ATOM 0 H ASN A 6 -13.509 9.315 -1.213 1.00 0.00 H new ATOM 0 HA ASN A 6 -11.190 8.031 -2.443 1.00 0.00 H new ATOM 0 HB2 ASN A 6 -12.738 9.599 -3.627 1.00 0.00 H new ATOM 0 HB3 ASN A 6 -12.197 10.896 -2.581 1.00 0.00 H new ATOM 0 HD21 ASN A 6 -9.845 9.771 -5.729 1.00 0.00 H new ATOM 0 HD22 ASN A 6 -11.441 9.070 -5.443 1.00 0.00 H new ATOM 83 N TRP A 7 -9.236 9.362 -1.326 1.00 0.00 N ATOM 84 CA TRP A 7 -8.212 9.873 -0.367 1.00 0.00 C ATOM 85 C TRP A 7 -7.160 10.740 -1.031 1.00 0.00 C ATOM 86 O TRP A 7 -6.548 10.368 -2.014 1.00 0.00 O ATOM 87 CB TRP A 7 -7.532 8.689 0.282 1.00 0.00 C ATOM 88 CG TRP A 7 -8.547 7.870 0.985 1.00 0.00 C ATOM 89 CD1 TRP A 7 -9.138 6.762 0.496 1.00 0.00 C ATOM 90 CD2 TRP A 7 -9.121 8.107 2.287 1.00 0.00 C ATOM 91 NE1 TRP A 7 -9.997 6.261 1.456 1.00 0.00 N ATOM 92 CE2 TRP A 7 -10.030 7.070 2.580 1.00 0.00 C ATOM 93 CE3 TRP A 7 -8.920 9.111 3.236 1.00 0.00 C ATOM 94 CZ2 TRP A 7 -10.722 7.034 3.791 1.00 0.00 C ATOM 95 CZ3 TRP A 7 -9.615 9.097 4.443 1.00 0.00 C ATOM 96 CH2 TRP A 7 -10.518 8.058 4.729 1.00 0.00 C ATOM 0 H TRP A 7 -8.877 8.933 -2.179 1.00 0.00 H new ATOM 0 HA TRP A 7 -8.727 10.496 0.365 1.00 0.00 H new ATOM 0 HB2 TRP A 7 -7.022 8.089 -0.472 1.00 0.00 H new ATOM 0 HB3 TRP A 7 -6.773 9.031 0.985 1.00 0.00 H new ATOM 0 HD1 TRP A 7 -8.969 6.337 -0.482 1.00 0.00 H new ATOM 0 HE1 TRP A 7 -10.539 5.403 1.350 1.00 0.00 H new ATOM 0 HE3 TRP A 7 -8.219 9.907 3.032 1.00 0.00 H new ATOM 0 HZ2 TRP A 7 -11.407 6.227 4.004 1.00 0.00 H new ATOM 0 HZ3 TRP A 7 -9.460 9.888 5.162 1.00 0.00 H new ATOM 0 HH2 TRP A 7 -11.053 8.048 5.667 1.00 0.00 H new ATOM 107 N LYS A 8 -6.927 11.890 -0.458 1.00 0.00 N ATOM 108 CA LYS A 8 -5.889 12.803 -0.996 1.00 0.00 C ATOM 109 C LYS A 8 -4.574 12.468 -0.290 1.00 0.00 C ATOM 110 O LYS A 8 -4.579 11.887 0.782 1.00 0.00 O ATOM 111 CB LYS A 8 -6.245 14.278 -0.717 1.00 0.00 C ATOM 112 CG LYS A 8 -7.770 14.491 -0.675 1.00 0.00 C ATOM 113 CD LYS A 8 -8.213 14.710 0.773 1.00 0.00 C ATOM 114 CE LYS A 8 -8.274 16.210 1.070 1.00 0.00 C ATOM 115 NZ LYS A 8 -6.890 16.750 1.186 1.00 0.00 N ATOM 0 H LYS A 8 -7.418 12.235 0.367 1.00 0.00 H new ATOM 0 HA LYS A 8 -5.813 12.672 -2.075 1.00 0.00 H new ATOM 0 HB2 LYS A 8 -5.807 14.586 0.232 1.00 0.00 H new ATOM 0 HB3 LYS A 8 -5.809 14.911 -1.490 1.00 0.00 H new ATOM 0 HG2 LYS A 8 -8.045 15.351 -1.285 1.00 0.00 H new ATOM 0 HG3 LYS A 8 -8.281 13.625 -1.096 1.00 0.00 H new ATOM 0 HD2 LYS A 8 -9.190 14.256 0.937 1.00 0.00 H new ATOM 0 HD3 LYS A 8 -7.516 14.222 1.455 1.00 0.00 H new ATOM 0 HE2 LYS A 8 -8.812 16.727 0.276 1.00 0.00 H new ATOM 0 HE3 LYS A 8 -8.823 16.386 1.995 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 -6.931 17.758 1.438 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 -6.375 16.229 1.924 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 -6.397 16.640 0.277 1.00 0.00 H new ATOM 129 N ILE A 9 -3.455 12.822 -0.870 1.00 0.00 N ATOM 130 CA ILE A 9 -2.147 12.513 -0.218 1.00 0.00 C ATOM 131 C ILE A 9 -1.886 13.531 0.902 1.00 0.00 C ATOM 132 O ILE A 9 -2.188 14.702 0.782 1.00 0.00 O ATOM 133 CB ILE A 9 -1.027 12.506 -1.292 1.00 0.00 C ATOM 134 CG1 ILE A 9 0.017 11.435 -0.936 1.00 0.00 C ATOM 135 CG2 ILE A 9 -0.341 13.877 -1.430 1.00 0.00 C ATOM 136 CD1 ILE A 9 0.730 11.786 0.375 1.00 0.00 C ATOM 0 H ILE A 9 -3.391 13.310 -1.763 1.00 0.00 H new ATOM 0 HA ILE A 9 -2.165 11.523 0.239 1.00 0.00 H new ATOM 0 HB ILE A 9 -1.491 12.277 -2.252 1.00 0.00 H new ATOM 0 HG12 ILE A 9 -0.469 10.464 -0.842 1.00 0.00 H new ATOM 0 HG13 ILE A 9 0.747 11.350 -1.741 1.00 0.00 H new ATOM 0 HG21 ILE A 9 0.435 13.820 -2.194 1.00 0.00 H new ATOM 0 HG22 ILE A 9 -1.079 14.626 -1.717 1.00 0.00 H new ATOM 0 HG23 ILE A 9 0.108 14.157 -0.477 1.00 0.00 H new ATOM 0 HD11 ILE A 9 1.464 11.015 0.608 1.00 0.00 H new ATOM 0 HD12 ILE A 9 1.234 12.747 0.269 1.00 0.00 H new ATOM 0 HD13 ILE A 9 -0.001 11.846 1.182 1.00 0.00 H new ATOM 148 N ILE A 10 -1.327 13.071 1.981 1.00 0.00 N ATOM 149 CA ILE A 10 -1.033 13.950 3.133 1.00 0.00 C ATOM 150 C ILE A 10 0.164 13.343 3.880 1.00 0.00 C ATOM 151 O ILE A 10 0.117 12.222 4.343 1.00 0.00 O ATOM 152 CB ILE A 10 -2.290 14.029 4.025 1.00 0.00 C ATOM 153 CG1 ILE A 10 -3.325 14.949 3.357 1.00 0.00 C ATOM 154 CG2 ILE A 10 -1.960 14.588 5.417 1.00 0.00 C ATOM 155 CD1 ILE A 10 -4.315 14.120 2.530 1.00 0.00 C ATOM 0 H ILE A 10 -1.056 12.097 2.113 1.00 0.00 H new ATOM 0 HA ILE A 10 -0.780 14.964 2.825 1.00 0.00 H new ATOM 0 HB ILE A 10 -2.684 13.020 4.143 1.00 0.00 H new ATOM 0 HG12 ILE A 10 -3.861 15.517 4.117 1.00 0.00 H new ATOM 0 HG13 ILE A 10 -2.820 15.672 2.716 1.00 0.00 H new ATOM 0 HG21 ILE A 10 -2.869 14.629 6.017 1.00 0.00 H new ATOM 0 HG22 ILE A 10 -1.231 13.941 5.906 1.00 0.00 H new ATOM 0 HG23 ILE A 10 -1.545 15.591 5.317 1.00 0.00 H new ATOM 0 HD11 ILE A 10 -5.043 14.783 2.062 1.00 0.00 H new ATOM 0 HD12 ILE A 10 -3.775 13.572 1.758 1.00 0.00 H new ATOM 0 HD13 ILE A 10 -4.832 13.415 3.181 1.00 0.00 H new ATOM 167 N ARG A 11 1.234 14.080 3.964 1.00 0.00 N ATOM 168 CA ARG A 11 2.471 13.591 4.650 1.00 0.00 C ATOM 169 C ARG A 11 3.047 12.392 3.895 1.00 0.00 C ATOM 170 O ARG A 11 2.388 11.388 3.705 1.00 0.00 O ATOM 171 CB ARG A 11 2.157 13.199 6.101 1.00 0.00 C ATOM 172 CG ARG A 11 2.289 14.432 6.997 1.00 0.00 C ATOM 173 CD ARG A 11 1.228 15.462 6.604 1.00 0.00 C ATOM 174 NE ARG A 11 1.045 16.438 7.716 1.00 0.00 N ATOM 175 CZ ARG A 11 0.621 17.645 7.461 1.00 0.00 C ATOM 176 NH1 ARG A 11 -0.522 17.822 6.858 1.00 0.00 N ATOM 177 NH2 ARG A 11 1.340 18.676 7.811 1.00 0.00 N ATOM 0 H ARG A 11 1.309 15.022 3.579 1.00 0.00 H new ATOM 0 HA ARG A 11 3.208 14.394 4.658 1.00 0.00 H new ATOM 0 HB2 ARG A 11 1.148 12.791 6.170 1.00 0.00 H new ATOM 0 HB3 ARG A 11 2.840 12.418 6.435 1.00 0.00 H new ATOM 0 HG2 ARG A 11 2.168 14.150 8.043 1.00 0.00 H new ATOM 0 HG3 ARG A 11 3.285 14.863 6.897 1.00 0.00 H new ATOM 0 HD2 ARG A 11 1.531 15.983 5.695 1.00 0.00 H new ATOM 0 HD3 ARG A 11 0.284 14.962 6.386 1.00 0.00 H new ATOM 0 HE ARG A 11 1.251 16.162 8.676 1.00 0.00 H new ATOM 0 HH11 ARG A 11 -1.085 17.016 6.586 1.00 0.00 H new ATOM 0 HH12 ARG A 11 -0.853 18.766 6.659 1.00 0.00 H new ATOM 0 HH21 ARG A 11 2.233 18.538 8.284 1.00 0.00 H new ATOM 0 HH22 ARG A 11 1.009 19.620 7.612 1.00 0.00 H new ATOM 191 N SER A 12 4.277 12.503 3.459 1.00 0.00 N ATOM 192 CA SER A 12 4.920 11.387 2.706 1.00 0.00 C ATOM 193 C SER A 12 6.440 11.583 2.703 1.00 0.00 C ATOM 194 O SER A 12 6.932 12.666 2.444 1.00 0.00 O ATOM 195 CB SER A 12 4.405 11.391 1.263 1.00 0.00 C ATOM 196 OG SER A 12 4.216 10.051 0.827 1.00 0.00 O ATOM 0 H SER A 12 4.866 13.325 3.594 1.00 0.00 H new ATOM 0 HA SER A 12 4.677 10.437 3.181 1.00 0.00 H new ATOM 0 HB2 SER A 12 3.466 11.941 1.202 1.00 0.00 H new ATOM 0 HB3 SER A 12 5.116 11.900 0.612 1.00 0.00 H new ATOM 0 HG SER A 12 3.885 10.051 -0.095 1.00 0.00 H new ATOM 202 N GLU A 13 7.183 10.543 2.981 1.00 0.00 N ATOM 203 CA GLU A 13 8.672 10.656 2.990 1.00 0.00 C ATOM 204 C GLU A 13 9.278 9.281 3.273 1.00 0.00 C ATOM 205 O GLU A 13 9.985 9.082 4.244 1.00 0.00 O ATOM 206 CB GLU A 13 9.107 11.651 4.071 1.00 0.00 C ATOM 207 CG GLU A 13 10.465 12.248 3.698 1.00 0.00 C ATOM 208 CD GLU A 13 10.738 13.478 4.564 1.00 0.00 C ATOM 209 OE1 GLU A 13 9.840 14.293 4.701 1.00 0.00 O ATOM 210 OE2 GLU A 13 11.840 13.585 5.076 1.00 0.00 O ATOM 0 H GLU A 13 6.820 9.616 3.203 1.00 0.00 H new ATOM 0 HA GLU A 13 9.019 11.013 2.020 1.00 0.00 H new ATOM 0 HB2 GLU A 13 8.365 12.443 4.171 1.00 0.00 H new ATOM 0 HB3 GLU A 13 9.171 11.150 5.037 1.00 0.00 H new ATOM 0 HG2 GLU A 13 11.251 11.507 3.842 1.00 0.00 H new ATOM 0 HG3 GLU A 13 10.476 12.523 2.643 1.00 0.00 H new ATOM 217 N ASN A 14 8.986 8.329 2.430 1.00 0.00 N ATOM 218 CA ASN A 14 9.517 6.948 2.633 1.00 0.00 C ATOM 219 C ASN A 14 10.174 6.408 1.348 1.00 0.00 C ATOM 220 O ASN A 14 10.905 5.444 1.400 1.00 0.00 O ATOM 221 CB ASN A 14 8.362 6.028 3.025 1.00 0.00 C ATOM 222 CG ASN A 14 8.302 5.891 4.549 1.00 0.00 C ATOM 223 OD1 ASN A 14 9.198 5.341 5.156 1.00 0.00 O ATOM 224 ND2 ASN A 14 7.275 6.371 5.195 1.00 0.00 N ATOM 0 H ASN A 14 8.399 8.448 1.604 1.00 0.00 H new ATOM 0 HA ASN A 14 10.272 6.979 3.419 1.00 0.00 H new ATOM 0 HB2 ASN A 14 7.421 6.430 2.650 1.00 0.00 H new ATOM 0 HB3 ASN A 14 8.495 5.048 2.568 1.00 0.00 H new ATOM 0 HD21 ASN A 14 7.225 6.284 6.210 1.00 0.00 H new ATOM 0 HD22 ASN A 14 6.522 6.833 4.685 1.00 0.00 H new ATOM 231 N PHE A 15 9.905 7.002 0.201 1.00 0.00 N ATOM 232 CA PHE A 15 10.487 6.507 -1.095 1.00 0.00 C ATOM 233 C PHE A 15 12.006 6.232 -0.961 1.00 0.00 C ATOM 234 O PHE A 15 12.482 5.164 -1.313 1.00 0.00 O ATOM 235 CB PHE A 15 10.187 7.563 -2.207 1.00 0.00 C ATOM 236 CG PHE A 15 11.357 7.702 -3.165 1.00 0.00 C ATOM 237 CD1 PHE A 15 11.743 6.610 -3.946 1.00 0.00 C ATOM 238 CD2 PHE A 15 12.087 8.895 -3.217 1.00 0.00 C ATOM 239 CE1 PHE A 15 12.852 6.713 -4.784 1.00 0.00 C ATOM 240 CE2 PHE A 15 13.206 8.992 -4.046 1.00 0.00 C ATOM 241 CZ PHE A 15 13.588 7.900 -4.828 1.00 0.00 C ATOM 0 H PHE A 15 9.300 7.818 0.109 1.00 0.00 H new ATOM 0 HA PHE A 15 10.026 5.557 -1.366 1.00 0.00 H new ATOM 0 HB2 PHE A 15 9.295 7.269 -2.760 1.00 0.00 H new ATOM 0 HB3 PHE A 15 9.974 8.528 -1.747 1.00 0.00 H new ATOM 0 HD1 PHE A 15 11.183 5.688 -3.901 1.00 0.00 H new ATOM 0 HD2 PHE A 15 11.785 9.740 -2.616 1.00 0.00 H new ATOM 0 HE1 PHE A 15 13.143 5.875 -5.400 1.00 0.00 H new ATOM 0 HE2 PHE A 15 13.775 9.909 -4.082 1.00 0.00 H new ATOM 0 HZ PHE A 15 14.455 7.973 -5.468 1.00 0.00 H new ATOM 251 N GLU A 16 12.764 7.184 -0.492 1.00 0.00 N ATOM 252 CA GLU A 16 14.231 6.959 -0.375 1.00 0.00 C ATOM 253 C GLU A 16 14.480 5.926 0.717 1.00 0.00 C ATOM 254 O GLU A 16 15.354 5.092 0.599 1.00 0.00 O ATOM 255 CB GLU A 16 14.938 8.280 -0.038 1.00 0.00 C ATOM 256 CG GLU A 16 16.448 8.052 0.102 1.00 0.00 C ATOM 257 CD GLU A 16 17.095 9.289 0.727 1.00 0.00 C ATOM 258 OE1 GLU A 16 16.482 9.875 1.605 1.00 0.00 O ATOM 259 OE2 GLU A 16 18.193 9.630 0.318 1.00 0.00 O ATOM 0 H GLU A 16 12.435 8.100 -0.187 1.00 0.00 H new ATOM 0 HA GLU A 16 14.630 6.591 -1.321 1.00 0.00 H new ATOM 0 HB2 GLU A 16 14.745 9.014 -0.820 1.00 0.00 H new ATOM 0 HB3 GLU A 16 14.537 8.689 0.889 1.00 0.00 H new ATOM 0 HG2 GLU A 16 16.638 7.176 0.722 1.00 0.00 H new ATOM 0 HG3 GLU A 16 16.889 7.852 -0.875 1.00 0.00 H new ATOM 266 N GLU A 17 13.693 5.952 1.763 1.00 0.00 N ATOM 267 CA GLU A 17 13.854 4.939 2.850 1.00 0.00 C ATOM 268 C GLU A 17 13.664 3.534 2.251 1.00 0.00 C ATOM 269 O GLU A 17 14.118 2.548 2.796 1.00 0.00 O ATOM 270 CB GLU A 17 12.795 5.187 3.929 1.00 0.00 C ATOM 271 CG GLU A 17 13.405 4.971 5.318 1.00 0.00 C ATOM 272 CD GLU A 17 12.917 6.065 6.271 1.00 0.00 C ATOM 273 OE1 GLU A 17 11.714 6.183 6.440 1.00 0.00 O ATOM 274 OE2 GLU A 17 13.754 6.767 6.815 1.00 0.00 O ATOM 0 H GLU A 17 12.946 6.631 1.911 1.00 0.00 H new ATOM 0 HA GLU A 17 14.847 5.018 3.294 1.00 0.00 H new ATOM 0 HB2 GLU A 17 12.409 6.203 3.846 1.00 0.00 H new ATOM 0 HB3 GLU A 17 11.951 4.513 3.784 1.00 0.00 H new ATOM 0 HG2 GLU A 17 13.124 3.990 5.701 1.00 0.00 H new ATOM 0 HG3 GLU A 17 14.493 4.989 5.255 1.00 0.00 H new ATOM 281 N LEU A 18 13.000 3.452 1.119 1.00 0.00 N ATOM 282 CA LEU A 18 12.774 2.145 0.458 1.00 0.00 C ATOM 283 C LEU A 18 14.064 1.667 -0.161 1.00 0.00 C ATOM 284 O LEU A 18 14.444 0.525 -0.020 1.00 0.00 O ATOM 285 CB LEU A 18 11.749 2.303 -0.670 1.00 0.00 C ATOM 286 CG LEU A 18 10.537 3.156 -0.274 1.00 0.00 C ATOM 287 CD1 LEU A 18 9.418 2.867 -1.259 1.00 0.00 C ATOM 288 CD2 LEU A 18 10.028 2.858 1.136 1.00 0.00 C ATOM 0 H LEU A 18 12.604 4.253 0.627 1.00 0.00 H new ATOM 0 HA LEU A 18 12.414 1.435 1.202 1.00 0.00 H new ATOM 0 HB2 LEU A 18 12.236 2.756 -1.534 1.00 0.00 H new ATOM 0 HB3 LEU A 18 11.404 1.316 -0.979 1.00 0.00 H new ATOM 0 HG LEU A 18 10.848 4.201 -0.291 1.00 0.00 H new ATOM 0 HD11 LEU A 18 8.542 3.462 -1.000 1.00 0.00 H new ATOM 0 HD12 LEU A 18 9.745 3.123 -2.267 1.00 0.00 H new ATOM 0 HD13 LEU A 18 9.162 1.808 -1.219 1.00 0.00 H new ATOM 0 HD21 LEU A 18 9.170 3.494 1.355 1.00 0.00 H new ATOM 0 HD22 LEU A 18 9.730 1.812 1.202 1.00 0.00 H new ATOM 0 HD23 LEU A 18 10.820 3.056 1.858 1.00 0.00 H new ATOM 300 N LEU A 19 14.729 2.534 -0.860 1.00 0.00 N ATOM 301 CA LEU A 19 16.001 2.131 -1.506 1.00 0.00 C ATOM 302 C LEU A 19 17.141 2.160 -0.477 1.00 0.00 C ATOM 303 O LEU A 19 18.245 1.730 -0.750 1.00 0.00 O ATOM 304 CB LEU A 19 16.331 3.076 -2.669 1.00 0.00 C ATOM 305 CG LEU A 19 15.129 3.283 -3.627 1.00 0.00 C ATOM 306 CD1 LEU A 19 14.179 2.071 -3.668 1.00 0.00 C ATOM 307 CD2 LEU A 19 14.352 4.529 -3.199 1.00 0.00 C ATOM 0 H LEU A 19 14.448 3.503 -1.012 1.00 0.00 H new ATOM 0 HA LEU A 19 15.890 1.119 -1.894 1.00 0.00 H new ATOM 0 HB2 LEU A 19 16.644 4.041 -2.271 1.00 0.00 H new ATOM 0 HB3 LEU A 19 17.174 2.674 -3.231 1.00 0.00 H new ATOM 0 HG LEU A 19 15.533 3.405 -4.632 1.00 0.00 H new ATOM 0 HD11 LEU A 19 13.358 2.275 -4.355 1.00 0.00 H new ATOM 0 HD12 LEU A 19 14.726 1.191 -4.007 1.00 0.00 H new ATOM 0 HD13 LEU A 19 13.780 1.888 -2.670 1.00 0.00 H new ATOM 0 HD21 LEU A 19 13.506 4.678 -3.870 1.00 0.00 H new ATOM 0 HD22 LEU A 19 13.988 4.399 -2.180 1.00 0.00 H new ATOM 0 HD23 LEU A 19 15.007 5.399 -3.242 1.00 0.00 H new ATOM 319 N LYS A 20 16.874 2.661 0.703 1.00 0.00 N ATOM 320 CA LYS A 20 17.909 2.727 1.761 1.00 0.00 C ATOM 321 C LYS A 20 17.821 1.480 2.643 1.00 0.00 C ATOM 322 O LYS A 20 18.772 1.104 3.302 1.00 0.00 O ATOM 323 CB LYS A 20 17.632 3.960 2.617 1.00 0.00 C ATOM 324 CG LYS A 20 18.396 5.154 2.051 1.00 0.00 C ATOM 325 CD LYS A 20 18.536 6.231 3.129 1.00 0.00 C ATOM 326 CE LYS A 20 19.551 5.779 4.182 1.00 0.00 C ATOM 327 NZ LYS A 20 19.060 6.158 5.538 1.00 0.00 N ATOM 0 H LYS A 20 15.964 3.032 0.975 1.00 0.00 H new ATOM 0 HA LYS A 20 18.901 2.782 1.313 1.00 0.00 H new ATOM 0 HB2 LYS A 20 16.563 4.173 2.632 1.00 0.00 H new ATOM 0 HB3 LYS A 20 17.935 3.776 3.648 1.00 0.00 H new ATOM 0 HG2 LYS A 20 19.381 4.839 1.708 1.00 0.00 H new ATOM 0 HG3 LYS A 20 17.871 5.558 1.185 1.00 0.00 H new ATOM 0 HD2 LYS A 20 18.858 7.170 2.679 1.00 0.00 H new ATOM 0 HD3 LYS A 20 17.570 6.418 3.598 1.00 0.00 H new ATOM 0 HE2 LYS A 20 19.696 4.700 4.124 1.00 0.00 H new ATOM 0 HE3 LYS A 20 20.520 6.241 3.992 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 19.749 5.852 6.255 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 18.943 7.190 5.589 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 18.145 5.697 5.717 1.00 0.00 H new ATOM 341 N VAL A 21 16.674 0.853 2.673 1.00 0.00 N ATOM 342 CA VAL A 21 16.490 -0.350 3.520 1.00 0.00 C ATOM 343 C VAL A 21 16.615 -1.615 2.678 1.00 0.00 C ATOM 344 O VAL A 21 17.138 -2.615 3.136 1.00 0.00 O ATOM 345 CB VAL A 21 15.117 -0.279 4.178 1.00 0.00 C ATOM 346 CG1 VAL A 21 15.060 0.958 5.071 1.00 0.00 C ATOM 347 CG2 VAL A 21 14.022 -0.190 3.111 1.00 0.00 C ATOM 0 H VAL A 21 15.851 1.131 2.139 1.00 0.00 H new ATOM 0 HA VAL A 21 17.262 -0.381 4.289 1.00 0.00 H new ATOM 0 HB VAL A 21 14.955 -1.178 4.773 1.00 0.00 H new ATOM 0 HG11 VAL A 21 14.081 1.018 5.547 1.00 0.00 H new ATOM 0 HG12 VAL A 21 15.832 0.890 5.837 1.00 0.00 H new ATOM 0 HG13 VAL A 21 15.226 1.850 4.467 1.00 0.00 H new ATOM 0 HG21 VAL A 21 13.046 -0.140 3.594 1.00 0.00 H new ATOM 0 HG22 VAL A 21 14.174 0.705 2.507 1.00 0.00 H new ATOM 0 HG23 VAL A 21 14.065 -1.071 2.471 1.00 0.00 H new ATOM 357 N LEU A 22 16.185 -1.576 1.440 1.00 0.00 N ATOM 358 CA LEU A 22 16.335 -2.776 0.568 1.00 0.00 C ATOM 359 C LEU A 22 17.832 -3.061 0.405 1.00 0.00 C ATOM 360 O LEU A 22 18.236 -4.159 0.074 1.00 0.00 O ATOM 361 CB LEU A 22 15.676 -2.531 -0.807 1.00 0.00 C ATOM 362 CG LEU A 22 16.238 -1.306 -1.527 1.00 0.00 C ATOM 363 CD1 LEU A 22 17.649 -1.575 -2.069 1.00 0.00 C ATOM 364 CD2 LEU A 22 15.306 -1.006 -2.702 1.00 0.00 C ATOM 0 H LEU A 22 15.740 -0.770 1.001 1.00 0.00 H new ATOM 0 HA LEU A 22 15.839 -3.634 1.022 1.00 0.00 H new ATOM 0 HB2 LEU A 22 15.818 -3.411 -1.434 1.00 0.00 H new ATOM 0 HB3 LEU A 22 14.602 -2.406 -0.672 1.00 0.00 H new ATOM 0 HG LEU A 22 16.300 -0.470 -0.831 1.00 0.00 H new ATOM 0 HD11 LEU A 22 18.020 -0.684 -2.576 1.00 0.00 H new ATOM 0 HD12 LEU A 22 18.314 -1.826 -1.243 1.00 0.00 H new ATOM 0 HD13 LEU A 22 17.616 -2.406 -2.774 1.00 0.00 H new ATOM 0 HD21 LEU A 22 15.673 -0.135 -3.244 1.00 0.00 H new ATOM 0 HD22 LEU A 22 15.277 -1.865 -3.372 1.00 0.00 H new ATOM 0 HD23 LEU A 22 14.302 -0.804 -2.328 1.00 0.00 H new ATOM 376 N GLY A 23 18.656 -2.060 0.640 1.00 0.00 N ATOM 377 CA GLY A 23 20.115 -2.241 0.506 1.00 0.00 C ATOM 378 C GLY A 23 20.668 -1.180 -0.424 1.00 0.00 C ATOM 379 O GLY A 23 20.922 -1.440 -1.585 1.00 0.00 O ATOM 0 H GLY A 23 18.363 -1.124 0.920 1.00 0.00 H new ATOM 0 HA2 GLY A 23 20.593 -2.170 1.483 1.00 0.00 H new ATOM 0 HA3 GLY A 23 20.335 -3.234 0.115 1.00 0.00 H new ATOM 383 N VAL A 24 20.853 0.018 0.074 1.00 0.00 N ATOM 384 CA VAL A 24 21.397 1.124 -0.781 1.00 0.00 C ATOM 385 C VAL A 24 22.642 0.629 -1.552 1.00 0.00 C ATOM 386 O VAL A 24 23.430 -0.152 -1.053 1.00 0.00 O ATOM 387 CB VAL A 24 21.705 2.354 0.123 1.00 0.00 C ATOM 388 CG1 VAL A 24 23.215 2.639 0.257 1.00 0.00 C ATOM 389 CG2 VAL A 24 21.028 3.594 -0.469 1.00 0.00 C ATOM 0 H VAL A 24 20.651 0.280 1.039 1.00 0.00 H new ATOM 0 HA VAL A 24 20.664 1.430 -1.527 1.00 0.00 H new ATOM 0 HB VAL A 24 21.322 2.123 1.117 1.00 0.00 H new ATOM 0 HG11 VAL A 24 23.366 3.507 0.899 1.00 0.00 H new ATOM 0 HG12 VAL A 24 23.711 1.773 0.695 1.00 0.00 H new ATOM 0 HG13 VAL A 24 23.636 2.838 -0.728 1.00 0.00 H new ATOM 0 HG21 VAL A 24 21.240 4.459 0.159 1.00 0.00 H new ATOM 0 HG22 VAL A 24 21.411 3.773 -1.474 1.00 0.00 H new ATOM 0 HG23 VAL A 24 19.951 3.434 -0.515 1.00 0.00 H new ATOM 399 N ASN A 25 22.794 1.078 -2.760 1.00 0.00 N ATOM 400 CA ASN A 25 23.949 0.656 -3.601 1.00 0.00 C ATOM 401 C ASN A 25 23.794 1.359 -4.937 1.00 0.00 C ATOM 402 O ASN A 25 23.393 0.770 -5.919 1.00 0.00 O ATOM 403 CB ASN A 25 23.931 -0.865 -3.799 1.00 0.00 C ATOM 404 CG ASN A 25 25.366 -1.382 -3.910 1.00 0.00 C ATOM 405 OD1 ASN A 25 26.285 -0.774 -3.398 1.00 0.00 O ATOM 406 ND2 ASN A 25 25.599 -2.488 -4.562 1.00 0.00 N ATOM 0 H ASN A 25 22.156 1.733 -3.212 1.00 0.00 H new ATOM 0 HA ASN A 25 24.895 0.917 -3.127 1.00 0.00 H new ATOM 0 HB2 ASN A 25 23.424 -1.345 -2.962 1.00 0.00 H new ATOM 0 HB3 ASN A 25 23.371 -1.119 -4.699 1.00 0.00 H new ATOM 0 HD21 ASN A 25 26.552 -2.842 -4.642 1.00 0.00 H new ATOM 0 HD22 ASN A 25 24.828 -2.999 -4.992 1.00 0.00 H new ATOM 413 N VAL A 26 24.058 2.643 -4.936 1.00 0.00 N ATOM 414 CA VAL A 26 23.899 3.507 -6.148 1.00 0.00 C ATOM 415 C VAL A 26 22.453 4.003 -6.236 1.00 0.00 C ATOM 416 O VAL A 26 22.159 4.909 -6.994 1.00 0.00 O ATOM 417 CB VAL A 26 24.279 2.789 -7.453 1.00 0.00 C ATOM 418 CG1 VAL A 26 24.275 3.802 -8.596 1.00 0.00 C ATOM 419 CG2 VAL A 26 25.674 2.175 -7.315 1.00 0.00 C ATOM 0 H VAL A 26 24.390 3.146 -4.113 1.00 0.00 H new ATOM 0 HA VAL A 26 24.587 4.345 -6.035 1.00 0.00 H new ATOM 0 HB VAL A 26 23.560 1.997 -7.660 1.00 0.00 H new ATOM 0 HG11 VAL A 26 24.544 3.302 -9.526 1.00 0.00 H new ATOM 0 HG12 VAL A 26 23.281 4.238 -8.692 1.00 0.00 H new ATOM 0 HG13 VAL A 26 24.998 4.590 -8.386 1.00 0.00 H new ATOM 0 HG21 VAL A 26 25.941 1.667 -8.241 1.00 0.00 H new ATOM 0 HG22 VAL A 26 26.400 2.962 -7.111 1.00 0.00 H new ATOM 0 HG23 VAL A 26 25.676 1.458 -6.494 1.00 0.00 H new ATOM 429 N MET A 27 21.547 3.461 -5.440 1.00 0.00 N ATOM 430 CA MET A 27 20.148 3.957 -5.464 1.00 0.00 C ATOM 431 C MET A 27 20.200 5.388 -4.939 1.00 0.00 C ATOM 432 O MET A 27 19.983 6.334 -5.671 1.00 0.00 O ATOM 433 CB MET A 27 19.258 3.096 -4.549 1.00 0.00 C ATOM 434 CG MET A 27 19.519 1.590 -4.767 1.00 0.00 C ATOM 435 SD MET A 27 18.157 0.855 -5.711 1.00 0.00 S ATOM 436 CE MET A 27 18.771 1.278 -7.360 1.00 0.00 C ATOM 0 H MET A 27 21.728 2.702 -4.783 1.00 0.00 H new ATOM 0 HA MET A 27 19.729 3.910 -6.469 1.00 0.00 H new ATOM 0 HB2 MET A 27 19.448 3.353 -3.507 1.00 0.00 H new ATOM 0 HB3 MET A 27 18.209 3.318 -4.746 1.00 0.00 H new ATOM 0 HG2 MET A 27 20.459 1.449 -5.300 1.00 0.00 H new ATOM 0 HG3 MET A 27 19.619 1.087 -3.805 1.00 0.00 H new ATOM 0 HE1 MET A 27 18.657 0.420 -8.022 1.00 0.00 H new ATOM 0 HE2 MET A 27 18.202 2.120 -7.755 1.00 0.00 H new ATOM 0 HE3 MET A 27 19.825 1.550 -7.297 1.00 0.00 H new ATOM 446 N LEU A 28 20.554 5.550 -3.679 1.00 0.00 N ATOM 447 CA LEU A 28 20.694 6.915 -3.082 1.00 0.00 C ATOM 448 C LEU A 28 19.498 7.796 -3.463 1.00 0.00 C ATOM 449 O LEU A 28 19.623 8.733 -4.231 1.00 0.00 O ATOM 450 CB LEU A 28 22.002 7.523 -3.605 1.00 0.00 C ATOM 451 CG LEU A 28 23.081 7.513 -2.510 1.00 0.00 C ATOM 452 CD1 LEU A 28 22.609 8.327 -1.302 1.00 0.00 C ATOM 453 CD2 LEU A 28 23.363 6.072 -2.074 1.00 0.00 C ATOM 0 H LEU A 28 20.753 4.783 -3.037 1.00 0.00 H new ATOM 0 HA LEU A 28 20.717 6.851 -1.994 1.00 0.00 H new ATOM 0 HB2 LEU A 28 22.350 6.960 -4.471 1.00 0.00 H new ATOM 0 HB3 LEU A 28 21.826 8.545 -3.940 1.00 0.00 H new ATOM 0 HG LEU A 28 23.993 7.958 -2.909 1.00 0.00 H new ATOM 0 HD11 LEU A 28 23.380 8.314 -0.531 1.00 0.00 H new ATOM 0 HD12 LEU A 28 22.419 9.356 -1.608 1.00 0.00 H new ATOM 0 HD13 LEU A 28 21.692 7.891 -0.905 1.00 0.00 H new ATOM 0 HD21 LEU A 28 24.128 6.070 -1.298 1.00 0.00 H new ATOM 0 HD22 LEU A 28 22.449 5.625 -1.684 1.00 0.00 H new ATOM 0 HD23 LEU A 28 23.713 5.495 -2.930 1.00 0.00 H new ATOM 465 N ARG A 29 18.332 7.477 -2.955 1.00 0.00 N ATOM 466 CA ARG A 29 17.113 8.265 -3.310 1.00 0.00 C ATOM 467 C ARG A 29 16.905 8.209 -4.831 1.00 0.00 C ATOM 468 O ARG A 29 16.301 9.088 -5.413 1.00 0.00 O ATOM 469 CB ARG A 29 17.294 9.719 -2.864 1.00 0.00 C ATOM 470 CG ARG A 29 15.932 10.411 -2.808 1.00 0.00 C ATOM 471 CD ARG A 29 15.908 11.410 -1.648 1.00 0.00 C ATOM 472 NE ARG A 29 16.227 12.773 -2.158 1.00 0.00 N ATOM 473 CZ ARG A 29 16.141 13.802 -1.360 1.00 0.00 C ATOM 474 NH1 ARG A 29 14.981 14.353 -1.128 1.00 0.00 N ATOM 475 NH2 ARG A 29 17.216 14.280 -0.793 1.00 0.00 N ATOM 0 H ARG A 29 18.173 6.704 -2.309 1.00 0.00 H new ATOM 0 HA ARG A 29 16.242 7.845 -2.807 1.00 0.00 H new ATOM 0 HB2 ARG A 29 17.771 9.753 -1.885 1.00 0.00 H new ATOM 0 HB3 ARG A 29 17.952 10.244 -3.557 1.00 0.00 H new ATOM 0 HG2 ARG A 29 15.736 10.926 -3.748 1.00 0.00 H new ATOM 0 HG3 ARG A 29 15.142 9.671 -2.680 1.00 0.00 H new ATOM 0 HD2 ARG A 29 14.927 11.408 -1.173 1.00 0.00 H new ATOM 0 HD3 ARG A 29 16.631 11.117 -0.887 1.00 0.00 H new ATOM 0 HE ARG A 29 16.512 12.902 -3.129 1.00 0.00 H new ATOM 0 HH11 ARG A 29 14.141 13.979 -1.570 1.00 0.00 H new ATOM 0 HH12 ARG A 29 14.914 15.157 -0.504 1.00 0.00 H new ATOM 0 HH21 ARG A 29 18.123 13.849 -0.974 1.00 0.00 H new ATOM 0 HH22 ARG A 29 17.149 15.084 -0.169 1.00 0.00 H new ATOM 489 N LYS A 30 17.421 7.168 -5.465 1.00 0.00 N ATOM 490 CA LYS A 30 17.303 6.977 -6.953 1.00 0.00 C ATOM 491 C LYS A 30 17.416 8.299 -7.729 1.00 0.00 C ATOM 492 O LYS A 30 16.862 8.421 -8.802 1.00 0.00 O ATOM 493 CB LYS A 30 15.970 6.295 -7.268 1.00 0.00 C ATOM 494 CG LYS A 30 16.194 4.790 -7.456 1.00 0.00 C ATOM 495 CD LYS A 30 14.906 4.142 -7.969 1.00 0.00 C ATOM 496 CE LYS A 30 15.255 2.989 -8.913 1.00 0.00 C ATOM 497 NZ LYS A 30 14.060 2.636 -9.730 1.00 0.00 N ATOM 0 H LYS A 30 17.934 6.423 -4.993 1.00 0.00 H new ATOM 0 HA LYS A 30 18.135 6.351 -7.275 1.00 0.00 H new ATOM 0 HB2 LYS A 30 15.261 6.469 -6.459 1.00 0.00 H new ATOM 0 HB3 LYS A 30 15.535 6.724 -8.171 1.00 0.00 H new ATOM 0 HG2 LYS A 30 17.006 4.618 -8.162 1.00 0.00 H new ATOM 0 HG3 LYS A 30 16.491 4.335 -6.511 1.00 0.00 H new ATOM 0 HD2 LYS A 30 14.313 3.774 -7.132 1.00 0.00 H new ATOM 0 HD3 LYS A 30 14.297 4.881 -8.490 1.00 0.00 H new ATOM 0 HE2 LYS A 30 16.082 3.275 -9.563 1.00 0.00 H new ATOM 0 HE3 LYS A 30 15.585 2.123 -8.340 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 14.297 1.853 -10.371 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 13.283 2.346 -9.102 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 13.764 3.463 -10.288 1.00 0.00 H new ATOM 511 N ILE A 31 18.157 9.262 -7.189 1.00 0.00 N ATOM 512 CA ILE A 31 18.385 10.615 -7.836 1.00 0.00 C ATOM 513 C ILE A 31 17.372 10.933 -8.956 1.00 0.00 C ATOM 514 O ILE A 31 17.742 11.210 -10.082 1.00 0.00 O ATOM 515 CB ILE A 31 19.809 10.644 -8.396 1.00 0.00 C ATOM 516 CG1 ILE A 31 20.808 10.230 -7.295 1.00 0.00 C ATOM 517 CG2 ILE A 31 20.143 12.052 -8.903 1.00 0.00 C ATOM 518 CD1 ILE A 31 20.728 11.198 -6.107 1.00 0.00 C ATOM 0 H ILE A 31 18.630 9.158 -6.291 1.00 0.00 H new ATOM 0 HA ILE A 31 18.243 11.380 -7.073 1.00 0.00 H new ATOM 0 HB ILE A 31 19.882 9.943 -9.228 1.00 0.00 H new ATOM 0 HG12 ILE A 31 20.590 9.216 -6.961 1.00 0.00 H new ATOM 0 HG13 ILE A 31 21.821 10.222 -7.698 1.00 0.00 H new ATOM 0 HG21 ILE A 31 21.158 12.064 -9.300 1.00 0.00 H new ATOM 0 HG22 ILE A 31 19.442 12.331 -9.690 1.00 0.00 H new ATOM 0 HG23 ILE A 31 20.066 12.763 -8.080 1.00 0.00 H new ATOM 0 HD11 ILE A 31 21.439 10.892 -5.340 1.00 0.00 H new ATOM 0 HD12 ILE A 31 20.969 12.207 -6.443 1.00 0.00 H new ATOM 0 HD13 ILE A 31 19.719 11.184 -5.694 1.00 0.00 H new ATOM 530 N ALA A 32 16.097 10.881 -8.648 1.00 0.00 N ATOM 531 CA ALA A 32 15.055 11.166 -9.685 1.00 0.00 C ATOM 532 C ALA A 32 13.648 11.019 -9.088 1.00 0.00 C ATOM 533 O ALA A 32 12.733 11.721 -9.478 1.00 0.00 O ATOM 534 CB ALA A 32 15.205 10.183 -10.851 1.00 0.00 C ATOM 0 H ALA A 32 15.734 10.653 -7.723 1.00 0.00 H new ATOM 0 HA ALA A 32 15.190 12.188 -10.038 1.00 0.00 H new ATOM 0 HB1 ALA A 32 14.445 10.393 -11.604 1.00 0.00 H new ATOM 0 HB2 ALA A 32 16.195 10.292 -11.294 1.00 0.00 H new ATOM 0 HB3 ALA A 32 15.082 9.164 -10.486 1.00 0.00 H new ATOM 540 N VAL A 33 13.461 10.116 -8.150 1.00 0.00 N ATOM 541 CA VAL A 33 12.094 9.939 -7.541 1.00 0.00 C ATOM 542 C VAL A 33 11.992 10.764 -6.251 1.00 0.00 C ATOM 543 O VAL A 33 11.262 10.413 -5.343 1.00 0.00 O ATOM 544 CB VAL A 33 11.763 8.446 -7.228 1.00 0.00 C ATOM 545 CG1 VAL A 33 10.470 8.049 -7.942 1.00 0.00 C ATOM 546 CG2 VAL A 33 12.880 7.482 -7.681 1.00 0.00 C ATOM 0 H VAL A 33 14.185 9.499 -7.781 1.00 0.00 H new ATOM 0 HA VAL A 33 11.368 10.287 -8.276 1.00 0.00 H new ATOM 0 HB VAL A 33 11.661 8.365 -6.146 1.00 0.00 H new ATOM 0 HG11 VAL A 33 10.239 7.006 -7.723 1.00 0.00 H new ATOM 0 HG12 VAL A 33 9.653 8.682 -7.595 1.00 0.00 H new ATOM 0 HG13 VAL A 33 10.595 8.175 -9.017 1.00 0.00 H new ATOM 0 HG21 VAL A 33 12.597 6.458 -7.439 1.00 0.00 H new ATOM 0 HG22 VAL A 33 13.025 7.573 -8.757 1.00 0.00 H new ATOM 0 HG23 VAL A 33 13.808 7.733 -7.167 1.00 0.00 H new ATOM 556 N ALA A 34 12.701 11.863 -6.171 1.00 0.00 N ATOM 557 CA ALA A 34 12.633 12.717 -4.949 1.00 0.00 C ATOM 558 C ALA A 34 12.472 14.183 -5.361 1.00 0.00 C ATOM 559 O ALA A 34 12.918 15.081 -4.671 1.00 0.00 O ATOM 560 CB ALA A 34 13.920 12.555 -4.140 1.00 0.00 C ATOM 0 H ALA A 34 13.325 12.205 -6.902 1.00 0.00 H new ATOM 0 HA ALA A 34 11.781 12.413 -4.341 1.00 0.00 H new ATOM 0 HB1 ALA A 34 13.870 13.179 -3.248 1.00 0.00 H new ATOM 0 HB2 ALA A 34 14.037 11.512 -3.847 1.00 0.00 H new ATOM 0 HB3 ALA A 34 14.772 12.859 -4.748 1.00 0.00 H new ATOM 566 N ALA A 35 11.839 14.428 -6.481 1.00 0.00 N ATOM 567 CA ALA A 35 11.646 15.833 -6.946 1.00 0.00 C ATOM 568 C ALA A 35 10.192 16.252 -6.717 1.00 0.00 C ATOM 569 O ALA A 35 9.914 17.172 -5.971 1.00 0.00 O ATOM 570 CB ALA A 35 11.974 15.926 -8.438 1.00 0.00 C ATOM 0 H ALA A 35 11.447 13.713 -7.094 1.00 0.00 H new ATOM 0 HA ALA A 35 12.307 16.494 -6.386 1.00 0.00 H new ATOM 0 HB1 ALA A 35 11.833 16.952 -8.778 1.00 0.00 H new ATOM 0 HB2 ALA A 35 13.010 15.628 -8.602 1.00 0.00 H new ATOM 0 HB3 ALA A 35 11.313 15.264 -8.998 1.00 0.00 H new ATOM 576 N ALA A 36 9.265 15.582 -7.354 1.00 0.00 N ATOM 577 CA ALA A 36 7.825 15.935 -7.179 1.00 0.00 C ATOM 578 C ALA A 36 6.960 14.701 -7.441 1.00 0.00 C ATOM 579 O ALA A 36 7.234 13.919 -8.332 1.00 0.00 O ATOM 580 CB ALA A 36 7.447 17.040 -8.167 1.00 0.00 C ATOM 0 H ALA A 36 9.445 14.804 -7.989 1.00 0.00 H new ATOM 0 HA ALA A 36 7.659 16.285 -6.160 1.00 0.00 H new ATOM 0 HB1 ALA A 36 6.396 17.298 -8.040 1.00 0.00 H new ATOM 0 HB2 ALA A 36 8.062 17.921 -7.981 1.00 0.00 H new ATOM 0 HB3 ALA A 36 7.614 16.690 -9.186 1.00 0.00 H new ATOM 586 N SER A 37 5.917 14.525 -6.671 1.00 0.00 N ATOM 587 CA SER A 37 5.024 13.345 -6.866 1.00 0.00 C ATOM 588 C SER A 37 3.627 13.671 -6.336 1.00 0.00 C ATOM 589 O SER A 37 3.466 14.492 -5.453 1.00 0.00 O ATOM 590 CB SER A 37 5.591 12.145 -6.106 1.00 0.00 C ATOM 591 OG SER A 37 6.692 11.609 -6.827 1.00 0.00 O ATOM 0 H SER A 37 5.645 15.151 -5.913 1.00 0.00 H new ATOM 0 HA SER A 37 4.963 13.106 -7.928 1.00 0.00 H new ATOM 0 HB2 SER A 37 5.908 12.449 -5.108 1.00 0.00 H new ATOM 0 HB3 SER A 37 4.821 11.384 -5.978 1.00 0.00 H new ATOM 0 HG SER A 37 6.963 12.239 -7.527 1.00 0.00 H new ATOM 597 N LYS A 38 2.617 13.032 -6.871 1.00 0.00 N ATOM 598 CA LYS A 38 1.225 13.298 -6.404 1.00 0.00 C ATOM 599 C LYS A 38 0.362 12.037 -6.616 1.00 0.00 C ATOM 600 O LYS A 38 -0.521 12.034 -7.454 1.00 0.00 O ATOM 601 CB LYS A 38 0.639 14.472 -7.197 1.00 0.00 C ATOM 602 CG LYS A 38 -0.725 14.850 -6.618 1.00 0.00 C ATOM 603 CD LYS A 38 -1.271 16.076 -7.353 1.00 0.00 C ATOM 604 CE LYS A 38 -2.515 16.593 -6.630 1.00 0.00 C ATOM 605 NZ LYS A 38 -3.341 17.397 -7.575 1.00 0.00 N ATOM 0 H LYS A 38 2.698 12.336 -7.613 1.00 0.00 H new ATOM 0 HA LYS A 38 1.235 13.550 -5.344 1.00 0.00 H new ATOM 0 HB2 LYS A 38 1.314 15.327 -7.153 1.00 0.00 H new ATOM 0 HB3 LYS A 38 0.537 14.200 -8.248 1.00 0.00 H new ATOM 0 HG2 LYS A 38 -1.418 14.015 -6.718 1.00 0.00 H new ATOM 0 HG3 LYS A 38 -0.633 15.063 -5.553 1.00 0.00 H new ATOM 0 HD2 LYS A 38 -0.511 16.856 -7.395 1.00 0.00 H new ATOM 0 HD3 LYS A 38 -1.518 15.816 -8.382 1.00 0.00 H new ATOM 0 HE2 LYS A 38 -3.097 15.757 -6.242 1.00 0.00 H new ATOM 0 HE3 LYS A 38 -2.224 17.203 -5.775 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 -4.187 17.749 -7.083 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 -2.784 18.202 -7.924 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 -3.629 16.801 -8.377 1.00 0.00 H new ATOM 619 N PRO A 39 0.633 10.991 -5.853 1.00 0.00 N ATOM 620 CA PRO A 39 -0.125 9.731 -5.963 1.00 0.00 C ATOM 621 C PRO A 39 -1.473 9.857 -5.248 1.00 0.00 C ATOM 622 O PRO A 39 -1.547 10.317 -4.124 1.00 0.00 O ATOM 623 CB PRO A 39 0.770 8.706 -5.259 1.00 0.00 C ATOM 624 CG PRO A 39 1.687 9.507 -4.305 1.00 0.00 C ATOM 625 CD PRO A 39 1.702 10.957 -4.822 1.00 0.00 C ATOM 0 HA PRO A 39 -0.349 9.455 -6.993 1.00 0.00 H new ATOM 0 HB2 PRO A 39 0.171 7.983 -4.705 1.00 0.00 H new ATOM 0 HB3 PRO A 39 1.360 8.144 -5.983 1.00 0.00 H new ATOM 0 HG2 PRO A 39 1.313 9.464 -3.282 1.00 0.00 H new ATOM 0 HG3 PRO A 39 2.694 9.089 -4.294 1.00 0.00 H new ATOM 0 HD2 PRO A 39 1.503 11.667 -4.020 1.00 0.00 H new ATOM 0 HD3 PRO A 39 2.672 11.218 -5.246 1.00 0.00 H new ATOM 633 N ALA A 40 -2.537 9.451 -5.893 1.00 0.00 N ATOM 634 CA ALA A 40 -3.885 9.544 -5.259 1.00 0.00 C ATOM 635 C ALA A 40 -4.522 8.154 -5.204 1.00 0.00 C ATOM 636 O ALA A 40 -3.947 7.181 -5.656 1.00 0.00 O ATOM 637 CB ALA A 40 -4.772 10.479 -6.084 1.00 0.00 C ATOM 0 H ALA A 40 -2.529 9.058 -6.834 1.00 0.00 H new ATOM 0 HA ALA A 40 -3.784 9.936 -4.247 1.00 0.00 H new ATOM 0 HB1 ALA A 40 -5.757 10.548 -5.622 1.00 0.00 H new ATOM 0 HB2 ALA A 40 -4.319 11.470 -6.123 1.00 0.00 H new ATOM 0 HB3 ALA A 40 -4.873 10.086 -7.096 1.00 0.00 H new ATOM 643 N VAL A 41 -5.706 8.057 -4.653 1.00 0.00 N ATOM 644 CA VAL A 41 -6.390 6.734 -4.564 1.00 0.00 C ATOM 645 C VAL A 41 -7.896 6.954 -4.390 1.00 0.00 C ATOM 646 O VAL A 41 -8.351 8.066 -4.194 1.00 0.00 O ATOM 647 CB VAL A 41 -5.803 5.935 -3.370 1.00 0.00 C ATOM 648 CG1 VAL A 41 -6.447 6.348 -2.041 1.00 0.00 C ATOM 649 CG2 VAL A 41 -6.020 4.432 -3.590 1.00 0.00 C ATOM 0 H VAL A 41 -6.228 8.840 -4.260 1.00 0.00 H new ATOM 0 HA VAL A 41 -6.228 6.162 -5.478 1.00 0.00 H new ATOM 0 HB VAL A 41 -4.737 6.157 -3.318 1.00 0.00 H new ATOM 0 HG11 VAL A 41 -6.010 5.767 -1.229 1.00 0.00 H new ATOM 0 HG12 VAL A 41 -6.269 7.409 -1.865 1.00 0.00 H new ATOM 0 HG13 VAL A 41 -7.520 6.162 -2.084 1.00 0.00 H new ATOM 0 HG21 VAL A 41 -5.605 3.877 -2.748 1.00 0.00 H new ATOM 0 HG22 VAL A 41 -7.087 4.226 -3.670 1.00 0.00 H new ATOM 0 HG23 VAL A 41 -5.521 4.123 -4.509 1.00 0.00 H new ATOM 659 N GLU A 42 -8.658 5.898 -4.425 1.00 0.00 N ATOM 660 CA GLU A 42 -10.125 6.033 -4.224 1.00 0.00 C ATOM 661 C GLU A 42 -10.677 4.721 -3.681 1.00 0.00 C ATOM 662 O GLU A 42 -10.683 3.711 -4.357 1.00 0.00 O ATOM 663 CB GLU A 42 -10.808 6.389 -5.541 1.00 0.00 C ATOM 664 CG GLU A 42 -10.452 5.345 -6.596 1.00 0.00 C ATOM 665 CD GLU A 42 -10.661 5.935 -7.992 1.00 0.00 C ATOM 666 OE1 GLU A 42 -9.772 6.625 -8.461 1.00 0.00 O ATOM 667 OE2 GLU A 42 -11.708 5.686 -8.568 1.00 0.00 O ATOM 0 H GLU A 42 -8.327 4.946 -4.584 1.00 0.00 H new ATOM 0 HA GLU A 42 -10.322 6.833 -3.510 1.00 0.00 H new ATOM 0 HB2 GLU A 42 -11.889 6.429 -5.404 1.00 0.00 H new ATOM 0 HB3 GLU A 42 -10.492 7.378 -5.871 1.00 0.00 H new ATOM 0 HG2 GLU A 42 -9.416 5.029 -6.475 1.00 0.00 H new ATOM 0 HG3 GLU A 42 -11.072 4.458 -6.468 1.00 0.00 H new ATOM 674 N ILE A 43 -11.127 4.732 -2.456 1.00 0.00 N ATOM 675 CA ILE A 43 -11.662 3.488 -1.845 1.00 0.00 C ATOM 676 C ILE A 43 -13.175 3.410 -2.035 1.00 0.00 C ATOM 677 O ILE A 43 -13.869 4.405 -2.103 1.00 0.00 O ATOM 678 CB ILE A 43 -11.321 3.464 -0.352 1.00 0.00 C ATOM 679 CG1 ILE A 43 -9.797 3.543 -0.172 1.00 0.00 C ATOM 680 CG2 ILE A 43 -11.853 2.175 0.292 1.00 0.00 C ATOM 681 CD1 ILE A 43 -9.121 2.331 -0.820 1.00 0.00 C ATOM 0 H ILE A 43 -11.146 5.554 -1.852 1.00 0.00 H new ATOM 0 HA ILE A 43 -11.206 2.628 -2.335 1.00 0.00 H new ATOM 0 HB ILE A 43 -11.790 4.320 0.134 1.00 0.00 H new ATOM 0 HG12 ILE A 43 -9.418 4.462 -0.620 1.00 0.00 H new ATOM 0 HG13 ILE A 43 -9.551 3.581 0.889 1.00 0.00 H new ATOM 0 HG21 ILE A 43 -11.605 2.169 1.353 1.00 0.00 H new ATOM 0 HG22 ILE A 43 -12.935 2.128 0.172 1.00 0.00 H new ATOM 0 HG23 ILE A 43 -11.397 1.311 -0.192 1.00 0.00 H new ATOM 0 HD11 ILE A 43 -8.042 2.401 -0.685 1.00 0.00 H new ATOM 0 HD12 ILE A 43 -9.487 1.417 -0.352 1.00 0.00 H new ATOM 0 HD13 ILE A 43 -9.352 2.312 -1.885 1.00 0.00 H new ATOM 693 N LYS A 44 -13.669 2.212 -2.110 1.00 0.00 N ATOM 694 CA LYS A 44 -15.124 1.978 -2.288 1.00 0.00 C ATOM 695 C LYS A 44 -15.440 0.677 -1.559 1.00 0.00 C ATOM 696 O LYS A 44 -14.976 -0.374 -1.948 1.00 0.00 O ATOM 697 CB LYS A 44 -15.418 1.842 -3.786 1.00 0.00 C ATOM 698 CG LYS A 44 -14.847 3.055 -4.526 1.00 0.00 C ATOM 699 CD LYS A 44 -15.519 3.198 -5.889 1.00 0.00 C ATOM 700 CE LYS A 44 -15.199 1.984 -6.765 1.00 0.00 C ATOM 701 NZ LYS A 44 -16.400 1.625 -7.572 1.00 0.00 N ATOM 0 H LYS A 44 -13.109 1.361 -2.054 1.00 0.00 H new ATOM 0 HA LYS A 44 -15.729 2.794 -1.893 1.00 0.00 H new ATOM 0 HB2 LYS A 44 -14.976 0.924 -4.173 1.00 0.00 H new ATOM 0 HB3 LYS A 44 -16.493 1.773 -3.953 1.00 0.00 H new ATOM 0 HG2 LYS A 44 -15.005 3.958 -3.937 1.00 0.00 H new ATOM 0 HG3 LYS A 44 -13.770 2.941 -4.652 1.00 0.00 H new ATOM 0 HD2 LYS A 44 -16.598 3.291 -5.763 1.00 0.00 H new ATOM 0 HD3 LYS A 44 -15.176 4.110 -6.378 1.00 0.00 H new ATOM 0 HE2 LYS A 44 -14.359 2.208 -7.423 1.00 0.00 H new ATOM 0 HE3 LYS A 44 -14.901 1.141 -6.142 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 -16.184 0.800 -8.168 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 -17.190 1.395 -6.936 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 -16.665 2.429 -8.176 1.00 0.00 H new ATOM 715 N GLN A 45 -16.164 0.732 -0.470 1.00 0.00 N ATOM 716 CA GLN A 45 -16.407 -0.528 0.291 1.00 0.00 C ATOM 717 C GLN A 45 -17.824 -0.619 0.859 1.00 0.00 C ATOM 718 O GLN A 45 -18.454 0.366 1.189 1.00 0.00 O ATOM 719 CB GLN A 45 -15.402 -0.581 1.443 1.00 0.00 C ATOM 720 CG GLN A 45 -15.565 0.655 2.333 1.00 0.00 C ATOM 721 CD GLN A 45 -16.447 0.308 3.537 1.00 0.00 C ATOM 722 OE1 GLN A 45 -16.076 -0.501 4.363 1.00 0.00 O ATOM 723 NE2 GLN A 45 -17.609 0.889 3.671 1.00 0.00 N ATOM 0 H GLN A 45 -16.588 1.575 -0.082 1.00 0.00 H new ATOM 0 HA GLN A 45 -16.288 -1.366 -0.395 1.00 0.00 H new ATOM 0 HB2 GLN A 45 -15.556 -1.486 2.031 1.00 0.00 H new ATOM 0 HB3 GLN A 45 -14.386 -0.626 1.050 1.00 0.00 H new ATOM 0 HG2 GLN A 45 -14.589 1.003 2.672 1.00 0.00 H new ATOM 0 HG3 GLN A 45 -16.013 1.469 1.764 1.00 0.00 H new ATOM 0 HE21 GLN A 45 -17.922 1.569 2.978 1.00 0.00 H new ATOM 0 HE22 GLN A 45 -18.203 0.663 4.469 1.00 0.00 H new ATOM 732 N GLU A 46 -18.298 -1.828 0.997 1.00 0.00 N ATOM 733 CA GLU A 46 -19.643 -2.075 1.569 1.00 0.00 C ATOM 734 C GLU A 46 -19.509 -3.176 2.629 1.00 0.00 C ATOM 735 O GLU A 46 -19.639 -4.350 2.336 1.00 0.00 O ATOM 736 CB GLU A 46 -20.587 -2.541 0.462 1.00 0.00 C ATOM 737 CG GLU A 46 -22.032 -2.300 0.893 1.00 0.00 C ATOM 738 CD GLU A 46 -22.919 -2.149 -0.344 1.00 0.00 C ATOM 739 OE1 GLU A 46 -22.990 -3.091 -1.117 1.00 0.00 O ATOM 740 OE2 GLU A 46 -23.513 -1.095 -0.498 1.00 0.00 O ATOM 0 H GLU A 46 -17.792 -2.672 0.729 1.00 0.00 H new ATOM 0 HA GLU A 46 -20.044 -1.165 2.015 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -20.377 -2.002 -0.462 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -20.429 -3.600 0.256 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -22.383 -3.131 1.505 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -22.093 -1.403 1.509 1.00 0.00 H new ATOM 747 N GLY A 47 -19.225 -2.805 3.853 1.00 0.00 N ATOM 748 CA GLY A 47 -19.058 -3.827 4.932 1.00 0.00 C ATOM 749 C GLY A 47 -17.655 -4.435 4.838 1.00 0.00 C ATOM 750 O GLY A 47 -16.672 -3.727 4.722 1.00 0.00 O ATOM 0 H GLY A 47 -19.102 -1.838 4.152 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -19.203 -3.368 5.910 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -19.813 -4.607 4.831 1.00 0.00 H new ATOM 754 N ASP A 48 -17.554 -5.742 4.877 1.00 0.00 N ATOM 755 CA ASP A 48 -16.220 -6.401 4.779 1.00 0.00 C ATOM 756 C ASP A 48 -15.731 -6.414 3.327 1.00 0.00 C ATOM 757 O ASP A 48 -14.637 -6.864 3.052 1.00 0.00 O ATOM 758 CB ASP A 48 -16.326 -7.832 5.288 1.00 0.00 C ATOM 759 CG ASP A 48 -17.431 -8.570 4.530 1.00 0.00 C ATOM 760 OD1 ASP A 48 -17.232 -8.856 3.361 1.00 0.00 O ATOM 761 OD2 ASP A 48 -18.459 -8.837 5.132 1.00 0.00 O ATOM 0 H ASP A 48 -18.344 -6.381 4.973 1.00 0.00 H new ATOM 0 HA ASP A 48 -15.507 -5.841 5.384 1.00 0.00 H new ATOM 0 HB2 ASP A 48 -15.374 -8.347 5.155 1.00 0.00 H new ATOM 0 HB3 ASP A 48 -16.542 -7.833 6.356 1.00 0.00 H new ATOM 766 N THR A 49 -16.511 -5.913 2.398 1.00 0.00 N ATOM 767 CA THR A 49 -16.060 -5.888 0.981 1.00 0.00 C ATOM 768 C THR A 49 -15.365 -4.549 0.724 1.00 0.00 C ATOM 769 O THR A 49 -15.856 -3.513 1.120 1.00 0.00 O ATOM 770 CB THR A 49 -17.276 -6.015 0.063 1.00 0.00 C ATOM 771 OG1 THR A 49 -17.997 -7.195 0.394 1.00 0.00 O ATOM 772 CG2 THR A 49 -16.816 -6.086 -1.391 1.00 0.00 C ATOM 0 H THR A 49 -17.438 -5.522 2.565 1.00 0.00 H new ATOM 0 HA THR A 49 -15.375 -6.712 0.785 1.00 0.00 H new ATOM 0 HB THR A 49 -17.922 -5.146 0.193 1.00 0.00 H new ATOM 0 HG1 THR A 49 -18.778 -7.277 -0.193 1.00 0.00 H new ATOM 0 HG21 THR A 49 -17.685 -6.177 -2.043 1.00 0.00 H new ATOM 0 HG22 THR A 49 -16.266 -5.180 -1.643 1.00 0.00 H new ATOM 0 HG23 THR A 49 -16.169 -6.953 -1.526 1.00 0.00 H new ATOM 780 N PHE A 50 -14.226 -4.555 0.085 1.00 0.00 N ATOM 781 CA PHE A 50 -13.520 -3.268 -0.176 1.00 0.00 C ATOM 782 C PHE A 50 -12.967 -3.226 -1.602 1.00 0.00 C ATOM 783 O PHE A 50 -12.690 -4.237 -2.217 1.00 0.00 O ATOM 784 CB PHE A 50 -12.358 -3.104 0.807 1.00 0.00 C ATOM 785 CG PHE A 50 -12.889 -3.179 2.211 1.00 0.00 C ATOM 786 CD1 PHE A 50 -13.076 -4.421 2.811 1.00 0.00 C ATOM 787 CD2 PHE A 50 -13.216 -2.009 2.900 1.00 0.00 C ATOM 788 CE1 PHE A 50 -13.595 -4.501 4.102 1.00 0.00 C ATOM 789 CE2 PHE A 50 -13.731 -2.085 4.201 1.00 0.00 C ATOM 790 CZ PHE A 50 -13.923 -3.337 4.799 1.00 0.00 C ATOM 0 H PHE A 50 -13.756 -5.390 -0.266 1.00 0.00 H new ATOM 0 HA PHE A 50 -14.239 -2.459 -0.048 1.00 0.00 H new ATOM 0 HB2 PHE A 50 -11.614 -3.884 0.644 1.00 0.00 H new ATOM 0 HB3 PHE A 50 -11.859 -2.149 0.644 1.00 0.00 H new ATOM 0 HD1 PHE A 50 -12.819 -5.323 2.276 1.00 0.00 H new ATOM 0 HD2 PHE A 50 -13.072 -1.047 2.431 1.00 0.00 H new ATOM 0 HE1 PHE A 50 -13.744 -5.466 4.564 1.00 0.00 H new ATOM 0 HE2 PHE A 50 -13.979 -1.183 4.740 1.00 0.00 H new ATOM 0 HZ PHE A 50 -14.325 -3.402 5.799 1.00 0.00 H new ATOM 800 N TYR A 51 -12.775 -2.039 -2.099 1.00 0.00 N ATOM 801 CA TYR A 51 -12.203 -1.838 -3.457 1.00 0.00 C ATOM 802 C TYR A 51 -11.122 -0.771 -3.275 1.00 0.00 C ATOM 803 O TYR A 51 -11.238 0.077 -2.407 1.00 0.00 O ATOM 804 CB TYR A 51 -13.337 -1.408 -4.423 1.00 0.00 C ATOM 805 CG TYR A 51 -12.865 -0.480 -5.530 1.00 0.00 C ATOM 806 CD1 TYR A 51 -12.609 0.865 -5.249 1.00 0.00 C ATOM 807 CD2 TYR A 51 -12.736 -0.955 -6.838 1.00 0.00 C ATOM 808 CE1 TYR A 51 -12.228 1.735 -6.266 1.00 0.00 C ATOM 809 CE2 TYR A 51 -12.341 -0.083 -7.862 1.00 0.00 C ATOM 810 CZ TYR A 51 -12.091 1.263 -7.577 1.00 0.00 C ATOM 811 OH TYR A 51 -11.726 2.123 -8.592 1.00 0.00 O ATOM 0 H TYR A 51 -12.997 -1.174 -1.606 1.00 0.00 H new ATOM 0 HA TYR A 51 -11.765 -2.735 -3.894 1.00 0.00 H new ATOM 0 HB2 TYR A 51 -13.781 -2.298 -4.869 1.00 0.00 H new ATOM 0 HB3 TYR A 51 -14.122 -0.912 -3.852 1.00 0.00 H new ATOM 0 HD1 TYR A 51 -12.707 1.231 -4.238 1.00 0.00 H new ATOM 0 HD2 TYR A 51 -12.940 -1.992 -7.059 1.00 0.00 H new ATOM 0 HE1 TYR A 51 -12.038 2.775 -6.044 1.00 0.00 H new ATOM 0 HE2 TYR A 51 -12.230 -0.451 -8.871 1.00 0.00 H new ATOM 0 HH TYR A 51 -12.052 3.025 -8.390 1.00 0.00 H new ATOM 821 N ILE A 52 -10.062 -0.821 -4.034 1.00 0.00 N ATOM 822 CA ILE A 52 -8.973 0.182 -3.830 1.00 0.00 C ATOM 823 C ILE A 52 -8.313 0.532 -5.165 1.00 0.00 C ATOM 824 O ILE A 52 -7.573 -0.253 -5.726 1.00 0.00 O ATOM 825 CB ILE A 52 -7.918 -0.395 -2.860 1.00 0.00 C ATOM 826 CG1 ILE A 52 -8.623 -1.133 -1.702 1.00 0.00 C ATOM 827 CG2 ILE A 52 -7.053 0.744 -2.303 1.00 0.00 C ATOM 828 CD1 ILE A 52 -7.602 -1.692 -0.704 1.00 0.00 C ATOM 0 H ILE A 52 -9.901 -1.501 -4.777 1.00 0.00 H new ATOM 0 HA ILE A 52 -9.402 1.090 -3.406 1.00 0.00 H new ATOM 0 HB ILE A 52 -7.282 -1.099 -3.396 1.00 0.00 H new ATOM 0 HG12 ILE A 52 -9.301 -0.450 -1.190 1.00 0.00 H new ATOM 0 HG13 ILE A 52 -9.230 -1.946 -2.100 1.00 0.00 H new ATOM 0 HG21 ILE A 52 -6.309 0.335 -1.619 1.00 0.00 H new ATOM 0 HG22 ILE A 52 -6.549 1.253 -3.124 1.00 0.00 H new ATOM 0 HG23 ILE A 52 -7.685 1.454 -1.769 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -8.125 -2.207 0.102 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -6.941 -2.393 -1.214 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -7.013 -0.874 -0.289 1.00 0.00 H new ATOM 840 N LYS A 53 -8.576 1.712 -5.670 1.00 0.00 N ATOM 841 CA LYS A 53 -7.972 2.133 -6.969 1.00 0.00 C ATOM 842 C LYS A 53 -6.824 3.113 -6.718 1.00 0.00 C ATOM 843 O LYS A 53 -7.020 4.315 -6.695 1.00 0.00 O ATOM 844 CB LYS A 53 -9.044 2.810 -7.830 1.00 0.00 C ATOM 845 CG LYS A 53 -9.067 2.186 -9.230 1.00 0.00 C ATOM 846 CD LYS A 53 -9.688 3.174 -10.220 1.00 0.00 C ATOM 847 CE LYS A 53 -8.600 4.098 -10.771 1.00 0.00 C ATOM 848 NZ LYS A 53 -7.872 3.407 -11.873 1.00 0.00 N ATOM 0 H LYS A 53 -9.186 2.404 -5.235 1.00 0.00 H new ATOM 0 HA LYS A 53 -7.584 1.256 -7.487 1.00 0.00 H new ATOM 0 HB2 LYS A 53 -10.021 2.702 -7.359 1.00 0.00 H new ATOM 0 HB3 LYS A 53 -8.842 3.879 -7.903 1.00 0.00 H new ATOM 0 HG2 LYS A 53 -8.054 1.930 -9.542 1.00 0.00 H new ATOM 0 HG3 LYS A 53 -9.640 1.259 -9.217 1.00 0.00 H new ATOM 0 HD2 LYS A 53 -10.168 2.634 -11.036 1.00 0.00 H new ATOM 0 HD3 LYS A 53 -10.463 3.761 -9.727 1.00 0.00 H new ATOM 0 HE2 LYS A 53 -9.045 5.023 -11.139 1.00 0.00 H new ATOM 0 HE3 LYS A 53 -7.905 4.372 -9.978 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 -7.132 4.035 -12.248 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 -7.435 2.537 -11.508 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 -8.540 3.167 -12.633 1.00 0.00 H new ATOM 862 N THR A 54 -5.630 2.609 -6.535 1.00 0.00 N ATOM 863 CA THR A 54 -4.462 3.506 -6.292 1.00 0.00 C ATOM 864 C THR A 54 -3.919 3.999 -7.630 1.00 0.00 C ATOM 865 O THR A 54 -2.995 3.431 -8.181 1.00 0.00 O ATOM 866 CB THR A 54 -3.371 2.738 -5.552 1.00 0.00 C ATOM 867 OG1 THR A 54 -3.926 2.118 -4.399 1.00 0.00 O ATOM 868 CG2 THR A 54 -2.261 3.702 -5.134 1.00 0.00 C ATOM 0 H THR A 54 -5.414 1.612 -6.544 1.00 0.00 H new ATOM 0 HA THR A 54 -4.776 4.357 -5.688 1.00 0.00 H new ATOM 0 HB THR A 54 -2.956 1.973 -6.208 1.00 0.00 H new ATOM 0 HG1 THR A 54 -3.226 1.623 -3.925 1.00 0.00 H new ATOM 0 HG21 THR A 54 -1.482 3.153 -4.605 1.00 0.00 H new ATOM 0 HG22 THR A 54 -1.835 4.173 -6.020 1.00 0.00 H new ATOM 0 HG23 THR A 54 -2.673 4.469 -4.478 1.00 0.00 H new ATOM 876 N SER A 55 -4.490 5.052 -8.157 1.00 0.00 N ATOM 877 CA SER A 55 -4.016 5.587 -9.464 1.00 0.00 C ATOM 878 C SER A 55 -3.628 7.060 -9.309 1.00 0.00 C ATOM 879 O SER A 55 -3.587 7.589 -8.214 1.00 0.00 O ATOM 880 CB SER A 55 -5.131 5.457 -10.502 1.00 0.00 C ATOM 881 OG SER A 55 -6.118 6.452 -10.264 1.00 0.00 O ATOM 0 H SER A 55 -5.265 5.564 -7.736 1.00 0.00 H new ATOM 0 HA SER A 55 -3.145 5.019 -9.793 1.00 0.00 H new ATOM 0 HB2 SER A 55 -4.722 5.568 -11.506 1.00 0.00 H new ATOM 0 HB3 SER A 55 -5.579 4.465 -10.448 1.00 0.00 H new ATOM 0 HG SER A 55 -6.832 6.370 -10.930 1.00 0.00 H new ATOM 887 N THR A 56 -3.347 7.723 -10.403 1.00 0.00 N ATOM 888 CA THR A 56 -2.962 9.165 -10.335 1.00 0.00 C ATOM 889 C THR A 56 -3.514 9.904 -11.559 1.00 0.00 C ATOM 890 O THR A 56 -4.059 10.986 -11.444 1.00 0.00 O ATOM 891 CB THR A 56 -1.437 9.290 -10.303 1.00 0.00 C ATOM 892 OG1 THR A 56 -1.071 10.661 -10.401 1.00 0.00 O ATOM 893 CG2 THR A 56 -0.833 8.513 -11.471 1.00 0.00 C ATOM 0 H THR A 56 -3.368 7.326 -11.342 1.00 0.00 H new ATOM 0 HA THR A 56 -3.378 9.606 -9.430 1.00 0.00 H new ATOM 0 HB THR A 56 -1.060 8.880 -9.366 1.00 0.00 H new ATOM 0 HG1 THR A 56 -0.904 11.020 -9.504 1.00 0.00 H new ATOM 0 HG21 THR A 56 0.253 8.604 -11.446 1.00 0.00 H new ATOM 0 HG22 THR A 56 -1.111 7.462 -11.392 1.00 0.00 H new ATOM 0 HG23 THR A 56 -1.209 8.918 -12.411 1.00 0.00 H new ATOM 901 N THR A 57 -3.379 9.327 -12.727 1.00 0.00 N ATOM 902 CA THR A 57 -3.897 9.991 -13.961 1.00 0.00 C ATOM 903 C THR A 57 -4.112 8.939 -15.050 1.00 0.00 C ATOM 904 O THR A 57 -5.231 8.643 -15.425 1.00 0.00 O ATOM 905 CB THR A 57 -2.889 11.039 -14.448 1.00 0.00 C ATOM 906 OG1 THR A 57 -2.059 11.444 -13.367 1.00 0.00 O ATOM 907 CG2 THR A 57 -3.638 12.254 -14.999 1.00 0.00 C ATOM 0 H THR A 57 -2.931 8.423 -12.879 1.00 0.00 H new ATOM 0 HA THR A 57 -4.844 10.483 -13.738 1.00 0.00 H new ATOM 0 HB THR A 57 -2.272 10.605 -15.235 1.00 0.00 H new ATOM 0 HG1 THR A 57 -1.415 12.112 -13.682 1.00 0.00 H new ATOM 0 HG21 THR A 57 -2.920 12.998 -15.345 1.00 0.00 H new ATOM 0 HG22 THR A 57 -4.270 11.945 -15.832 1.00 0.00 H new ATOM 0 HG23 THR A 57 -4.258 12.686 -14.214 1.00 0.00 H new ATOM 915 N VAL A 58 -3.048 8.372 -15.555 1.00 0.00 N ATOM 916 CA VAL A 58 -3.177 7.332 -16.619 1.00 0.00 C ATOM 917 C VAL A 58 -3.914 6.117 -16.053 1.00 0.00 C ATOM 918 O VAL A 58 -4.390 6.137 -14.932 1.00 0.00 O ATOM 919 CB VAL A 58 -1.786 6.908 -17.093 1.00 0.00 C ATOM 920 CG1 VAL A 58 -1.128 8.066 -17.847 1.00 0.00 C ATOM 921 CG2 VAL A 58 -0.930 6.537 -15.882 1.00 0.00 C ATOM 0 H VAL A 58 -2.091 8.585 -15.275 1.00 0.00 H new ATOM 0 HA VAL A 58 -3.737 7.741 -17.460 1.00 0.00 H new ATOM 0 HB VAL A 58 -1.873 6.047 -17.756 1.00 0.00 H new ATOM 0 HG11 VAL A 58 -0.137 7.764 -18.185 1.00 0.00 H new ATOM 0 HG12 VAL A 58 -1.739 8.333 -18.709 1.00 0.00 H new ATOM 0 HG13 VAL A 58 -1.039 8.927 -17.185 1.00 0.00 H new ATOM 0 HG21 VAL A 58 0.062 6.234 -16.217 1.00 0.00 H new ATOM 0 HG22 VAL A 58 -0.843 7.399 -15.220 1.00 0.00 H new ATOM 0 HG23 VAL A 58 -1.398 5.713 -15.344 1.00 0.00 H new ATOM 931 N ARG A 59 -4.011 5.059 -16.818 1.00 0.00 N ATOM 932 CA ARG A 59 -4.715 3.837 -16.328 1.00 0.00 C ATOM 933 C ARG A 59 -3.952 3.254 -15.138 1.00 0.00 C ATOM 934 O ARG A 59 -2.779 3.520 -14.954 1.00 0.00 O ATOM 935 CB ARG A 59 -4.785 2.800 -17.452 1.00 0.00 C ATOM 936 CG ARG A 59 -3.377 2.523 -17.985 1.00 0.00 C ATOM 937 CD ARG A 59 -3.332 1.122 -18.597 1.00 0.00 C ATOM 938 NE ARG A 59 -1.985 0.879 -19.187 1.00 0.00 N ATOM 939 CZ ARG A 59 -1.738 -0.243 -19.807 1.00 0.00 C ATOM 940 NH1 ARG A 59 -1.856 -1.378 -19.174 1.00 0.00 N ATOM 941 NH2 ARG A 59 -1.373 -0.230 -21.060 1.00 0.00 N ATOM 0 H ARG A 59 -3.632 4.990 -17.762 1.00 0.00 H new ATOM 0 HA ARG A 59 -5.726 4.100 -16.017 1.00 0.00 H new ATOM 0 HB2 ARG A 59 -5.232 1.878 -17.082 1.00 0.00 H new ATOM 0 HB3 ARG A 59 -5.424 3.164 -18.257 1.00 0.00 H new ATOM 0 HG2 ARG A 59 -3.107 3.268 -18.734 1.00 0.00 H new ATOM 0 HG3 ARG A 59 -2.649 2.603 -17.178 1.00 0.00 H new ATOM 0 HD2 ARG A 59 -3.547 0.374 -17.834 1.00 0.00 H new ATOM 0 HD3 ARG A 59 -4.100 1.024 -19.365 1.00 0.00 H new ATOM 0 HE ARG A 59 -1.257 1.589 -19.106 1.00 0.00 H new ATOM 0 HH11 ARG A 59 -2.141 -1.389 -18.195 1.00 0.00 H new ATOM 0 HH12 ARG A 59 -1.663 -2.255 -19.658 1.00 0.00 H new ATOM 0 HH21 ARG A 59 -1.281 0.657 -21.555 1.00 0.00 H new ATOM 0 HH22 ARG A 59 -1.180 -1.107 -21.544 1.00 0.00 H new ATOM 955 N THR A 60 -4.611 2.463 -14.329 1.00 0.00 N ATOM 956 CA THR A 60 -3.930 1.860 -13.145 1.00 0.00 C ATOM 957 C THR A 60 -4.707 0.627 -12.682 1.00 0.00 C ATOM 958 O THR A 60 -5.854 0.435 -13.040 1.00 0.00 O ATOM 959 CB THR A 60 -3.879 2.886 -12.012 1.00 0.00 C ATOM 960 OG1 THR A 60 -3.344 4.106 -12.504 1.00 0.00 O ATOM 961 CG2 THR A 60 -2.996 2.358 -10.881 1.00 0.00 C ATOM 0 H THR A 60 -5.593 2.209 -14.438 1.00 0.00 H new ATOM 0 HA THR A 60 -2.916 1.568 -13.418 1.00 0.00 H new ATOM 0 HB THR A 60 -4.886 3.058 -11.632 1.00 0.00 H new ATOM 0 HG1 THR A 60 -2.782 3.925 -13.286 1.00 0.00 H new ATOM 0 HG21 THR A 60 -2.961 3.091 -10.075 1.00 0.00 H new ATOM 0 HG22 THR A 60 -3.409 1.422 -10.504 1.00 0.00 H new ATOM 0 HG23 THR A 60 -1.988 2.184 -11.257 1.00 0.00 H new ATOM 969 N THR A 61 -4.088 -0.208 -11.886 1.00 0.00 N ATOM 970 CA THR A 61 -4.782 -1.434 -11.392 1.00 0.00 C ATOM 971 C THR A 61 -5.475 -1.127 -10.062 1.00 0.00 C ATOM 972 O THR A 61 -5.270 -0.083 -9.473 1.00 0.00 O ATOM 973 CB THR A 61 -3.760 -2.555 -11.189 1.00 0.00 C ATOM 974 OG1 THR A 61 -4.401 -3.675 -10.594 1.00 0.00 O ATOM 975 CG2 THR A 61 -2.638 -2.063 -10.277 1.00 0.00 C ATOM 0 H THR A 61 -3.130 -0.092 -11.557 1.00 0.00 H new ATOM 0 HA THR A 61 -5.525 -1.750 -12.124 1.00 0.00 H new ATOM 0 HB THR A 61 -3.341 -2.846 -12.152 1.00 0.00 H new ATOM 0 HG1 THR A 61 -3.749 -4.395 -10.465 1.00 0.00 H new ATOM 0 HG21 THR A 61 -1.910 -2.861 -10.132 1.00 0.00 H new ATOM 0 HG22 THR A 61 -2.148 -1.204 -10.734 1.00 0.00 H new ATOM 0 HG23 THR A 61 -3.054 -1.772 -9.312 1.00 0.00 H new ATOM 983 N GLU A 62 -6.294 -2.032 -9.590 1.00 0.00 N ATOM 984 CA GLU A 62 -7.008 -1.804 -8.300 1.00 0.00 C ATOM 985 C GLU A 62 -7.465 -3.149 -7.730 1.00 0.00 C ATOM 986 O GLU A 62 -7.756 -4.069 -8.473 1.00 0.00 O ATOM 987 CB GLU A 62 -8.220 -0.885 -8.539 1.00 0.00 C ATOM 988 CG GLU A 62 -9.255 -1.554 -9.456 1.00 0.00 C ATOM 989 CD GLU A 62 -8.755 -1.534 -10.902 1.00 0.00 C ATOM 990 OE1 GLU A 62 -8.790 -0.474 -11.505 1.00 0.00 O ATOM 991 OE2 GLU A 62 -8.347 -2.579 -11.381 1.00 0.00 O ATOM 0 H GLU A 62 -6.499 -2.922 -10.045 1.00 0.00 H new ATOM 0 HA GLU A 62 -6.338 -1.325 -7.586 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -8.684 -0.636 -7.585 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -7.887 0.052 -8.986 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -9.428 -2.581 -9.136 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -10.209 -1.032 -9.384 1.00 0.00 H new ATOM 998 N ILE A 63 -7.537 -3.275 -6.425 1.00 0.00 N ATOM 999 CA ILE A 63 -7.984 -4.572 -5.841 1.00 0.00 C ATOM 1000 C ILE A 63 -9.452 -4.491 -5.439 1.00 0.00 C ATOM 1001 O ILE A 63 -9.805 -3.941 -4.414 1.00 0.00 O ATOM 1002 CB ILE A 63 -7.129 -4.985 -4.628 1.00 0.00 C ATOM 1003 CG1 ILE A 63 -6.815 -3.778 -3.735 1.00 0.00 C ATOM 1004 CG2 ILE A 63 -5.831 -5.617 -5.128 1.00 0.00 C ATOM 1005 CD1 ILE A 63 -6.024 -4.238 -2.504 1.00 0.00 C ATOM 0 H ILE A 63 -7.308 -2.545 -5.751 1.00 0.00 H new ATOM 0 HA ILE A 63 -7.858 -5.335 -6.609 1.00 0.00 H new ATOM 0 HB ILE A 63 -7.689 -5.704 -4.031 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -6.240 -3.040 -4.294 1.00 0.00 H new ATOM 0 HG13 ILE A 63 -7.740 -3.293 -3.424 1.00 0.00 H new ATOM 0 HG21 ILE A 63 -5.219 -5.913 -4.276 1.00 0.00 H new ATOM 0 HG22 ILE A 63 -6.063 -6.495 -5.731 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -5.284 -4.895 -5.734 1.00 0.00 H new ATOM 0 HD11 ILE A 63 -5.803 -3.378 -1.872 1.00 0.00 H new ATOM 0 HD12 ILE A 63 -6.615 -4.960 -1.941 1.00 0.00 H new ATOM 0 HD13 ILE A 63 -5.091 -4.703 -2.824 1.00 0.00 H new ATOM 1017 N ASN A 64 -10.301 -5.077 -6.238 1.00 0.00 N ATOM 1018 CA ASN A 64 -11.756 -5.104 -5.904 1.00 0.00 C ATOM 1019 C ASN A 64 -11.998 -6.424 -5.183 1.00 0.00 C ATOM 1020 O ASN A 64 -12.467 -7.396 -5.744 1.00 0.00 O ATOM 1021 CB ASN A 64 -12.656 -5.001 -7.157 1.00 0.00 C ATOM 1022 CG ASN A 64 -12.017 -5.650 -8.403 1.00 0.00 C ATOM 1023 OD1 ASN A 64 -12.169 -5.143 -9.496 1.00 0.00 O ATOM 1024 ND2 ASN A 64 -11.310 -6.744 -8.297 1.00 0.00 N ATOM 0 H ASN A 64 -10.050 -5.540 -7.111 1.00 0.00 H new ATOM 0 HA ASN A 64 -12.013 -4.243 -5.287 1.00 0.00 H new ATOM 0 HB2 ASN A 64 -13.613 -5.481 -6.953 1.00 0.00 H new ATOM 0 HB3 ASN A 64 -12.864 -3.951 -7.365 1.00 0.00 H new ATOM 0 HD21 ASN A 64 -10.892 -7.164 -9.127 1.00 0.00 H new ATOM 0 HD22 ASN A 64 -11.176 -7.178 -7.384 1.00 0.00 H new ATOM 1031 N PHE A 65 -11.613 -6.465 -3.945 1.00 0.00 N ATOM 1032 CA PHE A 65 -11.714 -7.718 -3.155 1.00 0.00 C ATOM 1033 C PHE A 65 -12.653 -7.534 -1.956 1.00 0.00 C ATOM 1034 O PHE A 65 -13.416 -6.600 -1.881 1.00 0.00 O ATOM 1035 CB PHE A 65 -10.283 -8.038 -2.649 1.00 0.00 C ATOM 1036 CG PHE A 65 -9.866 -7.012 -1.590 1.00 0.00 C ATOM 1037 CD1 PHE A 65 -9.404 -5.749 -1.977 1.00 0.00 C ATOM 1038 CD2 PHE A 65 -9.999 -7.309 -0.227 1.00 0.00 C ATOM 1039 CE1 PHE A 65 -9.074 -4.791 -1.019 1.00 0.00 C ATOM 1040 CE2 PHE A 65 -9.678 -6.345 0.737 1.00 0.00 C ATOM 1041 CZ PHE A 65 -9.215 -5.085 0.341 1.00 0.00 C ATOM 0 H PHE A 65 -11.226 -5.670 -3.437 1.00 0.00 H new ATOM 0 HA PHE A 65 -12.117 -8.524 -3.768 1.00 0.00 H new ATOM 0 HB2 PHE A 65 -10.253 -9.043 -2.227 1.00 0.00 H new ATOM 0 HB3 PHE A 65 -9.580 -8.021 -3.482 1.00 0.00 H new ATOM 0 HD1 PHE A 65 -9.302 -5.514 -3.026 1.00 0.00 H new ATOM 0 HD2 PHE A 65 -10.350 -8.283 0.081 1.00 0.00 H new ATOM 0 HE1 PHE A 65 -8.710 -3.822 -1.327 1.00 0.00 H new ATOM 0 HE2 PHE A 65 -9.788 -6.574 1.787 1.00 0.00 H new ATOM 0 HZ PHE A 65 -8.967 -4.341 1.084 1.00 0.00 H new ATOM 1051 N LYS A 66 -12.524 -8.415 -1.005 1.00 0.00 N ATOM 1052 CA LYS A 66 -13.291 -8.344 0.256 1.00 0.00 C ATOM 1053 C LYS A 66 -12.335 -8.888 1.311 1.00 0.00 C ATOM 1054 O LYS A 66 -11.743 -9.933 1.129 1.00 0.00 O ATOM 1055 CB LYS A 66 -14.573 -9.178 0.183 1.00 0.00 C ATOM 1056 CG LYS A 66 -14.275 -10.560 -0.391 1.00 0.00 C ATOM 1057 CD LYS A 66 -15.583 -11.232 -0.822 1.00 0.00 C ATOM 1058 CE LYS A 66 -15.803 -11.012 -2.320 1.00 0.00 C ATOM 1059 NZ LYS A 66 -16.939 -11.856 -2.785 1.00 0.00 N ATOM 0 H LYS A 66 -11.890 -9.212 -1.059 1.00 0.00 H new ATOM 0 HA LYS A 66 -13.621 -7.329 0.479 1.00 0.00 H new ATOM 0 HB2 LYS A 66 -15.008 -9.276 1.178 1.00 0.00 H new ATOM 0 HB3 LYS A 66 -15.310 -8.670 -0.439 1.00 0.00 H new ATOM 0 HG2 LYS A 66 -13.601 -10.473 -1.243 1.00 0.00 H new ATOM 0 HG3 LYS A 66 -13.768 -11.173 0.355 1.00 0.00 H new ATOM 0 HD2 LYS A 66 -15.545 -12.299 -0.602 1.00 0.00 H new ATOM 0 HD3 LYS A 66 -16.419 -10.820 -0.257 1.00 0.00 H new ATOM 0 HE2 LYS A 66 -16.013 -9.961 -2.517 1.00 0.00 H new ATOM 0 HE3 LYS A 66 -14.898 -11.265 -2.872 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 -17.089 -11.706 -3.803 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 -16.721 -12.858 -2.610 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 -17.801 -11.594 -2.266 1.00 0.00 H new ATOM 1073 N VAL A 67 -12.111 -8.148 2.360 1.00 0.00 N ATOM 1074 CA VAL A 67 -11.118 -8.548 3.413 1.00 0.00 C ATOM 1075 C VAL A 67 -11.144 -10.051 3.756 1.00 0.00 C ATOM 1076 O VAL A 67 -10.162 -10.573 4.253 1.00 0.00 O ATOM 1077 CB VAL A 67 -11.366 -7.696 4.656 1.00 0.00 C ATOM 1078 CG1 VAL A 67 -10.475 -8.169 5.813 1.00 0.00 C ATOM 1079 CG2 VAL A 67 -11.009 -6.255 4.317 1.00 0.00 C ATOM 0 H VAL A 67 -12.582 -7.262 2.541 1.00 0.00 H new ATOM 0 HA VAL A 67 -10.119 -8.369 3.015 1.00 0.00 H new ATOM 0 HB VAL A 67 -12.410 -7.782 4.958 1.00 0.00 H new ATOM 0 HG11 VAL A 67 -10.663 -7.553 6.692 1.00 0.00 H new ATOM 0 HG12 VAL A 67 -10.701 -9.210 6.045 1.00 0.00 H new ATOM 0 HG13 VAL A 67 -9.427 -8.081 5.525 1.00 0.00 H new ATOM 0 HG21 VAL A 67 -11.177 -5.624 5.189 1.00 0.00 H new ATOM 0 HG22 VAL A 67 -9.960 -6.199 4.025 1.00 0.00 H new ATOM 0 HG23 VAL A 67 -11.634 -5.910 3.493 1.00 0.00 H new ATOM 1089 N GLY A 68 -12.217 -10.753 3.502 1.00 0.00 N ATOM 1090 CA GLY A 68 -12.236 -12.209 3.821 1.00 0.00 C ATOM 1091 C GLY A 68 -11.619 -13.021 2.670 1.00 0.00 C ATOM 1092 O GLY A 68 -12.122 -14.076 2.328 1.00 0.00 O ATOM 0 H GLY A 68 -13.074 -10.384 3.091 1.00 0.00 H new ATOM 0 HA2 GLY A 68 -11.682 -12.393 4.741 1.00 0.00 H new ATOM 0 HA3 GLY A 68 -13.261 -12.536 3.996 1.00 0.00 H new ATOM 1096 N GLU A 69 -10.536 -12.558 2.068 1.00 0.00 N ATOM 1097 CA GLU A 69 -9.924 -13.350 0.948 1.00 0.00 C ATOM 1098 C GLU A 69 -8.540 -12.813 0.532 1.00 0.00 C ATOM 1099 O GLU A 69 -8.069 -11.785 0.995 1.00 0.00 O ATOM 1100 CB GLU A 69 -10.860 -13.324 -0.267 1.00 0.00 C ATOM 1101 CG GLU A 69 -11.046 -11.883 -0.761 1.00 0.00 C ATOM 1102 CD GLU A 69 -10.994 -11.848 -2.291 1.00 0.00 C ATOM 1103 OE1 GLU A 69 -9.898 -11.808 -2.825 1.00 0.00 O ATOM 1104 OE2 GLU A 69 -12.050 -11.863 -2.901 1.00 0.00 O ATOM 0 H GLU A 69 -10.062 -11.685 2.300 1.00 0.00 H new ATOM 0 HA GLU A 69 -9.787 -14.369 1.309 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -10.448 -13.940 -1.066 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -11.826 -13.752 -0.000 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -12.000 -11.489 -0.411 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -10.267 -11.243 -0.347 1.00 0.00 H new ATOM 1111 N GLU A 70 -7.898 -13.541 -0.352 1.00 0.00 N ATOM 1112 CA GLU A 70 -6.539 -13.159 -0.859 1.00 0.00 C ATOM 1113 C GLU A 70 -6.599 -12.764 -2.331 1.00 0.00 C ATOM 1114 O GLU A 70 -7.587 -12.968 -3.009 1.00 0.00 O ATOM 1115 CB GLU A 70 -5.585 -14.363 -0.781 1.00 0.00 C ATOM 1116 CG GLU A 70 -6.286 -15.634 -1.271 1.00 0.00 C ATOM 1117 CD GLU A 70 -6.815 -16.424 -0.071 1.00 0.00 C ATOM 1118 OE1 GLU A 70 -7.393 -15.808 0.810 1.00 0.00 O ATOM 1119 OE2 GLU A 70 -6.633 -17.630 -0.055 1.00 0.00 O ATOM 0 H GLU A 70 -8.267 -14.403 -0.752 1.00 0.00 H new ATOM 0 HA GLU A 70 -6.192 -12.329 -0.244 1.00 0.00 H new ATOM 0 HB2 GLU A 70 -4.699 -14.173 -1.387 1.00 0.00 H new ATOM 0 HB3 GLU A 70 -5.246 -14.500 0.246 1.00 0.00 H new ATOM 0 HG2 GLU A 70 -7.107 -15.374 -1.939 1.00 0.00 H new ATOM 0 HG3 GLU A 70 -5.591 -16.247 -1.845 1.00 0.00 H new ATOM 1126 N PHE A 71 -5.500 -12.261 -2.839 1.00 0.00 N ATOM 1127 CA PHE A 71 -5.415 -11.913 -4.282 1.00 0.00 C ATOM 1128 C PHE A 71 -4.238 -12.692 -4.845 1.00 0.00 C ATOM 1129 O PHE A 71 -3.629 -13.488 -4.158 1.00 0.00 O ATOM 1130 CB PHE A 71 -5.145 -10.411 -4.530 1.00 0.00 C ATOM 1131 CG PHE A 71 -5.740 -9.511 -3.469 1.00 0.00 C ATOM 1132 CD1 PHE A 71 -6.981 -9.794 -2.888 1.00 0.00 C ATOM 1133 CD2 PHE A 71 -5.039 -8.359 -3.090 1.00 0.00 C ATOM 1134 CE1 PHE A 71 -7.511 -8.925 -1.926 1.00 0.00 C ATOM 1135 CE2 PHE A 71 -5.575 -7.491 -2.139 1.00 0.00 C ATOM 1136 CZ PHE A 71 -6.805 -7.774 -1.556 1.00 0.00 C ATOM 0 H PHE A 71 -4.651 -12.077 -2.304 1.00 0.00 H new ATOM 0 HA PHE A 71 -6.369 -12.153 -4.752 1.00 0.00 H new ATOM 0 HB2 PHE A 71 -4.069 -10.245 -4.575 1.00 0.00 H new ATOM 0 HB3 PHE A 71 -5.551 -10.132 -5.502 1.00 0.00 H new ATOM 0 HD1 PHE A 71 -7.528 -10.678 -3.180 1.00 0.00 H new ATOM 0 HD2 PHE A 71 -4.080 -8.142 -3.536 1.00 0.00 H new ATOM 0 HE1 PHE A 71 -8.465 -9.143 -1.469 1.00 0.00 H new ATOM 0 HE2 PHE A 71 -5.035 -6.600 -1.856 1.00 0.00 H new ATOM 0 HZ PHE A 71 -7.217 -7.104 -0.816 1.00 0.00 H new ATOM 1146 N GLU A 72 -3.899 -12.447 -6.072 1.00 0.00 N ATOM 1147 CA GLU A 72 -2.734 -13.145 -6.676 1.00 0.00 C ATOM 1148 C GLU A 72 -1.866 -12.124 -7.387 1.00 0.00 C ATOM 1149 O GLU A 72 -2.322 -11.060 -7.764 1.00 0.00 O ATOM 1150 CB GLU A 72 -3.193 -14.192 -7.679 1.00 0.00 C ATOM 1151 CG GLU A 72 -4.209 -15.116 -7.017 1.00 0.00 C ATOM 1152 CD GLU A 72 -5.011 -15.853 -8.091 1.00 0.00 C ATOM 1153 OE1 GLU A 72 -4.414 -16.622 -8.826 1.00 0.00 O ATOM 1154 OE2 GLU A 72 -6.210 -15.636 -8.160 1.00 0.00 O ATOM 0 H GLU A 72 -4.379 -11.791 -6.688 1.00 0.00 H new ATOM 0 HA GLU A 72 -2.172 -13.642 -5.886 1.00 0.00 H new ATOM 0 HB2 GLU A 72 -3.637 -13.708 -8.549 1.00 0.00 H new ATOM 0 HB3 GLU A 72 -2.339 -14.768 -8.036 1.00 0.00 H new ATOM 0 HG2 GLU A 72 -3.698 -15.833 -6.374 1.00 0.00 H new ATOM 0 HG3 GLU A 72 -4.880 -14.539 -6.381 1.00 0.00 H new ATOM 1161 N GLU A 73 -0.620 -12.441 -7.570 1.00 0.00 N ATOM 1162 CA GLU A 73 0.295 -11.488 -8.260 1.00 0.00 C ATOM 1163 C GLU A 73 1.610 -12.179 -8.614 1.00 0.00 C ATOM 1164 O GLU A 73 1.783 -13.360 -8.396 1.00 0.00 O ATOM 1165 CB GLU A 73 0.571 -10.295 -7.336 1.00 0.00 C ATOM 1166 CG GLU A 73 0.502 -8.991 -8.136 1.00 0.00 C ATOM 1167 CD GLU A 73 1.365 -7.927 -7.455 1.00 0.00 C ATOM 1168 OE1 GLU A 73 2.402 -8.285 -6.923 1.00 0.00 O ATOM 1169 OE2 GLU A 73 0.973 -6.771 -7.476 1.00 0.00 O ATOM 0 H GLU A 73 -0.192 -13.318 -7.273 1.00 0.00 H new ATOM 0 HA GLU A 73 -0.176 -11.141 -9.180 1.00 0.00 H new ATOM 0 HB2 GLU A 73 -0.158 -10.274 -6.526 1.00 0.00 H new ATOM 0 HB3 GLU A 73 1.554 -10.399 -6.877 1.00 0.00 H new ATOM 0 HG2 GLU A 73 0.850 -9.159 -9.155 1.00 0.00 H new ATOM 0 HG3 GLU A 73 -0.530 -8.648 -8.204 1.00 0.00 H new ATOM 1176 N GLN A 74 2.531 -11.434 -9.161 1.00 0.00 N ATOM 1177 CA GLN A 74 3.855 -12.010 -9.541 1.00 0.00 C ATOM 1178 C GLN A 74 4.962 -11.061 -9.083 1.00 0.00 C ATOM 1179 O GLN A 74 4.887 -9.864 -9.294 1.00 0.00 O ATOM 1180 CB GLN A 74 3.931 -12.169 -11.057 1.00 0.00 C ATOM 1181 CG GLN A 74 3.073 -13.359 -11.493 1.00 0.00 C ATOM 1182 CD GLN A 74 2.762 -13.245 -12.986 1.00 0.00 C ATOM 1183 OE1 GLN A 74 1.637 -13.445 -13.401 1.00 0.00 O ATOM 1184 NE2 GLN A 74 3.717 -12.930 -13.817 1.00 0.00 N ATOM 0 H GLN A 74 2.423 -10.440 -9.363 1.00 0.00 H new ATOM 0 HA GLN A 74 3.977 -12.984 -9.067 1.00 0.00 H new ATOM 0 HB2 GLN A 74 3.583 -11.259 -11.546 1.00 0.00 H new ATOM 0 HB3 GLN A 74 4.965 -12.321 -11.365 1.00 0.00 H new ATOM 0 HG2 GLN A 74 3.598 -14.293 -11.290 1.00 0.00 H new ATOM 0 HG3 GLN A 74 2.147 -13.383 -10.919 1.00 0.00 H new ATOM 0 HE21 GLN A 74 4.661 -12.762 -13.469 1.00 0.00 H new ATOM 0 HE22 GLN A 74 3.520 -12.852 -14.815 1.00 0.00 H new ATOM 1193 N THR A 75 5.985 -11.582 -8.455 1.00 0.00 N ATOM 1194 CA THR A 75 7.095 -10.707 -7.978 1.00 0.00 C ATOM 1195 C THR A 75 7.843 -10.126 -9.176 1.00 0.00 C ATOM 1196 O THR A 75 7.803 -10.659 -10.269 1.00 0.00 O ATOM 1197 CB THR A 75 8.062 -11.517 -7.113 1.00 0.00 C ATOM 1198 OG1 THR A 75 7.322 -12.374 -6.254 1.00 0.00 O ATOM 1199 CG2 THR A 75 8.915 -10.566 -6.273 1.00 0.00 C ATOM 0 H THR A 75 6.098 -12.575 -8.253 1.00 0.00 H new ATOM 0 HA THR A 75 6.678 -9.895 -7.383 1.00 0.00 H new ATOM 0 HB THR A 75 8.710 -12.115 -7.754 1.00 0.00 H new ATOM 0 HG1 THR A 75 7.554 -13.307 -6.444 1.00 0.00 H new ATOM 0 HG21 THR A 75 9.604 -11.143 -5.657 1.00 0.00 H new ATOM 0 HG22 THR A 75 9.482 -9.908 -6.931 1.00 0.00 H new ATOM 0 HG23 THR A 75 8.268 -9.968 -5.631 1.00 0.00 H new ATOM 1207 N VAL A 76 8.522 -9.031 -8.971 1.00 0.00 N ATOM 1208 CA VAL A 76 9.284 -8.381 -10.075 1.00 0.00 C ATOM 1209 C VAL A 76 10.321 -9.352 -10.650 1.00 0.00 C ATOM 1210 O VAL A 76 10.658 -9.287 -11.817 1.00 0.00 O ATOM 1211 CB VAL A 76 9.997 -7.142 -9.526 1.00 0.00 C ATOM 1212 CG1 VAL A 76 8.967 -6.054 -9.220 1.00 0.00 C ATOM 1213 CG2 VAL A 76 10.750 -7.505 -8.241 1.00 0.00 C ATOM 0 H VAL A 76 8.582 -8.552 -8.072 1.00 0.00 H new ATOM 0 HA VAL A 76 8.593 -8.096 -10.868 1.00 0.00 H new ATOM 0 HB VAL A 76 10.705 -6.776 -10.269 1.00 0.00 H new ATOM 0 HG11 VAL A 76 9.475 -5.172 -8.829 1.00 0.00 H new ATOM 0 HG12 VAL A 76 8.434 -5.791 -10.133 1.00 0.00 H new ATOM 0 HG13 VAL A 76 8.258 -6.423 -8.479 1.00 0.00 H new ATOM 0 HG21 VAL A 76 11.256 -6.621 -7.854 1.00 0.00 H new ATOM 0 HG22 VAL A 76 10.044 -7.874 -7.497 1.00 0.00 H new ATOM 0 HG23 VAL A 76 11.487 -8.279 -8.457 1.00 0.00 H new ATOM 1223 N ASP A 77 10.829 -10.248 -9.840 1.00 0.00 N ATOM 1224 CA ASP A 77 11.846 -11.221 -10.339 1.00 0.00 C ATOM 1225 C ASP A 77 12.210 -12.203 -9.224 1.00 0.00 C ATOM 1226 O ASP A 77 12.488 -11.812 -8.106 1.00 0.00 O ATOM 1227 CB ASP A 77 13.102 -10.465 -10.781 1.00 0.00 C ATOM 1228 CG ASP A 77 13.801 -11.244 -11.897 1.00 0.00 C ATOM 1229 OD1 ASP A 77 13.986 -12.438 -11.732 1.00 0.00 O ATOM 1230 OD2 ASP A 77 14.139 -10.633 -12.897 1.00 0.00 O ATOM 0 H ASP A 77 10.583 -10.347 -8.855 1.00 0.00 H new ATOM 0 HA ASP A 77 11.434 -11.771 -11.185 1.00 0.00 H new ATOM 0 HB2 ASP A 77 12.835 -9.468 -11.131 1.00 0.00 H new ATOM 0 HB3 ASP A 77 13.778 -10.335 -9.935 1.00 0.00 H new ATOM 1235 N GLY A 78 12.209 -13.476 -9.525 1.00 0.00 N ATOM 1236 CA GLY A 78 12.553 -14.498 -8.494 1.00 0.00 C ATOM 1237 C GLY A 78 11.445 -15.550 -8.439 1.00 0.00 C ATOM 1238 O GLY A 78 11.589 -16.644 -8.951 1.00 0.00 O ATOM 0 H GLY A 78 11.983 -13.852 -10.446 1.00 0.00 H new ATOM 0 HA2 GLY A 78 13.506 -14.969 -8.735 1.00 0.00 H new ATOM 0 HA3 GLY A 78 12.669 -14.024 -7.519 1.00 0.00 H new ATOM 1242 N ARG A 79 10.340 -15.221 -7.822 1.00 0.00 N ATOM 1243 CA ARG A 79 9.210 -16.190 -7.727 1.00 0.00 C ATOM 1244 C ARG A 79 7.884 -15.412 -7.799 1.00 0.00 C ATOM 1245 O ARG A 79 7.902 -14.199 -7.822 1.00 0.00 O ATOM 1246 CB ARG A 79 9.308 -16.942 -6.391 1.00 0.00 C ATOM 1247 CG ARG A 79 9.640 -18.415 -6.647 1.00 0.00 C ATOM 1248 CD ARG A 79 9.862 -19.128 -5.312 1.00 0.00 C ATOM 1249 NE ARG A 79 11.214 -18.786 -4.786 1.00 0.00 N ATOM 1250 CZ ARG A 79 12.220 -19.588 -5.004 1.00 0.00 C ATOM 1251 NH1 ARG A 79 12.181 -20.817 -4.569 1.00 0.00 N ATOM 1252 NH2 ARG A 79 13.266 -19.160 -5.657 1.00 0.00 N ATOM 0 H ARG A 79 10.172 -14.318 -7.378 1.00 0.00 H new ATOM 0 HA ARG A 79 9.253 -16.908 -8.546 1.00 0.00 H new ATOM 0 HB2 ARG A 79 10.077 -16.490 -5.765 1.00 0.00 H new ATOM 0 HB3 ARG A 79 8.366 -16.861 -5.848 1.00 0.00 H new ATOM 0 HG2 ARG A 79 8.828 -18.892 -7.195 1.00 0.00 H new ATOM 0 HG3 ARG A 79 10.533 -18.495 -7.267 1.00 0.00 H new ATOM 0 HD2 ARG A 79 9.095 -18.830 -4.596 1.00 0.00 H new ATOM 0 HD3 ARG A 79 9.773 -20.206 -5.444 1.00 0.00 H new ATOM 0 HE ARG A 79 11.353 -17.926 -4.256 1.00 0.00 H new ATOM 0 HH11 ARG A 79 11.364 -21.152 -4.058 1.00 0.00 H new ATOM 0 HH12 ARG A 79 12.968 -21.444 -4.740 1.00 0.00 H new ATOM 0 HH21 ARG A 79 13.297 -18.199 -5.997 1.00 0.00 H new ATOM 0 HH22 ARG A 79 14.052 -19.787 -5.827 1.00 0.00 H new ATOM 1266 N PRO A 80 6.764 -16.113 -7.829 1.00 0.00 N ATOM 1267 CA PRO A 80 5.447 -15.457 -7.888 1.00 0.00 C ATOM 1268 C PRO A 80 5.085 -14.904 -6.508 1.00 0.00 C ATOM 1269 O PRO A 80 5.879 -14.964 -5.587 1.00 0.00 O ATOM 1270 CB PRO A 80 4.496 -16.578 -8.309 1.00 0.00 C ATOM 1271 CG PRO A 80 5.189 -17.906 -7.928 1.00 0.00 C ATOM 1272 CD PRO A 80 6.693 -17.597 -7.803 1.00 0.00 C ATOM 0 HA PRO A 80 5.410 -14.613 -8.577 1.00 0.00 H new ATOM 0 HB2 PRO A 80 3.535 -16.482 -7.803 1.00 0.00 H new ATOM 0 HB3 PRO A 80 4.298 -16.537 -9.380 1.00 0.00 H new ATOM 0 HG2 PRO A 80 4.794 -18.294 -6.989 1.00 0.00 H new ATOM 0 HG3 PRO A 80 5.012 -18.668 -8.687 1.00 0.00 H new ATOM 0 HD2 PRO A 80 7.107 -17.999 -6.878 1.00 0.00 H new ATOM 0 HD3 PRO A 80 7.260 -18.037 -8.624 1.00 0.00 H new ATOM 1280 N CYS A 81 3.901 -14.364 -6.355 1.00 0.00 N ATOM 1281 CA CYS A 81 3.507 -13.808 -5.028 1.00 0.00 C ATOM 1282 C CYS A 81 2.025 -13.443 -5.007 1.00 0.00 C ATOM 1283 O CYS A 81 1.479 -12.912 -5.953 1.00 0.00 O ATOM 1284 CB CYS A 81 4.345 -12.558 -4.725 1.00 0.00 C ATOM 1285 SG CYS A 81 4.135 -11.338 -6.045 1.00 0.00 S ATOM 0 H CYS A 81 3.196 -14.285 -7.088 1.00 0.00 H new ATOM 0 HA CYS A 81 3.687 -14.569 -4.269 1.00 0.00 H new ATOM 0 HB2 CYS A 81 4.041 -12.129 -3.770 1.00 0.00 H new ATOM 0 HB3 CYS A 81 5.397 -12.829 -4.633 1.00 0.00 H new ATOM 0 HG CYS A 81 4.847 -10.283 -5.778 1.00 0.00 H new ATOM 1291 N LYS A 82 1.391 -13.716 -3.905 1.00 0.00 N ATOM 1292 CA LYS A 82 -0.049 -13.394 -3.737 1.00 0.00 C ATOM 1293 C LYS A 82 -0.186 -12.453 -2.547 1.00 0.00 C ATOM 1294 O LYS A 82 0.795 -11.975 -2.007 1.00 0.00 O ATOM 1295 CB LYS A 82 -0.824 -14.679 -3.461 1.00 0.00 C ATOM 1296 CG LYS A 82 -0.208 -15.418 -2.259 1.00 0.00 C ATOM 1297 CD LYS A 82 -0.901 -16.776 -2.049 1.00 0.00 C ATOM 1298 CE LYS A 82 -2.425 -16.610 -2.070 1.00 0.00 C ATOM 1299 NZ LYS A 82 -3.043 -17.522 -1.066 1.00 0.00 N ATOM 0 H LYS A 82 1.822 -14.160 -3.094 1.00 0.00 H new ATOM 0 HA LYS A 82 -0.444 -12.925 -4.639 1.00 0.00 H new ATOM 0 HB2 LYS A 82 -1.869 -14.446 -3.258 1.00 0.00 H new ATOM 0 HB3 LYS A 82 -0.805 -15.321 -4.342 1.00 0.00 H new ATOM 0 HG2 LYS A 82 0.859 -15.569 -2.425 1.00 0.00 H new ATOM 0 HG3 LYS A 82 -0.308 -14.809 -1.360 1.00 0.00 H new ATOM 0 HD2 LYS A 82 -0.594 -17.472 -2.830 1.00 0.00 H new ATOM 0 HD3 LYS A 82 -0.589 -17.207 -1.097 1.00 0.00 H new ATOM 0 HE2 LYS A 82 -2.691 -15.576 -1.849 1.00 0.00 H new ATOM 0 HE3 LYS A 82 -2.811 -16.833 -3.065 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 -4.046 -17.667 -1.300 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 -2.549 -18.437 -1.077 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 -2.966 -17.099 -0.119 1.00 0.00 H new ATOM 1313 N SER A 83 -1.389 -12.184 -2.140 1.00 0.00 N ATOM 1314 CA SER A 83 -1.599 -11.268 -0.981 1.00 0.00 C ATOM 1315 C SER A 83 -2.808 -11.703 -0.170 1.00 0.00 C ATOM 1316 O SER A 83 -3.469 -12.664 -0.492 1.00 0.00 O ATOM 1317 CB SER A 83 -1.842 -9.856 -1.504 1.00 0.00 C ATOM 1318 OG SER A 83 -2.890 -9.897 -2.467 1.00 0.00 O ATOM 0 H SER A 83 -2.241 -12.557 -2.558 1.00 0.00 H new ATOM 0 HA SER A 83 -0.715 -11.296 -0.345 1.00 0.00 H new ATOM 0 HB2 SER A 83 -2.110 -9.190 -0.683 1.00 0.00 H new ATOM 0 HB3 SER A 83 -0.932 -9.458 -1.953 1.00 0.00 H new ATOM 0 HG SER A 83 -3.602 -9.278 -2.202 1.00 0.00 H new ATOM 1324 N LEU A 84 -3.107 -10.980 0.875 1.00 0.00 N ATOM 1325 CA LEU A 84 -4.298 -11.328 1.707 1.00 0.00 C ATOM 1326 C LEU A 84 -4.597 -10.201 2.678 1.00 0.00 C ATOM 1327 O LEU A 84 -3.782 -9.859 3.509 1.00 0.00 O ATOM 1328 CB LEU A 84 -4.051 -12.623 2.475 1.00 0.00 C ATOM 1329 CG LEU A 84 -5.336 -13.452 2.472 1.00 0.00 C ATOM 1330 CD1 LEU A 84 -4.986 -14.928 2.616 1.00 0.00 C ATOM 1331 CD2 LEU A 84 -6.236 -13.020 3.627 1.00 0.00 C ATOM 0 H LEU A 84 -2.580 -10.165 1.189 1.00 0.00 H new ATOM 0 HA LEU A 84 -5.154 -11.471 1.048 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -3.238 -13.185 2.015 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -3.747 -12.403 3.498 1.00 0.00 H new ATOM 0 HG LEU A 84 -5.865 -13.294 1.532 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -5.901 -15.521 2.614 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -4.353 -15.235 1.783 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -4.453 -15.086 3.554 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -7.149 -13.615 3.619 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -5.713 -13.171 4.572 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -6.489 -11.965 3.517 1.00 0.00 H new ATOM 1343 N VAL A 85 -5.764 -9.621 2.570 1.00 0.00 N ATOM 1344 CA VAL A 85 -6.128 -8.493 3.472 1.00 0.00 C ATOM 1345 C VAL A 85 -6.861 -9.012 4.717 1.00 0.00 C ATOM 1346 O VAL A 85 -7.645 -9.939 4.660 1.00 0.00 O ATOM 1347 CB VAL A 85 -7.012 -7.499 2.694 1.00 0.00 C ATOM 1348 CG1 VAL A 85 -7.634 -6.455 3.637 1.00 0.00 C ATOM 1349 CG2 VAL A 85 -6.155 -6.779 1.651 1.00 0.00 C ATOM 0 H VAL A 85 -6.481 -9.882 1.893 1.00 0.00 H new ATOM 0 HA VAL A 85 -5.223 -7.988 3.808 1.00 0.00 H new ATOM 0 HB VAL A 85 -7.817 -8.055 2.213 1.00 0.00 H new ATOM 0 HG11 VAL A 85 -8.252 -5.767 3.061 1.00 0.00 H new ATOM 0 HG12 VAL A 85 -8.249 -6.959 4.382 1.00 0.00 H new ATOM 0 HG13 VAL A 85 -6.841 -5.898 4.137 1.00 0.00 H new ATOM 0 HG21 VAL A 85 -6.773 -6.074 1.096 1.00 0.00 H new ATOM 0 HG22 VAL A 85 -5.350 -6.241 2.151 1.00 0.00 H new ATOM 0 HG23 VAL A 85 -5.730 -7.509 0.962 1.00 0.00 H new ATOM 1359 N LYS A 86 -6.609 -8.383 5.834 1.00 0.00 N ATOM 1360 CA LYS A 86 -7.271 -8.767 7.104 1.00 0.00 C ATOM 1361 C LYS A 86 -7.470 -7.505 7.946 1.00 0.00 C ATOM 1362 O LYS A 86 -7.450 -6.400 7.436 1.00 0.00 O ATOM 1363 CB LYS A 86 -6.393 -9.773 7.854 1.00 0.00 C ATOM 1364 CG LYS A 86 -7.258 -10.886 8.460 1.00 0.00 C ATOM 1365 CD LYS A 86 -8.023 -11.632 7.355 1.00 0.00 C ATOM 1366 CE LYS A 86 -9.513 -11.267 7.414 1.00 0.00 C ATOM 1367 NZ LYS A 86 -10.270 -12.378 8.058 1.00 0.00 N ATOM 0 H LYS A 86 -5.957 -7.603 5.916 1.00 0.00 H new ATOM 0 HA LYS A 86 -8.237 -9.231 6.905 1.00 0.00 H new ATOM 0 HB2 LYS A 86 -5.659 -10.204 7.173 1.00 0.00 H new ATOM 0 HB3 LYS A 86 -5.838 -9.265 8.642 1.00 0.00 H new ATOM 0 HG2 LYS A 86 -6.629 -11.585 9.011 1.00 0.00 H new ATOM 0 HG3 LYS A 86 -7.962 -10.460 9.174 1.00 0.00 H new ATOM 0 HD2 LYS A 86 -7.614 -11.372 6.379 1.00 0.00 H new ATOM 0 HD3 LYS A 86 -7.898 -12.708 7.477 1.00 0.00 H new ATOM 0 HE2 LYS A 86 -9.651 -10.344 7.977 1.00 0.00 H new ATOM 0 HE3 LYS A 86 -9.895 -11.087 6.409 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 -11.280 -12.132 8.099 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 -10.148 -13.249 7.503 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 -9.911 -12.529 9.022 1.00 0.00 H new ATOM 1381 N TRP A 87 -7.686 -7.664 9.219 1.00 0.00 N ATOM 1382 CA TRP A 87 -7.915 -6.486 10.104 1.00 0.00 C ATOM 1383 C TRP A 87 -6.886 -6.418 11.223 1.00 0.00 C ATOM 1384 O TRP A 87 -5.975 -7.217 11.318 1.00 0.00 O ATOM 1385 CB TRP A 87 -9.293 -6.606 10.717 1.00 0.00 C ATOM 1386 CG TRP A 87 -10.270 -6.505 9.625 1.00 0.00 C ATOM 1387 CD1 TRP A 87 -10.874 -7.548 9.041 1.00 0.00 C ATOM 1388 CD2 TRP A 87 -10.735 -5.314 8.945 1.00 0.00 C ATOM 1389 NE1 TRP A 87 -11.719 -7.075 8.068 1.00 0.00 N ATOM 1390 CE2 TRP A 87 -11.663 -5.702 7.964 1.00 0.00 C ATOM 1391 CE3 TRP A 87 -10.450 -3.946 9.092 1.00 0.00 C ATOM 1392 CZ2 TRP A 87 -12.293 -4.770 7.151 1.00 0.00 C ATOM 1393 CZ3 TRP A 87 -11.079 -3.001 8.269 1.00 0.00 C ATOM 1394 CH2 TRP A 87 -12.001 -3.414 7.300 1.00 0.00 C ATOM 0 H TRP A 87 -7.714 -8.568 9.691 1.00 0.00 H new ATOM 0 HA TRP A 87 -7.826 -5.581 9.504 1.00 0.00 H new ATOM 0 HB2 TRP A 87 -9.399 -7.556 11.240 1.00 0.00 H new ATOM 0 HB3 TRP A 87 -9.456 -5.818 11.452 1.00 0.00 H new ATOM 0 HD1 TRP A 87 -10.722 -8.587 9.293 1.00 0.00 H new ATOM 0 HE1 TRP A 87 -12.316 -7.668 7.492 1.00 0.00 H new ATOM 0 HE3 TRP A 87 -9.744 -3.621 9.842 1.00 0.00 H new ATOM 0 HZ2 TRP A 87 -13.006 -5.093 6.407 1.00 0.00 H new ATOM 0 HZ3 TRP A 87 -10.851 -1.951 8.383 1.00 0.00 H new ATOM 0 HH2 TRP A 87 -12.486 -2.684 6.669 1.00 0.00 H new ATOM 1405 N GLU A 88 -7.052 -5.447 12.068 1.00 0.00 N ATOM 1406 CA GLU A 88 -6.134 -5.246 13.215 1.00 0.00 C ATOM 1407 C GLU A 88 -6.997 -4.961 14.448 1.00 0.00 C ATOM 1408 O GLU A 88 -6.850 -5.574 15.489 1.00 0.00 O ATOM 1409 CB GLU A 88 -5.228 -4.045 12.874 1.00 0.00 C ATOM 1410 CG GLU A 88 -4.628 -3.394 14.131 1.00 0.00 C ATOM 1411 CD GLU A 88 -3.757 -4.411 14.872 1.00 0.00 C ATOM 1412 OE1 GLU A 88 -2.917 -5.021 14.231 1.00 0.00 O ATOM 1413 OE2 GLU A 88 -3.946 -4.562 16.068 1.00 0.00 O ATOM 0 H GLU A 88 -7.808 -4.765 12.009 1.00 0.00 H new ATOM 0 HA GLU A 88 -5.509 -6.117 13.414 1.00 0.00 H new ATOM 0 HB2 GLU A 88 -4.422 -4.375 12.218 1.00 0.00 H new ATOM 0 HB3 GLU A 88 -5.804 -3.302 12.322 1.00 0.00 H new ATOM 0 HG2 GLU A 88 -4.032 -2.525 13.853 1.00 0.00 H new ATOM 0 HG3 GLU A 88 -5.425 -3.039 14.784 1.00 0.00 H new ATOM 1420 N SER A 89 -7.886 -4.021 14.317 1.00 0.00 N ATOM 1421 CA SER A 89 -8.776 -3.645 15.448 1.00 0.00 C ATOM 1422 C SER A 89 -10.223 -3.569 14.959 1.00 0.00 C ATOM 1423 O SER A 89 -11.124 -4.146 15.533 1.00 0.00 O ATOM 1424 CB SER A 89 -8.355 -2.268 15.957 1.00 0.00 C ATOM 1425 OG SER A 89 -8.233 -1.382 14.845 1.00 0.00 O ATOM 0 H SER A 89 -8.037 -3.488 13.460 1.00 0.00 H new ATOM 0 HA SER A 89 -8.699 -4.388 16.242 1.00 0.00 H new ATOM 0 HB2 SER A 89 -9.091 -1.886 16.664 1.00 0.00 H new ATOM 0 HB3 SER A 89 -7.407 -2.337 16.490 1.00 0.00 H new ATOM 0 HG SER A 89 -8.958 -0.723 14.871 1.00 0.00 H new ATOM 1431 N GLU A 90 -10.429 -2.840 13.902 1.00 0.00 N ATOM 1432 CA GLU A 90 -11.791 -2.654 13.312 1.00 0.00 C ATOM 1433 C GLU A 90 -11.674 -1.568 12.245 1.00 0.00 C ATOM 1434 O GLU A 90 -12.265 -1.644 11.188 1.00 0.00 O ATOM 1435 CB GLU A 90 -12.797 -2.207 14.383 1.00 0.00 C ATOM 1436 CG GLU A 90 -12.251 -0.988 15.132 1.00 0.00 C ATOM 1437 CD GLU A 90 -12.759 -1.006 16.575 1.00 0.00 C ATOM 1438 OE1 GLU A 90 -13.934 -1.273 16.766 1.00 0.00 O ATOM 1439 OE2 GLU A 90 -11.964 -0.753 17.465 1.00 0.00 O ATOM 0 H GLU A 90 -9.688 -2.347 13.403 1.00 0.00 H new ATOM 0 HA GLU A 90 -12.147 -3.594 12.891 1.00 0.00 H new ATOM 0 HB2 GLU A 90 -13.752 -1.962 13.918 1.00 0.00 H new ATOM 0 HB3 GLU A 90 -12.983 -3.022 15.083 1.00 0.00 H new ATOM 0 HG2 GLU A 90 -11.161 -0.998 15.119 1.00 0.00 H new ATOM 0 HG3 GLU A 90 -12.567 -0.071 14.635 1.00 0.00 H new ATOM 1446 N ASN A 91 -10.862 -0.583 12.514 1.00 0.00 N ATOM 1447 CA ASN A 91 -10.616 0.509 11.530 1.00 0.00 C ATOM 1448 C ASN A 91 -9.176 0.393 11.024 1.00 0.00 C ATOM 1449 O ASN A 91 -8.721 1.216 10.253 1.00 0.00 O ATOM 1450 CB ASN A 91 -10.810 1.866 12.192 1.00 0.00 C ATOM 1451 CG ASN A 91 -12.246 2.009 12.701 1.00 0.00 C ATOM 1452 OD1 ASN A 91 -12.983 1.045 12.775 1.00 0.00 O ATOM 1453 ND2 ASN A 91 -12.678 3.190 13.049 1.00 0.00 N ATOM 0 H ASN A 91 -10.349 -0.487 13.391 1.00 0.00 H new ATOM 0 HA ASN A 91 -11.319 0.419 10.701 1.00 0.00 H new ATOM 0 HB2 ASN A 91 -10.111 1.977 13.021 1.00 0.00 H new ATOM 0 HB3 ASN A 91 -10.589 2.661 11.479 1.00 0.00 H new ATOM 0 HD21 ASN A 91 -13.635 3.305 13.383 1.00 0.00 H new ATOM 0 HD22 ASN A 91 -12.059 3.998 12.987 1.00 0.00 H new ATOM 1460 N LYS A 92 -8.459 -0.633 11.438 1.00 0.00 N ATOM 1461 CA LYS A 92 -7.080 -0.826 10.955 1.00 0.00 C ATOM 1462 C LYS A 92 -7.076 -2.159 10.222 1.00 0.00 C ATOM 1463 O LYS A 92 -7.730 -3.091 10.639 1.00 0.00 O ATOM 1464 CB LYS A 92 -6.116 -0.878 12.140 1.00 0.00 C ATOM 1465 CG LYS A 92 -5.807 0.541 12.607 1.00 0.00 C ATOM 1466 CD LYS A 92 -7.076 1.181 13.175 1.00 0.00 C ATOM 1467 CE LYS A 92 -6.703 2.129 14.317 1.00 0.00 C ATOM 1468 NZ LYS A 92 -6.793 1.401 15.614 1.00 0.00 N ATOM 0 H LYS A 92 -8.788 -1.341 12.095 1.00 0.00 H new ATOM 0 HA LYS A 92 -6.764 -0.010 10.305 1.00 0.00 H new ATOM 0 HB2 LYS A 92 -6.556 -1.453 12.955 1.00 0.00 H new ATOM 0 HB3 LYS A 92 -5.196 -1.386 11.852 1.00 0.00 H new ATOM 0 HG2 LYS A 92 -5.025 0.523 13.366 1.00 0.00 H new ATOM 0 HG3 LYS A 92 -5.429 1.135 11.775 1.00 0.00 H new ATOM 0 HD2 LYS A 92 -7.602 1.727 12.392 1.00 0.00 H new ATOM 0 HD3 LYS A 92 -7.755 0.409 13.536 1.00 0.00 H new ATOM 0 HE2 LYS A 92 -5.693 2.512 14.171 1.00 0.00 H new ATOM 0 HE3 LYS A 92 -7.372 2.990 14.323 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 -7.399 1.934 16.270 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 -7.200 0.457 15.455 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 -5.842 1.303 16.024 1.00 0.00 H new ATOM 1482 N MET A 93 -6.364 -2.263 9.142 1.00 0.00 N ATOM 1483 CA MET A 93 -6.340 -3.552 8.392 1.00 0.00 C ATOM 1484 C MET A 93 -4.974 -3.753 7.770 1.00 0.00 C ATOM 1485 O MET A 93 -4.191 -2.832 7.638 1.00 0.00 O ATOM 1486 CB MET A 93 -7.418 -3.627 7.287 1.00 0.00 C ATOM 1487 CG MET A 93 -7.907 -2.237 6.858 1.00 0.00 C ATOM 1488 SD MET A 93 -8.226 -2.213 5.074 1.00 0.00 S ATOM 1489 CE MET A 93 -9.331 -3.644 5.022 1.00 0.00 C ATOM 0 H MET A 93 -5.797 -1.515 8.742 1.00 0.00 H new ATOM 0 HA MET A 93 -6.558 -4.341 9.112 1.00 0.00 H new ATOM 0 HB2 MET A 93 -7.012 -4.151 6.421 1.00 0.00 H new ATOM 0 HB3 MET A 93 -8.264 -4.213 7.646 1.00 0.00 H new ATOM 0 HG2 MET A 93 -8.816 -1.979 7.401 1.00 0.00 H new ATOM 0 HG3 MET A 93 -7.159 -1.485 7.112 1.00 0.00 H new ATOM 0 HE1 MET A 93 -10.131 -3.460 4.305 1.00 0.00 H new ATOM 0 HE2 MET A 93 -8.769 -4.527 4.719 1.00 0.00 H new ATOM 0 HE3 MET A 93 -9.760 -3.808 6.010 1.00 0.00 H new ATOM 1499 N VAL A 94 -4.689 -4.964 7.406 1.00 0.00 N ATOM 1500 CA VAL A 94 -3.371 -5.285 6.801 1.00 0.00 C ATOM 1501 C VAL A 94 -3.561 -5.953 5.448 1.00 0.00 C ATOM 1502 O VAL A 94 -4.660 -6.119 4.960 1.00 0.00 O ATOM 1503 CB VAL A 94 -2.614 -6.250 7.716 1.00 0.00 C ATOM 1504 CG1 VAL A 94 -2.081 -5.502 8.939 1.00 0.00 C ATOM 1505 CG2 VAL A 94 -3.561 -7.365 8.163 1.00 0.00 C ATOM 0 H VAL A 94 -5.321 -5.759 7.502 1.00 0.00 H new ATOM 0 HA VAL A 94 -2.810 -4.359 6.676 1.00 0.00 H new ATOM 0 HB VAL A 94 -1.772 -6.680 7.173 1.00 0.00 H new ATOM 0 HG11 VAL A 94 -1.544 -6.197 9.585 1.00 0.00 H new ATOM 0 HG12 VAL A 94 -1.405 -4.710 8.615 1.00 0.00 H new ATOM 0 HG13 VAL A 94 -2.914 -5.065 9.490 1.00 0.00 H new ATOM 0 HG21 VAL A 94 -3.027 -8.056 8.815 1.00 0.00 H new ATOM 0 HG22 VAL A 94 -4.403 -6.932 8.704 1.00 0.00 H new ATOM 0 HG23 VAL A 94 -3.929 -7.902 7.289 1.00 0.00 H new ATOM 1515 N CYS A 95 -2.477 -6.346 4.859 1.00 0.00 N ATOM 1516 CA CYS A 95 -2.518 -7.036 3.549 1.00 0.00 C ATOM 1517 C CYS A 95 -1.167 -7.698 3.355 1.00 0.00 C ATOM 1518 O CYS A 95 -0.330 -7.216 2.620 1.00 0.00 O ATOM 1519 CB CYS A 95 -2.774 -6.034 2.434 1.00 0.00 C ATOM 1520 SG CYS A 95 -3.017 -6.921 0.875 1.00 0.00 S ATOM 0 H CYS A 95 -1.540 -6.215 5.240 1.00 0.00 H new ATOM 0 HA CYS A 95 -3.321 -7.773 3.524 1.00 0.00 H new ATOM 0 HB2 CYS A 95 -3.654 -5.433 2.665 1.00 0.00 H new ATOM 0 HB3 CYS A 95 -1.932 -5.347 2.347 1.00 0.00 H new ATOM 0 HG CYS A 95 -2.955 -6.082 -0.116 1.00 0.00 H new ATOM 1526 N GLU A 96 -0.932 -8.775 4.052 1.00 0.00 N ATOM 1527 CA GLU A 96 0.393 -9.443 3.956 1.00 0.00 C ATOM 1528 C GLU A 96 0.602 -10.051 2.573 1.00 0.00 C ATOM 1529 O GLU A 96 0.009 -11.054 2.224 1.00 0.00 O ATOM 1530 CB GLU A 96 0.514 -10.539 5.012 1.00 0.00 C ATOM 1531 CG GLU A 96 1.963 -11.026 5.044 1.00 0.00 C ATOM 1532 CD GLU A 96 2.070 -12.268 5.931 1.00 0.00 C ATOM 1533 OE1 GLU A 96 1.496 -12.254 7.008 1.00 0.00 O ATOM 1534 OE2 GLU A 96 2.723 -13.212 5.519 1.00 0.00 O ATOM 0 H GLU A 96 -1.600 -9.220 4.682 1.00 0.00 H new ATOM 0 HA GLU A 96 1.158 -8.686 4.127 1.00 0.00 H new ATOM 0 HB2 GLU A 96 0.222 -10.156 5.990 1.00 0.00 H new ATOM 0 HB3 GLU A 96 -0.158 -11.365 4.779 1.00 0.00 H new ATOM 0 HG2 GLU A 96 2.301 -11.258 4.034 1.00 0.00 H new ATOM 0 HG3 GLU A 96 2.613 -10.238 5.425 1.00 0.00 H new ATOM 1541 N GLN A 97 1.467 -9.456 1.798 1.00 0.00 N ATOM 1542 CA GLN A 97 1.763 -9.984 0.448 1.00 0.00 C ATOM 1543 C GLN A 97 3.030 -10.843 0.530 1.00 0.00 C ATOM 1544 O GLN A 97 4.064 -10.381 0.977 1.00 0.00 O ATOM 1545 CB GLN A 97 2.000 -8.810 -0.500 1.00 0.00 C ATOM 1546 CG GLN A 97 0.761 -7.912 -0.527 1.00 0.00 C ATOM 1547 CD GLN A 97 0.529 -7.391 -1.948 1.00 0.00 C ATOM 1548 OE1 GLN A 97 1.437 -7.362 -2.755 1.00 0.00 O ATOM 1549 NE2 GLN A 97 -0.660 -6.975 -2.290 1.00 0.00 N ATOM 0 H GLN A 97 1.985 -8.615 2.052 1.00 0.00 H new ATOM 0 HA GLN A 97 0.931 -10.585 0.081 1.00 0.00 H new ATOM 0 HB2 GLN A 97 2.869 -8.238 -0.176 1.00 0.00 H new ATOM 0 HB3 GLN A 97 2.217 -9.178 -1.503 1.00 0.00 H new ATOM 0 HG2 GLN A 97 -0.111 -8.470 -0.188 1.00 0.00 H new ATOM 0 HG3 GLN A 97 0.892 -7.076 0.160 1.00 0.00 H new ATOM 0 HE21 GLN A 97 -1.423 -6.999 -1.613 1.00 0.00 H new ATOM 0 HE22 GLN A 97 -0.826 -6.626 -3.234 1.00 0.00 H new ATOM 1558 N LYS A 98 2.964 -12.088 0.123 1.00 0.00 N ATOM 1559 CA LYS A 98 4.179 -12.961 0.203 1.00 0.00 C ATOM 1560 C LYS A 98 4.496 -13.554 -1.172 1.00 0.00 C ATOM 1561 O LYS A 98 3.685 -13.508 -2.073 1.00 0.00 O ATOM 1562 CB LYS A 98 3.925 -14.094 1.198 1.00 0.00 C ATOM 1563 CG LYS A 98 2.644 -14.836 0.811 1.00 0.00 C ATOM 1564 CD LYS A 98 2.369 -15.943 1.830 1.00 0.00 C ATOM 1565 CE LYS A 98 0.945 -16.469 1.641 1.00 0.00 C ATOM 1566 NZ LYS A 98 0.869 -17.880 2.114 1.00 0.00 N ATOM 0 H LYS A 98 2.130 -12.535 -0.258 1.00 0.00 H new ATOM 0 HA LYS A 98 5.026 -12.361 0.534 1.00 0.00 H new ATOM 0 HB2 LYS A 98 4.769 -14.783 1.204 1.00 0.00 H new ATOM 0 HB3 LYS A 98 3.834 -13.692 2.207 1.00 0.00 H new ATOM 0 HG2 LYS A 98 1.805 -14.141 0.777 1.00 0.00 H new ATOM 0 HG3 LYS A 98 2.745 -15.262 -0.187 1.00 0.00 H new ATOM 0 HD2 LYS A 98 3.087 -16.754 1.705 1.00 0.00 H new ATOM 0 HD3 LYS A 98 2.495 -15.559 2.842 1.00 0.00 H new ATOM 0 HE2 LYS A 98 0.241 -15.850 2.196 1.00 0.00 H new ATOM 0 HE3 LYS A 98 0.661 -16.411 0.590 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 -0.099 -18.238 1.985 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 1.530 -18.466 1.565 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 1.123 -17.922 3.122 1.00 0.00 H new ATOM 1580 N LEU A 99 5.668 -14.122 -1.331 1.00 0.00 N ATOM 1581 CA LEU A 99 6.032 -14.736 -2.653 1.00 0.00 C ATOM 1582 C LEU A 99 5.894 -16.257 -2.566 1.00 0.00 C ATOM 1583 O LEU A 99 6.664 -16.996 -3.148 1.00 0.00 O ATOM 1584 CB LEU A 99 7.462 -14.366 -3.110 1.00 0.00 C ATOM 1585 CG LEU A 99 8.381 -14.093 -1.922 1.00 0.00 C ATOM 1586 CD1 LEU A 99 9.816 -14.483 -2.282 1.00 0.00 C ATOM 1587 CD2 LEU A 99 8.333 -12.602 -1.583 1.00 0.00 C ATOM 0 H LEU A 99 6.386 -14.188 -0.609 1.00 0.00 H new ATOM 0 HA LEU A 99 5.344 -14.334 -3.397 1.00 0.00 H new ATOM 0 HB2 LEU A 99 7.874 -15.178 -3.710 1.00 0.00 H new ATOM 0 HB3 LEU A 99 7.423 -13.485 -3.750 1.00 0.00 H new ATOM 0 HG LEU A 99 8.051 -14.679 -1.064 1.00 0.00 H new ATOM 0 HD11 LEU A 99 10.470 -14.287 -1.432 1.00 0.00 H new ATOM 0 HD12 LEU A 99 9.853 -15.543 -2.532 1.00 0.00 H new ATOM 0 HD13 LEU A 99 10.148 -13.897 -3.139 1.00 0.00 H new ATOM 0 HD21 LEU A 99 8.987 -12.400 -0.735 1.00 0.00 H new ATOM 0 HD22 LEU A 99 8.666 -12.022 -2.444 1.00 0.00 H new ATOM 0 HD23 LEU A 99 7.312 -12.320 -1.328 1.00 0.00 H new ATOM 1599 N LEU A 100 4.898 -16.725 -1.852 1.00 0.00 N ATOM 1600 CA LEU A 100 4.670 -18.199 -1.726 1.00 0.00 C ATOM 1601 C LEU A 100 5.906 -18.901 -1.152 1.00 0.00 C ATOM 1602 O LEU A 100 6.066 -20.099 -1.295 1.00 0.00 O ATOM 1603 CB LEU A 100 4.371 -18.774 -3.104 1.00 0.00 C ATOM 1604 CG LEU A 100 3.119 -18.105 -3.675 1.00 0.00 C ATOM 1605 CD1 LEU A 100 3.061 -18.327 -5.187 1.00 0.00 C ATOM 1606 CD2 LEU A 100 1.875 -18.711 -3.022 1.00 0.00 C ATOM 0 H LEU A 100 4.228 -16.144 -1.347 1.00 0.00 H new ATOM 0 HA LEU A 100 3.831 -18.363 -1.050 1.00 0.00 H new ATOM 0 HB2 LEU A 100 5.219 -18.611 -3.769 1.00 0.00 H new ATOM 0 HB3 LEU A 100 4.222 -19.852 -3.036 1.00 0.00 H new ATOM 0 HG LEU A 100 3.155 -17.035 -3.469 1.00 0.00 H new ATOM 0 HD11 LEU A 100 2.168 -17.849 -5.591 1.00 0.00 H new ATOM 0 HD12 LEU A 100 3.946 -17.894 -5.653 1.00 0.00 H new ATOM 0 HD13 LEU A 100 3.027 -19.396 -5.397 1.00 0.00 H new ATOM 0 HD21 LEU A 100 0.982 -18.235 -3.428 1.00 0.00 H new ATOM 0 HD22 LEU A 100 1.841 -19.781 -3.227 1.00 0.00 H new ATOM 0 HD23 LEU A 100 1.914 -18.549 -1.945 1.00 0.00 H new ATOM 1618 N LYS A 101 6.774 -18.172 -0.505 1.00 0.00 N ATOM 1619 CA LYS A 101 7.997 -18.793 0.083 1.00 0.00 C ATOM 1620 C LYS A 101 8.801 -17.723 0.818 1.00 0.00 C ATOM 1621 O LYS A 101 9.047 -17.820 2.006 1.00 0.00 O ATOM 1622 CB LYS A 101 8.851 -19.406 -1.033 1.00 0.00 C ATOM 1623 CG LYS A 101 9.419 -20.750 -0.568 1.00 0.00 C ATOM 1624 CD LYS A 101 8.489 -21.879 -1.016 1.00 0.00 C ATOM 1625 CE LYS A 101 9.261 -23.200 -1.037 1.00 0.00 C ATOM 1626 NZ LYS A 101 8.779 -24.038 -2.171 1.00 0.00 N ATOM 0 H LYS A 101 6.689 -17.166 -0.357 1.00 0.00 H new ATOM 0 HA LYS A 101 7.708 -19.577 0.783 1.00 0.00 H new ATOM 0 HB2 LYS A 101 8.248 -19.546 -1.930 1.00 0.00 H new ATOM 0 HB3 LYS A 101 9.663 -18.729 -1.297 1.00 0.00 H new ATOM 0 HG2 LYS A 101 10.416 -20.899 -0.983 1.00 0.00 H new ATOM 0 HG3 LYS A 101 9.521 -20.758 0.517 1.00 0.00 H new ATOM 0 HD2 LYS A 101 7.638 -21.954 -0.339 1.00 0.00 H new ATOM 0 HD3 LYS A 101 8.090 -21.663 -2.007 1.00 0.00 H new ATOM 0 HE2 LYS A 101 10.329 -23.008 -1.141 1.00 0.00 H new ATOM 0 HE3 LYS A 101 9.122 -23.730 -0.095 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 9.303 -24.936 -2.186 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 7.764 -24.231 -2.053 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 8.933 -23.532 -3.067 1.00 0.00 H new ATOM 1640 N GLY A 102 9.206 -16.701 0.115 1.00 0.00 N ATOM 1641 CA GLY A 102 9.993 -15.607 0.752 1.00 0.00 C ATOM 1642 C GLY A 102 11.472 -15.984 0.789 1.00 0.00 C ATOM 1643 O GLY A 102 11.834 -17.101 1.108 1.00 0.00 O ATOM 0 H GLY A 102 9.024 -16.576 -0.881 1.00 0.00 H new ATOM 0 HA2 GLY A 102 9.859 -14.679 0.195 1.00 0.00 H new ATOM 0 HA3 GLY A 102 9.629 -15.427 1.764 1.00 0.00 H new ATOM 1647 N GLU A 103 12.324 -15.047 0.479 1.00 0.00 N ATOM 1648 CA GLU A 103 13.789 -15.314 0.505 1.00 0.00 C ATOM 1649 C GLU A 103 14.406 -14.513 1.650 1.00 0.00 C ATOM 1650 O GLU A 103 15.293 -14.976 2.342 1.00 0.00 O ATOM 1651 CB GLU A 103 14.425 -14.900 -0.828 1.00 0.00 C ATOM 1652 CG GLU A 103 14.011 -13.469 -1.185 1.00 0.00 C ATOM 1653 CD GLU A 103 14.719 -13.041 -2.472 1.00 0.00 C ATOM 1654 OE1 GLU A 103 15.857 -12.610 -2.383 1.00 0.00 O ATOM 1655 OE2 GLU A 103 14.112 -13.152 -3.524 1.00 0.00 O ATOM 0 H GLU A 103 12.065 -14.099 0.206 1.00 0.00 H new ATOM 0 HA GLU A 103 13.970 -16.378 0.655 1.00 0.00 H new ATOM 0 HB2 GLU A 103 15.511 -14.966 -0.758 1.00 0.00 H new ATOM 0 HB3 GLU A 103 14.114 -15.585 -1.617 1.00 0.00 H new ATOM 0 HG2 GLU A 103 12.930 -13.413 -1.316 1.00 0.00 H new ATOM 0 HG3 GLU A 103 14.269 -12.790 -0.372 1.00 0.00 H new ATOM 1662 N GLY A 104 13.922 -13.318 1.858 1.00 0.00 N ATOM 1663 CA GLY A 104 14.440 -12.466 2.959 1.00 0.00 C ATOM 1664 C GLY A 104 13.291 -11.581 3.470 1.00 0.00 C ATOM 1665 O GLY A 104 12.596 -11.966 4.390 1.00 0.00 O ATOM 0 H GLY A 104 13.180 -12.893 1.302 1.00 0.00 H new ATOM 0 HA2 GLY A 104 14.829 -13.086 3.767 1.00 0.00 H new ATOM 0 HA3 GLY A 104 15.265 -11.849 2.604 1.00 0.00 H new ATOM 1669 N PRO A 105 13.103 -10.422 2.861 1.00 0.00 N ATOM 1670 CA PRO A 105 12.025 -9.503 3.259 1.00 0.00 C ATOM 1671 C PRO A 105 10.701 -9.919 2.602 1.00 0.00 C ATOM 1672 O PRO A 105 10.545 -11.046 2.170 1.00 0.00 O ATOM 1673 CB PRO A 105 12.499 -8.148 2.739 1.00 0.00 C ATOM 1674 CG PRO A 105 13.504 -8.436 1.598 1.00 0.00 C ATOM 1675 CD PRO A 105 13.936 -9.908 1.745 1.00 0.00 C ATOM 0 HA PRO A 105 11.838 -9.495 4.333 1.00 0.00 H new ATOM 0 HB2 PRO A 105 11.658 -7.558 2.374 1.00 0.00 H new ATOM 0 HB3 PRO A 105 12.972 -7.572 3.535 1.00 0.00 H new ATOM 0 HG2 PRO A 105 13.044 -8.264 0.625 1.00 0.00 H new ATOM 0 HG3 PRO A 105 14.366 -7.772 1.665 1.00 0.00 H new ATOM 0 HD2 PRO A 105 13.761 -10.468 0.826 1.00 0.00 H new ATOM 0 HD3 PRO A 105 14.999 -9.990 1.971 1.00 0.00 H new ATOM 1683 N LYS A 106 9.742 -9.023 2.538 1.00 0.00 N ATOM 1684 CA LYS A 106 8.428 -9.372 1.928 1.00 0.00 C ATOM 1685 C LYS A 106 7.606 -8.103 1.687 1.00 0.00 C ATOM 1686 O LYS A 106 7.938 -7.035 2.164 1.00 0.00 O ATOM 1687 CB LYS A 106 7.680 -10.281 2.894 1.00 0.00 C ATOM 1688 CG LYS A 106 7.025 -11.433 2.128 1.00 0.00 C ATOM 1689 CD LYS A 106 7.008 -12.687 3.005 1.00 0.00 C ATOM 1690 CE LYS A 106 8.400 -13.321 3.021 1.00 0.00 C ATOM 1691 NZ LYS A 106 8.446 -14.391 4.058 1.00 0.00 N ATOM 0 H LYS A 106 9.818 -8.066 2.883 1.00 0.00 H new ATOM 0 HA LYS A 106 8.586 -9.874 0.973 1.00 0.00 H new ATOM 0 HB2 LYS A 106 8.368 -10.675 3.642 1.00 0.00 H new ATOM 0 HB3 LYS A 106 6.921 -9.711 3.429 1.00 0.00 H new ATOM 0 HG2 LYS A 106 6.008 -11.162 1.843 1.00 0.00 H new ATOM 0 HG3 LYS A 106 7.573 -11.629 1.206 1.00 0.00 H new ATOM 0 HD2 LYS A 106 6.703 -12.430 4.019 1.00 0.00 H new ATOM 0 HD3 LYS A 106 6.277 -13.400 2.624 1.00 0.00 H new ATOM 0 HE2 LYS A 106 8.632 -13.739 2.041 1.00 0.00 H new ATOM 0 HE3 LYS A 106 9.154 -12.563 3.231 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 9.392 -14.823 4.070 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 8.242 -13.979 4.991 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 7.736 -15.119 3.838 1.00 0.00 H new ATOM 1705 N THR A 107 6.526 -8.224 0.959 1.00 0.00 N ATOM 1706 CA THR A 107 5.663 -7.045 0.680 1.00 0.00 C ATOM 1707 C THR A 107 4.402 -7.128 1.540 1.00 0.00 C ATOM 1708 O THR A 107 4.089 -8.161 2.096 1.00 0.00 O ATOM 1709 CB THR A 107 5.271 -7.059 -0.802 1.00 0.00 C ATOM 1710 OG1 THR A 107 5.114 -8.401 -1.245 1.00 0.00 O ATOM 1711 CG2 THR A 107 6.355 -6.385 -1.636 1.00 0.00 C ATOM 0 H THR A 107 6.205 -9.099 0.544 1.00 0.00 H new ATOM 0 HA THR A 107 6.200 -6.126 0.913 1.00 0.00 H new ATOM 0 HB THR A 107 4.332 -6.519 -0.921 1.00 0.00 H new ATOM 0 HG1 THR A 107 4.862 -8.406 -2.192 1.00 0.00 H new ATOM 0 HG21 THR A 107 6.067 -6.400 -2.687 1.00 0.00 H new ATOM 0 HG22 THR A 107 6.477 -5.353 -1.308 1.00 0.00 H new ATOM 0 HG23 THR A 107 7.296 -6.920 -1.510 1.00 0.00 H new ATOM 1719 N SER A 108 3.680 -6.040 1.656 1.00 0.00 N ATOM 1720 CA SER A 108 2.429 -6.031 2.481 1.00 0.00 C ATOM 1721 C SER A 108 1.904 -4.597 2.571 1.00 0.00 C ATOM 1722 O SER A 108 2.569 -3.666 2.162 1.00 0.00 O ATOM 1723 CB SER A 108 2.731 -6.529 3.898 1.00 0.00 C ATOM 1724 OG SER A 108 3.966 -5.979 4.337 1.00 0.00 O ATOM 0 H SER A 108 3.905 -5.150 1.211 1.00 0.00 H new ATOM 0 HA SER A 108 1.689 -6.682 2.016 1.00 0.00 H new ATOM 0 HB2 SER A 108 1.929 -6.238 4.576 1.00 0.00 H new ATOM 0 HB3 SER A 108 2.780 -7.618 3.910 1.00 0.00 H new ATOM 0 HG SER A 108 4.161 -6.295 5.244 1.00 0.00 H new ATOM 1730 N TRP A 109 0.740 -4.405 3.145 1.00 0.00 N ATOM 1731 CA TRP A 109 0.212 -3.015 3.313 1.00 0.00 C ATOM 1732 C TRP A 109 -0.877 -2.998 4.354 1.00 0.00 C ATOM 1733 O TRP A 109 -1.661 -3.920 4.469 1.00 0.00 O ATOM 1734 CB TRP A 109 -0.297 -2.387 1.996 1.00 0.00 C ATOM 1735 CG TRP A 109 -1.529 -3.018 1.419 1.00 0.00 C ATOM 1736 CD1 TRP A 109 -1.551 -3.644 0.225 1.00 0.00 C ATOM 1737 CD2 TRP A 109 -2.915 -3.027 1.913 1.00 0.00 C ATOM 1738 NE1 TRP A 109 -2.842 -4.051 -0.053 1.00 0.00 N ATOM 1739 CE2 TRP A 109 -3.720 -3.701 0.954 1.00 0.00 C ATOM 1740 CE3 TRP A 109 -3.556 -2.540 3.081 1.00 0.00 C ATOM 1741 CZ2 TRP A 109 -5.093 -3.878 1.142 1.00 0.00 C ATOM 1742 CZ3 TRP A 109 -4.934 -2.726 3.263 1.00 0.00 C ATOM 1743 CH2 TRP A 109 -5.696 -3.391 2.297 1.00 0.00 C ATOM 0 H TRP A 109 0.137 -5.146 3.502 1.00 0.00 H new ATOM 0 HA TRP A 109 1.051 -2.402 3.641 1.00 0.00 H new ATOM 0 HB2 TRP A 109 -0.498 -1.330 2.171 1.00 0.00 H new ATOM 0 HB3 TRP A 109 0.500 -2.442 1.255 1.00 0.00 H new ATOM 0 HD1 TRP A 109 -0.695 -3.802 -0.414 1.00 0.00 H new ATOM 0 HE1 TRP A 109 -3.114 -4.550 -0.900 1.00 0.00 H new ATOM 0 HE3 TRP A 109 -2.980 -2.023 3.834 1.00 0.00 H new ATOM 0 HZ2 TRP A 109 -5.682 -4.390 0.395 1.00 0.00 H new ATOM 0 HZ3 TRP A 109 -5.411 -2.352 4.157 1.00 0.00 H new ATOM 0 HH2 TRP A 109 -6.757 -3.527 2.448 1.00 0.00 H new ATOM 1754 N THR A 110 -0.923 -1.945 5.128 1.00 0.00 N ATOM 1755 CA THR A 110 -1.964 -1.851 6.184 1.00 0.00 C ATOM 1756 C THR A 110 -2.659 -0.497 6.124 1.00 0.00 C ATOM 1757 O THR A 110 -2.079 0.532 6.399 1.00 0.00 O ATOM 1758 CB THR A 110 -1.333 -2.046 7.559 1.00 0.00 C ATOM 1759 OG1 THR A 110 -0.562 -0.901 7.893 1.00 0.00 O ATOM 1760 CG2 THR A 110 -0.438 -3.285 7.548 1.00 0.00 C ATOM 0 H THR A 110 -0.286 -1.151 5.072 1.00 0.00 H new ATOM 0 HA THR A 110 -2.703 -2.634 6.014 1.00 0.00 H new ATOM 0 HB THR A 110 -2.120 -2.182 8.301 1.00 0.00 H new ATOM 0 HG1 THR A 110 -0.739 -0.187 7.246 1.00 0.00 H new ATOM 0 HG21 THR A 110 0.010 -3.419 8.533 1.00 0.00 H new ATOM 0 HG22 THR A 110 -1.034 -4.162 7.298 1.00 0.00 H new ATOM 0 HG23 THR A 110 0.350 -3.158 6.805 1.00 0.00 H new ATOM 1768 N ARG A 111 -3.913 -0.511 5.784 1.00 0.00 N ATOM 1769 CA ARG A 111 -4.701 0.757 5.705 1.00 0.00 C ATOM 1770 C ARG A 111 -5.279 1.053 7.086 1.00 0.00 C ATOM 1771 O ARG A 111 -5.905 0.212 7.681 1.00 0.00 O ATOM 1772 CB ARG A 111 -5.830 0.580 4.682 1.00 0.00 C ATOM 1773 CG ARG A 111 -5.265 0.713 3.266 1.00 0.00 C ATOM 1774 CD ARG A 111 -6.381 0.498 2.238 1.00 0.00 C ATOM 1775 NE ARG A 111 -6.766 1.809 1.644 1.00 0.00 N ATOM 1776 CZ ARG A 111 -5.910 2.470 0.914 1.00 0.00 C ATOM 1777 NH1 ARG A 111 -5.190 1.843 0.025 1.00 0.00 N ATOM 1778 NH2 ARG A 111 -5.772 3.758 1.074 1.00 0.00 N ATOM 0 H ARG A 111 -4.437 -1.355 5.553 1.00 0.00 H new ATOM 0 HA ARG A 111 -4.067 1.587 5.391 1.00 0.00 H new ATOM 0 HB2 ARG A 111 -6.298 -0.396 4.807 1.00 0.00 H new ATOM 0 HB3 ARG A 111 -6.605 1.329 4.847 1.00 0.00 H new ATOM 0 HG2 ARG A 111 -4.821 1.700 3.133 1.00 0.00 H new ATOM 0 HG3 ARG A 111 -4.471 -0.017 3.112 1.00 0.00 H new ATOM 0 HD2 ARG A 111 -6.044 -0.183 1.456 1.00 0.00 H new ATOM 0 HD3 ARG A 111 -7.245 0.034 2.714 1.00 0.00 H new ATOM 0 HE ARG A 111 -7.698 2.190 1.808 1.00 0.00 H new ATOM 0 HH11 ARG A 111 -5.296 0.836 -0.099 1.00 0.00 H new ATOM 0 HH12 ARG A 111 -4.521 2.360 -0.546 1.00 0.00 H new ATOM 0 HH21 ARG A 111 -6.333 4.248 1.770 1.00 0.00 H new ATOM 0 HH22 ARG A 111 -5.103 4.274 0.503 1.00 0.00 H new ATOM 1792 N GLU A 112 -5.068 2.233 7.609 1.00 0.00 N ATOM 1793 CA GLU A 112 -5.602 2.543 8.967 1.00 0.00 C ATOM 1794 C GLU A 112 -6.390 3.852 8.919 1.00 0.00 C ATOM 1795 O GLU A 112 -6.102 4.730 8.144 1.00 0.00 O ATOM 1796 CB GLU A 112 -4.414 2.630 9.955 1.00 0.00 C ATOM 1797 CG GLU A 112 -4.783 3.411 11.231 1.00 0.00 C ATOM 1798 CD GLU A 112 -3.805 3.051 12.352 1.00 0.00 C ATOM 1799 OE1 GLU A 112 -3.404 1.901 12.415 1.00 0.00 O ATOM 1800 OE2 GLU A 112 -3.475 3.933 13.128 1.00 0.00 O ATOM 0 H GLU A 112 -4.553 2.989 7.158 1.00 0.00 H new ATOM 0 HA GLU A 112 -6.280 1.759 9.304 1.00 0.00 H new ATOM 0 HB2 GLU A 112 -4.092 1.624 10.225 1.00 0.00 H new ATOM 0 HB3 GLU A 112 -3.569 3.114 9.465 1.00 0.00 H new ATOM 0 HG2 GLU A 112 -4.750 4.483 11.036 1.00 0.00 H new ATOM 0 HG3 GLU A 112 -5.803 3.173 11.534 1.00 0.00 H new ATOM 1807 N LEU A 113 -7.389 3.961 9.749 1.00 0.00 N ATOM 1808 CA LEU A 113 -8.229 5.190 9.787 1.00 0.00 C ATOM 1809 C LEU A 113 -7.918 5.978 11.062 1.00 0.00 C ATOM 1810 O LEU A 113 -7.288 5.470 11.972 1.00 0.00 O ATOM 1811 CB LEU A 113 -9.699 4.753 9.795 1.00 0.00 C ATOM 1812 CG LEU A 113 -10.227 4.479 8.377 1.00 0.00 C ATOM 1813 CD1 LEU A 113 -10.628 5.790 7.710 1.00 0.00 C ATOM 1814 CD2 LEU A 113 -9.188 3.756 7.525 1.00 0.00 C ATOM 0 H LEU A 113 -7.663 3.238 10.414 1.00 0.00 H new ATOM 0 HA LEU A 113 -8.026 5.823 8.923 1.00 0.00 H new ATOM 0 HB2 LEU A 113 -9.806 3.854 10.402 1.00 0.00 H new ATOM 0 HB3 LEU A 113 -10.305 5.528 10.264 1.00 0.00 H new ATOM 0 HG LEU A 113 -11.100 3.832 8.462 1.00 0.00 H new ATOM 0 HD11 LEU A 113 -11.001 5.588 6.706 1.00 0.00 H new ATOM 0 HD12 LEU A 113 -11.409 6.273 8.297 1.00 0.00 H new ATOM 0 HD13 LEU A 113 -9.761 6.448 7.649 1.00 0.00 H new ATOM 0 HD21 LEU A 113 -9.594 3.578 6.529 1.00 0.00 H new ATOM 0 HD22 LEU A 113 -8.291 4.370 7.447 1.00 0.00 H new ATOM 0 HD23 LEU A 113 -8.936 2.803 7.990 1.00 0.00 H new ATOM 1826 N THR A 114 -8.356 7.210 11.139 1.00 0.00 N ATOM 1827 CA THR A 114 -8.086 8.028 12.358 1.00 0.00 C ATOM 1828 C THR A 114 -9.138 9.132 12.485 1.00 0.00 C ATOM 1829 O THR A 114 -9.381 9.880 11.558 1.00 0.00 O ATOM 1830 CB THR A 114 -6.695 8.660 12.253 1.00 0.00 C ATOM 1831 OG1 THR A 114 -5.858 7.832 11.458 1.00 0.00 O ATOM 1832 CG2 THR A 114 -6.093 8.808 13.651 1.00 0.00 C ATOM 0 H THR A 114 -8.889 7.683 10.409 1.00 0.00 H new ATOM 0 HA THR A 114 -8.130 7.386 13.237 1.00 0.00 H new ATOM 0 HB THR A 114 -6.777 9.643 11.790 1.00 0.00 H new ATOM 0 HG1 THR A 114 -5.687 8.269 10.598 1.00 0.00 H new ATOM 0 HG21 THR A 114 -5.103 9.258 13.575 1.00 0.00 H new ATOM 0 HG22 THR A 114 -6.736 9.445 14.258 1.00 0.00 H new ATOM 0 HG23 THR A 114 -6.011 7.826 14.117 1.00 0.00 H new ATOM 1840 N ASN A 115 -9.759 9.235 13.633 1.00 0.00 N ATOM 1841 CA ASN A 115 -10.799 10.286 13.851 1.00 0.00 C ATOM 1842 C ASN A 115 -11.945 10.109 12.839 1.00 0.00 C ATOM 1843 O ASN A 115 -12.900 9.404 13.105 1.00 0.00 O ATOM 1844 CB ASN A 115 -10.160 11.675 13.717 1.00 0.00 C ATOM 1845 CG ASN A 115 -9.178 11.897 14.870 1.00 0.00 C ATOM 1846 OD1 ASN A 115 -8.431 11.008 15.227 1.00 0.00 O ATOM 1847 ND2 ASN A 115 -9.149 13.054 15.473 1.00 0.00 N ATOM 0 H ASN A 115 -9.588 8.630 14.436 1.00 0.00 H new ATOM 0 HA ASN A 115 -11.213 10.188 14.855 1.00 0.00 H new ATOM 0 HB2 ASN A 115 -9.641 11.758 12.762 1.00 0.00 H new ATOM 0 HB3 ASN A 115 -10.932 12.445 13.729 1.00 0.00 H new ATOM 0 HD21 ASN A 115 -8.499 13.211 16.243 1.00 0.00 H new ATOM 0 HD22 ASN A 115 -9.776 13.801 15.174 1.00 0.00 H new ATOM 1854 N ASP A 116 -11.865 10.736 11.687 1.00 0.00 N ATOM 1855 CA ASP A 116 -12.954 10.594 10.676 1.00 0.00 C ATOM 1856 C ASP A 116 -12.496 11.188 9.343 1.00 0.00 C ATOM 1857 O ASP A 116 -13.286 11.730 8.592 1.00 0.00 O ATOM 1858 CB ASP A 116 -14.199 11.337 11.161 1.00 0.00 C ATOM 1859 CG ASP A 116 -15.442 10.734 10.503 1.00 0.00 C ATOM 1860 OD1 ASP A 116 -15.717 9.573 10.757 1.00 0.00 O ATOM 1861 OD2 ASP A 116 -16.096 11.443 9.757 1.00 0.00 O ATOM 0 H ASP A 116 -11.091 11.339 11.407 1.00 0.00 H new ATOM 0 HA ASP A 116 -13.188 9.538 10.542 1.00 0.00 H new ATOM 0 HB2 ASP A 116 -14.278 11.266 12.246 1.00 0.00 H new ATOM 0 HB3 ASP A 116 -14.122 12.396 10.915 1.00 0.00 H new ATOM 1866 N GLY A 117 -11.227 11.087 9.045 1.00 0.00 N ATOM 1867 CA GLY A 117 -10.706 11.641 7.760 1.00 0.00 C ATOM 1868 C GLY A 117 -9.180 11.694 7.806 1.00 0.00 C ATOM 1869 O GLY A 117 -8.564 12.646 7.370 1.00 0.00 O ATOM 0 H GLY A 117 -10.526 10.643 9.639 1.00 0.00 H new ATOM 0 HA2 GLY A 117 -11.033 11.021 6.926 1.00 0.00 H new ATOM 0 HA3 GLY A 117 -11.110 12.640 7.593 1.00 0.00 H new ATOM 1873 N GLU A 118 -8.573 10.666 8.322 1.00 0.00 N ATOM 1874 CA GLU A 118 -7.087 10.616 8.396 1.00 0.00 C ATOM 1875 C GLU A 118 -6.663 9.166 8.168 1.00 0.00 C ATOM 1876 O GLU A 118 -6.312 8.452 9.087 1.00 0.00 O ATOM 1877 CB GLU A 118 -6.620 11.088 9.775 1.00 0.00 C ATOM 1878 CG GLU A 118 -6.204 12.559 9.698 1.00 0.00 C ATOM 1879 CD GLU A 118 -6.186 13.158 11.106 1.00 0.00 C ATOM 1880 OE1 GLU A 118 -5.168 13.037 11.767 1.00 0.00 O ATOM 1881 OE2 GLU A 118 -7.190 13.728 11.498 1.00 0.00 O ATOM 0 H GLU A 118 -9.048 9.847 8.701 1.00 0.00 H new ATOM 0 HA GLU A 118 -6.642 11.267 7.643 1.00 0.00 H new ATOM 0 HB2 GLU A 118 -7.421 10.963 10.504 1.00 0.00 H new ATOM 0 HB3 GLU A 118 -5.782 10.479 10.115 1.00 0.00 H new ATOM 0 HG2 GLU A 118 -5.218 12.646 9.242 1.00 0.00 H new ATOM 0 HG3 GLU A 118 -6.898 13.112 9.065 1.00 0.00 H new ATOM 1888 N LEU A 119 -6.744 8.724 6.944 1.00 0.00 N ATOM 1889 CA LEU A 119 -6.404 7.312 6.616 1.00 0.00 C ATOM 1890 C LEU A 119 -4.898 7.144 6.369 1.00 0.00 C ATOM 1891 O LEU A 119 -4.401 7.485 5.318 1.00 0.00 O ATOM 1892 CB LEU A 119 -7.177 6.929 5.350 1.00 0.00 C ATOM 1893 CG LEU A 119 -7.222 5.407 5.188 1.00 0.00 C ATOM 1894 CD1 LEU A 119 -8.620 4.971 4.736 1.00 0.00 C ATOM 1895 CD2 LEU A 119 -6.197 4.980 4.138 1.00 0.00 C ATOM 0 H LEU A 119 -7.035 9.289 6.147 1.00 0.00 H new ATOM 0 HA LEU A 119 -6.675 6.669 7.453 1.00 0.00 H new ATOM 0 HB2 LEU A 119 -8.191 7.325 5.402 1.00 0.00 H new ATOM 0 HB3 LEU A 119 -6.704 7.380 4.478 1.00 0.00 H new ATOM 0 HG LEU A 119 -6.991 4.938 6.144 1.00 0.00 H new ATOM 0 HD11 LEU A 119 -8.644 3.887 4.623 1.00 0.00 H new ATOM 0 HD12 LEU A 119 -9.355 5.275 5.482 1.00 0.00 H new ATOM 0 HD13 LEU A 119 -8.857 5.441 3.781 1.00 0.00 H new ATOM 0 HD21 LEU A 119 -6.226 3.897 4.020 1.00 0.00 H new ATOM 0 HD22 LEU A 119 -6.432 5.455 3.186 1.00 0.00 H new ATOM 0 HD23 LEU A 119 -5.200 5.283 4.458 1.00 0.00 H new ATOM 1907 N ILE A 120 -4.169 6.596 7.315 1.00 0.00 N ATOM 1908 CA ILE A 120 -2.702 6.389 7.096 1.00 0.00 C ATOM 1909 C ILE A 120 -2.497 4.996 6.495 1.00 0.00 C ATOM 1910 O ILE A 120 -2.699 3.990 7.142 1.00 0.00 O ATOM 1911 CB ILE A 120 -1.942 6.550 8.420 1.00 0.00 C ATOM 1912 CG1 ILE A 120 -2.333 5.445 9.410 1.00 0.00 C ATOM 1913 CG2 ILE A 120 -2.295 7.907 9.019 1.00 0.00 C ATOM 1914 CD1 ILE A 120 -1.246 4.367 9.421 1.00 0.00 C ATOM 0 H ILE A 120 -4.523 6.286 8.220 1.00 0.00 H new ATOM 0 HA ILE A 120 -2.309 7.136 6.406 1.00 0.00 H new ATOM 0 HB ILE A 120 -0.871 6.479 8.228 1.00 0.00 H new ATOM 0 HG12 ILE A 120 -2.457 5.863 10.409 1.00 0.00 H new ATOM 0 HG13 ILE A 120 -3.291 5.009 9.126 1.00 0.00 H new ATOM 0 HG21 ILE A 120 -1.763 8.038 9.961 1.00 0.00 H new ATOM 0 HG22 ILE A 120 -2.006 8.697 8.326 1.00 0.00 H new ATOM 0 HG23 ILE A 120 -3.369 7.957 9.199 1.00 0.00 H new ATOM 0 HD11 ILE A 120 -1.521 3.580 10.124 1.00 0.00 H new ATOM 0 HD12 ILE A 120 -1.145 3.942 8.422 1.00 0.00 H new ATOM 0 HD13 ILE A 120 -0.298 4.810 9.725 1.00 0.00 H new ATOM 1926 N LEU A 121 -2.139 4.942 5.243 1.00 0.00 N ATOM 1927 CA LEU A 121 -1.973 3.633 4.558 1.00 0.00 C ATOM 1928 C LEU A 121 -0.486 3.350 4.270 1.00 0.00 C ATOM 1929 O LEU A 121 0.182 4.071 3.553 1.00 0.00 O ATOM 1930 CB LEU A 121 -2.826 3.681 3.265 1.00 0.00 C ATOM 1931 CG LEU A 121 -2.546 2.512 2.299 1.00 0.00 C ATOM 1932 CD1 LEU A 121 -1.313 2.826 1.454 1.00 0.00 C ATOM 1933 CD2 LEU A 121 -2.318 1.205 3.058 1.00 0.00 C ATOM 0 H LEU A 121 -1.953 5.758 4.660 1.00 0.00 H new ATOM 0 HA LEU A 121 -2.314 2.813 5.190 1.00 0.00 H new ATOM 0 HB2 LEU A 121 -3.882 3.673 3.535 1.00 0.00 H new ATOM 0 HB3 LEU A 121 -2.636 4.622 2.749 1.00 0.00 H new ATOM 0 HG LEU A 121 -3.419 2.390 1.657 1.00 0.00 H new ATOM 0 HD11 LEU A 121 -1.118 1.998 0.773 1.00 0.00 H new ATOM 0 HD12 LEU A 121 -1.488 3.735 0.879 1.00 0.00 H new ATOM 0 HD13 LEU A 121 -0.452 2.969 2.106 1.00 0.00 H new ATOM 0 HD21 LEU A 121 -2.123 0.401 2.348 1.00 0.00 H new ATOM 0 HD22 LEU A 121 -1.463 1.316 3.724 1.00 0.00 H new ATOM 0 HD23 LEU A 121 -3.205 0.965 3.644 1.00 0.00 H new ATOM 1945 N THR A 122 0.014 2.282 4.843 1.00 0.00 N ATOM 1946 CA THR A 122 1.438 1.868 4.656 1.00 0.00 C ATOM 1947 C THR A 122 1.497 0.732 3.634 1.00 0.00 C ATOM 1948 O THR A 122 0.526 0.057 3.397 1.00 0.00 O ATOM 1949 CB THR A 122 1.965 1.336 5.983 1.00 0.00 C ATOM 1950 OG1 THR A 122 1.800 2.320 6.993 1.00 0.00 O ATOM 1951 CG2 THR A 122 3.443 0.970 5.851 1.00 0.00 C ATOM 0 H THR A 122 -0.523 1.663 5.450 1.00 0.00 H new ATOM 0 HA THR A 122 2.030 2.717 4.315 1.00 0.00 H new ATOM 0 HB THR A 122 1.403 0.443 6.257 1.00 0.00 H new ATOM 0 HG1 THR A 122 2.506 2.221 7.665 1.00 0.00 H new ATOM 0 HG21 THR A 122 3.811 0.591 6.805 1.00 0.00 H new ATOM 0 HG22 THR A 122 3.561 0.203 5.086 1.00 0.00 H new ATOM 0 HG23 THR A 122 4.013 1.855 5.568 1.00 0.00 H new ATOM 1959 N MET A 123 2.640 0.493 3.063 1.00 0.00 N ATOM 1960 CA MET A 123 2.772 -0.628 2.085 1.00 0.00 C ATOM 1961 C MET A 123 4.236 -1.034 1.995 1.00 0.00 C ATOM 1962 O MET A 123 5.011 -0.455 1.259 1.00 0.00 O ATOM 1963 CB MET A 123 2.260 -0.206 0.717 1.00 0.00 C ATOM 1964 CG MET A 123 2.223 -1.434 -0.205 1.00 0.00 C ATOM 1965 SD MET A 123 3.655 -1.426 -1.312 1.00 0.00 S ATOM 1966 CE MET A 123 3.319 0.174 -2.077 1.00 0.00 C ATOM 0 H MET A 123 3.494 1.025 3.229 1.00 0.00 H new ATOM 0 HA MET A 123 2.175 -1.475 2.423 1.00 0.00 H new ATOM 0 HB2 MET A 123 1.264 0.228 0.805 1.00 0.00 H new ATOM 0 HB3 MET A 123 2.907 0.563 0.294 1.00 0.00 H new ATOM 0 HG2 MET A 123 2.220 -2.346 0.392 1.00 0.00 H new ATOM 0 HG3 MET A 123 1.303 -1.432 -0.789 1.00 0.00 H new ATOM 0 HE1 MET A 123 3.586 0.136 -3.133 1.00 0.00 H new ATOM 0 HE2 MET A 123 2.259 0.409 -1.979 1.00 0.00 H new ATOM 0 HE3 MET A 123 3.909 0.945 -1.581 1.00 0.00 H new ATOM 1976 N THR A 124 4.617 -2.014 2.765 1.00 0.00 N ATOM 1977 CA THR A 124 6.044 -2.460 2.770 1.00 0.00 C ATOM 1978 C THR A 124 6.378 -3.186 1.480 1.00 0.00 C ATOM 1979 O THR A 124 5.513 -3.506 0.685 1.00 0.00 O ATOM 1980 CB THR A 124 6.359 -3.381 3.980 1.00 0.00 C ATOM 1981 OG1 THR A 124 6.246 -4.752 3.608 1.00 0.00 O ATOM 1982 CG2 THR A 124 5.418 -3.115 5.160 1.00 0.00 C ATOM 0 H THR A 124 4.002 -2.529 3.395 1.00 0.00 H new ATOM 0 HA THR A 124 6.660 -1.565 2.856 1.00 0.00 H new ATOM 0 HB THR A 124 7.381 -3.158 4.288 1.00 0.00 H new ATOM 0 HG1 THR A 124 5.373 -5.097 3.890 1.00 0.00 H new ATOM 0 HG21 THR A 124 5.672 -3.780 5.985 1.00 0.00 H new ATOM 0 HG22 THR A 124 5.523 -2.079 5.483 1.00 0.00 H new ATOM 0 HG23 THR A 124 4.388 -3.296 4.852 1.00 0.00 H new ATOM 1990 N ALA A 125 7.642 -3.445 1.276 1.00 0.00 N ATOM 1991 CA ALA A 125 8.058 -4.157 0.035 1.00 0.00 C ATOM 1992 C ALA A 125 9.553 -4.480 0.035 1.00 0.00 C ATOM 1993 O ALA A 125 10.382 -3.637 -0.235 1.00 0.00 O ATOM 1994 CB ALA A 125 7.741 -3.290 -1.178 1.00 0.00 C ATOM 0 H ALA A 125 8.400 -3.196 1.911 1.00 0.00 H new ATOM 0 HA ALA A 125 7.507 -5.096 -0.007 1.00 0.00 H new ATOM 0 HB1 ALA A 125 8.045 -3.810 -2.086 1.00 0.00 H new ATOM 0 HB2 ALA A 125 6.670 -3.093 -1.214 1.00 0.00 H new ATOM 0 HB3 ALA A 125 8.281 -2.346 -1.102 1.00 0.00 H new ATOM 2000 N ASP A 126 9.906 -5.711 0.297 1.00 0.00 N ATOM 2001 CA ASP A 126 11.353 -6.093 0.289 1.00 0.00 C ATOM 2002 C ASP A 126 12.076 -5.366 1.426 1.00 0.00 C ATOM 2003 O ASP A 126 13.237 -5.025 1.313 1.00 0.00 O ATOM 2004 CB ASP A 126 11.989 -5.705 -1.051 1.00 0.00 C ATOM 2005 CG ASP A 126 12.860 -6.853 -1.567 1.00 0.00 C ATOM 2006 OD1 ASP A 126 13.957 -7.014 -1.058 1.00 0.00 O ATOM 2007 OD2 ASP A 126 12.415 -7.552 -2.463 1.00 0.00 O ATOM 0 H ASP A 126 9.258 -6.468 0.516 1.00 0.00 H new ATOM 0 HA ASP A 126 11.440 -7.171 0.427 1.00 0.00 H new ATOM 0 HB2 ASP A 126 11.211 -5.472 -1.778 1.00 0.00 H new ATOM 0 HB3 ASP A 126 12.592 -4.805 -0.930 1.00 0.00 H new ATOM 2012 N ASP A 127 11.371 -5.139 2.513 1.00 0.00 N ATOM 2013 CA ASP A 127 11.926 -4.444 3.734 1.00 0.00 C ATOM 2014 C ASP A 127 11.661 -2.939 3.667 1.00 0.00 C ATOM 2015 O ASP A 127 11.911 -2.228 4.624 1.00 0.00 O ATOM 2016 CB ASP A 127 13.432 -4.691 3.915 1.00 0.00 C ATOM 2017 CG ASP A 127 13.845 -4.312 5.339 1.00 0.00 C ATOM 2018 OD1 ASP A 127 13.230 -4.812 6.266 1.00 0.00 O ATOM 2019 OD2 ASP A 127 14.770 -3.529 5.478 1.00 0.00 O ATOM 0 H ASP A 127 10.394 -5.417 2.611 1.00 0.00 H new ATOM 0 HA ASP A 127 11.411 -4.870 4.595 1.00 0.00 H new ATOM 0 HB2 ASP A 127 13.665 -5.739 3.724 1.00 0.00 H new ATOM 0 HB3 ASP A 127 13.997 -4.102 3.192 1.00 0.00 H new ATOM 2024 N VAL A 128 11.142 -2.439 2.568 1.00 0.00 N ATOM 2025 CA VAL A 128 10.853 -0.989 2.487 1.00 0.00 C ATOM 2026 C VAL A 128 9.483 -0.738 3.108 1.00 0.00 C ATOM 2027 O VAL A 128 8.790 -1.661 3.487 1.00 0.00 O ATOM 2028 CB VAL A 128 10.865 -0.538 1.014 1.00 0.00 C ATOM 2029 CG1 VAL A 128 12.153 -1.009 0.335 1.00 0.00 C ATOM 2030 CG2 VAL A 128 9.665 -1.115 0.261 1.00 0.00 C ATOM 0 H VAL A 128 10.911 -2.978 1.733 1.00 0.00 H new ATOM 0 HA VAL A 128 11.611 -0.420 3.026 1.00 0.00 H new ATOM 0 HB VAL A 128 10.810 0.550 0.992 1.00 0.00 H new ATOM 0 HG11 VAL A 128 12.154 -0.686 -0.706 1.00 0.00 H new ATOM 0 HG12 VAL A 128 13.013 -0.580 0.849 1.00 0.00 H new ATOM 0 HG13 VAL A 128 12.210 -2.097 0.378 1.00 0.00 H new ATOM 0 HG21 VAL A 128 9.693 -0.784 -0.777 1.00 0.00 H new ATOM 0 HG22 VAL A 128 9.703 -2.204 0.296 1.00 0.00 H new ATOM 0 HG23 VAL A 128 8.742 -0.769 0.727 1.00 0.00 H new ATOM 2040 N VAL A 129 9.091 0.494 3.201 1.00 0.00 N ATOM 2041 CA VAL A 129 7.762 0.808 3.773 1.00 0.00 C ATOM 2042 C VAL A 129 7.301 2.173 3.270 1.00 0.00 C ATOM 2043 O VAL A 129 7.891 3.193 3.558 1.00 0.00 O ATOM 2044 CB VAL A 129 7.840 0.715 5.313 1.00 0.00 C ATOM 2045 CG1 VAL A 129 6.974 1.786 6.011 1.00 0.00 C ATOM 2046 CG2 VAL A 129 7.349 -0.673 5.726 1.00 0.00 C ATOM 0 H VAL A 129 9.637 1.302 2.904 1.00 0.00 H new ATOM 0 HA VAL A 129 7.013 0.086 3.447 1.00 0.00 H new ATOM 0 HB VAL A 129 8.873 0.885 5.617 1.00 0.00 H new ATOM 0 HG11 VAL A 129 7.063 1.678 7.092 1.00 0.00 H new ATOM 0 HG12 VAL A 129 7.315 2.778 5.716 1.00 0.00 H new ATOM 0 HG13 VAL A 129 5.932 1.658 5.718 1.00 0.00 H new ATOM 0 HG21 VAL A 129 7.393 -0.767 6.811 1.00 0.00 H new ATOM 0 HG22 VAL A 129 6.321 -0.809 5.392 1.00 0.00 H new ATOM 0 HG23 VAL A 129 7.983 -1.434 5.270 1.00 0.00 H new ATOM 2056 N CYS A 130 6.229 2.171 2.533 1.00 0.00 N ATOM 2057 CA CYS A 130 5.672 3.444 1.996 1.00 0.00 C ATOM 2058 C CYS A 130 4.530 3.897 2.906 1.00 0.00 C ATOM 2059 O CYS A 130 3.395 3.494 2.735 1.00 0.00 O ATOM 2060 CB CYS A 130 5.138 3.213 0.581 1.00 0.00 C ATOM 2061 SG CYS A 130 4.720 4.804 -0.174 1.00 0.00 S ATOM 0 H CYS A 130 5.708 1.333 2.276 1.00 0.00 H new ATOM 0 HA CYS A 130 6.449 4.207 1.963 1.00 0.00 H new ATOM 0 HB2 CYS A 130 5.886 2.698 -0.022 1.00 0.00 H new ATOM 0 HB3 CYS A 130 4.257 2.571 0.613 1.00 0.00 H new ATOM 0 HG CYS A 130 4.268 4.608 -1.377 1.00 0.00 H new ATOM 2067 N THR A 131 4.827 4.718 3.880 1.00 0.00 N ATOM 2068 CA THR A 131 3.767 5.189 4.820 1.00 0.00 C ATOM 2069 C THR A 131 3.409 6.641 4.520 1.00 0.00 C ATOM 2070 O THR A 131 4.239 7.526 4.609 1.00 0.00 O ATOM 2071 CB THR A 131 4.284 5.092 6.256 1.00 0.00 C ATOM 2072 OG1 THR A 131 5.163 3.981 6.368 1.00 0.00 O ATOM 2073 CG2 THR A 131 3.108 4.915 7.218 1.00 0.00 C ATOM 0 H THR A 131 5.761 5.083 4.065 1.00 0.00 H new ATOM 0 HA THR A 131 2.882 4.565 4.697 1.00 0.00 H new ATOM 0 HB THR A 131 4.820 6.007 6.510 1.00 0.00 H new ATOM 0 HG1 THR A 131 5.496 3.919 7.287 1.00 0.00 H new ATOM 0 HG21 THR A 131 3.481 4.846 8.240 1.00 0.00 H new ATOM 0 HG22 THR A 131 2.437 5.770 7.133 1.00 0.00 H new ATOM 0 HG23 THR A 131 2.567 4.003 6.967 1.00 0.00 H new ATOM 2081 N ARG A 132 2.172 6.891 4.183 1.00 0.00 N ATOM 2082 CA ARG A 132 1.738 8.293 3.894 1.00 0.00 C ATOM 2083 C ARG A 132 0.320 8.486 4.422 1.00 0.00 C ATOM 2084 O ARG A 132 -0.551 7.666 4.200 1.00 0.00 O ATOM 2085 CB ARG A 132 1.777 8.598 2.384 1.00 0.00 C ATOM 2086 CG ARG A 132 1.520 7.337 1.553 1.00 0.00 C ATOM 2087 CD ARG A 132 1.516 7.704 0.070 1.00 0.00 C ATOM 2088 NE ARG A 132 1.815 6.492 -0.743 1.00 0.00 N ATOM 2089 CZ ARG A 132 1.898 6.580 -2.043 1.00 0.00 C ATOM 2090 NH1 ARG A 132 3.030 6.910 -2.603 1.00 0.00 N ATOM 2091 NH2 ARG A 132 0.850 6.338 -2.782 1.00 0.00 N ATOM 0 H ARG A 132 1.441 6.185 4.095 1.00 0.00 H new ATOM 0 HA ARG A 132 2.426 8.979 4.387 1.00 0.00 H new ATOM 0 HB2 ARG A 132 1.028 9.353 2.144 1.00 0.00 H new ATOM 0 HB3 ARG A 132 2.748 9.018 2.121 1.00 0.00 H new ATOM 0 HG2 ARG A 132 2.290 6.592 1.753 1.00 0.00 H new ATOM 0 HG3 ARG A 132 0.565 6.892 1.832 1.00 0.00 H new ATOM 0 HD2 ARG A 132 0.546 8.113 -0.212 1.00 0.00 H new ATOM 0 HD3 ARG A 132 2.258 8.478 -0.126 1.00 0.00 H new ATOM 0 HE ARG A 132 1.955 5.592 -0.283 1.00 0.00 H new ATOM 0 HH11 ARG A 132 3.849 7.099 -2.025 1.00 0.00 H new ATOM 0 HH12 ARG A 132 3.096 6.979 -3.619 1.00 0.00 H new ATOM 0 HH21 ARG A 132 -0.034 6.080 -2.344 1.00 0.00 H new ATOM 0 HH22 ARG A 132 0.915 6.407 -3.798 1.00 0.00 H new ATOM 2105 N VAL A 133 0.088 9.562 5.128 1.00 0.00 N ATOM 2106 CA VAL A 133 -1.268 9.815 5.685 1.00 0.00 C ATOM 2107 C VAL A 133 -2.195 10.266 4.563 1.00 0.00 C ATOM 2108 O VAL A 133 -1.763 10.788 3.561 1.00 0.00 O ATOM 2109 CB VAL A 133 -1.176 10.906 6.767 1.00 0.00 C ATOM 2110 CG1 VAL A 133 -2.579 11.323 7.224 1.00 0.00 C ATOM 2111 CG2 VAL A 133 -0.396 10.361 7.966 1.00 0.00 C ATOM 0 H VAL A 133 0.783 10.277 5.342 1.00 0.00 H new ATOM 0 HA VAL A 133 -1.665 8.903 6.131 1.00 0.00 H new ATOM 0 HB VAL A 133 -0.666 11.775 6.352 1.00 0.00 H new ATOM 0 HG11 VAL A 133 -2.498 12.095 7.989 1.00 0.00 H new ATOM 0 HG12 VAL A 133 -3.138 11.713 6.373 1.00 0.00 H new ATOM 0 HG13 VAL A 133 -3.100 10.458 7.635 1.00 0.00 H new ATOM 0 HG21 VAL A 133 -0.328 11.130 8.736 1.00 0.00 H new ATOM 0 HG22 VAL A 133 -0.911 9.489 8.369 1.00 0.00 H new ATOM 0 HG23 VAL A 133 0.607 10.076 7.648 1.00 0.00 H new ATOM 2121 N TYR A 134 -3.470 10.076 4.745 1.00 0.00 N ATOM 2122 CA TYR A 134 -4.448 10.504 3.718 1.00 0.00 C ATOM 2123 C TYR A 134 -5.599 11.228 4.400 1.00 0.00 C ATOM 2124 O TYR A 134 -5.734 11.203 5.608 1.00 0.00 O ATOM 2125 CB TYR A 134 -5.052 9.301 3.015 1.00 0.00 C ATOM 2126 CG TYR A 134 -4.047 8.648 2.114 1.00 0.00 C ATOM 2127 CD1 TYR A 134 -2.999 7.911 2.664 1.00 0.00 C ATOM 2128 CD2 TYR A 134 -4.178 8.761 0.728 1.00 0.00 C ATOM 2129 CE1 TYR A 134 -2.078 7.285 1.830 1.00 0.00 C ATOM 2130 CE2 TYR A 134 -3.256 8.138 -0.111 1.00 0.00 C ATOM 2131 CZ TYR A 134 -2.201 7.397 0.438 1.00 0.00 C ATOM 2132 OH TYR A 134 -1.287 6.776 -0.390 1.00 0.00 O ATOM 0 H TYR A 134 -3.877 9.638 5.571 1.00 0.00 H new ATOM 0 HA TYR A 134 -3.928 11.141 3.003 1.00 0.00 H new ATOM 0 HB2 TYR A 134 -5.405 8.582 3.754 1.00 0.00 H new ATOM 0 HB3 TYR A 134 -5.920 9.612 2.433 1.00 0.00 H new ATOM 0 HD1 TYR A 134 -2.902 7.826 3.736 1.00 0.00 H new ATOM 0 HD2 TYR A 134 -4.993 9.331 0.307 1.00 0.00 H new ATOM 0 HE1 TYR A 134 -1.267 6.712 2.255 1.00 0.00 H new ATOM 0 HE2 TYR A 134 -3.354 8.226 -1.183 1.00 0.00 H new ATOM 0 HH TYR A 134 -1.519 6.954 -1.325 1.00 0.00 H new ATOM 2142 N VAL A 135 -6.457 11.818 3.624 1.00 0.00 N ATOM 2143 CA VAL A 135 -7.648 12.493 4.185 1.00 0.00 C ATOM 2144 C VAL A 135 -8.792 12.236 3.223 1.00 0.00 C ATOM 2145 O VAL A 135 -8.563 11.858 2.098 1.00 0.00 O ATOM 2146 CB VAL A 135 -7.402 13.977 4.320 1.00 0.00 C ATOM 2147 CG1 VAL A 135 -8.627 14.622 4.949 1.00 0.00 C ATOM 2148 CG2 VAL A 135 -6.192 14.194 5.218 1.00 0.00 C ATOM 0 H VAL A 135 -6.380 11.861 2.608 1.00 0.00 H new ATOM 0 HA VAL A 135 -7.878 12.109 5.179 1.00 0.00 H new ATOM 0 HB VAL A 135 -7.216 14.422 3.342 1.00 0.00 H new ATOM 0 HG11 VAL A 135 -8.461 15.694 5.052 1.00 0.00 H new ATOM 0 HG12 VAL A 135 -9.496 14.448 4.314 1.00 0.00 H new ATOM 0 HG13 VAL A 135 -8.803 14.186 5.932 1.00 0.00 H new ATOM 0 HG21 VAL A 135 -6.004 15.262 5.323 1.00 0.00 H new ATOM 0 HG22 VAL A 135 -6.385 13.761 6.200 1.00 0.00 H new ATOM 0 HG23 VAL A 135 -5.319 13.714 4.775 1.00 0.00 H new ATOM 2158 N ARG A 136 -10.011 12.411 3.634 1.00 0.00 N ATOM 2159 CA ARG A 136 -11.122 12.129 2.682 1.00 0.00 C ATOM 2160 C ARG A 136 -11.343 13.333 1.777 1.00 0.00 C ATOM 2161 O ARG A 136 -11.674 14.416 2.218 1.00 0.00 O ATOM 2162 CB ARG A 136 -12.418 11.772 3.412 1.00 0.00 C ATOM 2163 CG ARG A 136 -12.615 10.254 3.383 1.00 0.00 C ATOM 2164 CD ARG A 136 -13.222 9.787 4.707 1.00 0.00 C ATOM 2165 NE ARG A 136 -14.468 10.556 4.981 1.00 0.00 N ATOM 2166 CZ ARG A 136 -15.633 10.003 4.784 1.00 0.00 C ATOM 2167 NH1 ARG A 136 -16.129 9.191 5.676 1.00 0.00 N ATOM 2168 NH2 ARG A 136 -16.304 10.263 3.694 1.00 0.00 N ATOM 0 H ARG A 136 -10.287 12.729 4.563 1.00 0.00 H new ATOM 0 HA ARG A 136 -10.837 11.267 2.080 1.00 0.00 H new ATOM 0 HB2 ARG A 136 -12.377 12.125 4.442 1.00 0.00 H new ATOM 0 HB3 ARG A 136 -13.264 12.269 2.938 1.00 0.00 H new ATOM 0 HG2 ARG A 136 -13.268 9.978 2.555 1.00 0.00 H new ATOM 0 HG3 ARG A 136 -11.660 9.757 3.214 1.00 0.00 H new ATOM 0 HD2 ARG A 136 -13.443 8.721 4.662 1.00 0.00 H new ATOM 0 HD3 ARG A 136 -12.508 9.931 5.518 1.00 0.00 H new ATOM 0 HE ARG A 136 -14.410 11.515 5.323 1.00 0.00 H new ATOM 0 HH11 ARG A 136 -15.606 8.988 6.528 1.00 0.00 H new ATOM 0 HH12 ARG A 136 -17.040 8.759 5.522 1.00 0.00 H new ATOM 0 HH21 ARG A 136 -15.917 10.899 2.996 1.00 0.00 H new ATOM 0 HH22 ARG A 136 -17.215 9.830 3.540 1.00 0.00 H new ATOM 2182 N GLU A 137 -11.150 13.134 0.504 1.00 0.00 N ATOM 2183 CA GLU A 137 -11.326 14.238 -0.487 1.00 0.00 C ATOM 2184 C GLU A 137 -12.716 14.869 -0.341 1.00 0.00 C ATOM 2185 O GLU A 137 -12.892 15.981 -0.811 1.00 0.00 O ATOM 2186 CB GLU A 137 -11.175 13.673 -1.901 1.00 0.00 C ATOM 2187 CG GLU A 137 -10.958 14.820 -2.889 1.00 0.00 C ATOM 2188 CD GLU A 137 -11.371 14.370 -4.292 1.00 0.00 C ATOM 2189 OE1 GLU A 137 -12.541 14.082 -4.480 1.00 0.00 O ATOM 2190 OE2 GLU A 137 -10.509 14.321 -5.154 1.00 0.00 O ATOM 2191 OXT GLU A 137 -13.578 14.229 0.239 1.00 0.00 O ATOM 0 H GLU A 137 -10.873 12.240 0.099 1.00 0.00 H new ATOM 0 HA GLU A 137 -10.570 15.002 -0.306 1.00 0.00 H new ATOM 0 HB2 GLU A 137 -10.333 12.982 -1.940 1.00 0.00 H new ATOM 0 HB3 GLU A 137 -12.065 13.107 -2.175 1.00 0.00 H new ATOM 0 HG2 GLU A 137 -11.543 15.689 -2.588 1.00 0.00 H new ATOM 0 HG3 GLU A 137 -9.911 15.123 -2.886 1.00 0.00 H new TER 2198 GLU A 137