USER MOD reduce.3.24.130724 H: found=0, std=0, add=893, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 895 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 82 TYR OH : rot 6:sc= 0.881 USER MOD Set 1.2: A 99 HIS : no HE2:sc= 0.668 K(o=1.5,f=-5.4!) USER MOD Set 2.1: A 74 GLN : amide:sc= -0.38 K(o=-0.077,f=0.89) USER MOD Set 2.2: A 103 TYR OH : rot 30:sc= 0.303 USER MOD Single : A 8 ASN : amide:sc= -0.0631 X(o=-0.063,f=-0.18) USER MOD Single : A 10 SER OG : rot 180:sc= -0.0143 USER MOD Single : A 16 THR OG1 : rot 54:sc= 1.25 USER MOD Single : A 22 TYR OH : rot 72:sc= 1.21 USER MOD Single : A 39 SER OG : rot 180:sc= 0.0164 USER MOD Single : A 42 SER OG : rot 180:sc= 0 USER MOD Single : A 46 ASN : amide:sc= 1.16 K(o=1.2,f=-0.054) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 THR OG1 : rot -150:sc= -0.693 USER MOD Single : A 60 LYS NZ :NH3+ 175:sc= 1.35 (180deg=1.09) USER MOD Single : A 61 SER OG : rot -87:sc= 1.66 USER MOD Single : A 64 TYR OH : rot 180:sc= 0 USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 THR OG1 : rot 180:sc= 0.0157 USER MOD Single : A 81 ASN : amide:sc= -5.99! C(o=-6!,f=-9.8!) USER MOD Single : A 83 LYS NZ :NH3+ 163:sc= -0.0634 (180deg=-0.392) USER MOD Single : A 84 HIS : no HE2:sc= 0.295 K(o=0.3,f=-5.6!) USER MOD Single : A 91 TYR OH : rot 180:sc= 0 USER MOD Single : A 94 SER OG : rot 104:sc= 1.06 USER MOD Single : A 105 ASN : amide:sc= -1.08 K(o=-1.1,f=0) USER MOD Single : A 114 SER OG : rot -110:sc=-0.00676 USER MOD Single : A 115 TYR OH : rot 54:sc= 0.839 USER MOD Single : A 118 SER OG : rot 65:sc= 0.00151 USER MOD Single : A 121 TYR OH : rot 180:sc= 0 USER MOD Single : A 122 THR OG1 : rot 77:sc= 1.58 USER MOD Single : A 123 ASN : amide:sc= 0.298 K(o=0.3,f=-0.32) USER MOD Single : A 124 SER OG : rot 79:sc= 0.788 USER MOD Single : A 132 TYR OH : rot 180:sc= 0 USER MOD Single : A 133 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 20 N PRO A 2 -9.028 4.629 -13.214 1.00 0.00 N ATOM 21 CA PRO A 2 -8.593 3.946 -11.990 1.00 0.00 C ATOM 22 C PRO A 2 -9.377 4.395 -10.757 1.00 0.00 C ATOM 23 O PRO A 2 -10.055 5.426 -10.775 1.00 0.00 O ATOM 24 CB PRO A 2 -7.120 4.342 -11.863 1.00 0.00 C ATOM 25 CG PRO A 2 -7.009 5.638 -12.589 1.00 0.00 C ATOM 26 CD PRO A 2 -8.002 5.566 -13.717 1.00 0.00 C ATOM 0 HA PRO A 2 -8.755 2.870 -12.049 1.00 0.00 H new ATOM 0 HB2 PRO A 2 -6.828 4.448 -10.818 1.00 0.00 H new ATOM 0 HB3 PRO A 2 -6.468 3.586 -12.301 1.00 0.00 H new ATOM 0 HG2 PRO A 2 -7.229 6.476 -11.928 1.00 0.00 H new ATOM 0 HG3 PRO A 2 -5.998 5.788 -12.968 1.00 0.00 H new ATOM 0 HD2 PRO A 2 -8.427 6.544 -13.941 1.00 0.00 H new ATOM 0 HD3 PRO A 2 -7.541 5.201 -14.635 1.00 0.00 H new ATOM 34 N VAL A 3 -9.286 3.606 -9.692 1.00 0.00 N ATOM 35 CA VAL A 3 -9.953 3.932 -8.441 1.00 0.00 C ATOM 36 C VAL A 3 -9.169 5.009 -7.705 1.00 0.00 C ATOM 37 O VAL A 3 -8.117 4.745 -7.121 1.00 0.00 O ATOM 38 CB VAL A 3 -10.111 2.692 -7.533 1.00 0.00 C ATOM 39 CG1 VAL A 3 -10.914 3.039 -6.288 1.00 0.00 C ATOM 40 CG2 VAL A 3 -10.763 1.548 -8.297 1.00 0.00 C ATOM 0 H VAL A 3 -8.755 2.735 -9.672 1.00 0.00 H new ATOM 0 HA VAL A 3 -10.951 4.297 -8.683 1.00 0.00 H new ATOM 0 HB VAL A 3 -9.119 2.368 -7.218 1.00 0.00 H new ATOM 0 HG11 VAL A 3 -11.014 2.153 -5.661 1.00 0.00 H new ATOM 0 HG12 VAL A 3 -10.400 3.822 -5.730 1.00 0.00 H new ATOM 0 HG13 VAL A 3 -11.903 3.391 -6.580 1.00 0.00 H new ATOM 0 HG21 VAL A 3 -10.866 0.684 -7.641 1.00 0.00 H new ATOM 0 HG22 VAL A 3 -11.748 1.858 -8.645 1.00 0.00 H new ATOM 0 HG23 VAL A 3 -10.143 1.282 -9.153 1.00 0.00 H new ATOM 50 N GLU A 4 -9.673 6.229 -7.768 1.00 0.00 N ATOM 51 CA GLU A 4 -9.008 7.368 -7.162 1.00 0.00 C ATOM 52 C GLU A 4 -9.924 8.057 -6.159 1.00 0.00 C ATOM 53 O GLU A 4 -11.142 8.096 -6.337 1.00 0.00 O ATOM 54 CB GLU A 4 -8.580 8.360 -8.248 1.00 0.00 C ATOM 55 CG GLU A 4 -9.683 8.663 -9.248 1.00 0.00 C ATOM 56 CD GLU A 4 -9.344 9.802 -10.182 1.00 0.00 C ATOM 57 OE1 GLU A 4 -8.562 9.592 -11.130 1.00 0.00 O ATOM 58 OE2 GLU A 4 -9.874 10.916 -9.975 1.00 0.00 O ATOM 0 H GLU A 4 -10.549 6.457 -8.238 1.00 0.00 H new ATOM 0 HA GLU A 4 -8.125 7.011 -6.632 1.00 0.00 H new ATOM 0 HB2 GLU A 4 -8.260 9.289 -7.777 1.00 0.00 H new ATOM 0 HB3 GLU A 4 -7.717 7.958 -8.779 1.00 0.00 H new ATOM 0 HG2 GLU A 4 -9.887 7.768 -9.836 1.00 0.00 H new ATOM 0 HG3 GLU A 4 -10.598 8.905 -8.707 1.00 0.00 H new ATOM 65 N LEU A 5 -9.334 8.584 -5.100 1.00 0.00 N ATOM 66 CA LEU A 5 -10.077 9.350 -4.116 1.00 0.00 C ATOM 67 C LEU A 5 -9.852 10.835 -4.360 1.00 0.00 C ATOM 68 O LEU A 5 -8.725 11.320 -4.270 1.00 0.00 O ATOM 69 CB LEU A 5 -9.638 8.974 -2.698 1.00 0.00 C ATOM 70 CG LEU A 5 -10.491 9.562 -1.572 1.00 0.00 C ATOM 71 CD1 LEU A 5 -11.916 9.038 -1.656 1.00 0.00 C ATOM 72 CD2 LEU A 5 -9.884 9.235 -0.216 1.00 0.00 C ATOM 0 H LEU A 5 -8.338 8.494 -4.900 1.00 0.00 H new ATOM 0 HA LEU A 5 -11.138 9.123 -4.214 1.00 0.00 H new ATOM 0 HB2 LEU A 5 -9.647 7.888 -2.609 1.00 0.00 H new ATOM 0 HB3 LEU A 5 -8.607 9.297 -2.557 1.00 0.00 H new ATOM 0 HG LEU A 5 -10.513 10.646 -1.687 1.00 0.00 H new ATOM 0 HD11 LEU A 5 -12.509 9.466 -0.848 1.00 0.00 H new ATOM 0 HD12 LEU A 5 -12.351 9.320 -2.615 1.00 0.00 H new ATOM 0 HD13 LEU A 5 -11.910 7.952 -1.566 1.00 0.00 H new ATOM 0 HD21 LEU A 5 -10.504 9.661 0.573 1.00 0.00 H new ATOM 0 HD22 LEU A 5 -9.832 8.153 -0.092 1.00 0.00 H new ATOM 0 HD23 LEU A 5 -8.880 9.656 -0.156 1.00 0.00 H new ATOM 84 N ARG A 6 -10.916 11.544 -4.699 1.00 0.00 N ATOM 85 CA ARG A 6 -10.815 12.963 -5.005 1.00 0.00 C ATOM 86 C ARG A 6 -10.779 13.780 -3.720 1.00 0.00 C ATOM 87 O ARG A 6 -11.160 13.291 -2.662 1.00 0.00 O ATOM 88 CB ARG A 6 -11.981 13.423 -5.890 1.00 0.00 C ATOM 89 CG ARG A 6 -11.977 12.815 -7.288 1.00 0.00 C ATOM 90 CD ARG A 6 -12.437 11.365 -7.277 1.00 0.00 C ATOM 91 NE ARG A 6 -12.262 10.722 -8.572 1.00 0.00 N ATOM 92 CZ ARG A 6 -13.084 9.792 -9.053 1.00 0.00 C ATOM 93 NH1 ARG A 6 -14.176 9.452 -8.380 1.00 0.00 N ATOM 94 NH2 ARG A 6 -12.821 9.212 -10.214 1.00 0.00 N ATOM 0 H ARG A 6 -11.859 11.162 -4.769 1.00 0.00 H new ATOM 0 HA ARG A 6 -9.887 13.123 -5.554 1.00 0.00 H new ATOM 0 HB2 ARG A 6 -12.920 13.169 -5.397 1.00 0.00 H new ATOM 0 HB3 ARG A 6 -11.951 14.509 -5.977 1.00 0.00 H new ATOM 0 HG2 ARG A 6 -12.629 13.398 -7.939 1.00 0.00 H new ATOM 0 HG3 ARG A 6 -10.972 12.874 -7.707 1.00 0.00 H new ATOM 0 HD2 ARG A 6 -11.877 10.814 -6.521 1.00 0.00 H new ATOM 0 HD3 ARG A 6 -13.488 11.321 -6.991 1.00 0.00 H new ATOM 0 HE ARG A 6 -11.464 11.000 -9.143 1.00 0.00 H new ATOM 0 HH11 ARG A 6 -14.388 9.904 -7.490 1.00 0.00 H new ATOM 0 HH12 ARG A 6 -14.803 8.739 -8.752 1.00 0.00 H new ATOM 0 HH21 ARG A 6 -11.988 9.478 -10.740 1.00 0.00 H new ATOM 0 HH22 ARG A 6 -13.451 8.499 -10.582 1.00 0.00 H new ATOM 108 N ALA A 7 -10.325 15.022 -3.815 1.00 0.00 N ATOM 109 CA ALA A 7 -10.262 15.899 -2.652 1.00 0.00 C ATOM 110 C ALA A 7 -11.668 16.255 -2.181 1.00 0.00 C ATOM 111 O ALA A 7 -11.931 16.351 -0.983 1.00 0.00 O ATOM 112 CB ALA A 7 -9.473 17.157 -2.973 1.00 0.00 C ATOM 0 H ALA A 7 -9.995 15.445 -4.683 1.00 0.00 H new ATOM 0 HA ALA A 7 -9.750 15.371 -1.848 1.00 0.00 H new ATOM 0 HB1 ALA A 7 -9.437 17.799 -2.093 1.00 0.00 H new ATOM 0 HB2 ALA A 7 -8.459 16.886 -3.266 1.00 0.00 H new ATOM 0 HB3 ALA A 7 -9.956 17.691 -3.791 1.00 0.00 H new ATOM 118 N ASN A 8 -12.565 16.435 -3.137 1.00 0.00 N ATOM 119 CA ASN A 8 -13.967 16.711 -2.844 1.00 0.00 C ATOM 120 C ASN A 8 -14.801 15.457 -3.087 1.00 0.00 C ATOM 121 O ASN A 8 -15.857 15.504 -3.720 1.00 0.00 O ATOM 122 CB ASN A 8 -14.480 17.882 -3.700 1.00 0.00 C ATOM 123 CG ASN A 8 -14.193 17.713 -5.183 1.00 0.00 C ATOM 124 OD1 ASN A 8 -13.142 18.127 -5.674 1.00 0.00 O ATOM 125 ND2 ASN A 8 -15.118 17.102 -5.904 1.00 0.00 N ATOM 0 H ASN A 8 -12.347 16.395 -4.133 1.00 0.00 H new ATOM 0 HA ASN A 8 -14.060 16.997 -1.796 1.00 0.00 H new ATOM 0 HB2 ASN A 8 -15.555 17.986 -3.555 1.00 0.00 H new ATOM 0 HB3 ASN A 8 -14.021 18.807 -3.351 1.00 0.00 H new ATOM 0 HD21 ASN A 8 -14.974 16.959 -6.904 1.00 0.00 H new ATOM 0 HD22 ASN A 8 -15.976 16.773 -5.460 1.00 0.00 H new ATOM 132 N TRP A 9 -14.309 14.341 -2.567 1.00 0.00 N ATOM 133 CA TRP A 9 -14.942 13.040 -2.757 1.00 0.00 C ATOM 134 C TRP A 9 -16.344 12.987 -2.159 1.00 0.00 C ATOM 135 O TRP A 9 -16.685 13.751 -1.254 1.00 0.00 O ATOM 136 CB TRP A 9 -14.082 11.939 -2.125 1.00 0.00 C ATOM 137 CG TRP A 9 -13.761 12.172 -0.672 1.00 0.00 C ATOM 138 CD1 TRP A 9 -12.638 12.760 -0.165 1.00 0.00 C ATOM 139 CD2 TRP A 9 -14.566 11.814 0.463 1.00 0.00 C ATOM 140 NE1 TRP A 9 -12.698 12.796 1.205 1.00 0.00 N ATOM 141 CE2 TRP A 9 -13.868 12.222 1.614 1.00 0.00 C ATOM 142 CE3 TRP A 9 -15.808 11.194 0.616 1.00 0.00 C ATOM 143 CZ2 TRP A 9 -14.371 12.029 2.897 1.00 0.00 C ATOM 144 CZ3 TRP A 9 -16.306 11.002 1.888 1.00 0.00 C ATOM 145 CH2 TRP A 9 -15.591 11.418 3.015 1.00 0.00 C ATOM 0 H TRP A 9 -13.461 14.310 -2.002 1.00 0.00 H new ATOM 0 HA TRP A 9 -15.029 12.880 -3.832 1.00 0.00 H new ATOM 0 HB2 TRP A 9 -14.600 10.985 -2.224 1.00 0.00 H new ATOM 0 HB3 TRP A 9 -13.150 11.854 -2.684 1.00 0.00 H new ATOM 0 HD1 TRP A 9 -11.820 13.142 -0.758 1.00 0.00 H new ATOM 0 HE1 TRP A 9 -11.984 13.188 1.819 1.00 0.00 H new ATOM 0 HE3 TRP A 9 -16.370 10.870 -0.248 1.00 0.00 H new ATOM 0 HZ2 TRP A 9 -13.819 12.349 3.768 1.00 0.00 H new ATOM 0 HZ3 TRP A 9 -17.265 10.522 2.015 1.00 0.00 H new ATOM 0 HH2 TRP A 9 -16.009 11.254 3.997 1.00 0.00 H new ATOM 156 N SER A 10 -17.149 12.083 -2.681 1.00 0.00 N ATOM 157 CA SER A 10 -18.438 11.782 -2.099 1.00 0.00 C ATOM 158 C SER A 10 -18.360 10.423 -1.405 1.00 0.00 C ATOM 159 O SER A 10 -17.393 9.682 -1.602 1.00 0.00 O ATOM 160 CB SER A 10 -19.519 11.778 -3.185 1.00 0.00 C ATOM 161 OG SER A 10 -20.809 11.597 -2.628 1.00 0.00 O ATOM 0 H SER A 10 -16.928 11.540 -3.516 1.00 0.00 H new ATOM 0 HA SER A 10 -18.702 12.545 -1.366 1.00 0.00 H new ATOM 0 HB2 SER A 10 -19.487 12.718 -3.736 1.00 0.00 H new ATOM 0 HB3 SER A 10 -19.315 10.982 -3.901 1.00 0.00 H new ATOM 0 HG SER A 10 -21.478 11.600 -3.344 1.00 0.00 H new ATOM 167 N GLU A 11 -19.364 10.096 -0.599 1.00 0.00 N ATOM 168 CA GLU A 11 -19.394 8.818 0.111 1.00 0.00 C ATOM 169 C GLU A 11 -19.305 7.662 -0.879 1.00 0.00 C ATOM 170 O GLU A 11 -18.706 6.627 -0.594 1.00 0.00 O ATOM 171 CB GLU A 11 -20.675 8.696 0.938 1.00 0.00 C ATOM 172 CG GLU A 11 -20.887 9.846 1.909 1.00 0.00 C ATOM 173 CD GLU A 11 -22.151 9.685 2.725 1.00 0.00 C ATOM 174 OE1 GLU A 11 -23.246 9.692 2.131 1.00 0.00 O ATOM 175 OE2 GLU A 11 -22.057 9.537 3.963 1.00 0.00 O ATOM 0 H GLU A 11 -20.169 10.697 -0.420 1.00 0.00 H new ATOM 0 HA GLU A 11 -18.537 8.777 0.783 1.00 0.00 H new ATOM 0 HB2 GLU A 11 -21.529 8.640 0.263 1.00 0.00 H new ATOM 0 HB3 GLU A 11 -20.649 7.760 1.497 1.00 0.00 H new ATOM 0 HG2 GLU A 11 -20.031 9.914 2.580 1.00 0.00 H new ATOM 0 HG3 GLU A 11 -20.933 10.783 1.354 1.00 0.00 H new ATOM 182 N GLU A 12 -19.889 7.872 -2.053 1.00 0.00 N ATOM 183 CA GLU A 12 -19.856 6.893 -3.130 1.00 0.00 C ATOM 184 C GLU A 12 -18.413 6.587 -3.530 1.00 0.00 C ATOM 185 O GLU A 12 -18.030 5.424 -3.682 1.00 0.00 O ATOM 186 CB GLU A 12 -20.630 7.434 -4.334 1.00 0.00 C ATOM 187 CG GLU A 12 -22.054 7.843 -3.996 1.00 0.00 C ATOM 188 CD GLU A 12 -22.736 8.577 -5.130 1.00 0.00 C ATOM 189 OE1 GLU A 12 -22.601 9.817 -5.206 1.00 0.00 O ATOM 190 OE2 GLU A 12 -23.421 7.927 -5.942 1.00 0.00 O ATOM 0 H GLU A 12 -20.398 8.725 -2.284 1.00 0.00 H new ATOM 0 HA GLU A 12 -20.321 5.970 -2.785 1.00 0.00 H new ATOM 0 HB2 GLU A 12 -20.099 8.294 -4.742 1.00 0.00 H new ATOM 0 HB3 GLU A 12 -20.653 6.673 -5.115 1.00 0.00 H new ATOM 0 HG2 GLU A 12 -22.633 6.954 -3.744 1.00 0.00 H new ATOM 0 HG3 GLU A 12 -22.045 8.479 -3.111 1.00 0.00 H new ATOM 197 N ASP A 13 -17.617 7.643 -3.679 1.00 0.00 N ATOM 198 CA ASP A 13 -16.214 7.507 -4.063 1.00 0.00 C ATOM 199 C ASP A 13 -15.420 6.872 -2.936 1.00 0.00 C ATOM 200 O ASP A 13 -14.592 5.991 -3.169 1.00 0.00 O ATOM 201 CB ASP A 13 -15.593 8.868 -4.391 1.00 0.00 C ATOM 202 CG ASP A 13 -16.332 9.624 -5.472 1.00 0.00 C ATOM 203 OD1 ASP A 13 -16.304 9.186 -6.640 1.00 0.00 O ATOM 204 OD2 ASP A 13 -16.932 10.673 -5.157 1.00 0.00 O ATOM 0 H ASP A 13 -17.921 8.606 -3.539 1.00 0.00 H new ATOM 0 HA ASP A 13 -16.178 6.875 -4.950 1.00 0.00 H new ATOM 0 HB2 ASP A 13 -15.569 9.475 -3.486 1.00 0.00 H new ATOM 0 HB3 ASP A 13 -14.559 8.721 -4.704 1.00 0.00 H new ATOM 209 N LEU A 14 -15.682 7.328 -1.715 1.00 0.00 N ATOM 210 CA LEU A 14 -14.982 6.830 -0.536 1.00 0.00 C ATOM 211 C LEU A 14 -15.149 5.322 -0.407 1.00 0.00 C ATOM 212 O LEU A 14 -14.167 4.589 -0.280 1.00 0.00 O ATOM 213 CB LEU A 14 -15.511 7.518 0.722 1.00 0.00 C ATOM 214 CG LEU A 14 -14.746 7.198 2.007 1.00 0.00 C ATOM 215 CD1 LEU A 14 -13.348 7.801 1.961 1.00 0.00 C ATOM 216 CD2 LEU A 14 -15.507 7.700 3.222 1.00 0.00 C ATOM 0 H LEU A 14 -16.378 8.046 -1.516 1.00 0.00 H new ATOM 0 HA LEU A 14 -13.922 7.055 -0.649 1.00 0.00 H new ATOM 0 HB2 LEU A 14 -15.490 8.596 0.564 1.00 0.00 H new ATOM 0 HB3 LEU A 14 -16.555 7.237 0.859 1.00 0.00 H new ATOM 0 HG LEU A 14 -14.649 6.115 2.089 1.00 0.00 H new ATOM 0 HD11 LEU A 14 -12.819 7.563 2.884 1.00 0.00 H new ATOM 0 HD12 LEU A 14 -12.802 7.389 1.113 1.00 0.00 H new ATOM 0 HD13 LEU A 14 -13.422 8.883 1.854 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -14.946 7.463 4.126 1.00 0.00 H new ATOM 0 HD22 LEU A 14 -15.638 8.780 3.149 1.00 0.00 H new ATOM 0 HD23 LEU A 14 -16.484 7.218 3.264 1.00 0.00 H new ATOM 228 N GLU A 15 -16.396 4.868 -0.456 1.00 0.00 N ATOM 229 CA GLU A 15 -16.698 3.445 -0.356 1.00 0.00 C ATOM 230 C GLU A 15 -16.081 2.662 -1.511 1.00 0.00 C ATOM 231 O GLU A 15 -15.712 1.502 -1.349 1.00 0.00 O ATOM 232 CB GLU A 15 -18.209 3.220 -0.305 1.00 0.00 C ATOM 233 CG GLU A 15 -18.754 3.033 1.103 1.00 0.00 C ATOM 234 CD GLU A 15 -18.448 4.196 2.028 1.00 0.00 C ATOM 235 OE1 GLU A 15 -17.323 4.254 2.564 1.00 0.00 O ATOM 236 OE2 GLU A 15 -19.347 5.040 2.248 1.00 0.00 O ATOM 0 H GLU A 15 -17.215 5.466 -0.565 1.00 0.00 H new ATOM 0 HA GLU A 15 -16.257 3.076 0.570 1.00 0.00 H new ATOM 0 HB2 GLU A 15 -18.710 4.070 -0.769 1.00 0.00 H new ATOM 0 HB3 GLU A 15 -18.457 2.341 -0.900 1.00 0.00 H new ATOM 0 HG2 GLU A 15 -19.834 2.894 1.051 1.00 0.00 H new ATOM 0 HG3 GLU A 15 -18.336 2.121 1.528 1.00 0.00 H new ATOM 243 N THR A 16 -15.958 3.301 -2.670 1.00 0.00 N ATOM 244 CA THR A 16 -15.299 2.677 -3.813 1.00 0.00 C ATOM 245 C THR A 16 -13.830 2.401 -3.489 1.00 0.00 C ATOM 246 O THR A 16 -13.327 1.297 -3.710 1.00 0.00 O ATOM 247 CB THR A 16 -15.385 3.564 -5.076 1.00 0.00 C ATOM 248 OG1 THR A 16 -16.755 3.824 -5.410 1.00 0.00 O ATOM 249 CG2 THR A 16 -14.702 2.899 -6.259 1.00 0.00 C ATOM 0 H THR A 16 -16.304 4.245 -2.843 1.00 0.00 H new ATOM 0 HA THR A 16 -15.817 1.740 -4.016 1.00 0.00 H new ATOM 0 HB THR A 16 -14.876 4.502 -4.856 1.00 0.00 H new ATOM 0 HG1 THR A 16 -17.215 4.203 -4.632 1.00 0.00 H new ATOM 0 HG21 THR A 16 -14.778 3.545 -7.133 1.00 0.00 H new ATOM 0 HG22 THR A 16 -13.651 2.729 -6.024 1.00 0.00 H new ATOM 0 HG23 THR A 16 -15.186 1.945 -6.470 1.00 0.00 H new ATOM 257 N VAL A 17 -13.162 3.412 -2.943 1.00 0.00 N ATOM 258 CA VAL A 17 -11.754 3.309 -2.579 1.00 0.00 C ATOM 259 C VAL A 17 -11.554 2.283 -1.469 1.00 0.00 C ATOM 260 O VAL A 17 -10.686 1.412 -1.561 1.00 0.00 O ATOM 261 CB VAL A 17 -11.198 4.677 -2.123 1.00 0.00 C ATOM 262 CG1 VAL A 17 -9.758 4.561 -1.644 1.00 0.00 C ATOM 263 CG2 VAL A 17 -11.305 5.693 -3.251 1.00 0.00 C ATOM 0 H VAL A 17 -13.579 4.321 -2.741 1.00 0.00 H new ATOM 0 HA VAL A 17 -11.210 2.985 -3.466 1.00 0.00 H new ATOM 0 HB VAL A 17 -11.800 5.020 -1.281 1.00 0.00 H new ATOM 0 HG11 VAL A 17 -9.399 5.541 -1.331 1.00 0.00 H new ATOM 0 HG12 VAL A 17 -9.709 3.871 -0.802 1.00 0.00 H new ATOM 0 HG13 VAL A 17 -9.133 4.188 -2.456 1.00 0.00 H new ATOM 0 HG21 VAL A 17 -10.910 6.652 -2.916 1.00 0.00 H new ATOM 0 HG22 VAL A 17 -10.732 5.345 -4.110 1.00 0.00 H new ATOM 0 HG23 VAL A 17 -12.350 5.811 -3.536 1.00 0.00 H new ATOM 273 N ILE A 18 -12.378 2.379 -0.433 1.00 0.00 N ATOM 274 CA ILE A 18 -12.282 1.477 0.707 1.00 0.00 C ATOM 275 C ILE A 18 -12.513 0.029 0.288 1.00 0.00 C ATOM 276 O ILE A 18 -11.719 -0.845 0.624 1.00 0.00 O ATOM 277 CB ILE A 18 -13.276 1.866 1.825 1.00 0.00 C ATOM 278 CG1 ILE A 18 -12.929 3.258 2.361 1.00 0.00 C ATOM 279 CG2 ILE A 18 -13.258 0.837 2.952 1.00 0.00 C ATOM 280 CD1 ILE A 18 -13.861 3.743 3.446 1.00 0.00 C ATOM 0 H ILE A 18 -13.121 3.074 -0.359 1.00 0.00 H new ATOM 0 HA ILE A 18 -11.270 1.570 1.100 1.00 0.00 H new ATOM 0 HB ILE A 18 -14.283 1.885 1.408 1.00 0.00 H new ATOM 0 HG12 ILE A 18 -11.911 3.244 2.749 1.00 0.00 H new ATOM 0 HG13 ILE A 18 -12.946 3.970 1.536 1.00 0.00 H new ATOM 0 HG21 ILE A 18 -13.966 1.133 3.726 1.00 0.00 H new ATOM 0 HG22 ILE A 18 -13.539 -0.139 2.558 1.00 0.00 H new ATOM 0 HG23 ILE A 18 -12.256 0.781 3.378 1.00 0.00 H new ATOM 0 HD11 ILE A 18 -13.551 4.735 3.775 1.00 0.00 H new ATOM 0 HD12 ILE A 18 -14.878 3.791 3.057 1.00 0.00 H new ATOM 0 HD13 ILE A 18 -13.827 3.054 4.290 1.00 0.00 H new ATOM 292 N ARG A 19 -13.579 -0.215 -0.470 1.00 0.00 N ATOM 293 CA ARG A 19 -13.928 -1.571 -0.903 1.00 0.00 C ATOM 294 C ARG A 19 -12.819 -2.180 -1.761 1.00 0.00 C ATOM 295 O ARG A 19 -12.587 -3.388 -1.730 1.00 0.00 O ATOM 296 CB ARG A 19 -15.233 -1.556 -1.701 1.00 0.00 C ATOM 297 CG ARG A 19 -15.813 -2.940 -1.958 1.00 0.00 C ATOM 298 CD ARG A 19 -16.208 -3.120 -3.416 1.00 0.00 C ATOM 299 NE ARG A 19 -15.037 -3.259 -4.283 1.00 0.00 N ATOM 300 CZ ARG A 19 -14.898 -2.665 -5.466 1.00 0.00 C ATOM 301 NH1 ARG A 19 -15.826 -1.826 -5.916 1.00 0.00 N ATOM 302 NH2 ARG A 19 -13.814 -2.903 -6.191 1.00 0.00 N ATOM 0 H ARG A 19 -14.219 0.508 -0.799 1.00 0.00 H new ATOM 0 HA ARG A 19 -14.054 -2.181 -0.008 1.00 0.00 H new ATOM 0 HB2 ARG A 19 -15.969 -0.958 -1.164 1.00 0.00 H new ATOM 0 HB3 ARG A 19 -15.058 -1.063 -2.657 1.00 0.00 H new ATOM 0 HG2 ARG A 19 -15.081 -3.699 -1.683 1.00 0.00 H new ATOM 0 HG3 ARG A 19 -16.685 -3.093 -1.323 1.00 0.00 H new ATOM 0 HD2 ARG A 19 -16.840 -4.002 -3.515 1.00 0.00 H new ATOM 0 HD3 ARG A 19 -16.801 -2.265 -3.740 1.00 0.00 H new ATOM 0 HE ARG A 19 -14.274 -3.853 -3.958 1.00 0.00 H new ATOM 0 HH11 ARG A 19 -16.654 -1.632 -5.353 1.00 0.00 H new ATOM 0 HH12 ARG A 19 -15.710 -1.376 -6.824 1.00 0.00 H new ATOM 0 HH21 ARG A 19 -13.095 -3.537 -5.841 1.00 0.00 H new ATOM 0 HH22 ARG A 19 -13.699 -2.452 -7.099 1.00 0.00 H new ATOM 316 N ALA A 20 -12.143 -1.336 -2.531 1.00 0.00 N ATOM 317 CA ALA A 20 -11.072 -1.792 -3.409 1.00 0.00 C ATOM 318 C ALA A 20 -9.873 -2.288 -2.608 1.00 0.00 C ATOM 319 O ALA A 20 -9.250 -3.290 -2.958 1.00 0.00 O ATOM 320 CB ALA A 20 -10.655 -0.677 -4.355 1.00 0.00 C ATOM 0 H ALA A 20 -12.317 -0.332 -2.565 1.00 0.00 H new ATOM 0 HA ALA A 20 -11.451 -2.629 -3.996 1.00 0.00 H new ATOM 0 HB1 ALA A 20 -9.855 -1.031 -5.005 1.00 0.00 H new ATOM 0 HB2 ALA A 20 -11.509 -0.376 -4.962 1.00 0.00 H new ATOM 0 HB3 ALA A 20 -10.302 0.177 -3.777 1.00 0.00 H new ATOM 326 N VAL A 21 -9.558 -1.588 -1.529 1.00 0.00 N ATOM 327 CA VAL A 21 -8.426 -1.957 -0.691 1.00 0.00 C ATOM 328 C VAL A 21 -8.832 -3.040 0.312 1.00 0.00 C ATOM 329 O VAL A 21 -8.032 -3.906 0.667 1.00 0.00 O ATOM 330 CB VAL A 21 -7.860 -0.732 0.064 1.00 0.00 C ATOM 331 CG1 VAL A 21 -6.599 -1.095 0.835 1.00 0.00 C ATOM 332 CG2 VAL A 21 -7.587 0.415 -0.900 1.00 0.00 C ATOM 0 H VAL A 21 -10.068 -0.763 -1.213 1.00 0.00 H new ATOM 0 HA VAL A 21 -7.646 -2.347 -1.345 1.00 0.00 H new ATOM 0 HB VAL A 21 -8.611 -0.407 0.784 1.00 0.00 H new ATOM 0 HG11 VAL A 21 -6.224 -0.214 1.355 1.00 0.00 H new ATOM 0 HG12 VAL A 21 -6.828 -1.875 1.561 1.00 0.00 H new ATOM 0 HG13 VAL A 21 -5.840 -1.457 0.141 1.00 0.00 H new ATOM 0 HG21 VAL A 21 -7.189 1.267 -0.349 1.00 0.00 H new ATOM 0 HG22 VAL A 21 -6.861 0.096 -1.648 1.00 0.00 H new ATOM 0 HG23 VAL A 21 -8.515 0.704 -1.394 1.00 0.00 H new ATOM 342 N TYR A 22 -10.086 -2.989 0.749 1.00 0.00 N ATOM 343 CA TYR A 22 -10.627 -3.945 1.714 1.00 0.00 C ATOM 344 C TYR A 22 -10.965 -5.278 1.047 1.00 0.00 C ATOM 345 O TYR A 22 -12.103 -5.748 1.120 1.00 0.00 O ATOM 346 CB TYR A 22 -11.891 -3.371 2.359 1.00 0.00 C ATOM 347 CG TYR A 22 -11.791 -3.141 3.848 1.00 0.00 C ATOM 348 CD1 TYR A 22 -11.218 -1.982 4.355 1.00 0.00 C ATOM 349 CD2 TYR A 22 -12.284 -4.078 4.747 1.00 0.00 C ATOM 350 CE1 TYR A 22 -11.139 -1.764 5.716 1.00 0.00 C ATOM 351 CE2 TYR A 22 -12.213 -3.865 6.109 1.00 0.00 C ATOM 352 CZ TYR A 22 -11.638 -2.709 6.589 1.00 0.00 C ATOM 353 OH TYR A 22 -11.582 -2.487 7.945 1.00 0.00 O ATOM 0 H TYR A 22 -10.758 -2.284 0.445 1.00 0.00 H new ATOM 0 HA TYR A 22 -9.865 -4.121 2.474 1.00 0.00 H new ATOM 0 HB2 TYR A 22 -12.132 -2.425 1.874 1.00 0.00 H new ATOM 0 HB3 TYR A 22 -12.722 -4.049 2.165 1.00 0.00 H new ATOM 0 HD1 TYR A 22 -10.828 -1.240 3.674 1.00 0.00 H new ATOM 0 HD2 TYR A 22 -12.730 -4.988 4.374 1.00 0.00 H new ATOM 0 HE1 TYR A 22 -10.689 -0.859 6.095 1.00 0.00 H new ATOM 0 HE2 TYR A 22 -12.606 -4.601 6.795 1.00 0.00 H new ATOM 0 HH TYR A 22 -12.233 -1.797 8.191 1.00 0.00 H new ATOM 586 N LEU A 37 -10.020 -2.575 11.552 1.00 0.00 N ATOM 587 CA LEU A 37 -9.622 -1.173 11.471 1.00 0.00 C ATOM 588 C LEU A 37 -10.764 -0.274 10.985 1.00 0.00 C ATOM 589 O LEU A 37 -10.600 0.533 10.067 1.00 0.00 O ATOM 590 CB LEU A 37 -8.378 -0.998 10.577 1.00 0.00 C ATOM 591 CG LEU A 37 -8.521 -1.418 9.106 1.00 0.00 C ATOM 592 CD1 LEU A 37 -7.452 -0.744 8.260 1.00 0.00 C ATOM 593 CD2 LEU A 37 -8.407 -2.925 8.961 1.00 0.00 C ATOM 0 HA LEU A 37 -9.368 -0.860 12.484 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -8.084 0.051 10.604 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -7.560 -1.569 11.016 1.00 0.00 H new ATOM 0 HG LEU A 37 -9.506 -1.106 8.760 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -7.565 -1.050 7.220 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -7.559 0.338 8.333 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -6.465 -1.036 8.620 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -8.511 -3.198 7.911 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -7.434 -3.253 9.326 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -9.194 -3.407 9.541 1.00 0.00 H new ATOM 605 N VAL A 38 -11.912 -0.391 11.639 1.00 0.00 N ATOM 606 CA VAL A 38 -13.045 0.481 11.359 1.00 0.00 C ATOM 607 C VAL A 38 -12.676 1.923 11.714 1.00 0.00 C ATOM 608 O VAL A 38 -13.208 2.881 11.149 1.00 0.00 O ATOM 609 CB VAL A 38 -14.304 0.033 12.143 1.00 0.00 C ATOM 610 CG1 VAL A 38 -14.065 0.085 13.645 1.00 0.00 C ATOM 611 CG2 VAL A 38 -15.514 0.870 11.756 1.00 0.00 C ATOM 0 H VAL A 38 -12.083 -1.083 12.369 1.00 0.00 H new ATOM 0 HA VAL A 38 -13.281 0.419 10.297 1.00 0.00 H new ATOM 0 HB VAL A 38 -14.511 -1.003 11.874 1.00 0.00 H new ATOM 0 HG11 VAL A 38 -14.966 -0.235 14.168 1.00 0.00 H new ATOM 0 HG12 VAL A 38 -13.240 -0.578 13.905 1.00 0.00 H new ATOM 0 HG13 VAL A 38 -13.818 1.105 13.939 1.00 0.00 H new ATOM 0 HG21 VAL A 38 -16.384 0.535 12.321 1.00 0.00 H new ATOM 0 HG22 VAL A 38 -15.318 1.919 11.980 1.00 0.00 H new ATOM 0 HG23 VAL A 38 -15.708 0.757 10.689 1.00 0.00 H new ATOM 621 N SER A 39 -11.727 2.059 12.635 1.00 0.00 N ATOM 622 CA SER A 39 -11.197 3.353 13.021 1.00 0.00 C ATOM 623 C SER A 39 -10.482 4.007 11.842 1.00 0.00 C ATOM 624 O SER A 39 -10.599 5.212 11.623 1.00 0.00 O ATOM 625 CB SER A 39 -10.241 3.173 14.198 1.00 0.00 C ATOM 626 OG SER A 39 -9.362 2.084 13.964 1.00 0.00 O ATOM 0 H SER A 39 -11.307 1.273 13.132 1.00 0.00 H new ATOM 0 HA SER A 39 -12.016 4.006 13.322 1.00 0.00 H new ATOM 0 HB2 SER A 39 -9.665 4.086 14.349 1.00 0.00 H new ATOM 0 HB3 SER A 39 -10.809 2.999 15.112 1.00 0.00 H new ATOM 0 HG SER A 39 -8.755 1.984 14.727 1.00 0.00 H new ATOM 632 N ALA A 40 -9.765 3.195 11.072 1.00 0.00 N ATOM 633 CA ALA A 40 -9.055 3.677 9.896 1.00 0.00 C ATOM 634 C ALA A 40 -10.041 4.196 8.859 1.00 0.00 C ATOM 635 O ALA A 40 -9.833 5.252 8.263 1.00 0.00 O ATOM 636 CB ALA A 40 -8.191 2.573 9.304 1.00 0.00 C ATOM 0 H ALA A 40 -9.661 2.195 11.244 1.00 0.00 H new ATOM 0 HA ALA A 40 -8.404 4.498 10.197 1.00 0.00 H new ATOM 0 HB1 ALA A 40 -7.668 2.952 8.426 1.00 0.00 H new ATOM 0 HB2 ALA A 40 -7.463 2.243 10.046 1.00 0.00 H new ATOM 0 HB3 ALA A 40 -8.822 1.732 9.016 1.00 0.00 H new ATOM 642 N GLU A 41 -11.120 3.449 8.659 1.00 0.00 N ATOM 643 CA GLU A 41 -12.185 3.867 7.756 1.00 0.00 C ATOM 644 C GLU A 41 -12.797 5.189 8.223 1.00 0.00 C ATOM 645 O GLU A 41 -13.108 6.066 7.414 1.00 0.00 O ATOM 646 CB GLU A 41 -13.260 2.786 7.679 1.00 0.00 C ATOM 647 CG GLU A 41 -12.761 1.478 7.086 1.00 0.00 C ATOM 648 CD GLU A 41 -13.771 0.360 7.221 1.00 0.00 C ATOM 649 OE1 GLU A 41 -14.825 0.417 6.549 1.00 0.00 O ATOM 650 OE2 GLU A 41 -13.524 -0.570 8.017 1.00 0.00 O ATOM 0 H GLU A 41 -11.281 2.549 9.111 1.00 0.00 H new ATOM 0 HA GLU A 41 -11.761 4.016 6.763 1.00 0.00 H new ATOM 0 HB2 GLU A 41 -13.648 2.598 8.680 1.00 0.00 H new ATOM 0 HB3 GLU A 41 -14.092 3.154 7.079 1.00 0.00 H new ATOM 0 HG2 GLU A 41 -12.526 1.626 6.032 1.00 0.00 H new ATOM 0 HG3 GLU A 41 -11.834 1.188 7.581 1.00 0.00 H new ATOM 657 N SER A 42 -12.950 5.327 9.534 1.00 0.00 N ATOM 658 CA SER A 42 -13.473 6.551 10.128 1.00 0.00 C ATOM 659 C SER A 42 -12.509 7.716 9.887 1.00 0.00 C ATOM 660 O SER A 42 -12.923 8.810 9.494 1.00 0.00 O ATOM 661 CB SER A 42 -13.708 6.341 11.629 1.00 0.00 C ATOM 662 OG SER A 42 -14.263 7.493 12.243 1.00 0.00 O ATOM 0 H SER A 42 -12.717 4.600 10.211 1.00 0.00 H new ATOM 0 HA SER A 42 -14.425 6.797 9.657 1.00 0.00 H new ATOM 0 HB2 SER A 42 -14.377 5.493 11.777 1.00 0.00 H new ATOM 0 HB3 SER A 42 -12.764 6.091 12.113 1.00 0.00 H new ATOM 0 HG SER A 42 -14.400 7.321 13.198 1.00 0.00 H new ATOM 668 N LEU A 43 -11.219 7.468 10.098 1.00 0.00 N ATOM 669 CA LEU A 43 -10.194 8.490 9.898 1.00 0.00 C ATOM 670 C LEU A 43 -10.137 8.932 8.440 1.00 0.00 C ATOM 671 O LEU A 43 -9.849 10.093 8.145 1.00 0.00 O ATOM 672 CB LEU A 43 -8.824 7.969 10.335 1.00 0.00 C ATOM 673 CG LEU A 43 -8.691 7.658 11.827 1.00 0.00 C ATOM 674 CD1 LEU A 43 -7.317 7.078 12.125 1.00 0.00 C ATOM 675 CD2 LEU A 43 -8.943 8.909 12.659 1.00 0.00 C ATOM 0 H LEU A 43 -10.858 6.566 10.408 1.00 0.00 H new ATOM 0 HA LEU A 43 -10.460 9.351 10.511 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -8.600 7.064 9.770 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -8.069 8.708 10.065 1.00 0.00 H new ATOM 0 HG LEU A 43 -9.442 6.916 12.096 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -7.237 6.862 13.190 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -7.179 6.158 11.556 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -6.549 7.798 11.842 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -8.844 8.668 13.717 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -8.216 9.676 12.392 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -9.949 9.279 12.464 1.00 0.00 H new ATOM 687 N LEU A 44 -10.409 8.002 7.534 1.00 0.00 N ATOM 688 CA LEU A 44 -10.409 8.301 6.109 1.00 0.00 C ATOM 689 C LEU A 44 -11.616 9.161 5.744 1.00 0.00 C ATOM 690 O LEU A 44 -11.502 10.107 4.969 1.00 0.00 O ATOM 691 CB LEU A 44 -10.411 7.005 5.291 1.00 0.00 C ATOM 692 CG LEU A 44 -10.237 7.187 3.781 1.00 0.00 C ATOM 693 CD1 LEU A 44 -8.887 7.819 3.471 1.00 0.00 C ATOM 694 CD2 LEU A 44 -10.375 5.853 3.066 1.00 0.00 C ATOM 0 H LEU A 44 -10.633 7.033 7.762 1.00 0.00 H new ATOM 0 HA LEU A 44 -9.503 8.859 5.874 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -9.611 6.361 5.658 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -11.350 6.481 5.472 1.00 0.00 H new ATOM 0 HG LEU A 44 -11.020 7.855 3.422 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -8.781 7.941 2.393 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -8.822 8.794 3.954 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -8.090 7.176 3.844 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -10.249 6.000 1.993 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -9.612 5.164 3.430 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -11.363 5.436 3.261 1.00 0.00 H new ATOM 706 N ARG A 45 -12.769 8.838 6.323 1.00 0.00 N ATOM 707 CA ARG A 45 -13.997 9.581 6.054 1.00 0.00 C ATOM 708 C ARG A 45 -13.903 11.013 6.579 1.00 0.00 C ATOM 709 O ARG A 45 -14.516 11.927 6.035 1.00 0.00 O ATOM 710 CB ARG A 45 -15.204 8.873 6.677 1.00 0.00 C ATOM 711 CG ARG A 45 -16.521 9.596 6.430 1.00 0.00 C ATOM 712 CD ARG A 45 -17.715 8.798 6.928 1.00 0.00 C ATOM 713 NE ARG A 45 -17.839 7.510 6.247 1.00 0.00 N ATOM 714 CZ ARG A 45 -18.508 7.327 5.106 1.00 0.00 C ATOM 715 NH1 ARG A 45 -19.098 8.352 4.498 1.00 0.00 N ATOM 716 NH2 ARG A 45 -18.567 6.121 4.566 1.00 0.00 N ATOM 0 H ARG A 45 -12.879 8.067 6.981 1.00 0.00 H new ATOM 0 HA ARG A 45 -14.129 9.620 4.973 1.00 0.00 H new ATOM 0 HB2 ARG A 45 -15.271 7.862 6.274 1.00 0.00 H new ATOM 0 HB3 ARG A 45 -15.046 8.778 7.751 1.00 0.00 H new ATOM 0 HG2 ARG A 45 -16.501 10.565 6.928 1.00 0.00 H new ATOM 0 HG3 ARG A 45 -16.634 9.788 5.363 1.00 0.00 H new ATOM 0 HD2 ARG A 45 -17.618 8.632 8.001 1.00 0.00 H new ATOM 0 HD3 ARG A 45 -18.626 9.377 6.776 1.00 0.00 H new ATOM 0 HE ARG A 45 -17.386 6.700 6.670 1.00 0.00 H new ATOM 0 HH11 ARG A 45 -19.041 9.286 4.903 1.00 0.00 H new ATOM 0 HH12 ARG A 45 -19.607 8.204 3.627 1.00 0.00 H new ATOM 0 HH21 ARG A 45 -18.103 5.335 5.021 1.00 0.00 H new ATOM 0 HH22 ARG A 45 -19.077 5.977 3.694 1.00 0.00 H new ATOM 730 N ASN A 46 -13.131 11.203 7.636 1.00 0.00 N ATOM 731 CA ASN A 46 -12.957 12.530 8.220 1.00 0.00 C ATOM 732 C ASN A 46 -11.763 13.248 7.603 1.00 0.00 C ATOM 733 O ASN A 46 -11.362 14.316 8.066 1.00 0.00 O ATOM 734 CB ASN A 46 -12.795 12.437 9.738 1.00 0.00 C ATOM 735 CG ASN A 46 -14.098 12.102 10.442 1.00 0.00 C ATOM 736 OD1 ASN A 46 -14.869 12.991 10.798 1.00 0.00 O ATOM 737 ND2 ASN A 46 -14.357 10.822 10.647 1.00 0.00 N ATOM 0 H ASN A 46 -12.615 10.461 8.108 1.00 0.00 H new ATOM 0 HA ASN A 46 -13.854 13.110 8.002 1.00 0.00 H new ATOM 0 HB2 ASN A 46 -12.052 11.676 9.975 1.00 0.00 H new ATOM 0 HB3 ASN A 46 -12.413 13.385 10.118 1.00 0.00 H new ATOM 0 HD21 ASN A 46 -15.220 10.545 11.114 1.00 0.00 H new ATOM 0 HD22 ASN A 46 -13.694 10.112 10.338 1.00 0.00 H new ATOM 744 N GLY A 47 -11.203 12.648 6.557 1.00 0.00 N ATOM 745 CA GLY A 47 -10.106 13.260 5.830 1.00 0.00 C ATOM 746 C GLY A 47 -8.872 13.478 6.684 1.00 0.00 C ATOM 747 O GLY A 47 -8.148 14.455 6.495 1.00 0.00 O ATOM 0 H GLY A 47 -11.494 11.739 6.197 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -9.845 12.629 4.980 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -10.435 14.218 5.427 1.00 0.00 H new ATOM 751 N LYS A 48 -8.629 12.573 7.622 1.00 0.00 N ATOM 752 CA LYS A 48 -7.469 12.680 8.497 1.00 0.00 C ATOM 753 C LYS A 48 -6.283 11.914 7.929 1.00 0.00 C ATOM 754 O LYS A 48 -5.148 12.386 7.977 1.00 0.00 O ATOM 755 CB LYS A 48 -7.791 12.173 9.905 1.00 0.00 C ATOM 756 CG LYS A 48 -8.688 13.108 10.698 1.00 0.00 C ATOM 757 CD LYS A 48 -8.720 12.726 12.168 1.00 0.00 C ATOM 758 CE LYS A 48 -9.374 13.807 13.015 1.00 0.00 C ATOM 759 NZ LYS A 48 -9.205 13.542 14.468 1.00 0.00 N ATOM 0 H LYS A 48 -9.218 11.758 7.797 1.00 0.00 H new ATOM 0 HA LYS A 48 -7.205 13.736 8.560 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -8.273 11.198 9.830 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -6.859 12.027 10.451 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -8.332 14.133 10.594 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -9.698 13.079 10.290 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -9.264 11.789 12.289 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -7.704 12.552 12.521 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -8.939 14.776 12.768 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -10.436 13.864 12.776 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -9.663 14.299 15.015 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -9.642 12.629 14.707 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -8.192 13.512 14.700 1.00 0.00 H new ATOM 773 N ILE A 49 -6.543 10.735 7.388 1.00 0.00 N ATOM 774 CA ILE A 49 -5.481 9.929 6.809 1.00 0.00 C ATOM 775 C ILE A 49 -5.563 9.947 5.291 1.00 0.00 C ATOM 776 O ILE A 49 -6.627 10.190 4.721 1.00 0.00 O ATOM 777 CB ILE A 49 -5.518 8.465 7.300 1.00 0.00 C ATOM 778 CG1 ILE A 49 -6.837 7.795 6.911 1.00 0.00 C ATOM 779 CG2 ILE A 49 -5.307 8.411 8.805 1.00 0.00 C ATOM 780 CD1 ILE A 49 -6.892 6.321 7.255 1.00 0.00 C ATOM 0 H ILE A 49 -7.472 10.317 7.338 1.00 0.00 H new ATOM 0 HA ILE A 49 -4.541 10.373 7.137 1.00 0.00 H new ATOM 0 HB ILE A 49 -4.709 7.917 6.817 1.00 0.00 H new ATOM 0 HG12 ILE A 49 -7.657 8.308 7.413 1.00 0.00 H new ATOM 0 HG13 ILE A 49 -6.994 7.916 5.839 1.00 0.00 H new ATOM 0 HG21 ILE A 49 -5.335 7.374 9.139 1.00 0.00 H new ATOM 0 HG22 ILE A 49 -4.339 8.846 9.052 1.00 0.00 H new ATOM 0 HG23 ILE A 49 -6.096 8.974 9.303 1.00 0.00 H new ATOM 0 HD11 ILE A 49 -7.856 5.912 6.951 1.00 0.00 H new ATOM 0 HD12 ILE A 49 -6.093 5.795 6.732 1.00 0.00 H new ATOM 0 HD13 ILE A 49 -6.767 6.193 8.330 1.00 0.00 H new ATOM 792 N THR A 50 -4.439 9.697 4.646 1.00 0.00 N ATOM 793 CA THR A 50 -4.378 9.687 3.197 1.00 0.00 C ATOM 794 C THR A 50 -4.648 8.284 2.671 1.00 0.00 C ATOM 795 O THR A 50 -4.761 7.335 3.450 1.00 0.00 O ATOM 796 CB THR A 50 -2.992 10.144 2.704 1.00 0.00 C ATOM 797 OG1 THR A 50 -1.994 9.214 3.147 1.00 0.00 O ATOM 798 CG2 THR A 50 -2.664 11.536 3.220 1.00 0.00 C ATOM 0 H THR A 50 -3.551 9.497 5.106 1.00 0.00 H new ATOM 0 HA THR A 50 -5.136 10.376 2.825 1.00 0.00 H new ATOM 0 HB THR A 50 -3.005 10.177 1.615 1.00 0.00 H new ATOM 0 HG1 THR A 50 -1.143 9.683 3.274 1.00 0.00 H new ATOM 0 HG21 THR A 50 -1.680 11.836 2.858 1.00 0.00 H new ATOM 0 HG22 THR A 50 -3.413 12.242 2.862 1.00 0.00 H new ATOM 0 HG23 THR A 50 -2.663 11.529 4.310 1.00 0.00 H new ATOM 806 N VAL A 51 -4.742 8.149 1.354 1.00 0.00 N ATOM 807 CA VAL A 51 -4.848 6.834 0.736 1.00 0.00 C ATOM 808 C VAL A 51 -3.598 6.015 1.056 1.00 0.00 C ATOM 809 O VAL A 51 -3.664 4.802 1.231 1.00 0.00 O ATOM 810 CB VAL A 51 -5.042 6.936 -0.795 1.00 0.00 C ATOM 811 CG1 VAL A 51 -5.079 5.557 -1.439 1.00 0.00 C ATOM 812 CG2 VAL A 51 -6.316 7.699 -1.114 1.00 0.00 C ATOM 0 H VAL A 51 -4.747 8.929 0.697 1.00 0.00 H new ATOM 0 HA VAL A 51 -5.727 6.337 1.145 1.00 0.00 H new ATOM 0 HB VAL A 51 -4.191 7.478 -1.207 1.00 0.00 H new ATOM 0 HG11 VAL A 51 -5.216 5.662 -2.515 1.00 0.00 H new ATOM 0 HG12 VAL A 51 -4.141 5.038 -1.242 1.00 0.00 H new ATOM 0 HG13 VAL A 51 -5.906 4.983 -1.022 1.00 0.00 H new ATOM 0 HG21 VAL A 51 -6.440 7.764 -2.195 1.00 0.00 H new ATOM 0 HG22 VAL A 51 -7.170 7.178 -0.681 1.00 0.00 H new ATOM 0 HG23 VAL A 51 -6.253 8.703 -0.695 1.00 0.00 H new ATOM 822 N ARG A 52 -2.463 6.700 1.171 1.00 0.00 N ATOM 823 CA ARG A 52 -1.211 6.056 1.552 1.00 0.00 C ATOM 824 C ARG A 52 -1.336 5.440 2.941 1.00 0.00 C ATOM 825 O ARG A 52 -1.004 4.274 3.142 1.00 0.00 O ATOM 826 CB ARG A 52 -0.061 7.067 1.539 1.00 0.00 C ATOM 827 CG ARG A 52 0.248 7.652 0.169 1.00 0.00 C ATOM 828 CD ARG A 52 0.967 6.658 -0.734 1.00 0.00 C ATOM 829 NE ARG A 52 0.091 5.592 -1.223 1.00 0.00 N ATOM 830 CZ ARG A 52 0.467 4.680 -2.125 1.00 0.00 C ATOM 831 NH1 ARG A 52 1.683 4.723 -2.663 1.00 0.00 N ATOM 832 NH2 ARG A 52 -0.379 3.732 -2.508 1.00 0.00 N ATOM 0 H ARG A 52 -2.386 7.703 1.005 1.00 0.00 H new ATOM 0 HA ARG A 52 -0.997 5.269 0.829 1.00 0.00 H new ATOM 0 HB2 ARG A 52 -0.302 7.881 2.222 1.00 0.00 H new ATOM 0 HB3 ARG A 52 0.836 6.583 1.924 1.00 0.00 H new ATOM 0 HG2 ARG A 52 -0.681 7.967 -0.307 1.00 0.00 H new ATOM 0 HG3 ARG A 52 0.864 8.544 0.287 1.00 0.00 H new ATOM 0 HD2 ARG A 52 1.392 7.190 -1.585 1.00 0.00 H new ATOM 0 HD3 ARG A 52 1.799 6.215 -0.187 1.00 0.00 H new ATOM 0 HE ARG A 52 -0.859 5.542 -0.855 1.00 0.00 H new ATOM 0 HH11 ARG A 52 2.337 5.456 -2.388 1.00 0.00 H new ATOM 0 HH12 ARG A 52 1.962 4.023 -3.351 1.00 0.00 H new ATOM 0 HH21 ARG A 52 -1.319 3.698 -2.114 1.00 0.00 H new ATOM 0 HH22 ARG A 52 -0.089 3.038 -3.197 1.00 0.00 H new ATOM 846 N GLU A 53 -1.833 6.233 3.886 1.00 0.00 N ATOM 847 CA GLU A 53 -2.017 5.773 5.257 1.00 0.00 C ATOM 848 C GLU A 53 -3.032 4.638 5.322 1.00 0.00 C ATOM 849 O GLU A 53 -2.833 3.655 6.034 1.00 0.00 O ATOM 850 CB GLU A 53 -2.478 6.921 6.159 1.00 0.00 C ATOM 851 CG GLU A 53 -1.481 8.061 6.267 1.00 0.00 C ATOM 852 CD GLU A 53 -0.120 7.598 6.737 1.00 0.00 C ATOM 853 OE1 GLU A 53 -0.014 7.111 7.883 1.00 0.00 O ATOM 854 OE2 GLU A 53 0.852 7.728 5.970 1.00 0.00 O ATOM 0 H GLU A 53 -2.116 7.200 3.726 1.00 0.00 H new ATOM 0 HA GLU A 53 -1.054 5.406 5.611 1.00 0.00 H new ATOM 0 HB2 GLU A 53 -3.421 7.312 5.778 1.00 0.00 H new ATOM 0 HB3 GLU A 53 -2.675 6.529 7.157 1.00 0.00 H new ATOM 0 HG2 GLU A 53 -1.381 8.545 5.296 1.00 0.00 H new ATOM 0 HG3 GLU A 53 -1.865 8.811 6.959 1.00 0.00 H new ATOM 861 N PHE A 54 -4.119 4.784 4.573 1.00 0.00 N ATOM 862 CA PHE A 54 -5.172 3.776 4.545 1.00 0.00 C ATOM 863 C PHE A 54 -4.642 2.458 3.984 1.00 0.00 C ATOM 864 O PHE A 54 -4.809 1.405 4.598 1.00 0.00 O ATOM 865 CB PHE A 54 -6.363 4.267 3.714 1.00 0.00 C ATOM 866 CG PHE A 54 -7.539 3.328 3.730 1.00 0.00 C ATOM 867 CD1 PHE A 54 -8.345 3.227 4.855 1.00 0.00 C ATOM 868 CD2 PHE A 54 -7.839 2.548 2.623 1.00 0.00 C ATOM 869 CE1 PHE A 54 -9.425 2.364 4.874 1.00 0.00 C ATOM 870 CE2 PHE A 54 -8.916 1.684 2.641 1.00 0.00 C ATOM 871 CZ PHE A 54 -9.710 1.593 3.766 1.00 0.00 C ATOM 0 H PHE A 54 -4.294 5.592 3.976 1.00 0.00 H new ATOM 0 HA PHE A 54 -5.508 3.605 5.568 1.00 0.00 H new ATOM 0 HB2 PHE A 54 -6.681 5.240 4.090 1.00 0.00 H new ATOM 0 HB3 PHE A 54 -6.040 4.413 2.683 1.00 0.00 H new ATOM 0 HD1 PHE A 54 -8.126 3.829 5.725 1.00 0.00 H new ATOM 0 HD2 PHE A 54 -7.224 2.617 1.738 1.00 0.00 H new ATOM 0 HE1 PHE A 54 -10.045 2.293 5.755 1.00 0.00 H new ATOM 0 HE2 PHE A 54 -9.137 1.079 1.774 1.00 0.00 H new ATOM 0 HZ PHE A 54 -10.554 0.919 3.779 1.00 0.00 H new ATOM 881 N VAL A 55 -3.989 2.524 2.826 1.00 0.00 N ATOM 882 CA VAL A 55 -3.411 1.335 2.211 1.00 0.00 C ATOM 883 C VAL A 55 -2.376 0.703 3.136 1.00 0.00 C ATOM 884 O VAL A 55 -2.345 -0.518 3.302 1.00 0.00 O ATOM 885 CB VAL A 55 -2.765 1.652 0.840 1.00 0.00 C ATOM 886 CG1 VAL A 55 -2.003 0.449 0.300 1.00 0.00 C ATOM 887 CG2 VAL A 55 -3.827 2.087 -0.159 1.00 0.00 C ATOM 0 H VAL A 55 -3.848 3.385 2.298 1.00 0.00 H new ATOM 0 HA VAL A 55 -4.225 0.630 2.045 1.00 0.00 H new ATOM 0 HB VAL A 55 -2.057 2.468 0.985 1.00 0.00 H new ATOM 0 HG11 VAL A 55 -1.560 0.701 -0.664 1.00 0.00 H new ATOM 0 HG12 VAL A 55 -1.215 0.173 1.000 1.00 0.00 H new ATOM 0 HG13 VAL A 55 -2.688 -0.390 0.176 1.00 0.00 H new ATOM 0 HG21 VAL A 55 -3.357 2.306 -1.118 1.00 0.00 H new ATOM 0 HG22 VAL A 55 -4.556 1.287 -0.287 1.00 0.00 H new ATOM 0 HG23 VAL A 55 -4.330 2.980 0.211 1.00 0.00 H new ATOM 897 N ARG A 56 -1.547 1.537 3.757 1.00 0.00 N ATOM 898 CA ARG A 56 -0.540 1.054 4.689 1.00 0.00 C ATOM 899 C ARG A 56 -1.196 0.346 5.870 1.00 0.00 C ATOM 900 O ARG A 56 -0.738 -0.710 6.296 1.00 0.00 O ATOM 901 CB ARG A 56 0.344 2.201 5.186 1.00 0.00 C ATOM 902 CG ARG A 56 1.414 1.751 6.167 1.00 0.00 C ATOM 903 CD ARG A 56 2.481 2.810 6.388 1.00 0.00 C ATOM 904 NE ARG A 56 1.982 4.005 7.065 1.00 0.00 N ATOM 905 CZ ARG A 56 2.699 4.698 7.951 1.00 0.00 C ATOM 906 NH1 ARG A 56 3.901 4.267 8.325 1.00 0.00 N ATOM 907 NH2 ARG A 56 2.217 5.817 8.472 1.00 0.00 N ATOM 0 H ARG A 56 -1.555 2.549 3.630 1.00 0.00 H new ATOM 0 HA ARG A 56 0.090 0.340 4.159 1.00 0.00 H new ATOM 0 HB2 ARG A 56 0.822 2.679 4.331 1.00 0.00 H new ATOM 0 HB3 ARG A 56 -0.283 2.954 5.663 1.00 0.00 H new ATOM 0 HG2 ARG A 56 0.948 1.505 7.121 1.00 0.00 H new ATOM 0 HG3 ARG A 56 1.882 0.839 5.796 1.00 0.00 H new ATOM 0 HD2 ARG A 56 3.292 2.381 6.976 1.00 0.00 H new ATOM 0 HD3 ARG A 56 2.903 3.097 5.425 1.00 0.00 H new ATOM 0 HE ARG A 56 1.038 4.325 6.849 1.00 0.00 H new ATOM 0 HH11 ARG A 56 4.278 3.404 7.934 1.00 0.00 H new ATOM 0 HH12 ARG A 56 4.446 4.800 9.003 1.00 0.00 H new ATOM 0 HH21 ARG A 56 1.294 6.152 8.196 1.00 0.00 H new ATOM 0 HH22 ARG A 56 2.769 6.343 9.149 1.00 0.00 H new ATOM 921 N ALA A 57 -2.278 0.919 6.379 1.00 0.00 N ATOM 922 CA ALA A 57 -2.984 0.346 7.517 1.00 0.00 C ATOM 923 C ALA A 57 -3.549 -1.027 7.179 1.00 0.00 C ATOM 924 O ALA A 57 -3.398 -1.974 7.949 1.00 0.00 O ATOM 925 CB ALA A 57 -4.098 1.274 7.981 1.00 0.00 C ATOM 0 H ALA A 57 -2.687 1.782 6.021 1.00 0.00 H new ATOM 0 HA ALA A 57 -2.266 0.228 8.328 1.00 0.00 H new ATOM 0 HB1 ALA A 57 -4.613 0.827 8.832 1.00 0.00 H new ATOM 0 HB2 ALA A 57 -3.673 2.233 8.277 1.00 0.00 H new ATOM 0 HB3 ALA A 57 -4.807 1.427 7.167 1.00 0.00 H new ATOM 931 N VAL A 58 -4.192 -1.132 6.023 1.00 0.00 N ATOM 932 CA VAL A 58 -4.791 -2.393 5.599 1.00 0.00 C ATOM 933 C VAL A 58 -3.712 -3.442 5.325 1.00 0.00 C ATOM 934 O VAL A 58 -3.815 -4.577 5.782 1.00 0.00 O ATOM 935 CB VAL A 58 -5.669 -2.212 4.339 1.00 0.00 C ATOM 936 CG1 VAL A 58 -6.323 -3.527 3.938 1.00 0.00 C ATOM 937 CG2 VAL A 58 -6.727 -1.143 4.570 1.00 0.00 C ATOM 0 H VAL A 58 -4.312 -0.363 5.364 1.00 0.00 H new ATOM 0 HA VAL A 58 -5.427 -2.736 6.415 1.00 0.00 H new ATOM 0 HB VAL A 58 -5.023 -1.889 3.523 1.00 0.00 H new ATOM 0 HG11 VAL A 58 -6.935 -3.373 3.049 1.00 0.00 H new ATOM 0 HG12 VAL A 58 -5.552 -4.267 3.723 1.00 0.00 H new ATOM 0 HG13 VAL A 58 -6.951 -3.884 4.754 1.00 0.00 H new ATOM 0 HG21 VAL A 58 -7.334 -1.031 3.671 1.00 0.00 H new ATOM 0 HG22 VAL A 58 -7.364 -1.436 5.404 1.00 0.00 H new ATOM 0 HG23 VAL A 58 -6.242 -0.195 4.800 1.00 0.00 H new ATOM 947 N ALA A 59 -2.667 -3.046 4.606 1.00 0.00 N ATOM 948 CA ALA A 59 -1.586 -3.963 4.260 1.00 0.00 C ATOM 949 C ALA A 59 -0.826 -4.431 5.500 1.00 0.00 C ATOM 950 O ALA A 59 -0.365 -5.569 5.560 1.00 0.00 O ATOM 951 CB ALA A 59 -0.633 -3.309 3.271 1.00 0.00 C ATOM 0 H ALA A 59 -2.545 -2.097 4.252 1.00 0.00 H new ATOM 0 HA ALA A 59 -2.033 -4.841 3.795 1.00 0.00 H new ATOM 0 HB1 ALA A 59 0.168 -4.005 3.023 1.00 0.00 H new ATOM 0 HB2 ALA A 59 -1.176 -3.042 2.364 1.00 0.00 H new ATOM 0 HB3 ALA A 59 -0.207 -2.410 3.716 1.00 0.00 H new ATOM 957 N LYS A 60 -0.698 -3.550 6.488 1.00 0.00 N ATOM 958 CA LYS A 60 -0.012 -3.889 7.734 1.00 0.00 C ATOM 959 C LYS A 60 -0.881 -4.762 8.633 1.00 0.00 C ATOM 960 O LYS A 60 -0.390 -5.335 9.606 1.00 0.00 O ATOM 961 CB LYS A 60 0.389 -2.626 8.502 1.00 0.00 C ATOM 962 CG LYS A 60 1.615 -1.911 7.948 1.00 0.00 C ATOM 963 CD LYS A 60 1.859 -0.609 8.695 1.00 0.00 C ATOM 964 CE LYS A 60 3.173 -0.624 9.460 1.00 0.00 C ATOM 965 NZ LYS A 60 4.352 -0.476 8.570 1.00 0.00 N ATOM 0 H LYS A 60 -1.059 -2.597 6.452 1.00 0.00 H new ATOM 0 HA LYS A 60 0.883 -4.447 7.459 1.00 0.00 H new ATOM 0 HB2 LYS A 60 -0.452 -1.933 8.500 1.00 0.00 H new ATOM 0 HB3 LYS A 60 0.579 -2.893 9.541 1.00 0.00 H new ATOM 0 HG2 LYS A 60 2.489 -2.556 8.036 1.00 0.00 H new ATOM 0 HG3 LYS A 60 1.475 -1.707 6.887 1.00 0.00 H new ATOM 0 HD2 LYS A 60 1.862 0.219 7.987 1.00 0.00 H new ATOM 0 HD3 LYS A 60 1.038 -0.431 9.390 1.00 0.00 H new ATOM 0 HE2 LYS A 60 3.172 0.183 10.193 1.00 0.00 H new ATOM 0 HE3 LYS A 60 3.256 -1.559 10.015 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 5.215 -0.407 9.146 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 4.419 -1.303 7.942 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 4.249 0.386 7.997 1.00 0.00 H new ATOM 979 N SER A 61 -2.164 -4.859 8.326 1.00 0.00 N ATOM 980 CA SER A 61 -3.062 -5.648 9.145 1.00 0.00 C ATOM 981 C SER A 61 -3.523 -6.901 8.408 1.00 0.00 C ATOM 982 O SER A 61 -2.828 -7.920 8.435 1.00 0.00 O ATOM 983 CB SER A 61 -4.254 -4.802 9.612 1.00 0.00 C ATOM 984 OG SER A 61 -4.860 -4.120 8.528 1.00 0.00 O ATOM 0 H SER A 61 -2.601 -4.406 7.524 1.00 0.00 H new ATOM 0 HA SER A 61 -2.516 -5.974 10.030 1.00 0.00 H new ATOM 0 HB2 SER A 61 -4.990 -5.444 10.097 1.00 0.00 H new ATOM 0 HB3 SER A 61 -3.920 -4.080 10.357 1.00 0.00 H new ATOM 0 HG SER A 61 -4.408 -3.262 8.387 1.00 0.00 H new ATOM 990 N GLU A 62 -4.672 -6.800 7.727 1.00 0.00 N ATOM 991 CA GLU A 62 -5.333 -7.941 7.074 1.00 0.00 C ATOM 992 C GLU A 62 -5.798 -8.962 8.122 1.00 0.00 C ATOM 993 O GLU A 62 -6.991 -9.260 8.219 1.00 0.00 O ATOM 994 CB GLU A 62 -4.411 -8.603 6.039 1.00 0.00 C ATOM 995 CG GLU A 62 -5.100 -9.658 5.180 1.00 0.00 C ATOM 996 CD GLU A 62 -6.128 -9.068 4.229 1.00 0.00 C ATOM 997 OE1 GLU A 62 -7.254 -8.759 4.671 1.00 0.00 O ATOM 998 OE2 GLU A 62 -5.815 -8.913 3.026 1.00 0.00 O ATOM 0 H GLU A 62 -5.173 -5.919 7.612 1.00 0.00 H new ATOM 0 HA GLU A 62 -6.208 -7.565 6.544 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -3.999 -7.832 5.388 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -3.571 -9.064 6.558 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -4.348 -10.198 4.605 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -5.588 -10.385 5.829 1.00 0.00 H new ATOM 1005 N LEU A 63 -4.839 -9.469 8.904 1.00 0.00 N ATOM 1006 CA LEU A 63 -5.088 -10.384 10.017 1.00 0.00 C ATOM 1007 C LEU A 63 -5.350 -11.802 9.516 1.00 0.00 C ATOM 1008 O LEU A 63 -5.638 -12.010 8.337 1.00 0.00 O ATOM 1009 CB LEU A 63 -6.250 -9.885 10.893 1.00 0.00 C ATOM 1010 CG LEU A 63 -6.471 -10.645 12.201 1.00 0.00 C ATOM 1011 CD1 LEU A 63 -5.276 -10.479 13.128 1.00 0.00 C ATOM 1012 CD2 LEU A 63 -7.742 -10.170 12.883 1.00 0.00 C ATOM 0 H LEU A 63 -3.851 -9.249 8.777 1.00 0.00 H new ATOM 0 HA LEU A 63 -4.190 -10.409 10.634 1.00 0.00 H new ATOM 0 HB2 LEU A 63 -6.077 -8.835 11.130 1.00 0.00 H new ATOM 0 HB3 LEU A 63 -7.168 -9.933 10.307 1.00 0.00 H new ATOM 0 HG LEU A 63 -6.578 -11.704 11.967 1.00 0.00 H new ATOM 0 HD11 LEU A 63 -5.454 -11.028 14.053 1.00 0.00 H new ATOM 0 HD12 LEU A 63 -4.381 -10.868 12.642 1.00 0.00 H new ATOM 0 HD13 LEU A 63 -5.135 -9.422 13.355 1.00 0.00 H new ATOM 0 HD21 LEU A 63 -7.884 -10.721 13.812 1.00 0.00 H new ATOM 0 HD22 LEU A 63 -7.662 -9.105 13.101 1.00 0.00 H new ATOM 0 HD23 LEU A 63 -8.594 -10.342 12.225 1.00 0.00 H new ATOM 1024 N TYR A 64 -5.218 -12.773 10.425 1.00 0.00 N ATOM 1025 CA TYR A 64 -5.426 -14.187 10.113 1.00 0.00 C ATOM 1026 C TYR A 64 -4.304 -14.705 9.215 1.00 0.00 C ATOM 1027 O TYR A 64 -3.312 -14.016 8.978 1.00 0.00 O ATOM 1028 CB TYR A 64 -6.791 -14.398 9.435 1.00 0.00 C ATOM 1029 CG TYR A 64 -7.577 -15.590 9.945 1.00 0.00 C ATOM 1030 CD1 TYR A 64 -6.947 -16.657 10.580 1.00 0.00 C ATOM 1031 CD2 TYR A 64 -8.958 -15.643 9.794 1.00 0.00 C ATOM 1032 CE1 TYR A 64 -7.672 -17.738 11.046 1.00 0.00 C ATOM 1033 CE2 TYR A 64 -9.688 -16.721 10.258 1.00 0.00 C ATOM 1034 CZ TYR A 64 -9.041 -17.764 10.882 1.00 0.00 C ATOM 1035 OH TYR A 64 -9.768 -18.839 11.343 1.00 0.00 O ATOM 0 H TYR A 64 -4.964 -12.599 11.397 1.00 0.00 H new ATOM 0 HA TYR A 64 -5.414 -14.749 11.047 1.00 0.00 H new ATOM 0 HB2 TYR A 64 -7.392 -13.499 9.572 1.00 0.00 H new ATOM 0 HB3 TYR A 64 -6.634 -14.516 8.363 1.00 0.00 H new ATOM 0 HD1 TYR A 64 -5.875 -16.640 10.711 1.00 0.00 H new ATOM 0 HD2 TYR A 64 -9.470 -14.827 9.305 1.00 0.00 H new ATOM 0 HE1 TYR A 64 -7.169 -18.558 11.536 1.00 0.00 H new ATOM 0 HE2 TYR A 64 -10.760 -16.745 10.132 1.00 0.00 H new ATOM 0 HH TYR A 64 -10.718 -18.699 11.149 1.00 0.00 H new ATOM 1045 N LYS A 65 -4.441 -15.939 8.763 1.00 0.00 N ATOM 1046 CA LYS A 65 -3.544 -16.485 7.767 1.00 0.00 C ATOM 1047 C LYS A 65 -4.317 -16.704 6.479 1.00 0.00 C ATOM 1048 O LYS A 65 -4.487 -15.778 5.703 1.00 0.00 O ATOM 1049 CB LYS A 65 -2.896 -17.791 8.239 1.00 0.00 C ATOM 1050 CG LYS A 65 -1.651 -17.601 9.091 1.00 0.00 C ATOM 1051 CD LYS A 65 -1.964 -17.076 10.482 1.00 0.00 C ATOM 1052 CE LYS A 65 -0.687 -16.884 11.286 1.00 0.00 C ATOM 1053 NZ LYS A 65 -0.951 -16.476 12.690 1.00 0.00 N ATOM 0 H LYS A 65 -5.169 -16.582 9.073 1.00 0.00 H new ATOM 0 HA LYS A 65 -2.734 -15.775 7.598 1.00 0.00 H new ATOM 0 HB2 LYS A 65 -3.629 -18.361 8.810 1.00 0.00 H new ATOM 0 HB3 LYS A 65 -2.636 -18.390 7.366 1.00 0.00 H new ATOM 0 HG2 LYS A 65 -1.126 -18.552 9.176 1.00 0.00 H new ATOM 0 HG3 LYS A 65 -0.975 -16.908 8.590 1.00 0.00 H new ATOM 0 HD2 LYS A 65 -2.498 -16.129 10.407 1.00 0.00 H new ATOM 0 HD3 LYS A 65 -2.623 -17.773 10.999 1.00 0.00 H new ATOM 0 HE2 LYS A 65 -0.117 -17.813 11.283 1.00 0.00 H new ATOM 0 HE3 LYS A 65 -0.068 -16.128 10.802 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 -0.048 -16.359 13.193 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 -1.471 -15.575 12.698 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 -1.519 -17.208 13.163 1.00 0.00 H new ATOM 1185 N PHE A 73 6.282 -20.772 1.562 1.00 0.00 N ATOM 1186 CA PHE A 73 7.422 -19.895 1.801 1.00 0.00 C ATOM 1187 C PHE A 73 6.946 -18.500 2.168 1.00 0.00 C ATOM 1188 O PHE A 73 5.814 -18.122 1.860 1.00 0.00 O ATOM 1189 CB PHE A 73 8.315 -19.817 0.558 1.00 0.00 C ATOM 1190 CG PHE A 73 8.848 -21.148 0.101 1.00 0.00 C ATOM 1191 CD1 PHE A 73 9.916 -21.744 0.753 1.00 0.00 C ATOM 1192 CD2 PHE A 73 8.275 -21.804 -0.978 1.00 0.00 C ATOM 1193 CE1 PHE A 73 10.404 -22.968 0.335 1.00 0.00 C ATOM 1194 CE2 PHE A 73 8.760 -23.028 -1.400 1.00 0.00 C ATOM 1195 CZ PHE A 73 9.825 -23.611 -0.741 1.00 0.00 C ATOM 0 HA PHE A 73 8.000 -20.309 2.627 1.00 0.00 H new ATOM 0 HB2 PHE A 73 7.748 -19.366 -0.256 1.00 0.00 H new ATOM 0 HB3 PHE A 73 9.154 -19.154 0.768 1.00 0.00 H new ATOM 0 HD1 PHE A 73 10.372 -21.247 1.597 1.00 0.00 H new ATOM 0 HD2 PHE A 73 7.440 -21.354 -1.495 1.00 0.00 H new ATOM 0 HE1 PHE A 73 11.238 -23.421 0.850 1.00 0.00 H new ATOM 0 HE2 PHE A 73 8.307 -23.528 -2.244 1.00 0.00 H new ATOM 0 HZ PHE A 73 10.204 -24.568 -1.067 1.00 0.00 H new ATOM 1205 N GLN A 74 7.819 -17.734 2.805 1.00 0.00 N ATOM 1206 CA GLN A 74 7.484 -16.379 3.220 1.00 0.00 C ATOM 1207 C GLN A 74 7.599 -15.424 2.035 1.00 0.00 C ATOM 1208 O GLN A 74 6.916 -14.400 1.979 1.00 0.00 O ATOM 1209 CB GLN A 74 8.394 -15.921 4.364 1.00 0.00 C ATOM 1210 CG GLN A 74 8.470 -16.910 5.517 1.00 0.00 C ATOM 1211 CD GLN A 74 7.119 -17.220 6.140 1.00 0.00 C ATOM 1212 OE1 GLN A 74 6.884 -18.336 6.608 1.00 0.00 O ATOM 1213 NE2 GLN A 74 6.228 -16.239 6.180 1.00 0.00 N ATOM 0 H GLN A 74 8.766 -18.027 3.046 1.00 0.00 H new ATOM 0 HA GLN A 74 6.455 -16.372 3.580 1.00 0.00 H new ATOM 0 HB2 GLN A 74 9.398 -15.754 3.973 1.00 0.00 H new ATOM 0 HB3 GLN A 74 8.035 -14.963 4.741 1.00 0.00 H new ATOM 0 HG2 GLN A 74 8.918 -17.837 5.161 1.00 0.00 H new ATOM 0 HG3 GLN A 74 9.132 -16.510 6.285 1.00 0.00 H new ATOM 0 HE21 GLN A 74 6.455 -15.327 5.783 1.00 0.00 H new ATOM 0 HE22 GLN A 74 5.315 -16.396 6.608 1.00 0.00 H new ATOM 1222 N THR A 75 8.454 -15.785 1.082 1.00 0.00 N ATOM 1223 CA THR A 75 8.636 -15.012 -0.141 1.00 0.00 C ATOM 1224 C THR A 75 7.315 -14.880 -0.904 1.00 0.00 C ATOM 1225 O THR A 75 7.077 -13.889 -1.598 1.00 0.00 O ATOM 1226 CB THR A 75 9.685 -15.685 -1.044 1.00 0.00 C ATOM 1227 OG1 THR A 75 10.797 -16.116 -0.244 1.00 0.00 O ATOM 1228 CG2 THR A 75 10.170 -14.728 -2.122 1.00 0.00 C ATOM 0 H THR A 75 9.038 -16.619 1.136 1.00 0.00 H new ATOM 0 HA THR A 75 8.982 -14.016 0.137 1.00 0.00 H new ATOM 0 HB THR A 75 9.224 -16.544 -1.531 1.00 0.00 H new ATOM 0 HG1 THR A 75 11.465 -16.546 -0.817 1.00 0.00 H new ATOM 0 HG21 THR A 75 10.910 -15.228 -2.746 1.00 0.00 H new ATOM 0 HG22 THR A 75 9.327 -14.417 -2.738 1.00 0.00 H new ATOM 0 HG23 THR A 75 10.621 -13.852 -1.655 1.00 0.00 H new ATOM 1236 N ARG A 76 6.452 -15.881 -0.742 1.00 0.00 N ATOM 1237 CA ARG A 76 5.138 -15.898 -1.377 1.00 0.00 C ATOM 1238 C ARG A 76 4.324 -14.662 -1.001 1.00 0.00 C ATOM 1239 O ARG A 76 3.574 -14.124 -1.818 1.00 0.00 O ATOM 1240 CB ARG A 76 4.389 -17.163 -0.962 1.00 0.00 C ATOM 1241 CG ARG A 76 4.933 -18.431 -1.602 1.00 0.00 C ATOM 1242 CD ARG A 76 4.340 -18.644 -2.984 1.00 0.00 C ATOM 1243 NE ARG A 76 2.894 -18.849 -2.908 1.00 0.00 N ATOM 1244 CZ ARG A 76 2.082 -18.924 -3.961 1.00 0.00 C ATOM 1245 NH1 ARG A 76 2.560 -18.795 -5.194 1.00 0.00 N ATOM 1246 NH2 ARG A 76 0.781 -19.112 -3.766 1.00 0.00 N ATOM 0 H ARG A 76 6.645 -16.702 -0.167 1.00 0.00 H new ATOM 0 HA ARG A 76 5.278 -15.890 -2.458 1.00 0.00 H new ATOM 0 HB2 ARG A 76 4.437 -17.264 0.122 1.00 0.00 H new ATOM 0 HB3 ARG A 76 3.337 -17.055 -1.226 1.00 0.00 H new ATOM 0 HG2 ARG A 76 6.019 -18.368 -1.675 1.00 0.00 H new ATOM 0 HG3 ARG A 76 4.705 -19.288 -0.969 1.00 0.00 H new ATOM 0 HD2 ARG A 76 4.556 -17.781 -3.613 1.00 0.00 H new ATOM 0 HD3 ARG A 76 4.809 -19.507 -3.456 1.00 0.00 H new ATOM 0 HE ARG A 76 2.477 -18.941 -1.982 1.00 0.00 H new ATOM 0 HH11 ARG A 76 3.557 -18.637 -5.341 1.00 0.00 H new ATOM 0 HH12 ARG A 76 1.930 -18.854 -5.994 1.00 0.00 H new ATOM 0 HH21 ARG A 76 0.414 -19.197 -2.818 1.00 0.00 H new ATOM 0 HH22 ARG A 76 0.149 -19.171 -4.564 1.00 0.00 H new ATOM 1260 N VAL A 77 4.491 -14.206 0.233 1.00 0.00 N ATOM 1261 CA VAL A 77 3.767 -13.040 0.720 1.00 0.00 C ATOM 1262 C VAL A 77 4.339 -11.768 0.106 1.00 0.00 C ATOM 1263 O VAL A 77 3.603 -10.835 -0.207 1.00 0.00 O ATOM 1264 CB VAL A 77 3.837 -12.939 2.259 1.00 0.00 C ATOM 1265 CG1 VAL A 77 2.955 -11.809 2.772 1.00 0.00 C ATOM 1266 CG2 VAL A 77 3.444 -14.258 2.902 1.00 0.00 C ATOM 0 H VAL A 77 5.122 -14.626 0.915 1.00 0.00 H new ATOM 0 HA VAL A 77 2.724 -13.153 0.425 1.00 0.00 H new ATOM 0 HB VAL A 77 4.868 -12.716 2.535 1.00 0.00 H new ATOM 0 HG11 VAL A 77 3.022 -11.760 3.859 1.00 0.00 H new ATOM 0 HG12 VAL A 77 3.289 -10.864 2.344 1.00 0.00 H new ATOM 0 HG13 VAL A 77 1.921 -11.994 2.481 1.00 0.00 H new ATOM 0 HG21 VAL A 77 3.500 -14.165 3.987 1.00 0.00 H new ATOM 0 HG22 VAL A 77 2.425 -14.515 2.612 1.00 0.00 H new ATOM 0 HG23 VAL A 77 4.124 -15.042 2.569 1.00 0.00 H new ATOM 1276 N ILE A 78 5.654 -11.744 -0.078 1.00 0.00 N ATOM 1277 CA ILE A 78 6.320 -10.592 -0.673 1.00 0.00 C ATOM 1278 C ILE A 78 5.877 -10.413 -2.121 1.00 0.00 C ATOM 1279 O ILE A 78 5.620 -9.294 -2.567 1.00 0.00 O ATOM 1280 CB ILE A 78 7.858 -10.730 -0.604 1.00 0.00 C ATOM 1281 CG1 ILE A 78 8.307 -10.860 0.855 1.00 0.00 C ATOM 1282 CG2 ILE A 78 8.534 -9.536 -1.268 1.00 0.00 C ATOM 1283 CD1 ILE A 78 9.803 -11.009 1.023 1.00 0.00 C ATOM 0 H ILE A 78 6.279 -12.509 0.176 1.00 0.00 H new ATOM 0 HA ILE A 78 6.034 -9.711 -0.099 1.00 0.00 H new ATOM 0 HB ILE A 78 8.153 -11.630 -1.143 1.00 0.00 H new ATOM 0 HG12 ILE A 78 7.975 -9.981 1.407 1.00 0.00 H new ATOM 0 HG13 ILE A 78 7.813 -11.723 1.302 1.00 0.00 H new ATOM 0 HG21 ILE A 78 9.616 -9.652 -1.209 1.00 0.00 H new ATOM 0 HG22 ILE A 78 8.231 -9.482 -2.314 1.00 0.00 H new ATOM 0 HG23 ILE A 78 8.239 -8.620 -0.757 1.00 0.00 H new ATOM 0 HD11 ILE A 78 10.043 -11.095 2.083 1.00 0.00 H new ATOM 0 HD12 ILE A 78 10.140 -11.904 0.500 1.00 0.00 H new ATOM 0 HD13 ILE A 78 10.305 -10.135 0.607 1.00 0.00 H new ATOM 1295 N GLU A 79 5.777 -11.524 -2.846 1.00 0.00 N ATOM 1296 CA GLU A 79 5.261 -11.501 -4.207 1.00 0.00 C ATOM 1297 C GLU A 79 3.841 -10.953 -4.205 1.00 0.00 C ATOM 1298 O GLU A 79 3.527 -10.017 -4.929 1.00 0.00 O ATOM 1299 CB GLU A 79 5.253 -12.906 -4.808 1.00 0.00 C ATOM 1300 CG GLU A 79 6.601 -13.599 -4.800 1.00 0.00 C ATOM 1301 CD GLU A 79 6.505 -15.018 -5.313 1.00 0.00 C ATOM 1302 OE1 GLU A 79 5.852 -15.849 -4.644 1.00 0.00 O ATOM 1303 OE2 GLU A 79 7.064 -15.306 -6.390 1.00 0.00 O ATOM 0 H GLU A 79 6.047 -12.449 -2.512 1.00 0.00 H new ATOM 0 HA GLU A 79 5.908 -10.863 -4.809 1.00 0.00 H new ATOM 0 HB2 GLU A 79 4.540 -13.519 -4.257 1.00 0.00 H new ATOM 0 HB3 GLU A 79 4.895 -12.846 -5.836 1.00 0.00 H new ATOM 0 HG2 GLU A 79 7.303 -13.036 -5.416 1.00 0.00 H new ATOM 0 HG3 GLU A 79 7.001 -13.605 -3.786 1.00 0.00 H new ATOM 1310 N LEU A 80 3.008 -11.546 -3.355 1.00 0.00 N ATOM 1311 CA LEU A 80 1.608 -11.158 -3.213 1.00 0.00 C ATOM 1312 C LEU A 80 1.494 -9.652 -2.970 1.00 0.00 C ATOM 1313 O LEU A 80 0.807 -8.927 -3.708 1.00 0.00 O ATOM 1314 CB LEU A 80 1.005 -11.928 -2.029 1.00 0.00 C ATOM 1315 CG LEU A 80 -0.483 -12.275 -2.124 1.00 0.00 C ATOM 1316 CD1 LEU A 80 -0.901 -13.129 -0.939 1.00 0.00 C ATOM 1317 CD2 LEU A 80 -1.345 -11.022 -2.195 1.00 0.00 C ATOM 0 H LEU A 80 3.286 -12.313 -2.742 1.00 0.00 H new ATOM 0 HA LEU A 80 1.067 -11.397 -4.129 1.00 0.00 H new ATOM 0 HB2 LEU A 80 1.564 -12.856 -1.906 1.00 0.00 H new ATOM 0 HB3 LEU A 80 1.161 -11.339 -1.125 1.00 0.00 H new ATOM 0 HG LEU A 80 -0.634 -12.839 -3.044 1.00 0.00 H new ATOM 0 HD11 LEU A 80 -1.961 -13.368 -1.019 1.00 0.00 H new ATOM 0 HD12 LEU A 80 -0.320 -14.051 -0.932 1.00 0.00 H new ATOM 0 HD13 LEU A 80 -0.722 -12.581 -0.014 1.00 0.00 H new ATOM 0 HD21 LEU A 80 -2.395 -11.306 -2.262 1.00 0.00 H new ATOM 0 HD22 LEU A 80 -1.188 -10.421 -1.299 1.00 0.00 H new ATOM 0 HD23 LEU A 80 -1.070 -10.441 -3.075 1.00 0.00 H new ATOM 1329 N ASN A 81 2.191 -9.206 -1.935 1.00 0.00 N ATOM 1330 CA ASN A 81 2.186 -7.812 -1.511 1.00 0.00 C ATOM 1331 C ASN A 81 2.557 -6.881 -2.665 1.00 0.00 C ATOM 1332 O ASN A 81 1.754 -6.051 -3.092 1.00 0.00 O ATOM 1333 CB ASN A 81 3.172 -7.642 -0.344 1.00 0.00 C ATOM 1334 CG ASN A 81 3.186 -6.246 0.256 1.00 0.00 C ATOM 1335 OD1 ASN A 81 2.952 -5.253 -0.423 1.00 0.00 O ATOM 1336 ND2 ASN A 81 3.473 -6.166 1.543 1.00 0.00 N ATOM 0 H ASN A 81 2.782 -9.807 -1.360 1.00 0.00 H new ATOM 0 HA ASN A 81 1.181 -7.544 -1.186 1.00 0.00 H new ATOM 0 HB2 ASN A 81 2.921 -8.359 0.437 1.00 0.00 H new ATOM 0 HB3 ASN A 81 4.176 -7.887 -0.691 1.00 0.00 H new ATOM 0 HD21 ASN A 81 3.505 -5.256 2.003 1.00 0.00 H new ATOM 0 HD22 ASN A 81 3.662 -7.014 2.077 1.00 0.00 H new ATOM 1343 N TYR A 82 3.757 -7.054 -3.191 1.00 0.00 N ATOM 1344 CA TYR A 82 4.305 -6.122 -4.165 1.00 0.00 C ATOM 1345 C TYR A 82 3.612 -6.236 -5.516 1.00 0.00 C ATOM 1346 O TYR A 82 3.517 -5.253 -6.252 1.00 0.00 O ATOM 1347 CB TYR A 82 5.815 -6.330 -4.291 1.00 0.00 C ATOM 1348 CG TYR A 82 6.571 -5.812 -3.084 1.00 0.00 C ATOM 1349 CD1 TYR A 82 6.294 -6.291 -1.809 1.00 0.00 C ATOM 1350 CD2 TYR A 82 7.530 -4.818 -3.214 1.00 0.00 C ATOM 1351 CE1 TYR A 82 6.953 -5.800 -0.703 1.00 0.00 C ATOM 1352 CE2 TYR A 82 8.191 -4.318 -2.108 1.00 0.00 C ATOM 1353 CZ TYR A 82 7.898 -4.815 -0.856 1.00 0.00 C ATOM 1354 OH TYR A 82 8.541 -4.312 0.246 1.00 0.00 O ATOM 0 H TYR A 82 4.373 -7.833 -2.960 1.00 0.00 H new ATOM 0 HA TYR A 82 4.120 -5.109 -3.808 1.00 0.00 H new ATOM 0 HB2 TYR A 82 6.024 -7.392 -4.419 1.00 0.00 H new ATOM 0 HB3 TYR A 82 6.175 -5.824 -5.187 1.00 0.00 H new ATOM 0 HD1 TYR A 82 5.549 -7.062 -1.683 1.00 0.00 H new ATOM 0 HD2 TYR A 82 7.764 -4.429 -4.194 1.00 0.00 H new ATOM 0 HE1 TYR A 82 6.728 -6.188 0.279 1.00 0.00 H new ATOM 0 HE2 TYR A 82 8.933 -3.542 -2.224 1.00 0.00 H new ATOM 0 HH TYR A 82 8.280 -4.825 1.039 1.00 0.00 H new ATOM 1364 N LYS A 83 3.095 -7.415 -5.832 1.00 0.00 N ATOM 1365 CA LYS A 83 2.353 -7.597 -7.071 1.00 0.00 C ATOM 1366 C LYS A 83 1.049 -6.812 -7.022 1.00 0.00 C ATOM 1367 O LYS A 83 0.502 -6.432 -8.053 1.00 0.00 O ATOM 1368 CB LYS A 83 2.064 -9.079 -7.324 1.00 0.00 C ATOM 1369 CG LYS A 83 1.403 -9.356 -8.666 1.00 0.00 C ATOM 1370 CD LYS A 83 1.211 -10.845 -8.896 1.00 0.00 C ATOM 1371 CE LYS A 83 0.617 -11.126 -10.265 1.00 0.00 C ATOM 1372 NZ LYS A 83 1.462 -10.571 -11.356 1.00 0.00 N ATOM 0 H LYS A 83 3.174 -8.252 -5.254 1.00 0.00 H new ATOM 0 HA LYS A 83 2.965 -7.223 -7.892 1.00 0.00 H new ATOM 0 HB2 LYS A 83 2.999 -9.636 -7.268 1.00 0.00 H new ATOM 0 HB3 LYS A 83 1.421 -9.455 -6.528 1.00 0.00 H new ATOM 0 HG2 LYS A 83 0.437 -8.853 -8.707 1.00 0.00 H new ATOM 0 HG3 LYS A 83 2.014 -8.939 -9.467 1.00 0.00 H new ATOM 0 HD2 LYS A 83 2.170 -11.355 -8.803 1.00 0.00 H new ATOM 0 HD3 LYS A 83 0.557 -11.252 -8.124 1.00 0.00 H new ATOM 0 HE2 LYS A 83 0.508 -12.202 -10.401 1.00 0.00 H new ATOM 0 HE3 LYS A 83 -0.382 -10.695 -10.324 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 1.198 -11.014 -12.259 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 1.317 -9.543 -11.419 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 2.463 -10.767 -11.154 1.00 0.00 H new ATOM 1386 N HIS A 84 0.540 -6.583 -5.819 1.00 0.00 N ATOM 1387 CA HIS A 84 -0.688 -5.815 -5.666 1.00 0.00 C ATOM 1388 C HIS A 84 -0.429 -4.335 -5.373 1.00 0.00 C ATOM 1389 O HIS A 84 -1.153 -3.475 -5.869 1.00 0.00 O ATOM 1390 CB HIS A 84 -1.579 -6.442 -4.594 1.00 0.00 C ATOM 1391 CG HIS A 84 -2.232 -7.703 -5.061 1.00 0.00 C ATOM 1392 ND1 HIS A 84 -1.657 -8.943 -4.922 1.00 0.00 N ATOM 1393 CD2 HIS A 84 -3.408 -7.905 -5.698 1.00 0.00 C ATOM 1394 CE1 HIS A 84 -2.448 -9.854 -5.456 1.00 0.00 C ATOM 1395 NE2 HIS A 84 -3.518 -9.253 -5.936 1.00 0.00 N ATOM 0 H HIS A 84 0.951 -6.913 -4.946 1.00 0.00 H new ATOM 0 HA HIS A 84 -1.209 -5.851 -6.623 1.00 0.00 H new ATOM 0 HB2 HIS A 84 -0.982 -6.652 -3.707 1.00 0.00 H new ATOM 0 HB3 HIS A 84 -2.346 -5.726 -4.299 1.00 0.00 H new ATOM 0 HD1 HIS A 84 -0.759 -9.130 -4.476 1.00 0.00 H new ATOM 0 HD2 HIS A 84 -4.127 -7.146 -5.969 1.00 0.00 H new ATOM 0 HE1 HIS A 84 -2.251 -10.915 -5.493 1.00 0.00 H new ATOM 1404 N LEU A 85 0.596 -4.028 -4.582 1.00 0.00 N ATOM 1405 CA LEU A 85 0.873 -2.636 -4.214 1.00 0.00 C ATOM 1406 C LEU A 85 1.658 -1.895 -5.301 1.00 0.00 C ATOM 1407 O LEU A 85 1.431 -0.706 -5.530 1.00 0.00 O ATOM 1408 CB LEU A 85 1.619 -2.545 -2.879 1.00 0.00 C ATOM 1409 CG LEU A 85 0.817 -2.965 -1.639 1.00 0.00 C ATOM 1410 CD1 LEU A 85 1.560 -2.571 -0.371 1.00 0.00 C ATOM 1411 CD2 LEU A 85 -0.574 -2.347 -1.654 1.00 0.00 C ATOM 0 H LEU A 85 1.242 -4.711 -4.187 1.00 0.00 H new ATOM 0 HA LEU A 85 -0.097 -2.150 -4.107 1.00 0.00 H new ATOM 0 HB2 LEU A 85 2.512 -3.167 -2.940 1.00 0.00 H new ATOM 0 HB3 LEU A 85 1.955 -1.517 -2.741 1.00 0.00 H new ATOM 0 HG LEU A 85 0.705 -4.049 -1.657 1.00 0.00 H new ATOM 0 HD11 LEU A 85 0.980 -2.875 0.500 1.00 0.00 H new ATOM 0 HD12 LEU A 85 2.531 -3.065 -0.350 1.00 0.00 H new ATOM 0 HD13 LEU A 85 1.702 -1.490 -0.353 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -1.121 -2.660 -0.765 1.00 0.00 H new ATOM 0 HD22 LEU A 85 -0.489 -1.260 -1.664 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -1.109 -2.677 -2.544 1.00 0.00 H new ATOM 1423 N LEU A 86 2.587 -2.582 -5.950 1.00 0.00 N ATOM 1424 CA LEU A 86 3.342 -1.986 -7.050 1.00 0.00 C ATOM 1425 C LEU A 86 2.738 -2.399 -8.385 1.00 0.00 C ATOM 1426 O LEU A 86 2.980 -1.774 -9.416 1.00 0.00 O ATOM 1427 CB LEU A 86 4.812 -2.415 -6.991 1.00 0.00 C ATOM 1428 CG LEU A 86 5.615 -1.849 -5.819 1.00 0.00 C ATOM 1429 CD1 LEU A 86 7.027 -2.411 -5.829 1.00 0.00 C ATOM 1430 CD2 LEU A 86 5.648 -0.328 -5.885 1.00 0.00 C ATOM 0 H LEU A 86 2.837 -3.548 -5.738 1.00 0.00 H new ATOM 0 HA LEU A 86 3.290 -0.902 -6.953 1.00 0.00 H new ATOM 0 HB2 LEU A 86 4.854 -3.503 -6.946 1.00 0.00 H new ATOM 0 HB3 LEU A 86 5.298 -2.116 -7.920 1.00 0.00 H new ATOM 0 HG LEU A 86 5.130 -2.144 -4.889 1.00 0.00 H new ATOM 0 HD11 LEU A 86 7.588 -2.000 -4.990 1.00 0.00 H new ATOM 0 HD12 LEU A 86 6.987 -3.497 -5.742 1.00 0.00 H new ATOM 0 HD13 LEU A 86 7.520 -2.140 -6.763 1.00 0.00 H new ATOM 0 HD21 LEU A 86 6.223 0.060 -5.044 1.00 0.00 H new ATOM 0 HD22 LEU A 86 6.114 -0.014 -6.819 1.00 0.00 H new ATOM 0 HD23 LEU A 86 4.631 0.060 -5.839 1.00 0.00 H new ATOM 1442 N GLY A 87 1.952 -3.463 -8.350 1.00 0.00 N ATOM 1443 CA GLY A 87 1.327 -3.966 -9.549 1.00 0.00 C ATOM 1444 C GLY A 87 2.234 -4.907 -10.311 1.00 0.00 C ATOM 1445 O GLY A 87 1.962 -5.251 -11.463 1.00 0.00 O ATOM 0 H GLY A 87 1.736 -3.990 -7.504 1.00 0.00 H new ATOM 0 HA2 GLY A 87 0.405 -4.485 -9.287 1.00 0.00 H new ATOM 0 HA3 GLY A 87 1.050 -3.130 -10.191 1.00 0.00 H new ATOM 1449 N ARG A 88 3.301 -5.343 -9.654 1.00 0.00 N ATOM 1450 CA ARG A 88 4.271 -6.242 -10.259 1.00 0.00 C ATOM 1451 C ARG A 88 5.204 -6.792 -9.185 1.00 0.00 C ATOM 1452 O ARG A 88 5.660 -6.054 -8.315 1.00 0.00 O ATOM 1453 CB ARG A 88 5.068 -5.504 -11.344 1.00 0.00 C ATOM 1454 CG ARG A 88 6.105 -6.362 -12.049 1.00 0.00 C ATOM 1455 CD ARG A 88 6.744 -5.617 -13.208 1.00 0.00 C ATOM 1456 NE ARG A 88 7.860 -6.358 -13.791 1.00 0.00 N ATOM 1457 CZ ARG A 88 8.352 -6.135 -15.008 1.00 0.00 C ATOM 1458 NH1 ARG A 88 7.758 -5.270 -15.823 1.00 0.00 N ATOM 1459 NH2 ARG A 88 9.416 -6.806 -15.423 1.00 0.00 N ATOM 0 H ARG A 88 3.517 -5.084 -8.691 1.00 0.00 H new ATOM 0 HA ARG A 88 3.747 -7.076 -10.726 1.00 0.00 H new ATOM 0 HB2 ARG A 88 4.373 -5.112 -12.086 1.00 0.00 H new ATOM 0 HB3 ARG A 88 5.568 -4.648 -10.892 1.00 0.00 H new ATOM 0 HG2 ARG A 88 6.875 -6.662 -11.338 1.00 0.00 H new ATOM 0 HG3 ARG A 88 5.636 -7.275 -12.416 1.00 0.00 H new ATOM 0 HD2 ARG A 88 5.993 -5.430 -13.976 1.00 0.00 H new ATOM 0 HD3 ARG A 88 7.096 -4.645 -12.863 1.00 0.00 H new ATOM 0 HE ARG A 88 8.290 -7.093 -13.230 1.00 0.00 H new ATOM 0 HH11 ARG A 88 6.921 -4.773 -15.517 1.00 0.00 H new ATOM 0 HH12 ARG A 88 8.139 -5.103 -16.754 1.00 0.00 H new ATOM 0 HH21 ARG A 88 9.857 -7.492 -14.811 1.00 0.00 H new ATOM 0 HH22 ARG A 88 9.794 -6.637 -16.355 1.00 0.00 H new ATOM 1473 N ALA A 89 5.457 -8.094 -9.237 1.00 0.00 N ATOM 1474 CA ALA A 89 6.321 -8.749 -8.262 1.00 0.00 C ATOM 1475 C ALA A 89 7.773 -8.299 -8.432 1.00 0.00 C ATOM 1476 O ALA A 89 8.142 -7.780 -9.490 1.00 0.00 O ATOM 1477 CB ALA A 89 6.203 -10.264 -8.398 1.00 0.00 C ATOM 0 H ALA A 89 5.075 -8.719 -9.947 1.00 0.00 H new ATOM 0 HA ALA A 89 5.999 -8.461 -7.261 1.00 0.00 H new ATOM 0 HB1 ALA A 89 6.851 -10.747 -7.667 1.00 0.00 H new ATOM 0 HB2 ALA A 89 5.170 -10.566 -8.223 1.00 0.00 H new ATOM 0 HB3 ALA A 89 6.503 -10.564 -9.402 1.00 0.00 H new ATOM 1483 N PRO A 90 8.612 -8.478 -7.386 1.00 0.00 N ATOM 1484 CA PRO A 90 10.039 -8.121 -7.430 1.00 0.00 C ATOM 1485 C PRO A 90 10.728 -8.612 -8.703 1.00 0.00 C ATOM 1486 O PRO A 90 10.499 -9.740 -9.154 1.00 0.00 O ATOM 1487 CB PRO A 90 10.608 -8.819 -6.198 1.00 0.00 C ATOM 1488 CG PRO A 90 9.473 -8.853 -5.238 1.00 0.00 C ATOM 1489 CD PRO A 90 8.231 -9.032 -6.069 1.00 0.00 C ATOM 0 HA PRO A 90 10.193 -7.042 -7.435 1.00 0.00 H new ATOM 0 HB2 PRO A 90 10.958 -9.824 -6.436 1.00 0.00 H new ATOM 0 HB3 PRO A 90 11.459 -8.274 -5.789 1.00 0.00 H new ATOM 0 HG2 PRO A 90 9.588 -9.671 -4.527 1.00 0.00 H new ATOM 0 HG3 PRO A 90 9.425 -7.931 -4.658 1.00 0.00 H new ATOM 0 HD2 PRO A 90 7.946 -10.081 -6.143 1.00 0.00 H new ATOM 0 HD3 PRO A 90 7.382 -8.500 -5.641 1.00 0.00 H new ATOM 1497 N TYR A 91 11.574 -7.759 -9.265 1.00 0.00 N ATOM 1498 CA TYR A 91 12.172 -8.008 -10.572 1.00 0.00 C ATOM 1499 C TYR A 91 13.164 -9.167 -10.531 1.00 0.00 C ATOM 1500 O TYR A 91 13.002 -10.158 -11.244 1.00 0.00 O ATOM 1501 CB TYR A 91 12.873 -6.746 -11.089 1.00 0.00 C ATOM 1502 CG TYR A 91 11.982 -5.521 -11.145 1.00 0.00 C ATOM 1503 CD1 TYR A 91 11.061 -5.351 -12.172 1.00 0.00 C ATOM 1504 CD2 TYR A 91 12.062 -4.537 -10.166 1.00 0.00 C ATOM 1505 CE1 TYR A 91 10.248 -4.232 -12.223 1.00 0.00 C ATOM 1506 CE2 TYR A 91 11.253 -3.416 -10.212 1.00 0.00 C ATOM 1507 CZ TYR A 91 10.347 -3.270 -11.240 1.00 0.00 C ATOM 1508 OH TYR A 91 9.544 -2.152 -11.286 1.00 0.00 O ATOM 0 H TYR A 91 11.864 -6.882 -8.833 1.00 0.00 H new ATOM 0 HA TYR A 91 11.364 -8.280 -11.251 1.00 0.00 H new ATOM 0 HB2 TYR A 91 13.728 -6.531 -10.449 1.00 0.00 H new ATOM 0 HB3 TYR A 91 13.264 -6.944 -12.087 1.00 0.00 H new ATOM 0 HD1 TYR A 91 10.978 -6.104 -12.942 1.00 0.00 H new ATOM 0 HD2 TYR A 91 12.768 -4.650 -9.356 1.00 0.00 H new ATOM 0 HE1 TYR A 91 9.539 -4.113 -13.029 1.00 0.00 H new ATOM 0 HE2 TYR A 91 11.331 -2.659 -9.446 1.00 0.00 H new ATOM 0 HH TYR A 91 9.741 -1.576 -10.518 1.00 0.00 H new ATOM 1518 N ASP A 92 14.188 -9.046 -9.699 1.00 0.00 N ATOM 1519 CA ASP A 92 15.245 -10.049 -9.654 1.00 0.00 C ATOM 1520 C ASP A 92 15.635 -10.370 -8.204 1.00 0.00 C ATOM 1521 O ASP A 92 15.037 -9.843 -7.261 1.00 0.00 O ATOM 1522 CB ASP A 92 16.457 -9.550 -10.459 1.00 0.00 C ATOM 1523 CG ASP A 92 17.527 -10.607 -10.650 1.00 0.00 C ATOM 1524 OD1 ASP A 92 17.247 -11.636 -11.305 1.00 0.00 O ATOM 1525 OD2 ASP A 92 18.647 -10.420 -10.131 1.00 0.00 O ATOM 0 H ASP A 92 14.311 -8.269 -9.049 1.00 0.00 H new ATOM 0 HA ASP A 92 14.880 -10.973 -10.103 1.00 0.00 H new ATOM 0 HB2 ASP A 92 16.118 -9.205 -11.436 1.00 0.00 H new ATOM 0 HB3 ASP A 92 16.893 -8.690 -9.951 1.00 0.00 H new ATOM 1530 N GLU A 93 16.635 -11.240 -8.050 1.00 0.00 N ATOM 1531 CA GLU A 93 17.123 -11.707 -6.752 1.00 0.00 C ATOM 1532 C GLU A 93 17.434 -10.547 -5.804 1.00 0.00 C ATOM 1533 O GLU A 93 17.186 -10.636 -4.602 1.00 0.00 O ATOM 1534 CB GLU A 93 18.388 -12.546 -6.971 1.00 0.00 C ATOM 1535 CG GLU A 93 18.991 -13.122 -5.699 1.00 0.00 C ATOM 1536 CD GLU A 93 18.153 -14.230 -5.100 1.00 0.00 C ATOM 1537 OE1 GLU A 93 17.203 -13.932 -4.349 1.00 0.00 O ATOM 1538 OE2 GLU A 93 18.449 -15.412 -5.375 1.00 0.00 O ATOM 0 H GLU A 93 17.137 -11.647 -8.839 1.00 0.00 H new ATOM 0 HA GLU A 93 16.339 -12.306 -6.289 1.00 0.00 H new ATOM 0 HB2 GLU A 93 18.152 -13.366 -7.650 1.00 0.00 H new ATOM 0 HB3 GLU A 93 19.137 -11.928 -7.466 1.00 0.00 H new ATOM 0 HG2 GLU A 93 19.988 -13.504 -5.916 1.00 0.00 H new ATOM 0 HG3 GLU A 93 19.108 -12.325 -4.965 1.00 0.00 H new ATOM 1545 N SER A 94 17.966 -9.463 -6.354 1.00 0.00 N ATOM 1546 CA SER A 94 18.359 -8.303 -5.564 1.00 0.00 C ATOM 1547 C SER A 94 17.205 -7.795 -4.700 1.00 0.00 C ATOM 1548 O SER A 94 17.383 -7.519 -3.511 1.00 0.00 O ATOM 1549 CB SER A 94 18.849 -7.203 -6.501 1.00 0.00 C ATOM 1550 OG SER A 94 18.063 -7.167 -7.683 1.00 0.00 O ATOM 0 H SER A 94 18.137 -9.363 -7.355 1.00 0.00 H new ATOM 0 HA SER A 94 19.163 -8.597 -4.889 1.00 0.00 H new ATOM 0 HB2 SER A 94 18.800 -6.239 -5.996 1.00 0.00 H new ATOM 0 HB3 SER A 94 19.894 -7.375 -6.758 1.00 0.00 H new ATOM 0 HG SER A 94 17.446 -6.407 -7.642 1.00 0.00 H new ATOM 1556 N GLU A 95 16.023 -7.699 -5.295 1.00 0.00 N ATOM 1557 CA GLU A 95 14.848 -7.225 -4.581 1.00 0.00 C ATOM 1558 C GLU A 95 14.418 -8.249 -3.541 1.00 0.00 C ATOM 1559 O GLU A 95 14.038 -7.898 -2.423 1.00 0.00 O ATOM 1560 CB GLU A 95 13.689 -6.955 -5.545 1.00 0.00 C ATOM 1561 CG GLU A 95 13.904 -5.769 -6.473 1.00 0.00 C ATOM 1562 CD GLU A 95 15.040 -5.977 -7.454 1.00 0.00 C ATOM 1563 OE1 GLU A 95 14.879 -6.784 -8.387 1.00 0.00 O ATOM 1564 OE2 GLU A 95 16.096 -5.324 -7.303 1.00 0.00 O ATOM 0 H GLU A 95 15.854 -7.944 -6.271 1.00 0.00 H new ATOM 0 HA GLU A 95 15.111 -6.291 -4.085 1.00 0.00 H new ATOM 0 HB2 GLU A 95 13.520 -7.847 -6.149 1.00 0.00 H new ATOM 0 HB3 GLU A 95 12.782 -6.786 -4.965 1.00 0.00 H new ATOM 0 HG2 GLU A 95 12.985 -5.578 -7.027 1.00 0.00 H new ATOM 0 HG3 GLU A 95 14.107 -4.880 -5.875 1.00 0.00 H new ATOM 1571 N VAL A 96 14.493 -9.519 -3.916 1.00 0.00 N ATOM 1572 CA VAL A 96 14.092 -10.604 -3.036 1.00 0.00 C ATOM 1573 C VAL A 96 14.959 -10.621 -1.780 1.00 0.00 C ATOM 1574 O VAL A 96 14.442 -10.618 -0.665 1.00 0.00 O ATOM 1575 CB VAL A 96 14.175 -11.975 -3.744 1.00 0.00 C ATOM 1576 CG1 VAL A 96 13.644 -13.079 -2.842 1.00 0.00 C ATOM 1577 CG2 VAL A 96 13.410 -11.944 -5.059 1.00 0.00 C ATOM 0 H VAL A 96 14.830 -9.822 -4.830 1.00 0.00 H new ATOM 0 HA VAL A 96 13.053 -10.428 -2.757 1.00 0.00 H new ATOM 0 HB VAL A 96 15.222 -12.185 -3.960 1.00 0.00 H new ATOM 0 HG11 VAL A 96 13.711 -14.036 -3.360 1.00 0.00 H new ATOM 0 HG12 VAL A 96 14.236 -13.118 -1.928 1.00 0.00 H new ATOM 0 HG13 VAL A 96 12.603 -12.875 -2.591 1.00 0.00 H new ATOM 0 HG21 VAL A 96 13.480 -12.918 -5.543 1.00 0.00 H new ATOM 0 HG22 VAL A 96 12.363 -11.709 -4.866 1.00 0.00 H new ATOM 0 HG23 VAL A 96 13.838 -11.183 -5.711 1.00 0.00 H new ATOM 1587 N ILE A 97 16.275 -10.601 -1.972 1.00 0.00 N ATOM 1588 CA ILE A 97 17.216 -10.614 -0.857 1.00 0.00 C ATOM 1589 C ILE A 97 16.983 -9.424 0.069 1.00 0.00 C ATOM 1590 O ILE A 97 16.842 -9.590 1.281 1.00 0.00 O ATOM 1591 CB ILE A 97 18.680 -10.590 -1.345 1.00 0.00 C ATOM 1592 CG1 ILE A 97 18.982 -11.830 -2.187 1.00 0.00 C ATOM 1593 CG2 ILE A 97 19.635 -10.506 -0.162 1.00 0.00 C ATOM 1594 CD1 ILE A 97 20.409 -11.895 -2.684 1.00 0.00 C ATOM 0 H ILE A 97 16.714 -10.576 -2.892 1.00 0.00 H new ATOM 0 HA ILE A 97 17.042 -11.541 -0.311 1.00 0.00 H new ATOM 0 HB ILE A 97 18.822 -9.706 -1.967 1.00 0.00 H new ATOM 0 HG12 ILE A 97 18.772 -12.720 -1.594 1.00 0.00 H new ATOM 0 HG13 ILE A 97 18.307 -11.850 -3.043 1.00 0.00 H new ATOM 0 HG21 ILE A 97 20.663 -10.490 -0.525 1.00 0.00 H new ATOM 0 HG22 ILE A 97 19.435 -9.595 0.403 1.00 0.00 H new ATOM 0 HG23 ILE A 97 19.491 -11.372 0.484 1.00 0.00 H new ATOM 0 HD11 ILE A 97 20.548 -12.801 -3.273 1.00 0.00 H new ATOM 0 HD12 ILE A 97 20.618 -11.023 -3.304 1.00 0.00 H new ATOM 0 HD13 ILE A 97 21.090 -11.907 -1.833 1.00 0.00 H new ATOM 1606 N PHE A 98 16.932 -8.232 -0.513 1.00 0.00 N ATOM 1607 CA PHE A 98 16.756 -7.007 0.258 1.00 0.00 C ATOM 1608 C PHE A 98 15.475 -7.051 1.085 1.00 0.00 C ATOM 1609 O PHE A 98 15.471 -6.685 2.262 1.00 0.00 O ATOM 1610 CB PHE A 98 16.736 -5.793 -0.677 1.00 0.00 C ATOM 1611 CG PHE A 98 16.496 -4.486 0.029 1.00 0.00 C ATOM 1612 CD1 PHE A 98 17.505 -3.882 0.763 1.00 0.00 C ATOM 1613 CD2 PHE A 98 15.259 -3.861 -0.041 1.00 0.00 C ATOM 1614 CE1 PHE A 98 17.284 -2.683 1.415 1.00 0.00 C ATOM 1615 CE2 PHE A 98 15.034 -2.662 0.608 1.00 0.00 C ATOM 1616 CZ PHE A 98 16.050 -2.072 1.335 1.00 0.00 C ATOM 0 H PHE A 98 17.010 -8.087 -1.520 1.00 0.00 H new ATOM 0 HA PHE A 98 17.598 -6.919 0.944 1.00 0.00 H new ATOM 0 HB2 PHE A 98 17.687 -5.739 -1.208 1.00 0.00 H new ATOM 0 HB3 PHE A 98 15.959 -5.937 -1.428 1.00 0.00 H new ATOM 0 HD1 PHE A 98 18.475 -4.353 0.826 1.00 0.00 H new ATOM 0 HD2 PHE A 98 14.462 -4.317 -0.610 1.00 0.00 H new ATOM 0 HE1 PHE A 98 18.077 -2.225 1.987 1.00 0.00 H new ATOM 0 HE2 PHE A 98 14.066 -2.187 0.547 1.00 0.00 H new ATOM 0 HZ PHE A 98 15.878 -1.133 1.840 1.00 0.00 H new ATOM 1626 N HIS A 99 14.395 -7.519 0.479 1.00 0.00 N ATOM 1627 CA HIS A 99 13.103 -7.525 1.149 1.00 0.00 C ATOM 1628 C HIS A 99 12.980 -8.685 2.131 1.00 0.00 C ATOM 1629 O HIS A 99 12.362 -8.533 3.176 1.00 0.00 O ATOM 1630 CB HIS A 99 11.958 -7.523 0.136 1.00 0.00 C ATOM 1631 CG HIS A 99 11.795 -6.194 -0.542 1.00 0.00 C ATOM 1632 ND1 HIS A 99 11.404 -5.060 0.131 1.00 0.00 N ATOM 1633 CD2 HIS A 99 12.013 -5.810 -1.822 1.00 0.00 C ATOM 1634 CE1 HIS A 99 11.392 -4.035 -0.701 1.00 0.00 C ATOM 1635 NE2 HIS A 99 11.759 -4.462 -1.894 1.00 0.00 N ATOM 0 H HIS A 99 14.386 -7.897 -0.468 1.00 0.00 H new ATOM 0 HA HIS A 99 13.032 -6.606 1.731 1.00 0.00 H new ATOM 0 HB2 HIS A 99 12.140 -8.291 -0.616 1.00 0.00 H new ATOM 0 HB3 HIS A 99 11.029 -7.786 0.642 1.00 0.00 H new ATOM 0 HD1 HIS A 99 11.161 -5.017 1.121 1.00 0.00 H new ATOM 0 HD2 HIS A 99 12.328 -6.446 -2.636 1.00 0.00 H new ATOM 0 HE1 HIS A 99 11.127 -3.019 -0.448 1.00 0.00 H new ATOM 1644 N LEU A 100 13.576 -9.832 1.817 1.00 0.00 N ATOM 1645 CA LEU A 100 13.620 -10.940 2.772 1.00 0.00 C ATOM 1646 C LEU A 100 14.393 -10.519 4.013 1.00 0.00 C ATOM 1647 O LEU A 100 13.991 -10.810 5.141 1.00 0.00 O ATOM 1648 CB LEU A 100 14.275 -12.181 2.157 1.00 0.00 C ATOM 1649 CG LEU A 100 13.401 -12.978 1.187 1.00 0.00 C ATOM 1650 CD1 LEU A 100 14.195 -14.125 0.581 1.00 0.00 C ATOM 1651 CD2 LEU A 100 12.164 -13.507 1.899 1.00 0.00 C ATOM 0 H LEU A 100 14.030 -10.019 0.923 1.00 0.00 H new ATOM 0 HA LEU A 100 12.595 -11.193 3.042 1.00 0.00 H new ATOM 0 HB2 LEU A 100 15.179 -11.871 1.632 1.00 0.00 H new ATOM 0 HB3 LEU A 100 14.587 -12.843 2.965 1.00 0.00 H new ATOM 0 HG LEU A 100 13.080 -12.315 0.384 1.00 0.00 H new ATOM 0 HD11 LEU A 100 13.560 -14.683 -0.107 1.00 0.00 H new ATOM 0 HD12 LEU A 100 15.054 -13.727 0.041 1.00 0.00 H new ATOM 0 HD13 LEU A 100 14.540 -14.788 1.375 1.00 0.00 H new ATOM 0 HD21 LEU A 100 11.553 -14.072 1.195 1.00 0.00 H new ATOM 0 HD22 LEU A 100 12.467 -14.157 2.720 1.00 0.00 H new ATOM 0 HD23 LEU A 100 11.586 -12.671 2.293 1.00 0.00 H new ATOM 1663 N ASP A 101 15.498 -9.819 3.782 1.00 0.00 N ATOM 1664 CA ASP A 101 16.328 -9.288 4.855 1.00 0.00 C ATOM 1665 C ASP A 101 15.502 -8.415 5.794 1.00 0.00 C ATOM 1666 O ASP A 101 15.449 -8.652 6.998 1.00 0.00 O ATOM 1667 CB ASP A 101 17.479 -8.473 4.254 1.00 0.00 C ATOM 1668 CG ASP A 101 18.407 -7.891 5.298 1.00 0.00 C ATOM 1669 OD1 ASP A 101 18.141 -6.774 5.784 1.00 0.00 O ATOM 1670 OD2 ASP A 101 19.422 -8.537 5.622 1.00 0.00 O ATOM 0 H ASP A 101 15.843 -9.604 2.846 1.00 0.00 H new ATOM 0 HA ASP A 101 16.733 -10.119 5.432 1.00 0.00 H new ATOM 0 HB2 ASP A 101 18.054 -9.110 3.581 1.00 0.00 H new ATOM 0 HB3 ASP A 101 17.067 -7.663 3.652 1.00 0.00 H new ATOM 1675 N LEU A 102 14.839 -7.417 5.228 1.00 0.00 N ATOM 1676 CA LEU A 102 14.035 -6.486 6.007 1.00 0.00 C ATOM 1677 C LEU A 102 12.834 -7.196 6.638 1.00 0.00 C ATOM 1678 O LEU A 102 12.530 -7.000 7.820 1.00 0.00 O ATOM 1679 CB LEU A 102 13.569 -5.333 5.110 1.00 0.00 C ATOM 1680 CG LEU A 102 12.917 -4.154 5.835 1.00 0.00 C ATOM 1681 CD1 LEU A 102 13.878 -3.546 6.844 1.00 0.00 C ATOM 1682 CD2 LEU A 102 12.468 -3.100 4.833 1.00 0.00 C ATOM 0 H LEU A 102 14.842 -7.230 4.225 1.00 0.00 H new ATOM 0 HA LEU A 102 14.647 -6.085 6.815 1.00 0.00 H new ATOM 0 HB2 LEU A 102 14.427 -4.962 4.550 1.00 0.00 H new ATOM 0 HB3 LEU A 102 12.859 -5.726 4.382 1.00 0.00 H new ATOM 0 HG LEU A 102 12.043 -4.523 6.372 1.00 0.00 H new ATOM 0 HD11 LEU A 102 13.395 -2.709 7.348 1.00 0.00 H new ATOM 0 HD12 LEU A 102 14.158 -4.300 7.579 1.00 0.00 H new ATOM 0 HD13 LEU A 102 14.771 -3.192 6.329 1.00 0.00 H new ATOM 0 HD21 LEU A 102 12.006 -2.267 5.363 1.00 0.00 H new ATOM 0 HD22 LEU A 102 13.331 -2.740 4.273 1.00 0.00 H new ATOM 0 HD23 LEU A 102 11.745 -3.537 4.144 1.00 0.00 H new ATOM 1694 N TYR A 103 12.180 -8.044 5.851 1.00 0.00 N ATOM 1695 CA TYR A 103 10.989 -8.773 6.287 1.00 0.00 C ATOM 1696 C TYR A 103 11.261 -9.653 7.511 1.00 0.00 C ATOM 1697 O TYR A 103 10.486 -9.649 8.466 1.00 0.00 O ATOM 1698 CB TYR A 103 10.454 -9.628 5.130 1.00 0.00 C ATOM 1699 CG TYR A 103 9.387 -10.628 5.524 1.00 0.00 C ATOM 1700 CD1 TYR A 103 8.063 -10.243 5.691 1.00 0.00 C ATOM 1701 CD2 TYR A 103 9.709 -11.964 5.720 1.00 0.00 C ATOM 1702 CE1 TYR A 103 7.094 -11.164 6.049 1.00 0.00 C ATOM 1703 CE2 TYR A 103 8.749 -12.885 6.076 1.00 0.00 C ATOM 1704 CZ TYR A 103 7.445 -12.484 6.238 1.00 0.00 C ATOM 1705 OH TYR A 103 6.491 -13.406 6.598 1.00 0.00 O ATOM 0 H TYR A 103 12.459 -8.247 4.891 1.00 0.00 H new ATOM 0 HA TYR A 103 10.241 -8.037 6.581 1.00 0.00 H new ATOM 0 HB2 TYR A 103 10.048 -8.967 4.365 1.00 0.00 H new ATOM 0 HB3 TYR A 103 11.287 -10.165 4.678 1.00 0.00 H new ATOM 0 HD1 TYR A 103 7.786 -9.210 5.539 1.00 0.00 H new ATOM 0 HD2 TYR A 103 10.731 -12.287 5.591 1.00 0.00 H new ATOM 0 HE1 TYR A 103 6.069 -10.851 6.180 1.00 0.00 H new ATOM 0 HE2 TYR A 103 9.020 -13.919 6.227 1.00 0.00 H new ATOM 0 HH TYR A 103 5.622 -13.137 6.233 1.00 0.00 H new ATOM 1715 N GLU A 104 12.350 -10.409 7.487 1.00 0.00 N ATOM 1716 CA GLU A 104 12.629 -11.344 8.572 1.00 0.00 C ATOM 1717 C GLU A 104 13.354 -10.665 9.734 1.00 0.00 C ATOM 1718 O GLU A 104 13.209 -11.072 10.886 1.00 0.00 O ATOM 1719 CB GLU A 104 13.437 -12.540 8.066 1.00 0.00 C ATOM 1720 CG GLU A 104 12.738 -13.317 6.964 1.00 0.00 C ATOM 1721 CD GLU A 104 13.408 -14.639 6.663 1.00 0.00 C ATOM 1722 OE1 GLU A 104 14.492 -14.637 6.045 1.00 0.00 O ATOM 1723 OE2 GLU A 104 12.851 -15.691 7.049 1.00 0.00 O ATOM 0 H GLU A 104 13.046 -10.396 6.741 1.00 0.00 H new ATOM 0 HA GLU A 104 11.669 -11.702 8.944 1.00 0.00 H new ATOM 0 HB2 GLU A 104 14.401 -12.188 7.697 1.00 0.00 H new ATOM 0 HB3 GLU A 104 13.641 -13.211 8.901 1.00 0.00 H new ATOM 0 HG2 GLU A 104 11.703 -13.497 7.253 1.00 0.00 H new ATOM 0 HG3 GLU A 104 12.715 -12.712 6.058 1.00 0.00 H new ATOM 1730 N ASN A 105 14.129 -9.630 9.440 1.00 0.00 N ATOM 1731 CA ASN A 105 14.854 -8.921 10.490 1.00 0.00 C ATOM 1732 C ASN A 105 13.930 -7.993 11.262 1.00 0.00 C ATOM 1733 O ASN A 105 13.782 -8.116 12.477 1.00 0.00 O ATOM 1734 CB ASN A 105 16.013 -8.101 9.916 1.00 0.00 C ATOM 1735 CG ASN A 105 17.249 -8.927 9.616 1.00 0.00 C ATOM 1736 OD1 ASN A 105 18.374 -8.435 9.721 1.00 0.00 O ATOM 1737 ND2 ASN A 105 17.060 -10.178 9.228 1.00 0.00 N ATOM 0 H ASN A 105 14.272 -9.265 8.498 1.00 0.00 H new ATOM 0 HA ASN A 105 15.253 -9.679 11.163 1.00 0.00 H new ATOM 0 HB2 ASN A 105 15.682 -7.611 9.000 1.00 0.00 H new ATOM 0 HB3 ASN A 105 16.275 -7.313 10.622 1.00 0.00 H new ATOM 0 HD21 ASN A 105 17.861 -10.769 9.004 1.00 0.00 H new ATOM 0 HD22 ASN A 105 16.114 -10.551 9.153 1.00 0.00 H new ATOM 1744 N GLU A 106 13.296 -7.076 10.548 1.00 0.00 N ATOM 1745 CA GLU A 106 12.502 -6.036 11.180 1.00 0.00 C ATOM 1746 C GLU A 106 11.038 -6.438 11.274 1.00 0.00 C ATOM 1747 O GLU A 106 10.339 -6.056 12.211 1.00 0.00 O ATOM 1748 CB GLU A 106 12.646 -4.730 10.404 1.00 0.00 C ATOM 1749 CG GLU A 106 14.075 -4.225 10.339 1.00 0.00 C ATOM 1750 CD GLU A 106 14.657 -3.972 11.711 1.00 0.00 C ATOM 1751 OE1 GLU A 106 14.335 -2.926 12.309 1.00 0.00 O ATOM 1752 OE2 GLU A 106 15.423 -4.822 12.208 1.00 0.00 O ATOM 0 H GLU A 106 13.316 -7.032 9.529 1.00 0.00 H new ATOM 0 HA GLU A 106 12.872 -5.893 12.195 1.00 0.00 H new ATOM 0 HB2 GLU A 106 12.273 -4.875 9.390 1.00 0.00 H new ATOM 0 HB3 GLU A 106 12.020 -3.968 10.869 1.00 0.00 H new ATOM 0 HG2 GLU A 106 14.692 -4.954 9.814 1.00 0.00 H new ATOM 0 HG3 GLU A 106 14.106 -3.303 9.758 1.00 0.00 H new ATOM 1759 N GLY A 107 10.579 -7.205 10.303 1.00 0.00 N ATOM 1760 CA GLY A 107 9.205 -7.657 10.311 1.00 0.00 C ATOM 1761 C GLY A 107 8.465 -7.243 9.059 1.00 0.00 C ATOM 1762 O GLY A 107 8.951 -6.402 8.297 1.00 0.00 O ATOM 0 H GLY A 107 11.132 -7.524 9.508 1.00 0.00 H new ATOM 0 HA2 GLY A 107 9.181 -8.743 10.404 1.00 0.00 H new ATOM 0 HA3 GLY A 107 8.695 -7.251 11.185 1.00 0.00 H new ATOM 1766 N PHE A 108 7.289 -7.823 8.846 1.00 0.00 N ATOM 1767 CA PHE A 108 6.497 -7.503 7.669 1.00 0.00 C ATOM 1768 C PHE A 108 6.054 -6.045 7.717 1.00 0.00 C ATOM 1769 O PHE A 108 5.923 -5.397 6.682 1.00 0.00 O ATOM 1770 CB PHE A 108 5.285 -8.443 7.533 1.00 0.00 C ATOM 1771 CG PHE A 108 4.232 -8.279 8.596 1.00 0.00 C ATOM 1772 CD1 PHE A 108 4.333 -8.946 9.806 1.00 0.00 C ATOM 1773 CD2 PHE A 108 3.131 -7.465 8.375 1.00 0.00 C ATOM 1774 CE1 PHE A 108 3.359 -8.801 10.777 1.00 0.00 C ATOM 1775 CE2 PHE A 108 2.157 -7.316 9.340 1.00 0.00 C ATOM 1776 CZ PHE A 108 2.270 -7.985 10.543 1.00 0.00 C ATOM 0 H PHE A 108 6.867 -8.512 9.469 1.00 0.00 H new ATOM 0 HA PHE A 108 7.121 -7.650 6.788 1.00 0.00 H new ATOM 0 HB2 PHE A 108 4.825 -8.280 6.558 1.00 0.00 H new ATOM 0 HB3 PHE A 108 5.640 -9.474 7.550 1.00 0.00 H new ATOM 0 HD1 PHE A 108 5.182 -9.587 9.993 1.00 0.00 H new ATOM 0 HD2 PHE A 108 3.035 -6.941 7.435 1.00 0.00 H new ATOM 0 HE1 PHE A 108 3.450 -9.325 11.717 1.00 0.00 H new ATOM 0 HE2 PHE A 108 1.306 -6.677 9.155 1.00 0.00 H new ATOM 0 HZ PHE A 108 1.508 -7.870 11.299 1.00 0.00 H new ATOM 1786 N ASP A 109 5.855 -5.528 8.929 1.00 0.00 N ATOM 1787 CA ASP A 109 5.481 -4.129 9.114 1.00 0.00 C ATOM 1788 C ASP A 109 6.493 -3.215 8.449 1.00 0.00 C ATOM 1789 O ASP A 109 6.126 -2.317 7.690 1.00 0.00 O ATOM 1790 CB ASP A 109 5.391 -3.767 10.598 1.00 0.00 C ATOM 1791 CG ASP A 109 4.175 -4.342 11.286 1.00 0.00 C ATOM 1792 OD1 ASP A 109 3.105 -3.697 11.245 1.00 0.00 O ATOM 1793 OD2 ASP A 109 4.293 -5.432 11.887 1.00 0.00 O ATOM 0 H ASP A 109 5.947 -6.058 9.796 1.00 0.00 H new ATOM 0 HA ASP A 109 4.501 -3.994 8.655 1.00 0.00 H new ATOM 0 HB2 ASP A 109 6.288 -4.122 11.106 1.00 0.00 H new ATOM 0 HB3 ASP A 109 5.377 -2.682 10.699 1.00 0.00 H new ATOM 1798 N ALA A 110 7.765 -3.460 8.729 1.00 0.00 N ATOM 1799 CA ALA A 110 8.840 -2.612 8.235 1.00 0.00 C ATOM 1800 C ALA A 110 8.960 -2.693 6.722 1.00 0.00 C ATOM 1801 O ALA A 110 9.087 -1.670 6.052 1.00 0.00 O ATOM 1802 CB ALA A 110 10.155 -2.993 8.892 1.00 0.00 C ATOM 0 H ALA A 110 8.079 -4.245 9.300 1.00 0.00 H new ATOM 0 HA ALA A 110 8.600 -1.581 8.495 1.00 0.00 H new ATOM 0 HB1 ALA A 110 10.950 -2.351 8.513 1.00 0.00 H new ATOM 0 HB2 ALA A 110 10.072 -2.869 9.972 1.00 0.00 H new ATOM 0 HB3 ALA A 110 10.388 -4.033 8.663 1.00 0.00 H new ATOM 1808 N ASP A 111 8.902 -3.906 6.182 1.00 0.00 N ATOM 1809 CA ASP A 111 9.041 -4.093 4.741 1.00 0.00 C ATOM 1810 C ASP A 111 7.877 -3.443 4.004 1.00 0.00 C ATOM 1811 O ASP A 111 8.068 -2.764 2.998 1.00 0.00 O ATOM 1812 CB ASP A 111 9.132 -5.576 4.384 1.00 0.00 C ATOM 1813 CG ASP A 111 9.491 -5.782 2.925 1.00 0.00 C ATOM 1814 OD1 ASP A 111 10.654 -5.516 2.553 1.00 0.00 O ATOM 1815 OD2 ASP A 111 8.611 -6.191 2.142 1.00 0.00 O ATOM 0 H ASP A 111 8.761 -4.766 6.713 1.00 0.00 H new ATOM 0 HA ASP A 111 9.968 -3.611 4.428 1.00 0.00 H new ATOM 0 HB2 ASP A 111 9.881 -6.056 5.014 1.00 0.00 H new ATOM 0 HB3 ASP A 111 8.179 -6.060 4.596 1.00 0.00 H new ATOM 1820 N ILE A 112 6.676 -3.629 4.535 1.00 0.00 N ATOM 1821 CA ILE A 112 5.480 -2.998 3.988 1.00 0.00 C ATOM 1822 C ILE A 112 5.590 -1.474 4.051 1.00 0.00 C ATOM 1823 O ILE A 112 5.118 -0.760 3.164 1.00 0.00 O ATOM 1824 CB ILE A 112 4.222 -3.465 4.759 1.00 0.00 C ATOM 1825 CG1 ILE A 112 3.921 -4.933 4.445 1.00 0.00 C ATOM 1826 CG2 ILE A 112 3.015 -2.583 4.449 1.00 0.00 C ATOM 1827 CD1 ILE A 112 2.792 -5.511 5.270 1.00 0.00 C ATOM 0 H ILE A 112 6.503 -4.216 5.351 1.00 0.00 H new ATOM 0 HA ILE A 112 5.390 -3.297 2.944 1.00 0.00 H new ATOM 0 HB ILE A 112 4.427 -3.372 5.825 1.00 0.00 H new ATOM 0 HG12 ILE A 112 3.672 -5.026 3.388 1.00 0.00 H new ATOM 0 HG13 ILE A 112 4.822 -5.524 4.613 1.00 0.00 H new ATOM 0 HG21 ILE A 112 2.150 -2.940 5.008 1.00 0.00 H new ATOM 0 HG22 ILE A 112 3.233 -1.554 4.736 1.00 0.00 H new ATOM 0 HG23 ILE A 112 2.799 -2.624 3.381 1.00 0.00 H new ATOM 0 HD11 ILE A 112 2.636 -6.554 4.993 1.00 0.00 H new ATOM 0 HD12 ILE A 112 3.047 -5.451 6.328 1.00 0.00 H new ATOM 0 HD13 ILE A 112 1.879 -4.945 5.084 1.00 0.00 H new ATOM 1839 N ASP A 113 6.241 -0.985 5.095 1.00 0.00 N ATOM 1840 CA ASP A 113 6.361 0.449 5.325 1.00 0.00 C ATOM 1841 C ASP A 113 7.284 1.085 4.286 1.00 0.00 C ATOM 1842 O ASP A 113 7.155 2.267 3.963 1.00 0.00 O ATOM 1843 CB ASP A 113 6.887 0.701 6.735 1.00 0.00 C ATOM 1844 CG ASP A 113 6.269 1.926 7.370 1.00 0.00 C ATOM 1845 OD1 ASP A 113 5.046 1.904 7.632 1.00 0.00 O ATOM 1846 OD2 ASP A 113 6.997 2.898 7.636 1.00 0.00 O ATOM 0 H ASP A 113 6.697 -1.563 5.801 1.00 0.00 H new ATOM 0 HA ASP A 113 5.377 0.907 5.227 1.00 0.00 H new ATOM 0 HB2 ASP A 113 6.682 -0.170 7.357 1.00 0.00 H new ATOM 0 HB3 ASP A 113 7.970 0.820 6.700 1.00 0.00 H new ATOM 1851 N SER A 114 8.189 0.274 3.742 1.00 0.00 N ATOM 1852 CA SER A 114 9.138 0.725 2.729 1.00 0.00 C ATOM 1853 C SER A 114 8.415 1.217 1.476 1.00 0.00 C ATOM 1854 O SER A 114 8.916 2.082 0.752 1.00 0.00 O ATOM 1855 CB SER A 114 10.081 -0.420 2.366 1.00 0.00 C ATOM 1856 OG SER A 114 10.629 -1.003 3.533 1.00 0.00 O ATOM 0 H SER A 114 8.284 -0.711 3.991 1.00 0.00 H new ATOM 0 HA SER A 114 9.709 1.557 3.140 1.00 0.00 H new ATOM 0 HB2 SER A 114 9.541 -1.175 1.795 1.00 0.00 H new ATOM 0 HB3 SER A 114 10.883 -0.049 1.727 1.00 0.00 H new ATOM 0 HG SER A 114 11.583 -0.786 3.590 1.00 0.00 H new ATOM 1862 N TYR A 115 7.233 0.663 1.232 1.00 0.00 N ATOM 1863 CA TYR A 115 6.415 1.055 0.090 1.00 0.00 C ATOM 1864 C TYR A 115 5.943 2.499 0.237 1.00 0.00 C ATOM 1865 O TYR A 115 5.893 3.252 -0.735 1.00 0.00 O ATOM 1866 CB TYR A 115 5.214 0.110 -0.043 1.00 0.00 C ATOM 1867 CG TYR A 115 4.185 0.550 -1.062 1.00 0.00 C ATOM 1868 CD1 TYR A 115 4.467 0.532 -2.421 1.00 0.00 C ATOM 1869 CD2 TYR A 115 2.928 0.986 -0.658 1.00 0.00 C ATOM 1870 CE1 TYR A 115 3.525 0.938 -3.349 1.00 0.00 C ATOM 1871 CE2 TYR A 115 1.985 1.392 -1.579 1.00 0.00 C ATOM 1872 CZ TYR A 115 2.286 1.366 -2.922 1.00 0.00 C ATOM 1873 OH TYR A 115 1.345 1.773 -3.843 1.00 0.00 O ATOM 0 H TYR A 115 6.817 -0.064 1.814 1.00 0.00 H new ATOM 0 HA TYR A 115 7.021 0.985 -0.814 1.00 0.00 H new ATOM 0 HB2 TYR A 115 5.575 -0.882 -0.314 1.00 0.00 H new ATOM 0 HB3 TYR A 115 4.729 0.018 0.929 1.00 0.00 H new ATOM 0 HD1 TYR A 115 5.436 0.196 -2.759 1.00 0.00 H new ATOM 0 HD2 TYR A 115 2.686 1.007 0.394 1.00 0.00 H new ATOM 0 HE1 TYR A 115 3.759 0.920 -4.403 1.00 0.00 H new ATOM 0 HE2 TYR A 115 1.014 1.729 -1.248 1.00 0.00 H new ATOM 0 HH TYR A 115 1.220 1.071 -4.515 1.00 0.00 H new ATOM 1883 N ILE A 116 5.622 2.882 1.464 1.00 0.00 N ATOM 1884 CA ILE A 116 5.122 4.221 1.739 1.00 0.00 C ATOM 1885 C ILE A 116 6.273 5.224 1.750 1.00 0.00 C ATOM 1886 O ILE A 116 6.083 6.411 1.486 1.00 0.00 O ATOM 1887 CB ILE A 116 4.355 4.262 3.081 1.00 0.00 C ATOM 1888 CG1 ILE A 116 3.234 3.217 3.076 1.00 0.00 C ATOM 1889 CG2 ILE A 116 3.784 5.651 3.349 1.00 0.00 C ATOM 1890 CD1 ILE A 116 2.199 3.431 1.992 1.00 0.00 C ATOM 0 H ILE A 116 5.699 2.283 2.286 1.00 0.00 H new ATOM 0 HA ILE A 116 4.427 4.494 0.945 1.00 0.00 H new ATOM 0 HB ILE A 116 5.057 4.029 3.882 1.00 0.00 H new ATOM 0 HG12 ILE A 116 3.674 2.227 2.954 1.00 0.00 H new ATOM 0 HG13 ILE A 116 2.737 3.227 4.046 1.00 0.00 H new ATOM 0 HG21 ILE A 116 3.250 5.648 4.299 1.00 0.00 H new ATOM 0 HG22 ILE A 116 4.596 6.376 3.391 1.00 0.00 H new ATOM 0 HG23 ILE A 116 3.097 5.923 2.548 1.00 0.00 H new ATOM 0 HD11 ILE A 116 1.440 2.651 2.055 1.00 0.00 H new ATOM 0 HD12 ILE A 116 1.730 4.406 2.124 1.00 0.00 H new ATOM 0 HD13 ILE A 116 2.681 3.390 1.015 1.00 0.00 H new ATOM 1902 N ASP A 117 7.478 4.728 2.016 1.00 0.00 N ATOM 1903 CA ASP A 117 8.676 5.565 1.997 1.00 0.00 C ATOM 1904 C ASP A 117 9.172 5.796 0.572 1.00 0.00 C ATOM 1905 O ASP A 117 10.301 6.242 0.365 1.00 0.00 O ATOM 1906 CB ASP A 117 9.799 4.949 2.839 1.00 0.00 C ATOM 1907 CG ASP A 117 9.672 5.276 4.314 1.00 0.00 C ATOM 1908 OD1 ASP A 117 9.850 6.458 4.684 1.00 0.00 O ATOM 1909 OD2 ASP A 117 9.419 4.359 5.117 1.00 0.00 O ATOM 0 H ASP A 117 7.652 3.750 2.248 1.00 0.00 H new ATOM 0 HA ASP A 117 8.398 6.526 2.430 1.00 0.00 H new ATOM 0 HB2 ASP A 117 9.793 3.867 2.709 1.00 0.00 H new ATOM 0 HB3 ASP A 117 10.761 5.308 2.473 1.00 0.00 H new ATOM 1914 N SER A 118 8.333 5.485 -0.407 1.00 0.00 N ATOM 1915 CA SER A 118 8.637 5.792 -1.798 1.00 0.00 C ATOM 1916 C SER A 118 7.704 6.894 -2.307 1.00 0.00 C ATOM 1917 O SER A 118 6.692 6.617 -2.961 1.00 0.00 O ATOM 1918 CB SER A 118 8.504 4.536 -2.663 1.00 0.00 C ATOM 1919 OG SER A 118 9.383 3.516 -2.221 1.00 0.00 O ATOM 0 H SER A 118 7.436 5.020 -0.263 1.00 0.00 H new ATOM 0 HA SER A 118 9.666 6.146 -1.863 1.00 0.00 H new ATOM 0 HB2 SER A 118 7.476 4.174 -2.629 1.00 0.00 H new ATOM 0 HB3 SER A 118 8.721 4.782 -3.702 1.00 0.00 H new ATOM 0 HG SER A 118 9.125 3.230 -1.320 1.00 0.00 H new ATOM 1925 N PRO A 119 8.018 8.162 -1.991 1.00 0.00 N ATOM 1926 CA PRO A 119 7.160 9.289 -2.337 1.00 0.00 C ATOM 1927 C PRO A 119 7.208 9.624 -3.823 1.00 0.00 C ATOM 1928 O PRO A 119 6.173 9.848 -4.438 1.00 0.00 O ATOM 1929 CB PRO A 119 7.721 10.437 -1.495 1.00 0.00 C ATOM 1930 CG PRO A 119 9.155 10.093 -1.283 1.00 0.00 C ATOM 1931 CD PRO A 119 9.236 8.591 -1.276 1.00 0.00 C ATOM 0 HA PRO A 119 6.109 9.079 -2.137 1.00 0.00 H new ATOM 0 HB2 PRO A 119 7.616 11.392 -2.010 1.00 0.00 H new ATOM 0 HB3 PRO A 119 7.192 10.526 -0.546 1.00 0.00 H new ATOM 0 HG2 PRO A 119 9.776 10.512 -2.075 1.00 0.00 H new ATOM 0 HG3 PRO A 119 9.518 10.506 -0.342 1.00 0.00 H new ATOM 0 HD2 PRO A 119 10.138 8.238 -1.777 1.00 0.00 H new ATOM 0 HD3 PRO A 119 9.261 8.198 -0.260 1.00 0.00 H new ATOM 1939 N GLU A 120 8.408 9.623 -4.397 1.00 0.00 N ATOM 1940 CA GLU A 120 8.603 9.979 -5.802 1.00 0.00 C ATOM 1941 C GLU A 120 7.757 9.080 -6.709 1.00 0.00 C ATOM 1942 O GLU A 120 7.035 9.561 -7.591 1.00 0.00 O ATOM 1943 CB GLU A 120 10.098 9.878 -6.146 1.00 0.00 C ATOM 1944 CG GLU A 120 10.480 10.370 -7.537 1.00 0.00 C ATOM 1945 CD GLU A 120 10.251 9.337 -8.621 1.00 0.00 C ATOM 1946 OE1 GLU A 120 10.658 8.171 -8.434 1.00 0.00 O ATOM 1947 OE2 GLU A 120 9.686 9.691 -9.676 1.00 0.00 O ATOM 0 H GLU A 120 9.268 9.377 -3.907 1.00 0.00 H new ATOM 0 HA GLU A 120 8.275 11.005 -5.968 1.00 0.00 H new ATOM 0 HB2 GLU A 120 10.663 10.448 -5.409 1.00 0.00 H new ATOM 0 HB3 GLU A 120 10.407 8.837 -6.049 1.00 0.00 H new ATOM 0 HG2 GLU A 120 9.903 11.265 -7.770 1.00 0.00 H new ATOM 0 HG3 GLU A 120 11.531 10.660 -7.537 1.00 0.00 H new ATOM 1954 N TYR A 121 7.827 7.777 -6.468 1.00 0.00 N ATOM 1955 CA TYR A 121 7.044 6.823 -7.238 1.00 0.00 C ATOM 1956 C TYR A 121 5.554 7.034 -6.985 1.00 0.00 C ATOM 1957 O TYR A 121 4.749 6.994 -7.914 1.00 0.00 O ATOM 1958 CB TYR A 121 7.446 5.386 -6.891 1.00 0.00 C ATOM 1959 CG TYR A 121 6.953 4.363 -7.892 1.00 0.00 C ATOM 1960 CD1 TYR A 121 7.644 4.146 -9.077 1.00 0.00 C ATOM 1961 CD2 TYR A 121 5.801 3.619 -7.660 1.00 0.00 C ATOM 1962 CE1 TYR A 121 7.206 3.222 -10.003 1.00 0.00 C ATOM 1963 CE2 TYR A 121 5.354 2.689 -8.582 1.00 0.00 C ATOM 1964 CZ TYR A 121 6.063 2.495 -9.753 1.00 0.00 C ATOM 1965 OH TYR A 121 5.627 1.573 -10.678 1.00 0.00 O ATOM 0 H TYR A 121 8.416 7.359 -5.748 1.00 0.00 H new ATOM 0 HA TYR A 121 7.246 6.988 -8.296 1.00 0.00 H new ATOM 0 HB2 TYR A 121 8.533 5.326 -6.828 1.00 0.00 H new ATOM 0 HB3 TYR A 121 7.055 5.136 -5.905 1.00 0.00 H new ATOM 0 HD1 TYR A 121 8.542 4.712 -9.277 1.00 0.00 H new ATOM 0 HD2 TYR A 121 5.246 3.770 -6.746 1.00 0.00 H new ATOM 0 HE1 TYR A 121 7.757 3.069 -10.919 1.00 0.00 H new ATOM 0 HE2 TYR A 121 4.458 2.119 -8.388 1.00 0.00 H new ATOM 0 HH TYR A 121 4.809 1.144 -10.352 1.00 0.00 H new ATOM 1975 N THR A 122 5.196 7.282 -5.728 1.00 0.00 N ATOM 1976 CA THR A 122 3.807 7.539 -5.362 1.00 0.00 C ATOM 1977 C THR A 122 3.263 8.780 -6.072 1.00 0.00 C ATOM 1978 O THR A 122 2.182 8.744 -6.650 1.00 0.00 O ATOM 1979 CB THR A 122 3.654 7.711 -3.837 1.00 0.00 C ATOM 1980 OG1 THR A 122 3.969 6.480 -3.169 1.00 0.00 O ATOM 1981 CG2 THR A 122 2.238 8.144 -3.477 1.00 0.00 C ATOM 0 H THR A 122 5.850 7.310 -4.945 1.00 0.00 H new ATOM 0 HA THR A 122 3.229 6.671 -5.680 1.00 0.00 H new ATOM 0 HB THR A 122 4.346 8.487 -3.511 1.00 0.00 H new ATOM 0 HG1 THR A 122 4.942 6.364 -3.139 1.00 0.00 H new ATOM 0 HG21 THR A 122 2.156 8.258 -2.396 1.00 0.00 H new ATOM 0 HG22 THR A 122 2.014 9.095 -3.960 1.00 0.00 H new ATOM 0 HG23 THR A 122 1.529 7.389 -3.817 1.00 0.00 H new ATOM 1989 N ASN A 123 4.030 9.863 -6.046 1.00 0.00 N ATOM 1990 CA ASN A 123 3.613 11.122 -6.659 1.00 0.00 C ATOM 1991 C ASN A 123 3.320 10.925 -8.139 1.00 0.00 C ATOM 1992 O ASN A 123 2.384 11.514 -8.684 1.00 0.00 O ATOM 1993 CB ASN A 123 4.696 12.198 -6.502 1.00 0.00 C ATOM 1994 CG ASN A 123 5.027 12.534 -5.055 1.00 0.00 C ATOM 1995 OD1 ASN A 123 6.158 12.911 -4.742 1.00 0.00 O ATOM 1996 ND2 ASN A 123 4.057 12.412 -4.165 1.00 0.00 N ATOM 0 H ASN A 123 4.949 9.896 -5.605 1.00 0.00 H new ATOM 0 HA ASN A 123 2.708 11.451 -6.148 1.00 0.00 H new ATOM 0 HB2 ASN A 123 5.604 11.862 -7.003 1.00 0.00 H new ATOM 0 HB3 ASN A 123 4.369 13.105 -7.010 1.00 0.00 H new ATOM 0 HD21 ASN A 123 4.233 12.633 -3.185 1.00 0.00 H new ATOM 0 HD22 ASN A 123 3.132 12.097 -4.458 1.00 0.00 H new ATOM 2003 N SER A 124 4.118 10.080 -8.776 1.00 0.00 N ATOM 2004 CA SER A 124 4.011 9.848 -10.206 1.00 0.00 C ATOM 2005 C SER A 124 2.944 8.795 -10.535 1.00 0.00 C ATOM 2006 O SER A 124 2.484 8.702 -11.676 1.00 0.00 O ATOM 2007 CB SER A 124 5.369 9.406 -10.746 1.00 0.00 C ATOM 2008 OG SER A 124 6.397 10.282 -10.312 1.00 0.00 O ATOM 0 H SER A 124 4.853 9.540 -8.318 1.00 0.00 H new ATOM 0 HA SER A 124 3.705 10.780 -10.682 1.00 0.00 H new ATOM 0 HB2 SER A 124 5.585 8.391 -10.411 1.00 0.00 H new ATOM 0 HB3 SER A 124 5.341 9.383 -11.835 1.00 0.00 H new ATOM 0 HG SER A 124 6.640 10.068 -9.387 1.00 0.00 H new ATOM 2014 N PHE A 125 2.556 8.006 -9.542 1.00 0.00 N ATOM 2015 CA PHE A 125 1.587 6.934 -9.752 1.00 0.00 C ATOM 2016 C PHE A 125 0.186 7.360 -9.322 1.00 0.00 C ATOM 2017 O PHE A 125 -0.804 7.029 -9.977 1.00 0.00 O ATOM 2018 CB PHE A 125 2.019 5.678 -8.985 1.00 0.00 C ATOM 2019 CG PHE A 125 1.080 4.511 -9.131 1.00 0.00 C ATOM 2020 CD1 PHE A 125 1.079 3.743 -10.286 1.00 0.00 C ATOM 2021 CD2 PHE A 125 0.199 4.184 -8.112 1.00 0.00 C ATOM 2022 CE1 PHE A 125 0.217 2.671 -10.420 1.00 0.00 C ATOM 2023 CE2 PHE A 125 -0.664 3.113 -8.241 1.00 0.00 C ATOM 2024 CZ PHE A 125 -0.656 2.355 -9.398 1.00 0.00 C ATOM 0 H PHE A 125 2.896 8.086 -8.584 1.00 0.00 H new ATOM 0 HA PHE A 125 1.556 6.710 -10.818 1.00 0.00 H new ATOM 0 HB2 PHE A 125 3.009 5.378 -9.329 1.00 0.00 H new ATOM 0 HB3 PHE A 125 2.111 5.926 -7.927 1.00 0.00 H new ATOM 0 HD1 PHE A 125 1.759 3.985 -11.089 1.00 0.00 H new ATOM 0 HD2 PHE A 125 0.187 4.773 -7.207 1.00 0.00 H new ATOM 0 HE1 PHE A 125 0.226 2.080 -11.324 1.00 0.00 H new ATOM 0 HE2 PHE A 125 -1.344 2.868 -7.439 1.00 0.00 H new ATOM 0 HZ PHE A 125 -1.331 1.518 -9.502 1.00 0.00 H new ATOM 2034 N GLY A 126 0.112 8.104 -8.233 1.00 0.00 N ATOM 2035 CA GLY A 126 -1.163 8.534 -7.709 1.00 0.00 C ATOM 2036 C GLY A 126 -1.137 8.651 -6.201 1.00 0.00 C ATOM 2037 O GLY A 126 -1.123 7.641 -5.495 1.00 0.00 O ATOM 0 H GLY A 126 0.921 8.420 -7.698 1.00 0.00 H new ATOM 0 HA2 GLY A 126 -1.429 9.497 -8.144 1.00 0.00 H new ATOM 0 HA3 GLY A 126 -1.936 7.825 -8.006 1.00 0.00 H new ATOM 2041 N ASP A 127 -1.127 9.882 -5.708 1.00 0.00 N ATOM 2042 CA ASP A 127 -1.061 10.135 -4.271 1.00 0.00 C ATOM 2043 C ASP A 127 -2.320 9.622 -3.586 1.00 0.00 C ATOM 2044 O ASP A 127 -2.261 9.006 -2.517 1.00 0.00 O ATOM 2045 CB ASP A 127 -0.907 11.632 -3.983 1.00 0.00 C ATOM 2046 CG ASP A 127 0.256 12.265 -4.719 1.00 0.00 C ATOM 2047 OD1 ASP A 127 1.411 12.090 -4.287 1.00 0.00 O ATOM 2048 OD2 ASP A 127 0.015 12.952 -5.737 1.00 0.00 O ATOM 0 H ASP A 127 -1.164 10.724 -6.282 1.00 0.00 H new ATOM 0 HA ASP A 127 -0.190 9.608 -3.881 1.00 0.00 H new ATOM 0 HB2 ASP A 127 -1.827 12.145 -4.261 1.00 0.00 H new ATOM 0 HB3 ASP A 127 -0.773 11.777 -2.911 1.00 0.00 H new ATOM 2053 N TRP A 128 -3.460 9.881 -4.214 1.00 0.00 N ATOM 2054 CA TRP A 128 -4.748 9.458 -3.683 1.00 0.00 C ATOM 2055 C TRP A 128 -5.393 8.425 -4.602 1.00 0.00 C ATOM 2056 O TRP A 128 -6.610 8.423 -4.796 1.00 0.00 O ATOM 2057 CB TRP A 128 -5.683 10.665 -3.523 1.00 0.00 C ATOM 2058 CG TRP A 128 -5.234 11.649 -2.480 1.00 0.00 C ATOM 2059 CD1 TRP A 128 -4.300 12.634 -2.628 1.00 0.00 C ATOM 2060 CD2 TRP A 128 -5.717 11.756 -1.134 1.00 0.00 C ATOM 2061 NE1 TRP A 128 -4.164 13.335 -1.456 1.00 0.00 N ATOM 2062 CE2 TRP A 128 -5.023 12.818 -0.524 1.00 0.00 C ATOM 2063 CE3 TRP A 128 -6.664 11.054 -0.380 1.00 0.00 C ATOM 2064 CZ2 TRP A 128 -5.248 13.197 0.797 1.00 0.00 C ATOM 2065 CZ3 TRP A 128 -6.887 11.432 0.931 1.00 0.00 C ATOM 2066 CH2 TRP A 128 -6.181 12.493 1.507 1.00 0.00 C ATOM 0 H TRP A 128 -3.518 10.386 -5.098 1.00 0.00 H new ATOM 0 HA TRP A 128 -4.581 9.005 -2.706 1.00 0.00 H new ATOM 0 HB2 TRP A 128 -5.765 11.178 -4.481 1.00 0.00 H new ATOM 0 HB3 TRP A 128 -6.680 10.308 -3.266 1.00 0.00 H new ATOM 0 HD1 TRP A 128 -3.749 12.833 -3.535 1.00 0.00 H new ATOM 0 HE1 TRP A 128 -3.525 14.116 -1.304 1.00 0.00 H new ATOM 0 HE3 TRP A 128 -7.211 10.231 -0.815 1.00 0.00 H new ATOM 0 HZ2 TRP A 128 -4.706 14.017 1.244 1.00 0.00 H new ATOM 0 HZ3 TRP A 128 -7.619 10.899 1.520 1.00 0.00 H new ATOM 0 HH2 TRP A 128 -6.377 12.762 2.534 1.00 0.00 H new ATOM 2077 N VAL A 129 -4.579 7.541 -5.162 1.00 0.00 N ATOM 2078 CA VAL A 129 -5.078 6.514 -6.067 1.00 0.00 C ATOM 2079 C VAL A 129 -4.805 5.120 -5.500 1.00 0.00 C ATOM 2080 O VAL A 129 -3.772 4.890 -4.868 1.00 0.00 O ATOM 2081 CB VAL A 129 -4.438 6.645 -7.471 1.00 0.00 C ATOM 2082 CG1 VAL A 129 -4.969 5.582 -8.427 1.00 0.00 C ATOM 2083 CG2 VAL A 129 -4.683 8.035 -8.040 1.00 0.00 C ATOM 0 H VAL A 129 -3.571 7.514 -5.006 1.00 0.00 H new ATOM 0 HA VAL A 129 -6.154 6.655 -6.165 1.00 0.00 H new ATOM 0 HB VAL A 129 -3.364 6.492 -7.361 1.00 0.00 H new ATOM 0 HG11 VAL A 129 -4.499 5.703 -9.403 1.00 0.00 H new ATOM 0 HG12 VAL A 129 -4.739 4.592 -8.034 1.00 0.00 H new ATOM 0 HG13 VAL A 129 -6.049 5.691 -8.528 1.00 0.00 H new ATOM 0 HG21 VAL A 129 -4.227 8.110 -9.027 1.00 0.00 H new ATOM 0 HG22 VAL A 129 -5.756 8.211 -8.122 1.00 0.00 H new ATOM 0 HG23 VAL A 129 -4.243 8.782 -7.379 1.00 0.00 H new ATOM 2093 N VAL A 130 -5.746 4.205 -5.712 1.00 0.00 N ATOM 2094 CA VAL A 130 -5.596 2.827 -5.268 1.00 0.00 C ATOM 2095 C VAL A 130 -4.692 2.059 -6.231 1.00 0.00 C ATOM 2096 O VAL A 130 -4.913 2.070 -7.443 1.00 0.00 O ATOM 2097 CB VAL A 130 -6.965 2.117 -5.162 1.00 0.00 C ATOM 2098 CG1 VAL A 130 -6.804 0.674 -4.698 1.00 0.00 C ATOM 2099 CG2 VAL A 130 -7.877 2.879 -4.216 1.00 0.00 C ATOM 0 H VAL A 130 -6.625 4.397 -6.192 1.00 0.00 H new ATOM 0 HA VAL A 130 -5.142 2.844 -4.277 1.00 0.00 H new ATOM 0 HB VAL A 130 -7.417 2.100 -6.154 1.00 0.00 H new ATOM 0 HG11 VAL A 130 -7.784 0.201 -4.633 1.00 0.00 H new ATOM 0 HG12 VAL A 130 -6.185 0.129 -5.411 1.00 0.00 H new ATOM 0 HG13 VAL A 130 -6.328 0.658 -3.718 1.00 0.00 H new ATOM 0 HG21 VAL A 130 -8.839 2.370 -4.149 1.00 0.00 H new ATOM 0 HG22 VAL A 130 -7.420 2.924 -3.227 1.00 0.00 H new ATOM 0 HG23 VAL A 130 -8.028 3.891 -4.592 1.00 0.00 H new ATOM 2109 N PRO A 131 -3.650 1.404 -5.698 1.00 0.00 N ATOM 2110 CA PRO A 131 -2.683 0.653 -6.504 1.00 0.00 C ATOM 2111 C PRO A 131 -3.324 -0.473 -7.309 1.00 0.00 C ATOM 2112 O PRO A 131 -4.091 -1.278 -6.779 1.00 0.00 O ATOM 2113 CB PRO A 131 -1.716 0.073 -5.468 1.00 0.00 C ATOM 2114 CG PRO A 131 -1.888 0.923 -4.258 1.00 0.00 C ATOM 2115 CD PRO A 131 -3.324 1.356 -4.264 1.00 0.00 C ATOM 0 HA PRO A 131 -2.207 1.295 -7.246 1.00 0.00 H new ATOM 0 HB2 PRO A 131 -1.948 -0.970 -5.253 1.00 0.00 H new ATOM 0 HB3 PRO A 131 -0.688 0.103 -5.828 1.00 0.00 H new ATOM 0 HG2 PRO A 131 -1.651 0.366 -3.352 1.00 0.00 H new ATOM 0 HG3 PRO A 131 -1.220 1.784 -4.286 1.00 0.00 H new ATOM 0 HD2 PRO A 131 -3.960 0.651 -3.729 1.00 0.00 H new ATOM 0 HD3 PRO A 131 -3.454 2.328 -3.788 1.00 0.00 H new ATOM 2123 N TYR A 132 -2.999 -0.520 -8.592 1.00 0.00 N ATOM 2124 CA TYR A 132 -3.467 -1.578 -9.470 1.00 0.00 C ATOM 2125 C TYR A 132 -2.275 -2.226 -10.162 1.00 0.00 C ATOM 2126 O TYR A 132 -1.181 -1.663 -10.172 1.00 0.00 O ATOM 2127 CB TYR A 132 -4.464 -1.029 -10.500 1.00 0.00 C ATOM 2128 CG TYR A 132 -3.946 0.142 -11.312 1.00 0.00 C ATOM 2129 CD1 TYR A 132 -3.235 -0.058 -12.489 1.00 0.00 C ATOM 2130 CD2 TYR A 132 -4.173 1.450 -10.900 1.00 0.00 C ATOM 2131 CE1 TYR A 132 -2.766 1.010 -13.231 1.00 0.00 C ATOM 2132 CE2 TYR A 132 -3.708 2.522 -11.635 1.00 0.00 C ATOM 2133 CZ TYR A 132 -3.004 2.297 -12.798 1.00 0.00 C ATOM 2134 OH TYR A 132 -2.543 3.363 -13.538 1.00 0.00 O ATOM 0 H TYR A 132 -2.406 0.172 -9.051 1.00 0.00 H new ATOM 0 HA TYR A 132 -3.986 -2.331 -8.877 1.00 0.00 H new ATOM 0 HB2 TYR A 132 -4.743 -1.833 -11.181 1.00 0.00 H new ATOM 0 HB3 TYR A 132 -5.372 -0.722 -9.981 1.00 0.00 H new ATOM 0 HD1 TYR A 132 -3.046 -1.065 -12.830 1.00 0.00 H new ATOM 0 HD2 TYR A 132 -4.723 1.631 -9.988 1.00 0.00 H new ATOM 0 HE1 TYR A 132 -2.216 0.837 -14.144 1.00 0.00 H new ATOM 0 HE2 TYR A 132 -3.895 3.532 -11.300 1.00 0.00 H new ATOM 0 HH TYR A 132 -2.795 4.201 -13.097 1.00 0.00 H new ATOM 2144 N TYR A 133 -2.484 -3.402 -10.731 1.00 0.00 N ATOM 2145 CA TYR A 133 -1.401 -4.132 -11.367 1.00 0.00 C ATOM 2146 C TYR A 133 -0.983 -3.470 -12.679 1.00 0.00 C ATOM 2147 O TYR A 133 -1.795 -3.267 -13.581 1.00 0.00 O ATOM 2148 CB TYR A 133 -1.780 -5.606 -11.581 1.00 0.00 C ATOM 2149 CG TYR A 133 -3.110 -5.830 -12.270 1.00 0.00 C ATOM 2150 CD1 TYR A 133 -4.303 -5.753 -11.557 1.00 0.00 C ATOM 2151 CD2 TYR A 133 -3.174 -6.133 -13.623 1.00 0.00 C ATOM 2152 CE1 TYR A 133 -5.519 -5.971 -12.176 1.00 0.00 C ATOM 2153 CE2 TYR A 133 -4.386 -6.350 -14.248 1.00 0.00 C ATOM 2154 CZ TYR A 133 -5.555 -6.267 -13.521 1.00 0.00 C ATOM 2155 OH TYR A 133 -6.763 -6.490 -14.142 1.00 0.00 O ATOM 0 H TYR A 133 -3.390 -3.870 -10.765 1.00 0.00 H new ATOM 0 HA TYR A 133 -0.542 -4.104 -10.697 1.00 0.00 H new ATOM 0 HB2 TYR A 133 -0.998 -6.085 -12.169 1.00 0.00 H new ATOM 0 HB3 TYR A 133 -1.801 -6.105 -10.612 1.00 0.00 H new ATOM 0 HD1 TYR A 133 -4.278 -5.519 -10.503 1.00 0.00 H new ATOM 0 HD2 TYR A 133 -2.261 -6.200 -14.196 1.00 0.00 H new ATOM 0 HE1 TYR A 133 -6.436 -5.910 -11.609 1.00 0.00 H new ATOM 0 HE2 TYR A 133 -4.418 -6.584 -15.302 1.00 0.00 H new ATOM 0 HH TYR A 133 -6.612 -6.685 -15.091 1.00 0.00 H new ATOM 2165 N ARG A 134 0.290 -3.114 -12.757 1.00 0.00 N ATOM 2166 CA ARG A 134 0.848 -2.478 -13.937 1.00 0.00 C ATOM 2167 C ARG A 134 2.034 -3.289 -14.437 1.00 0.00 C ATOM 2168 O ARG A 134 3.096 -3.286 -13.815 1.00 0.00 O ATOM 2169 CB ARG A 134 1.290 -1.052 -13.608 1.00 0.00 C ATOM 2170 CG ARG A 134 1.729 -0.255 -14.825 1.00 0.00 C ATOM 2171 CD ARG A 134 3.111 0.345 -14.633 1.00 0.00 C ATOM 2172 NE ARG A 134 4.150 -0.682 -14.541 1.00 0.00 N ATOM 2173 CZ ARG A 134 5.417 -0.494 -14.911 1.00 0.00 C ATOM 2174 NH1 ARG A 134 5.811 0.683 -15.385 1.00 0.00 N ATOM 2175 NH2 ARG A 134 6.291 -1.486 -14.808 1.00 0.00 N ATOM 0 H ARG A 134 0.963 -3.258 -12.004 1.00 0.00 H new ATOM 0 HA ARG A 134 0.086 -2.435 -14.715 1.00 0.00 H new ATOM 0 HB2 ARG A 134 0.468 -0.529 -13.119 1.00 0.00 H new ATOM 0 HB3 ARG A 134 2.112 -1.091 -12.894 1.00 0.00 H new ATOM 0 HG2 ARG A 134 1.731 -0.902 -15.702 1.00 0.00 H new ATOM 0 HG3 ARG A 134 1.010 0.541 -15.018 1.00 0.00 H new ATOM 0 HD2 ARG A 134 3.335 1.013 -15.465 1.00 0.00 H new ATOM 0 HD3 ARG A 134 3.120 0.951 -13.727 1.00 0.00 H new ATOM 0 HE ARG A 134 3.889 -1.596 -14.172 1.00 0.00 H new ATOM 0 HH11 ARG A 134 5.143 1.449 -15.468 1.00 0.00 H new ATOM 0 HH12 ARG A 134 6.782 0.820 -15.666 1.00 0.00 H new ATOM 0 HH21 ARG A 134 5.994 -2.392 -14.446 1.00 0.00 H new ATOM 0 HH22 ARG A 134 7.260 -1.343 -15.091 1.00 0.00 H new