USER MOD reduce.3.24.130724 H: found=0, std=0, add=899, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 899 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 49 LYS NZ :NH3+ 146:sc= 1.19 (180deg=-0.274) USER MOD Set 1.2: A 50 ASN : amide:sc= 1.02 K(o=2.2,f=-5.8!) USER MOD Set 2.1: A 18 THR OG1 : rot 180:sc= 0.209 USER MOD Set 2.2: A 21 SER OG : rot 91:sc= 0.269 USER MOD Single : A 1 MET CE :methyl 170:sc= 0 (180deg=-0.14) USER MOD Single : A 1 MET N :NH3+ -173:sc= -0.228 (180deg=-0.329) USER MOD Single : A 6 LYS NZ :NH3+ -174:sc= 0 (180deg=-0.0436) USER MOD Single : A 7 THR OG1 : rot 180:sc= 0.0581 USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 13 TYR OH : rot 159:sc= 0.909 USER MOD Single : A 17 ASN : amide:sc= -0.196 K(o=-0.2,f=-1.5) USER MOD Single : A 20 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 26 LYS NZ :NH3+ -168:sc= -0.0207 (180deg=-0.185) USER MOD Single : A 27 THR OG1 : rot 81:sc= 1.25 USER MOD Single : A 30 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 TYR OH : rot -33:sc= -2.55! USER MOD Single : A 43 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 52 GLN : amide:sc= 0.765 K(o=0.76,f=-5.5!) USER MOD Single : A 58 LYS NZ :NH3+ 168:sc=-0.00882 (180deg=-0.146) USER MOD Single : A 62 THR OG1 : rot -110:sc= 0 USER MOD Single : A 64 THR OG1 : rot -86:sc= -0.291! USER MOD Single : A 67 LYS NZ :NH3+ -115:sc= -0.592 (180deg=-3.84!) USER MOD Single : A 81 SER OG : rot 96:sc= 0.0645 USER MOD Single : A 82 ASN : amide:sc= -0.0459 K(o=-0.046,f=-4.3!) USER MOD Single : A 85 LYS NZ :NH3+ -170:sc= -0.0147 (180deg=-0.136) USER MOD Single : A 100 TYR OH : rot 180:sc= 0 USER MOD Single : A 101 LYS NZ :NH3+ 177:sc= 1.05 (180deg=1.04) USER MOD Single : A 106 LYS NZ :NH3+ 166:sc= -0.024 (180deg=-0.261) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -16.020 -10.531 -21.426 1.00 0.00 N ATOM 2 CA MET A 1 -14.806 -10.709 -22.268 1.00 0.00 C ATOM 3 C MET A 1 -13.558 -10.256 -21.519 1.00 0.00 C ATOM 4 O MET A 1 -12.439 -10.396 -22.011 1.00 0.00 O ATOM 5 CB MET A 1 -14.945 -9.917 -23.569 1.00 0.00 C ATOM 6 CG MET A 1 -15.990 -10.480 -24.520 1.00 0.00 C ATOM 7 SD MET A 1 -16.248 -9.437 -25.968 1.00 0.00 S ATOM 8 CE MET A 1 -14.706 -9.683 -26.845 1.00 0.00 C ATOM 0 H1 MET A 1 -16.840 -10.953 -21.906 1.00 0.00 H new ATOM 0 H2 MET A 1 -15.877 -10.999 -20.508 1.00 0.00 H new ATOM 0 H3 MET A 1 -16.192 -9.517 -21.275 1.00 0.00 H new ATOM 0 HA MET A 1 -14.706 -11.769 -22.502 1.00 0.00 H new ATOM 0 HB2 MET A 1 -15.203 -8.885 -23.330 1.00 0.00 H new ATOM 0 HB3 MET A 1 -13.980 -9.895 -24.075 1.00 0.00 H new ATOM 0 HG2 MET A 1 -15.682 -11.474 -24.844 1.00 0.00 H new ATOM 0 HG3 MET A 1 -16.934 -10.596 -23.988 1.00 0.00 H new ATOM 0 HE1 MET A 1 -14.781 -9.248 -27.842 1.00 0.00 H new ATOM 0 HE2 MET A 1 -13.896 -9.201 -26.299 1.00 0.00 H new ATOM 0 HE3 MET A 1 -14.502 -10.750 -26.929 1.00 0.00 H new ATOM 20 N ALA A 2 -13.764 -9.706 -20.329 1.00 0.00 N ATOM 21 CA ALA A 2 -12.660 -9.230 -19.504 1.00 0.00 C ATOM 22 C ALA A 2 -12.046 -10.370 -18.695 1.00 0.00 C ATOM 23 O ALA A 2 -12.735 -11.020 -17.906 1.00 0.00 O ATOM 24 CB ALA A 2 -13.134 -8.118 -18.578 1.00 0.00 C ATOM 0 H ALA A 2 -14.686 -9.578 -19.913 1.00 0.00 H new ATOM 0 HA ALA A 2 -11.890 -8.834 -20.166 1.00 0.00 H new ATOM 0 HB1 ALA A 2 -12.300 -7.772 -17.968 1.00 0.00 H new ATOM 0 HB2 ALA A 2 -13.517 -7.288 -19.172 1.00 0.00 H new ATOM 0 HB3 ALA A 2 -13.925 -8.496 -17.930 1.00 0.00 H new ATOM 30 N PRO A 3 -10.740 -10.633 -18.888 1.00 0.00 N ATOM 31 CA PRO A 3 -10.030 -11.700 -18.172 1.00 0.00 C ATOM 32 C PRO A 3 -9.792 -11.372 -16.702 1.00 0.00 C ATOM 33 O PRO A 3 -9.738 -10.204 -16.311 1.00 0.00 O ATOM 34 CB PRO A 3 -8.707 -11.808 -18.925 1.00 0.00 C ATOM 35 CG PRO A 3 -8.487 -10.446 -19.468 1.00 0.00 C ATOM 36 CD PRO A 3 -9.850 -9.919 -19.824 1.00 0.00 C ATOM 0 HA PRO A 3 -10.604 -12.627 -18.154 1.00 0.00 H new ATOM 0 HB2 PRO A 3 -7.895 -12.109 -18.263 1.00 0.00 H new ATOM 0 HB3 PRO A 3 -8.761 -12.551 -19.721 1.00 0.00 H new ATOM 0 HG2 PRO A 3 -8.001 -9.806 -18.732 1.00 0.00 H new ATOM 0 HG3 PRO A 3 -7.838 -10.475 -20.344 1.00 0.00 H new ATOM 0 HD2 PRO A 3 -9.911 -8.839 -19.693 1.00 0.00 H new ATOM 0 HD3 PRO A 3 -10.105 -10.130 -20.863 1.00 0.00 H new ATOM 44 N LEU A 4 -9.649 -12.412 -15.888 1.00 0.00 N ATOM 45 CA LEU A 4 -9.422 -12.234 -14.461 1.00 0.00 C ATOM 46 C LEU A 4 -8.023 -12.706 -14.079 1.00 0.00 C ATOM 47 O LEU A 4 -7.588 -13.781 -14.493 1.00 0.00 O ATOM 48 CB LEU A 4 -10.472 -13.003 -13.655 1.00 0.00 C ATOM 49 CG LEU A 4 -11.928 -12.650 -13.976 1.00 0.00 C ATOM 50 CD1 LEU A 4 -12.879 -13.482 -13.133 1.00 0.00 C ATOM 51 CD2 LEU A 4 -12.179 -11.165 -13.766 1.00 0.00 C ATOM 0 H LEU A 4 -9.686 -13.385 -16.192 1.00 0.00 H new ATOM 0 HA LEU A 4 -9.508 -11.172 -14.230 1.00 0.00 H new ATOM 0 HB2 LEU A 4 -10.328 -14.070 -13.825 1.00 0.00 H new ATOM 0 HB3 LEU A 4 -10.297 -12.823 -12.594 1.00 0.00 H new ATOM 0 HG LEU A 4 -12.113 -12.881 -15.025 1.00 0.00 H new ATOM 0 HD11 LEU A 4 -13.908 -13.216 -13.376 1.00 0.00 H new ATOM 0 HD12 LEU A 4 -12.719 -14.540 -13.341 1.00 0.00 H new ATOM 0 HD13 LEU A 4 -12.694 -13.288 -12.077 1.00 0.00 H new ATOM 0 HD21 LEU A 4 -13.219 -10.935 -13.999 1.00 0.00 H new ATOM 0 HD22 LEU A 4 -11.974 -10.905 -12.728 1.00 0.00 H new ATOM 0 HD23 LEU A 4 -11.524 -10.589 -14.420 1.00 0.00 H new ATOM 63 N ARG A 5 -7.328 -11.902 -13.282 1.00 0.00 N ATOM 64 CA ARG A 5 -5.977 -12.234 -12.841 1.00 0.00 C ATOM 65 C ARG A 5 -5.708 -11.661 -11.454 1.00 0.00 C ATOM 66 O ARG A 5 -6.504 -10.879 -10.936 1.00 0.00 O ATOM 67 CB ARG A 5 -4.928 -11.720 -13.833 1.00 0.00 C ATOM 68 CG ARG A 5 -5.331 -10.441 -14.539 1.00 0.00 C ATOM 69 CD ARG A 5 -5.722 -10.714 -15.981 1.00 0.00 C ATOM 70 NE ARG A 5 -6.144 -9.501 -16.678 1.00 0.00 N ATOM 71 CZ ARG A 5 -5.321 -8.725 -17.381 1.00 0.00 C ATOM 72 NH1 ARG A 5 -4.033 -9.033 -17.475 1.00 0.00 N ATOM 73 NH2 ARG A 5 -5.788 -7.642 -17.986 1.00 0.00 N ATOM 0 H ARG A 5 -7.679 -11.013 -12.927 1.00 0.00 H new ATOM 0 HA ARG A 5 -5.902 -13.320 -12.795 1.00 0.00 H new ATOM 0 HB2 ARG A 5 -3.991 -11.552 -13.302 1.00 0.00 H new ATOM 0 HB3 ARG A 5 -4.738 -12.492 -14.579 1.00 0.00 H new ATOM 0 HG2 ARG A 5 -6.167 -9.979 -14.013 1.00 0.00 H new ATOM 0 HG3 ARG A 5 -4.505 -9.730 -14.511 1.00 0.00 H new ATOM 0 HD2 ARG A 5 -4.877 -11.158 -16.507 1.00 0.00 H new ATOM 0 HD3 ARG A 5 -6.531 -11.444 -16.004 1.00 0.00 H new ATOM 0 HE ARG A 5 -7.127 -9.233 -16.623 1.00 0.00 H new ATOM 0 HH11 ARG A 5 -3.672 -9.865 -17.008 1.00 0.00 H new ATOM 0 HH12 ARG A 5 -3.404 -8.437 -18.014 1.00 0.00 H new ATOM 0 HH21 ARG A 5 -6.777 -7.403 -17.913 1.00 0.00 H new ATOM 0 HH22 ARG A 5 -5.158 -7.047 -18.525 1.00 0.00 H new ATOM 87 N LYS A 6 -4.589 -12.069 -10.854 1.00 0.00 N ATOM 88 CA LYS A 6 -4.207 -11.596 -9.523 1.00 0.00 C ATOM 89 C LYS A 6 -3.955 -10.094 -9.525 1.00 0.00 C ATOM 90 O LYS A 6 -4.306 -9.392 -8.575 1.00 0.00 O ATOM 91 CB LYS A 6 -2.958 -12.329 -9.028 1.00 0.00 C ATOM 92 CG LYS A 6 -3.182 -13.805 -8.732 1.00 0.00 C ATOM 93 CD LYS A 6 -4.095 -14.006 -7.532 1.00 0.00 C ATOM 94 CE LYS A 6 -4.164 -15.469 -7.125 1.00 0.00 C ATOM 95 NZ LYS A 6 -4.749 -16.319 -8.198 1.00 0.00 N ATOM 0 H LYS A 6 -3.930 -12.727 -11.270 1.00 0.00 H new ATOM 0 HA LYS A 6 -5.036 -11.808 -8.847 1.00 0.00 H new ATOM 0 HB2 LYS A 6 -2.173 -12.235 -9.778 1.00 0.00 H new ATOM 0 HB3 LYS A 6 -2.596 -11.839 -8.124 1.00 0.00 H new ATOM 0 HG2 LYS A 6 -3.618 -14.289 -9.606 1.00 0.00 H new ATOM 0 HG3 LYS A 6 -2.223 -14.288 -8.545 1.00 0.00 H new ATOM 0 HD2 LYS A 6 -3.733 -13.411 -6.694 1.00 0.00 H new ATOM 0 HD3 LYS A 6 -5.096 -13.646 -7.770 1.00 0.00 H new ATOM 0 HE2 LYS A 6 -3.163 -15.826 -6.885 1.00 0.00 H new ATOM 0 HE3 LYS A 6 -4.762 -15.566 -6.219 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 -4.872 -17.289 -7.844 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 -5.673 -15.934 -8.481 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 -4.111 -16.329 -9.020 1.00 0.00 H new ATOM 109 N THR A 7 -3.339 -9.614 -10.590 1.00 0.00 N ATOM 110 CA THR A 7 -3.038 -8.199 -10.721 1.00 0.00 C ATOM 111 C THR A 7 -4.238 -7.423 -11.250 1.00 0.00 C ATOM 112 O THR A 7 -4.755 -7.709 -12.330 1.00 0.00 O ATOM 113 CB THR A 7 -1.839 -7.963 -11.656 1.00 0.00 C ATOM 114 OG1 THR A 7 -1.820 -8.957 -12.689 1.00 0.00 O ATOM 115 CG2 THR A 7 -0.529 -7.993 -10.883 1.00 0.00 C ATOM 0 H THR A 7 -3.036 -10.185 -11.379 1.00 0.00 H new ATOM 0 HA THR A 7 -2.789 -7.839 -9.723 1.00 0.00 H new ATOM 0 HB THR A 7 -1.947 -6.976 -12.106 1.00 0.00 H new ATOM 0 HG1 THR A 7 -1.055 -8.799 -13.281 1.00 0.00 H new ATOM 0 HG21 THR A 7 0.302 -7.824 -11.568 1.00 0.00 H new ATOM 0 HG22 THR A 7 -0.537 -7.212 -10.123 1.00 0.00 H new ATOM 0 HG23 THR A 7 -0.412 -8.965 -10.404 1.00 0.00 H new ATOM 123 N ALA A 8 -4.665 -6.440 -10.476 1.00 0.00 N ATOM 124 CA ALA A 8 -5.794 -5.599 -10.842 1.00 0.00 C ATOM 125 C ALA A 8 -5.316 -4.344 -11.550 1.00 0.00 C ATOM 126 O ALA A 8 -4.190 -3.888 -11.334 1.00 0.00 O ATOM 127 CB ALA A 8 -6.605 -5.247 -9.611 1.00 0.00 C ATOM 0 H ALA A 8 -4.241 -6.202 -9.579 1.00 0.00 H new ATOM 0 HA ALA A 8 -6.434 -6.152 -11.530 1.00 0.00 H new ATOM 0 HB1 ALA A 8 -7.447 -4.617 -9.898 1.00 0.00 H new ATOM 0 HB2 ALA A 8 -6.977 -6.160 -9.147 1.00 0.00 H new ATOM 0 HB3 ALA A 8 -5.975 -4.710 -8.902 1.00 0.00 H new ATOM 133 N VAL A 9 -6.169 -3.776 -12.391 1.00 0.00 N ATOM 134 CA VAL A 9 -5.805 -2.584 -13.131 1.00 0.00 C ATOM 135 C VAL A 9 -6.550 -1.370 -12.590 1.00 0.00 C ATOM 136 O VAL A 9 -7.784 -1.336 -12.565 1.00 0.00 O ATOM 137 CB VAL A 9 -6.096 -2.739 -14.640 1.00 0.00 C ATOM 138 CG1 VAL A 9 -5.719 -1.470 -15.404 1.00 0.00 C ATOM 139 CG2 VAL A 9 -5.352 -3.941 -15.205 1.00 0.00 C ATOM 0 H VAL A 9 -7.111 -4.121 -12.575 1.00 0.00 H new ATOM 0 HA VAL A 9 -4.732 -2.439 -13.002 1.00 0.00 H new ATOM 0 HB VAL A 9 -7.167 -2.902 -14.763 1.00 0.00 H new ATOM 0 HG11 VAL A 9 -5.934 -1.606 -16.464 1.00 0.00 H new ATOM 0 HG12 VAL A 9 -6.298 -0.629 -15.021 1.00 0.00 H new ATOM 0 HG13 VAL A 9 -4.656 -1.268 -15.272 1.00 0.00 H new ATOM 0 HG21 VAL A 9 -5.568 -4.035 -16.269 1.00 0.00 H new ATOM 0 HG22 VAL A 9 -4.280 -3.805 -15.063 1.00 0.00 H new ATOM 0 HG23 VAL A 9 -5.674 -4.845 -14.688 1.00 0.00 H new ATOM 149 N LEU A 10 -5.788 -0.380 -12.169 1.00 0.00 N ATOM 150 CA LEU A 10 -6.346 0.849 -11.635 1.00 0.00 C ATOM 151 C LEU A 10 -5.974 1.961 -12.603 1.00 0.00 C ATOM 152 O LEU A 10 -4.795 2.150 -12.908 1.00 0.00 O ATOM 153 CB LEU A 10 -5.793 1.109 -10.223 1.00 0.00 C ATOM 154 CG LEU A 10 -6.390 2.299 -9.456 1.00 0.00 C ATOM 155 CD1 LEU A 10 -7.889 2.120 -9.243 1.00 0.00 C ATOM 156 CD2 LEU A 10 -5.689 2.455 -8.118 1.00 0.00 C ATOM 0 H LEU A 10 -4.768 -0.403 -12.187 1.00 0.00 H new ATOM 0 HA LEU A 10 -7.430 0.790 -11.540 1.00 0.00 H new ATOM 0 HB2 LEU A 10 -5.945 0.209 -9.627 1.00 0.00 H new ATOM 0 HB3 LEU A 10 -4.716 1.261 -10.302 1.00 0.00 H new ATOM 0 HG LEU A 10 -6.238 3.199 -10.051 1.00 0.00 H new ATOM 0 HD11 LEU A 10 -8.284 2.977 -8.698 1.00 0.00 H new ATOM 0 HD12 LEU A 10 -8.387 2.044 -10.209 1.00 0.00 H new ATOM 0 HD13 LEU A 10 -8.069 1.211 -8.669 1.00 0.00 H new ATOM 0 HD21 LEU A 10 -6.117 3.300 -7.579 1.00 0.00 H new ATOM 0 HD22 LEU A 10 -5.820 1.546 -7.530 1.00 0.00 H new ATOM 0 HD23 LEU A 10 -4.626 2.630 -8.283 1.00 0.00 H new ATOM 168 N LYS A 11 -6.959 2.701 -13.091 1.00 0.00 N ATOM 169 CA LYS A 11 -6.675 3.749 -14.061 1.00 0.00 C ATOM 170 C LYS A 11 -6.927 5.127 -13.476 1.00 0.00 C ATOM 171 O LYS A 11 -7.919 5.355 -12.778 1.00 0.00 O ATOM 172 CB LYS A 11 -7.512 3.578 -15.335 1.00 0.00 C ATOM 173 CG LYS A 11 -7.142 2.359 -16.161 1.00 0.00 C ATOM 174 CD LYS A 11 -7.981 2.274 -17.427 1.00 0.00 C ATOM 175 CE LYS A 11 -7.590 1.075 -18.275 1.00 0.00 C ATOM 176 NZ LYS A 11 -8.410 0.978 -19.515 1.00 0.00 N ATOM 0 H LYS A 11 -7.942 2.600 -12.838 1.00 0.00 H new ATOM 0 HA LYS A 11 -5.620 3.660 -14.318 1.00 0.00 H new ATOM 0 HB2 LYS A 11 -8.564 3.511 -15.059 1.00 0.00 H new ATOM 0 HB3 LYS A 11 -7.401 4.469 -15.952 1.00 0.00 H new ATOM 0 HG2 LYS A 11 -6.085 2.403 -16.425 1.00 0.00 H new ATOM 0 HG3 LYS A 11 -7.285 1.457 -15.566 1.00 0.00 H new ATOM 0 HD2 LYS A 11 -9.036 2.205 -17.162 1.00 0.00 H new ATOM 0 HD3 LYS A 11 -7.858 3.188 -18.008 1.00 0.00 H new ATOM 0 HE2 LYS A 11 -6.536 1.148 -18.542 1.00 0.00 H new ATOM 0 HE3 LYS A 11 -7.708 0.163 -17.690 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 -8.111 0.147 -20.065 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 -9.414 0.882 -19.261 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 -8.278 1.837 -20.087 1.00 0.00 H new ATOM 190 N LEU A 12 -6.015 6.039 -13.762 1.00 0.00 N ATOM 191 CA LEU A 12 -6.142 7.405 -13.295 1.00 0.00 C ATOM 192 C LEU A 12 -6.324 8.324 -14.490 1.00 0.00 C ATOM 193 O LEU A 12 -5.493 8.333 -15.400 1.00 0.00 O ATOM 194 CB LEU A 12 -4.904 7.826 -12.494 1.00 0.00 C ATOM 195 CG LEU A 12 -5.184 8.582 -11.188 1.00 0.00 C ATOM 196 CD1 LEU A 12 -3.884 9.045 -10.557 1.00 0.00 C ATOM 197 CD2 LEU A 12 -6.102 9.771 -11.428 1.00 0.00 C ATOM 0 H LEU A 12 -5.178 5.857 -14.316 1.00 0.00 H new ATOM 0 HA LEU A 12 -7.009 7.475 -12.638 1.00 0.00 H new ATOM 0 HB2 LEU A 12 -4.325 6.933 -12.259 1.00 0.00 H new ATOM 0 HB3 LEU A 12 -4.279 8.454 -13.129 1.00 0.00 H new ATOM 0 HG LEU A 12 -5.686 7.897 -10.505 1.00 0.00 H new ATOM 0 HD11 LEU A 12 -4.099 9.580 -9.632 1.00 0.00 H new ATOM 0 HD12 LEU A 12 -3.257 8.180 -10.339 1.00 0.00 H new ATOM 0 HD13 LEU A 12 -3.361 9.708 -11.246 1.00 0.00 H new ATOM 0 HD21 LEU A 12 -6.283 10.287 -10.485 1.00 0.00 H new ATOM 0 HD22 LEU A 12 -5.632 10.457 -12.133 1.00 0.00 H new ATOM 0 HD23 LEU A 12 -7.050 9.422 -11.838 1.00 0.00 H new ATOM 209 N TYR A 13 -7.395 9.091 -14.502 1.00 0.00 N ATOM 210 CA TYR A 13 -7.658 10.005 -15.595 1.00 0.00 C ATOM 211 C TYR A 13 -7.212 11.399 -15.188 1.00 0.00 C ATOM 212 O TYR A 13 -7.701 11.943 -14.201 1.00 0.00 O ATOM 213 CB TYR A 13 -9.155 10.002 -15.916 1.00 0.00 C ATOM 214 CG TYR A 13 -9.676 8.655 -16.378 1.00 0.00 C ATOM 215 CD1 TYR A 13 -10.105 7.702 -15.461 1.00 0.00 C ATOM 216 CD2 TYR A 13 -9.745 8.340 -17.728 1.00 0.00 C ATOM 217 CE1 TYR A 13 -10.582 6.474 -15.876 1.00 0.00 C ATOM 218 CE2 TYR A 13 -10.223 7.111 -18.151 1.00 0.00 C ATOM 219 CZ TYR A 13 -10.640 6.183 -17.221 1.00 0.00 C ATOM 220 OH TYR A 13 -11.116 4.960 -17.635 1.00 0.00 O ATOM 0 H TYR A 13 -8.100 9.099 -13.765 1.00 0.00 H new ATOM 0 HA TYR A 13 -7.108 9.694 -16.483 1.00 0.00 H new ATOM 0 HB2 TYR A 13 -9.708 10.311 -15.029 1.00 0.00 H new ATOM 0 HB3 TYR A 13 -9.353 10.743 -16.690 1.00 0.00 H new ATOM 0 HD1 TYR A 13 -10.065 7.926 -14.405 1.00 0.00 H new ATOM 0 HD2 TYR A 13 -9.421 9.065 -18.460 1.00 0.00 H new ATOM 0 HE1 TYR A 13 -10.908 5.745 -15.149 1.00 0.00 H new ATOM 0 HE2 TYR A 13 -10.269 6.881 -19.205 1.00 0.00 H new ATOM 0 HH TYR A 13 -11.411 5.022 -18.567 1.00 0.00 H new ATOM 230 N VAL A 14 -6.293 11.980 -15.940 1.00 0.00 N ATOM 231 CA VAL A 14 -5.782 13.304 -15.622 1.00 0.00 C ATOM 232 C VAL A 14 -5.908 14.234 -16.816 1.00 0.00 C ATOM 233 O VAL A 14 -6.046 13.784 -17.956 1.00 0.00 O ATOM 234 CB VAL A 14 -4.303 13.260 -15.163 1.00 0.00 C ATOM 235 CG1 VAL A 14 -4.175 12.584 -13.800 1.00 0.00 C ATOM 236 CG2 VAL A 14 -3.431 12.555 -16.191 1.00 0.00 C ATOM 0 H VAL A 14 -5.885 11.557 -16.774 1.00 0.00 H new ATOM 0 HA VAL A 14 -6.387 13.683 -14.798 1.00 0.00 H new ATOM 0 HB VAL A 14 -3.954 14.289 -15.070 1.00 0.00 H new ATOM 0 HG11 VAL A 14 -3.127 12.566 -13.500 1.00 0.00 H new ATOM 0 HG12 VAL A 14 -4.754 13.140 -13.062 1.00 0.00 H new ATOM 0 HG13 VAL A 14 -4.552 11.563 -13.863 1.00 0.00 H new ATOM 0 HG21 VAL A 14 -2.398 12.539 -15.842 1.00 0.00 H new ATOM 0 HG22 VAL A 14 -3.784 11.533 -16.328 1.00 0.00 H new ATOM 0 HG23 VAL A 14 -3.485 13.087 -17.141 1.00 0.00 H new ATOM 246 N ALA A 15 -5.859 15.531 -16.554 1.00 0.00 N ATOM 247 CA ALA A 15 -5.971 16.512 -17.615 1.00 0.00 C ATOM 248 C ALA A 15 -4.686 17.316 -17.725 1.00 0.00 C ATOM 249 O ALA A 15 -4.403 18.175 -16.885 1.00 0.00 O ATOM 250 CB ALA A 15 -7.164 17.429 -17.384 1.00 0.00 C ATOM 0 H ALA A 15 -5.743 15.924 -15.620 1.00 0.00 H new ATOM 0 HA ALA A 15 -6.132 15.985 -18.555 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -7.226 18.156 -18.194 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -8.079 16.837 -17.357 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -7.043 17.952 -16.435 1.00 0.00 H new ATOM 256 N GLY A 16 -3.915 17.038 -18.776 1.00 0.00 N ATOM 257 CA GLY A 16 -2.663 17.739 -18.994 1.00 0.00 C ATOM 258 C GLY A 16 -1.677 17.530 -17.865 1.00 0.00 C ATOM 259 O GLY A 16 -1.436 16.399 -17.444 1.00 0.00 O ATOM 0 H GLY A 16 -4.138 16.336 -19.482 1.00 0.00 H new ATOM 0 HA2 GLY A 16 -2.218 17.398 -19.929 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -2.862 18.805 -19.106 1.00 0.00 H new ATOM 263 N ASN A 17 -1.107 18.622 -17.373 1.00 0.00 N ATOM 264 CA ASN A 17 -0.139 18.549 -16.286 1.00 0.00 C ATOM 265 C ASN A 17 -0.439 19.612 -15.239 1.00 0.00 C ATOM 266 O ASN A 17 0.448 20.357 -14.819 1.00 0.00 O ATOM 267 CB ASN A 17 1.282 18.721 -16.831 1.00 0.00 C ATOM 268 CG ASN A 17 2.321 18.002 -15.994 1.00 0.00 C ATOM 269 OD1 ASN A 17 2.100 16.879 -15.545 1.00 0.00 O ATOM 270 ND2 ASN A 17 3.462 18.643 -15.782 1.00 0.00 N ATOM 0 H ASN A 17 -1.297 19.566 -17.708 1.00 0.00 H new ATOM 0 HA ASN A 17 -0.215 17.569 -15.815 1.00 0.00 H new ATOM 0 HB2 ASN A 17 1.322 18.346 -17.854 1.00 0.00 H new ATOM 0 HB3 ASN A 17 1.525 19.783 -16.871 1.00 0.00 H new ATOM 0 HD21 ASN A 17 4.198 18.205 -15.228 1.00 0.00 H new ATOM 0 HD22 ASN A 17 3.604 19.574 -16.173 1.00 0.00 H new ATOM 277 N THR A 18 -1.701 19.690 -14.836 1.00 0.00 N ATOM 278 CA THR A 18 -2.122 20.650 -13.825 1.00 0.00 C ATOM 279 C THR A 18 -1.651 20.193 -12.454 1.00 0.00 C ATOM 280 O THR A 18 -1.373 19.011 -12.260 1.00 0.00 O ATOM 281 CB THR A 18 -3.656 20.821 -13.811 1.00 0.00 C ATOM 282 OG1 THR A 18 -4.293 19.578 -13.482 1.00 0.00 O ATOM 283 CG2 THR A 18 -4.159 21.315 -15.156 1.00 0.00 C ATOM 0 H THR A 18 -2.451 19.099 -15.195 1.00 0.00 H new ATOM 0 HA THR A 18 -1.674 21.613 -14.071 1.00 0.00 H new ATOM 0 HB THR A 18 -3.905 21.563 -13.053 1.00 0.00 H new ATOM 0 HG1 THR A 18 -5.265 19.700 -13.475 1.00 0.00 H new ATOM 0 HG21 THR A 18 -5.243 21.427 -15.120 1.00 0.00 H new ATOM 0 HG22 THR A 18 -3.702 22.278 -15.384 1.00 0.00 H new ATOM 0 HG23 THR A 18 -3.894 20.595 -15.930 1.00 0.00 H new ATOM 291 N PRO A 19 -1.545 21.117 -11.480 1.00 0.00 N ATOM 292 CA PRO A 19 -1.099 20.773 -10.123 1.00 0.00 C ATOM 293 C PRO A 19 -1.922 19.647 -9.501 1.00 0.00 C ATOM 294 O PRO A 19 -1.376 18.799 -8.802 1.00 0.00 O ATOM 295 CB PRO A 19 -1.272 22.090 -9.357 1.00 0.00 C ATOM 296 CG PRO A 19 -1.131 23.136 -10.406 1.00 0.00 C ATOM 297 CD PRO A 19 -1.797 22.567 -11.625 1.00 0.00 C ATOM 0 HA PRO A 19 -0.078 20.393 -10.105 1.00 0.00 H new ATOM 0 HB2 PRO A 19 -2.245 22.143 -8.868 1.00 0.00 H new ATOM 0 HB3 PRO A 19 -0.518 22.201 -8.578 1.00 0.00 H new ATOM 0 HG2 PRO A 19 -1.605 24.068 -10.098 1.00 0.00 H new ATOM 0 HG3 PRO A 19 -0.082 23.360 -10.599 1.00 0.00 H new ATOM 0 HD2 PRO A 19 -2.863 22.793 -11.648 1.00 0.00 H new ATOM 0 HD3 PRO A 19 -1.367 22.964 -12.545 1.00 0.00 H new ATOM 305 N ASN A 20 -3.229 19.637 -9.763 1.00 0.00 N ATOM 306 CA ASN A 20 -4.098 18.582 -9.227 1.00 0.00 C ATOM 307 C ASN A 20 -3.712 17.234 -9.825 1.00 0.00 C ATOM 308 O ASN A 20 -3.607 16.238 -9.117 1.00 0.00 O ATOM 309 CB ASN A 20 -5.580 18.866 -9.530 1.00 0.00 C ATOM 310 CG ASN A 20 -6.086 20.118 -8.838 1.00 0.00 C ATOM 311 OD1 ASN A 20 -6.454 21.092 -9.489 1.00 0.00 O ATOM 312 ND2 ASN A 20 -6.109 20.097 -7.512 1.00 0.00 N ATOM 0 H ASN A 20 -3.706 20.335 -10.334 1.00 0.00 H new ATOM 0 HA ASN A 20 -3.964 18.561 -8.145 1.00 0.00 H new ATOM 0 HB2 ASN A 20 -5.714 18.971 -10.607 1.00 0.00 H new ATOM 0 HB3 ASN A 20 -6.182 18.013 -9.216 1.00 0.00 H new ATOM 0 HD21 ASN A 20 -6.442 20.911 -6.995 1.00 0.00 H new ATOM 0 HD22 ASN A 20 -5.794 19.267 -7.010 1.00 0.00 H new ATOM 319 N SER A 21 -3.503 17.223 -11.147 1.00 0.00 N ATOM 320 CA SER A 21 -3.103 16.017 -11.861 1.00 0.00 C ATOM 321 C SER A 21 -1.706 15.578 -11.452 1.00 0.00 C ATOM 322 O SER A 21 -1.471 14.392 -11.225 1.00 0.00 O ATOM 323 CB SER A 21 -3.147 16.261 -13.372 1.00 0.00 C ATOM 324 OG SER A 21 -4.470 16.521 -13.813 1.00 0.00 O ATOM 0 H SER A 21 -3.607 18.045 -11.742 1.00 0.00 H new ATOM 0 HA SER A 21 -3.803 15.223 -11.602 1.00 0.00 H new ATOM 0 HB2 SER A 21 -2.504 17.104 -13.625 1.00 0.00 H new ATOM 0 HB3 SER A 21 -2.751 15.390 -13.895 1.00 0.00 H new ATOM 0 HG SER A 21 -4.640 17.486 -13.786 1.00 0.00 H new ATOM 330 N VAL A 22 -0.783 16.528 -11.349 1.00 0.00 N ATOM 331 CA VAL A 22 0.583 16.209 -10.955 1.00 0.00 C ATOM 332 C VAL A 22 0.614 15.661 -9.531 1.00 0.00 C ATOM 333 O VAL A 22 1.247 14.638 -9.259 1.00 0.00 O ATOM 334 CB VAL A 22 1.512 17.440 -11.066 1.00 0.00 C ATOM 335 CG1 VAL A 22 2.866 17.167 -10.431 1.00 0.00 C ATOM 336 CG2 VAL A 22 1.675 17.863 -12.516 1.00 0.00 C ATOM 0 H VAL A 22 -0.954 17.517 -11.531 1.00 0.00 H new ATOM 0 HA VAL A 22 0.951 15.447 -11.642 1.00 0.00 H new ATOM 0 HB VAL A 22 1.045 18.260 -10.520 1.00 0.00 H new ATOM 0 HG11 VAL A 22 3.497 18.051 -10.525 1.00 0.00 H new ATOM 0 HG12 VAL A 22 2.732 16.928 -9.376 1.00 0.00 H new ATOM 0 HG13 VAL A 22 3.342 16.326 -10.936 1.00 0.00 H new ATOM 0 HG21 VAL A 22 2.332 18.731 -12.570 1.00 0.00 H new ATOM 0 HG22 VAL A 22 2.109 17.043 -13.088 1.00 0.00 H new ATOM 0 HG23 VAL A 22 0.701 18.120 -12.932 1.00 0.00 H new ATOM 346 N ARG A 23 -0.094 16.340 -8.638 1.00 0.00 N ATOM 347 CA ARG A 23 -0.169 15.941 -7.239 1.00 0.00 C ATOM 348 C ARG A 23 -0.809 14.570 -7.105 1.00 0.00 C ATOM 349 O ARG A 23 -0.307 13.704 -6.384 1.00 0.00 O ATOM 350 CB ARG A 23 -0.999 16.966 -6.473 1.00 0.00 C ATOM 351 CG ARG A 23 -0.984 16.791 -4.968 1.00 0.00 C ATOM 352 CD ARG A 23 -1.479 18.042 -4.259 1.00 0.00 C ATOM 353 NE ARG A 23 -0.556 19.164 -4.421 1.00 0.00 N ATOM 354 CZ ARG A 23 -0.777 20.380 -3.930 1.00 0.00 C ATOM 355 NH1 ARG A 23 -1.886 20.631 -3.246 1.00 0.00 N ATOM 356 NH2 ARG A 23 0.114 21.344 -4.120 1.00 0.00 N ATOM 0 H ARG A 23 -0.630 17.179 -8.861 1.00 0.00 H new ATOM 0 HA ARG A 23 0.840 15.893 -6.830 1.00 0.00 H new ATOM 0 HB2 ARG A 23 -0.632 17.964 -6.713 1.00 0.00 H new ATOM 0 HB3 ARG A 23 -2.030 16.913 -6.822 1.00 0.00 H new ATOM 0 HG2 ARG A 23 -1.611 15.943 -4.693 1.00 0.00 H new ATOM 0 HG3 ARG A 23 0.029 16.560 -4.637 1.00 0.00 H new ATOM 0 HD2 ARG A 23 -2.458 18.318 -4.651 1.00 0.00 H new ATOM 0 HD3 ARG A 23 -1.609 17.830 -3.198 1.00 0.00 H new ATOM 0 HE ARG A 23 0.307 19.005 -4.941 1.00 0.00 H new ATOM 0 HH11 ARG A 23 -2.571 19.890 -3.096 1.00 0.00 H new ATOM 0 HH12 ARG A 23 -2.053 21.564 -2.870 1.00 0.00 H new ATOM 0 HH21 ARG A 23 0.969 21.153 -4.643 1.00 0.00 H new ATOM 0 HH22 ARG A 23 -0.056 22.277 -3.743 1.00 0.00 H new ATOM 370 N ALA A 24 -1.923 14.384 -7.806 1.00 0.00 N ATOM 371 CA ALA A 24 -2.647 13.124 -7.754 1.00 0.00 C ATOM 372 C ALA A 24 -1.818 11.961 -8.304 1.00 0.00 C ATOM 373 O ALA A 24 -1.785 10.883 -7.709 1.00 0.00 O ATOM 374 CB ALA A 24 -3.967 13.227 -8.501 1.00 0.00 C ATOM 0 H ALA A 24 -2.341 15.088 -8.414 1.00 0.00 H new ATOM 0 HA ALA A 24 -2.850 12.917 -6.703 1.00 0.00 H new ATOM 0 HB1 ALA A 24 -4.490 12.272 -8.448 1.00 0.00 H new ATOM 0 HB2 ALA A 24 -4.582 14.004 -8.047 1.00 0.00 H new ATOM 0 HB3 ALA A 24 -3.776 13.479 -9.544 1.00 0.00 H new ATOM 380 N LEU A 25 -1.153 12.184 -9.440 1.00 0.00 N ATOM 381 CA LEU A 25 -0.322 11.147 -10.055 1.00 0.00 C ATOM 382 C LEU A 25 0.850 10.753 -9.164 1.00 0.00 C ATOM 383 O LEU A 25 1.160 9.568 -9.048 1.00 0.00 O ATOM 384 CB LEU A 25 0.175 11.580 -11.437 1.00 0.00 C ATOM 385 CG LEU A 25 -0.877 11.565 -12.541 1.00 0.00 C ATOM 386 CD1 LEU A 25 -0.349 12.257 -13.787 1.00 0.00 C ATOM 387 CD2 LEU A 25 -1.284 10.134 -12.855 1.00 0.00 C ATOM 0 H LEU A 25 -1.173 13.067 -9.950 1.00 0.00 H new ATOM 0 HA LEU A 25 -0.954 10.267 -10.178 1.00 0.00 H new ATOM 0 HB2 LEU A 25 0.582 12.588 -11.359 1.00 0.00 H new ATOM 0 HB3 LEU A 25 0.996 10.926 -11.731 1.00 0.00 H new ATOM 0 HG LEU A 25 -1.756 12.109 -12.196 1.00 0.00 H new ATOM 0 HD11 LEU A 25 -1.112 12.237 -14.565 1.00 0.00 H new ATOM 0 HD12 LEU A 25 -0.098 13.291 -13.550 1.00 0.00 H new ATOM 0 HD13 LEU A 25 0.543 11.739 -14.140 1.00 0.00 H new ATOM 0 HD21 LEU A 25 -2.036 10.134 -13.645 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -0.411 9.572 -13.185 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -1.698 9.669 -11.960 1.00 0.00 H new ATOM 399 N LYS A 26 1.499 11.731 -8.536 1.00 0.00 N ATOM 400 CA LYS A 26 2.614 11.430 -7.641 1.00 0.00 C ATOM 401 C LYS A 26 2.130 10.609 -6.451 1.00 0.00 C ATOM 402 O LYS A 26 2.800 9.672 -6.014 1.00 0.00 O ATOM 403 CB LYS A 26 3.294 12.712 -7.147 1.00 0.00 C ATOM 404 CG LYS A 26 4.086 13.441 -8.221 1.00 0.00 C ATOM 405 CD LYS A 26 4.757 14.687 -7.666 1.00 0.00 C ATOM 406 CE LYS A 26 5.561 15.411 -8.734 1.00 0.00 C ATOM 407 NZ LYS A 26 6.677 14.574 -9.254 1.00 0.00 N ATOM 0 H LYS A 26 1.277 12.722 -8.627 1.00 0.00 H new ATOM 0 HA LYS A 26 3.346 10.851 -8.204 1.00 0.00 H new ATOM 0 HB2 LYS A 26 2.534 13.385 -6.750 1.00 0.00 H new ATOM 0 HB3 LYS A 26 3.962 12.463 -6.322 1.00 0.00 H new ATOM 0 HG2 LYS A 26 4.841 12.773 -8.635 1.00 0.00 H new ATOM 0 HG3 LYS A 26 3.422 13.718 -9.040 1.00 0.00 H new ATOM 0 HD2 LYS A 26 4.000 15.359 -7.261 1.00 0.00 H new ATOM 0 HD3 LYS A 26 5.413 14.411 -6.840 1.00 0.00 H new ATOM 0 HE2 LYS A 26 4.903 15.690 -9.557 1.00 0.00 H new ATOM 0 HE3 LYS A 26 5.963 16.336 -8.320 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 7.318 15.164 -9.823 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 7.202 14.162 -8.457 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 6.292 13.811 -9.846 1.00 0.00 H new ATOM 421 N THR A 27 0.959 10.972 -5.939 1.00 0.00 N ATOM 422 CA THR A 27 0.350 10.288 -4.804 1.00 0.00 C ATOM 423 C THR A 27 -0.046 8.853 -5.161 1.00 0.00 C ATOM 424 O THR A 27 0.226 7.922 -4.408 1.00 0.00 O ATOM 425 CB THR A 27 -0.892 11.073 -4.335 1.00 0.00 C ATOM 426 OG1 THR A 27 -0.511 12.405 -3.972 1.00 0.00 O ATOM 427 CG2 THR A 27 -1.556 10.409 -3.146 1.00 0.00 C ATOM 0 H THR A 27 0.405 11.749 -6.299 1.00 0.00 H new ATOM 0 HA THR A 27 1.085 10.242 -4.000 1.00 0.00 H new ATOM 0 HB THR A 27 -1.604 11.092 -5.160 1.00 0.00 H new ATOM 0 HG1 THR A 27 -0.427 12.953 -4.780 1.00 0.00 H new ATOM 0 HG21 THR A 27 -2.427 10.991 -2.844 1.00 0.00 H new ATOM 0 HG22 THR A 27 -1.870 9.402 -3.420 1.00 0.00 H new ATOM 0 HG23 THR A 27 -0.850 10.356 -2.317 1.00 0.00 H new ATOM 435 N LEU A 28 -0.668 8.678 -6.323 1.00 0.00 N ATOM 436 CA LEU A 28 -1.119 7.358 -6.761 1.00 0.00 C ATOM 437 C LEU A 28 0.034 6.449 -7.181 1.00 0.00 C ATOM 438 O LEU A 28 0.134 5.311 -6.718 1.00 0.00 O ATOM 439 CB LEU A 28 -2.093 7.495 -7.935 1.00 0.00 C ATOM 440 CG LEU A 28 -3.560 7.168 -7.630 1.00 0.00 C ATOM 441 CD1 LEU A 28 -3.690 5.787 -7.005 1.00 0.00 C ATOM 442 CD2 LEU A 28 -4.171 8.229 -6.727 1.00 0.00 C ATOM 0 H LEU A 28 -0.872 9.432 -6.979 1.00 0.00 H new ATOM 0 HA LEU A 28 -1.613 6.900 -5.904 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -2.039 8.517 -8.309 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -1.755 6.843 -8.740 1.00 0.00 H new ATOM 0 HG LEU A 28 -4.109 7.165 -8.572 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -4.740 5.579 -6.798 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -3.300 5.038 -7.694 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -3.123 5.754 -6.075 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -5.212 7.978 -6.523 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -3.617 8.271 -5.789 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -4.122 9.199 -7.221 1.00 0.00 H new ATOM 454 N ALA A 29 0.906 6.954 -8.057 1.00 0.00 N ATOM 455 CA ALA A 29 2.022 6.164 -8.573 1.00 0.00 C ATOM 456 C ALA A 29 2.990 5.715 -7.488 1.00 0.00 C ATOM 457 O ALA A 29 3.374 4.554 -7.456 1.00 0.00 O ATOM 458 CB ALA A 29 2.772 6.949 -9.640 1.00 0.00 C ATOM 0 H ALA A 29 0.859 7.905 -8.422 1.00 0.00 H new ATOM 0 HA ALA A 29 1.589 5.262 -9.006 1.00 0.00 H new ATOM 0 HB1 ALA A 29 3.601 6.350 -10.017 1.00 0.00 H new ATOM 0 HB2 ALA A 29 2.094 7.187 -10.460 1.00 0.00 H new ATOM 0 HB3 ALA A 29 3.158 7.872 -9.208 1.00 0.00 H new ATOM 464 N ASN A 30 3.361 6.618 -6.588 1.00 0.00 N ATOM 465 CA ASN A 30 4.310 6.272 -5.525 1.00 0.00 C ATOM 466 C ASN A 30 3.729 5.215 -4.588 1.00 0.00 C ATOM 467 O ASN A 30 4.420 4.268 -4.212 1.00 0.00 O ATOM 468 CB ASN A 30 4.738 7.516 -4.741 1.00 0.00 C ATOM 469 CG ASN A 30 5.729 7.201 -3.637 1.00 0.00 C ATOM 470 OD1 ASN A 30 5.360 7.092 -2.469 1.00 0.00 O ATOM 471 ND2 ASN A 30 6.997 7.053 -4.001 1.00 0.00 N ATOM 0 H ASN A 30 3.028 7.582 -6.568 1.00 0.00 H new ATOM 0 HA ASN A 30 5.196 5.850 -5.999 1.00 0.00 H new ATOM 0 HB2 ASN A 30 5.182 8.238 -5.427 1.00 0.00 H new ATOM 0 HB3 ASN A 30 3.856 7.989 -4.308 1.00 0.00 H new ATOM 0 HD21 ASN A 30 7.707 6.841 -3.300 1.00 0.00 H new ATOM 0 HD22 ASN A 30 7.261 7.152 -4.981 1.00 0.00 H new ATOM 478 N ILE A 31 2.465 5.378 -4.219 1.00 0.00 N ATOM 479 CA ILE A 31 1.812 4.419 -3.344 1.00 0.00 C ATOM 480 C ILE A 31 1.727 3.041 -4.004 1.00 0.00 C ATOM 481 O ILE A 31 2.018 2.028 -3.381 1.00 0.00 O ATOM 482 CB ILE A 31 0.434 4.925 -2.880 1.00 0.00 C ATOM 483 CG1 ILE A 31 0.644 6.062 -1.884 1.00 0.00 C ATOM 484 CG2 ILE A 31 -0.406 3.812 -2.273 1.00 0.00 C ATOM 485 CD1 ILE A 31 -0.619 6.792 -1.521 1.00 0.00 C ATOM 0 H ILE A 31 1.877 6.159 -4.510 1.00 0.00 H new ATOM 0 HA ILE A 31 2.425 4.311 -2.449 1.00 0.00 H new ATOM 0 HB ILE A 31 -0.120 5.289 -3.745 1.00 0.00 H new ATOM 0 HG12 ILE A 31 1.093 5.659 -0.976 1.00 0.00 H new ATOM 0 HG13 ILE A 31 1.356 6.773 -2.303 1.00 0.00 H new ATOM 0 HG21 ILE A 31 -1.370 4.213 -1.959 1.00 0.00 H new ATOM 0 HG22 ILE A 31 -0.563 3.029 -3.015 1.00 0.00 H new ATOM 0 HG23 ILE A 31 0.112 3.395 -1.409 1.00 0.00 H new ATOM 0 HD11 ILE A 31 -0.389 7.585 -0.810 1.00 0.00 H new ATOM 0 HD12 ILE A 31 -1.059 7.226 -2.419 1.00 0.00 H new ATOM 0 HD13 ILE A 31 -1.326 6.095 -1.071 1.00 0.00 H new ATOM 497 N LEU A 32 1.336 3.008 -5.268 1.00 0.00 N ATOM 498 CA LEU A 32 1.242 1.749 -6.003 1.00 0.00 C ATOM 499 C LEU A 32 2.620 1.130 -6.274 1.00 0.00 C ATOM 500 O LEU A 32 2.763 -0.087 -6.268 1.00 0.00 O ATOM 501 CB LEU A 32 0.459 1.945 -7.301 1.00 0.00 C ATOM 502 CG LEU A 32 -1.043 2.164 -7.101 1.00 0.00 C ATOM 503 CD1 LEU A 32 -1.699 2.618 -8.394 1.00 0.00 C ATOM 504 CD2 LEU A 32 -1.695 0.888 -6.600 1.00 0.00 C ATOM 0 H LEU A 32 1.079 3.834 -5.808 1.00 0.00 H new ATOM 0 HA LEU A 32 0.700 1.043 -5.374 1.00 0.00 H new ATOM 0 HB2 LEU A 32 0.872 2.801 -7.835 1.00 0.00 H new ATOM 0 HB3 LEU A 32 0.606 1.072 -7.936 1.00 0.00 H new ATOM 0 HG LEU A 32 -1.180 2.947 -6.356 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -2.766 2.767 -8.228 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -1.248 3.555 -8.721 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -1.554 1.858 -9.162 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -2.763 1.055 -6.461 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -1.544 0.092 -7.329 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -1.247 0.599 -5.649 1.00 0.00 H new ATOM 516 N GLU A 33 3.624 1.965 -6.536 1.00 0.00 N ATOM 517 CA GLU A 33 4.983 1.485 -6.814 1.00 0.00 C ATOM 518 C GLU A 33 5.677 0.916 -5.575 1.00 0.00 C ATOM 519 O GLU A 33 6.575 0.088 -5.698 1.00 0.00 O ATOM 520 CB GLU A 33 5.852 2.599 -7.404 1.00 0.00 C ATOM 521 CG GLU A 33 5.449 3.012 -8.809 1.00 0.00 C ATOM 522 CD GLU A 33 6.292 4.150 -9.350 1.00 0.00 C ATOM 523 OE1 GLU A 33 7.079 4.733 -8.574 1.00 0.00 O ATOM 524 OE2 GLU A 33 6.163 4.462 -10.554 1.00 0.00 O ATOM 0 H GLU A 33 3.525 2.980 -6.562 1.00 0.00 H new ATOM 0 HA GLU A 33 4.870 0.679 -7.539 1.00 0.00 H new ATOM 0 HB2 GLU A 33 5.802 3.470 -6.751 1.00 0.00 H new ATOM 0 HB3 GLU A 33 6.891 2.269 -7.416 1.00 0.00 H new ATOM 0 HG2 GLU A 33 5.536 2.153 -9.474 1.00 0.00 H new ATOM 0 HG3 GLU A 33 4.401 3.310 -8.809 1.00 0.00 H new ATOM 531 N LYS A 34 5.302 1.384 -4.390 1.00 0.00 N ATOM 532 CA LYS A 34 5.940 0.903 -3.166 1.00 0.00 C ATOM 533 C LYS A 34 4.982 0.124 -2.265 1.00 0.00 C ATOM 534 O LYS A 34 5.218 -1.044 -1.958 1.00 0.00 O ATOM 535 CB LYS A 34 6.541 2.075 -2.395 1.00 0.00 C ATOM 536 CG LYS A 34 7.640 1.660 -1.433 1.00 0.00 C ATOM 537 CD LYS A 34 8.630 2.784 -1.207 1.00 0.00 C ATOM 538 CE LYS A 34 8.010 3.936 -0.429 1.00 0.00 C ATOM 539 NZ LYS A 34 8.995 5.019 -0.157 1.00 0.00 N ATOM 0 H LYS A 34 4.573 2.083 -4.249 1.00 0.00 H new ATOM 0 HA LYS A 34 6.727 0.212 -3.468 1.00 0.00 H new ATOM 0 HB2 LYS A 34 6.942 2.800 -3.104 1.00 0.00 H new ATOM 0 HB3 LYS A 34 5.751 2.578 -1.838 1.00 0.00 H new ATOM 0 HG2 LYS A 34 7.200 1.364 -0.481 1.00 0.00 H new ATOM 0 HG3 LYS A 34 8.161 0.788 -1.828 1.00 0.00 H new ATOM 0 HD2 LYS A 34 9.495 2.403 -0.664 1.00 0.00 H new ATOM 0 HD3 LYS A 34 8.992 3.148 -2.168 1.00 0.00 H new ATOM 0 HE2 LYS A 34 7.170 4.343 -0.992 1.00 0.00 H new ATOM 0 HE3 LYS A 34 7.611 3.563 0.514 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 8.532 5.784 0.375 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 9.785 4.638 0.402 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 9.357 5.393 -1.057 1.00 0.00 H new ATOM 553 N GLU A 35 3.903 0.779 -1.851 1.00 0.00 N ATOM 554 CA GLU A 35 2.916 0.174 -0.954 1.00 0.00 C ATOM 555 C GLU A 35 2.194 -1.026 -1.576 1.00 0.00 C ATOM 556 O GLU A 35 1.964 -2.028 -0.900 1.00 0.00 O ATOM 557 CB GLU A 35 1.891 1.233 -0.526 1.00 0.00 C ATOM 558 CG GLU A 35 2.462 2.288 0.416 1.00 0.00 C ATOM 559 CD GLU A 35 2.995 1.700 1.707 1.00 0.00 C ATOM 560 OE1 GLU A 35 2.266 0.915 2.348 1.00 0.00 O ATOM 561 OE2 GLU A 35 4.143 2.025 2.075 1.00 0.00 O ATOM 0 H GLU A 35 3.686 1.738 -2.123 1.00 0.00 H new ATOM 0 HA GLU A 35 3.461 -0.201 -0.088 1.00 0.00 H new ATOM 0 HB2 GLU A 35 1.497 1.726 -1.415 1.00 0.00 H new ATOM 0 HB3 GLU A 35 1.051 0.738 -0.038 1.00 0.00 H new ATOM 0 HG2 GLU A 35 3.264 2.825 -0.091 1.00 0.00 H new ATOM 0 HG3 GLU A 35 1.687 3.018 0.648 1.00 0.00 H new ATOM 568 N PHE A 36 1.835 -0.931 -2.853 1.00 0.00 N ATOM 569 CA PHE A 36 1.119 -2.025 -3.516 1.00 0.00 C ATOM 570 C PHE A 36 1.871 -2.571 -4.728 1.00 0.00 C ATOM 571 O PHE A 36 1.251 -3.067 -5.676 1.00 0.00 O ATOM 572 CB PHE A 36 -0.283 -1.572 -3.927 1.00 0.00 C ATOM 573 CG PHE A 36 -1.141 -1.168 -2.762 1.00 0.00 C ATOM 574 CD1 PHE A 36 -1.253 0.164 -2.398 1.00 0.00 C ATOM 575 CD2 PHE A 36 -1.821 -2.122 -2.022 1.00 0.00 C ATOM 576 CE1 PHE A 36 -2.029 0.537 -1.319 1.00 0.00 C ATOM 577 CE2 PHE A 36 -2.600 -1.753 -0.942 1.00 0.00 C ATOM 578 CZ PHE A 36 -2.703 -0.421 -0.591 1.00 0.00 C ATOM 0 H PHE A 36 2.023 -0.122 -3.445 1.00 0.00 H new ATOM 0 HA PHE A 36 1.043 -2.837 -2.793 1.00 0.00 H new ATOM 0 HB2 PHE A 36 -0.199 -0.732 -4.616 1.00 0.00 H new ATOM 0 HB3 PHE A 36 -0.774 -2.380 -4.469 1.00 0.00 H new ATOM 0 HD1 PHE A 36 -0.728 0.919 -2.964 1.00 0.00 H new ATOM 0 HD2 PHE A 36 -1.741 -3.165 -2.292 1.00 0.00 H new ATOM 0 HE1 PHE A 36 -2.108 1.579 -1.045 1.00 0.00 H new ATOM 0 HE2 PHE A 36 -3.127 -2.505 -0.373 1.00 0.00 H new ATOM 0 HZ PHE A 36 -3.311 -0.130 0.253 1.00 0.00 H new ATOM 588 N LYS A 37 3.198 -2.474 -4.700 1.00 0.00 N ATOM 589 CA LYS A 37 4.027 -2.961 -5.803 1.00 0.00 C ATOM 590 C LYS A 37 3.805 -4.451 -6.056 1.00 0.00 C ATOM 591 O LYS A 37 3.891 -5.271 -5.141 1.00 0.00 O ATOM 592 CB LYS A 37 5.507 -2.715 -5.503 1.00 0.00 C ATOM 593 CG LYS A 37 6.438 -3.130 -6.635 1.00 0.00 C ATOM 594 CD LYS A 37 7.891 -2.840 -6.298 1.00 0.00 C ATOM 595 CE LYS A 37 8.815 -3.249 -7.434 1.00 0.00 C ATOM 596 NZ LYS A 37 10.241 -2.965 -7.121 1.00 0.00 N ATOM 0 H LYS A 37 3.723 -2.064 -3.928 1.00 0.00 H new ATOM 0 HA LYS A 37 3.736 -2.411 -6.698 1.00 0.00 H new ATOM 0 HB2 LYS A 37 5.655 -1.656 -5.293 1.00 0.00 H new ATOM 0 HB3 LYS A 37 5.781 -3.261 -4.600 1.00 0.00 H new ATOM 0 HG2 LYS A 37 6.316 -4.194 -6.836 1.00 0.00 H new ATOM 0 HG3 LYS A 37 6.162 -2.600 -7.547 1.00 0.00 H new ATOM 0 HD2 LYS A 37 8.013 -1.777 -6.092 1.00 0.00 H new ATOM 0 HD3 LYS A 37 8.169 -3.375 -5.390 1.00 0.00 H new ATOM 0 HE2 LYS A 37 8.693 -4.313 -7.636 1.00 0.00 H new ATOM 0 HE3 LYS A 37 8.530 -2.718 -8.342 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 10.837 -3.259 -7.921 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 10.363 -1.946 -6.954 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 10.521 -3.492 -6.269 1.00 0.00 H new ATOM 610 N GLY A 38 3.515 -4.790 -7.309 1.00 0.00 N ATOM 611 CA GLY A 38 3.303 -6.177 -7.678 1.00 0.00 C ATOM 612 C GLY A 38 1.858 -6.621 -7.557 1.00 0.00 C ATOM 613 O GLY A 38 1.513 -7.720 -7.987 1.00 0.00 O ATOM 0 H GLY A 38 3.423 -4.125 -8.077 1.00 0.00 H new ATOM 0 HA2 GLY A 38 3.636 -6.326 -8.705 1.00 0.00 H new ATOM 0 HA3 GLY A 38 3.924 -6.812 -7.046 1.00 0.00 H new ATOM 617 N VAL A 39 1.004 -5.780 -6.978 1.00 0.00 N ATOM 618 CA VAL A 39 -0.399 -6.143 -6.821 1.00 0.00 C ATOM 619 C VAL A 39 -1.297 -5.340 -7.762 1.00 0.00 C ATOM 620 O VAL A 39 -2.184 -5.903 -8.409 1.00 0.00 O ATOM 621 CB VAL A 39 -0.885 -5.972 -5.362 1.00 0.00 C ATOM 622 CG1 VAL A 39 -2.333 -6.424 -5.213 1.00 0.00 C ATOM 623 CG2 VAL A 39 0.017 -6.735 -4.403 1.00 0.00 C ATOM 0 H VAL A 39 1.254 -4.860 -6.616 1.00 0.00 H new ATOM 0 HA VAL A 39 -0.472 -7.199 -7.083 1.00 0.00 H new ATOM 0 HB VAL A 39 -0.835 -4.912 -5.111 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -2.650 -6.294 -4.178 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -2.970 -5.827 -5.866 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -2.416 -7.475 -5.488 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -0.342 -6.602 -3.382 1.00 0.00 H new ATOM 0 HG22 VAL A 39 0.004 -7.795 -4.657 1.00 0.00 H new ATOM 0 HG23 VAL A 39 1.036 -6.355 -4.482 1.00 0.00 H new ATOM 633 N TYR A 40 -1.073 -4.031 -7.856 1.00 0.00 N ATOM 634 CA TYR A 40 -1.906 -3.212 -8.729 1.00 0.00 C ATOM 635 C TYR A 40 -1.112 -2.614 -9.882 1.00 0.00 C ATOM 636 O TYR A 40 0.049 -2.233 -9.728 1.00 0.00 O ATOM 637 CB TYR A 40 -2.578 -2.080 -7.953 1.00 0.00 C ATOM 638 CG TYR A 40 -4.001 -2.338 -7.528 1.00 0.00 C ATOM 639 CD1 TYR A 40 -4.295 -2.820 -6.261 1.00 0.00 C ATOM 640 CD2 TYR A 40 -5.053 -2.068 -8.391 1.00 0.00 C ATOM 641 CE1 TYR A 40 -5.600 -3.030 -5.866 1.00 0.00 C ATOM 642 CE2 TYR A 40 -6.361 -2.278 -8.004 1.00 0.00 C ATOM 643 CZ TYR A 40 -6.629 -2.757 -6.744 1.00 0.00 C ATOM 644 OH TYR A 40 -7.930 -2.967 -6.359 1.00 0.00 O ATOM 0 H TYR A 40 -0.343 -3.527 -7.353 1.00 0.00 H new ATOM 0 HA TYR A 40 -2.667 -3.878 -9.136 1.00 0.00 H new ATOM 0 HB2 TYR A 40 -1.984 -1.871 -7.063 1.00 0.00 H new ATOM 0 HB3 TYR A 40 -2.559 -1.180 -8.568 1.00 0.00 H new ATOM 0 HD1 TYR A 40 -3.490 -3.034 -5.573 1.00 0.00 H new ATOM 0 HD2 TYR A 40 -4.845 -1.688 -9.380 1.00 0.00 H new ATOM 0 HE1 TYR A 40 -5.815 -3.405 -4.876 1.00 0.00 H new ATOM 0 HE2 TYR A 40 -7.170 -2.067 -8.688 1.00 0.00 H new ATOM 0 HH TYR A 40 -7.971 -3.734 -5.750 1.00 0.00 H new ATOM 654 N ALA A 41 -1.758 -2.538 -11.038 1.00 0.00 N ATOM 655 CA ALA A 41 -1.158 -1.940 -12.219 1.00 0.00 C ATOM 656 C ALA A 41 -1.780 -0.566 -12.442 1.00 0.00 C ATOM 657 O ALA A 41 -3.005 -0.449 -12.526 1.00 0.00 O ATOM 658 CB ALA A 41 -1.366 -2.831 -13.435 1.00 0.00 C ATOM 0 H ALA A 41 -2.706 -2.887 -11.181 1.00 0.00 H new ATOM 0 HA ALA A 41 -0.084 -1.833 -12.070 1.00 0.00 H new ATOM 0 HB1 ALA A 41 -0.910 -2.366 -14.309 1.00 0.00 H new ATOM 0 HB2 ALA A 41 -0.904 -3.802 -13.258 1.00 0.00 H new ATOM 0 HB3 ALA A 41 -2.434 -2.964 -13.610 1.00 0.00 H new ATOM 664 N LEU A 42 -0.954 0.468 -12.529 1.00 0.00 N ATOM 665 CA LEU A 42 -1.465 1.824 -12.710 1.00 0.00 C ATOM 666 C LEU A 42 -1.448 2.250 -14.171 1.00 0.00 C ATOM 667 O LEU A 42 -0.422 2.176 -14.846 1.00 0.00 O ATOM 668 CB LEU A 42 -0.658 2.826 -11.878 1.00 0.00 C ATOM 669 CG LEU A 42 -1.095 4.289 -12.020 1.00 0.00 C ATOM 670 CD1 LEU A 42 -2.523 4.481 -11.530 1.00 0.00 C ATOM 671 CD2 LEU A 42 -0.146 5.206 -11.267 1.00 0.00 C ATOM 0 H LEU A 42 0.062 0.398 -12.478 1.00 0.00 H new ATOM 0 HA LEU A 42 -2.500 1.818 -12.368 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -0.728 2.542 -10.828 1.00 0.00 H new ATOM 0 HB3 LEU A 42 0.392 2.747 -12.161 1.00 0.00 H new ATOM 0 HG LEU A 42 -1.062 4.550 -13.078 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -2.808 5.527 -11.642 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -3.196 3.857 -12.117 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -2.589 4.197 -10.480 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -0.473 6.240 -11.380 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -0.144 4.939 -10.210 1.00 0.00 H new ATOM 0 HD23 LEU A 42 0.861 5.098 -11.670 1.00 0.00 H new ATOM 683 N LYS A 43 -2.603 2.696 -14.646 1.00 0.00 N ATOM 684 CA LYS A 43 -2.746 3.167 -16.013 1.00 0.00 C ATOM 685 C LYS A 43 -3.279 4.598 -16.018 1.00 0.00 C ATOM 686 O LYS A 43 -4.374 4.864 -15.537 1.00 0.00 O ATOM 687 CB LYS A 43 -3.685 2.257 -16.804 1.00 0.00 C ATOM 688 CG LYS A 43 -2.983 1.368 -17.813 1.00 0.00 C ATOM 689 CD LYS A 43 -2.586 0.031 -17.208 1.00 0.00 C ATOM 690 CE LYS A 43 -2.350 -1.010 -18.289 1.00 0.00 C ATOM 691 NZ LYS A 43 -1.118 -0.727 -19.076 1.00 0.00 N ATOM 0 H LYS A 43 -3.461 2.741 -14.097 1.00 0.00 H new ATOM 0 HA LYS A 43 -1.766 3.147 -16.489 1.00 0.00 H new ATOM 0 HB2 LYS A 43 -4.238 1.629 -16.106 1.00 0.00 H new ATOM 0 HB3 LYS A 43 -4.416 2.874 -17.326 1.00 0.00 H new ATOM 0 HG2 LYS A 43 -3.639 1.200 -18.667 1.00 0.00 H new ATOM 0 HG3 LYS A 43 -2.094 1.875 -18.188 1.00 0.00 H new ATOM 0 HD2 LYS A 43 -1.682 0.152 -16.612 1.00 0.00 H new ATOM 0 HD3 LYS A 43 -3.369 -0.313 -16.532 1.00 0.00 H new ATOM 0 HE2 LYS A 43 -2.269 -1.996 -17.831 1.00 0.00 H new ATOM 0 HE3 LYS A 43 -3.210 -1.039 -18.959 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 -0.994 -1.461 -19.803 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 -1.205 0.203 -19.534 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 -0.294 -0.725 -18.442 1.00 0.00 H new ATOM 705 N VAL A 44 -2.491 5.516 -16.556 1.00 0.00 N ATOM 706 CA VAL A 44 -2.880 6.922 -16.632 1.00 0.00 C ATOM 707 C VAL A 44 -3.437 7.250 -18.001 1.00 0.00 C ATOM 708 O VAL A 44 -2.837 6.948 -19.033 1.00 0.00 O ATOM 709 CB VAL A 44 -1.697 7.865 -16.296 1.00 0.00 C ATOM 710 CG1 VAL A 44 -0.395 7.348 -16.893 1.00 0.00 C ATOM 711 CG2 VAL A 44 -1.968 9.290 -16.763 1.00 0.00 C ATOM 0 H VAL A 44 -1.572 5.314 -16.950 1.00 0.00 H new ATOM 0 HA VAL A 44 -3.658 7.083 -15.885 1.00 0.00 H new ATOM 0 HB VAL A 44 -1.595 7.880 -15.211 1.00 0.00 H new ATOM 0 HG11 VAL A 44 0.417 8.030 -16.641 1.00 0.00 H new ATOM 0 HG12 VAL A 44 -0.177 6.359 -16.489 1.00 0.00 H new ATOM 0 HG13 VAL A 44 -0.492 7.284 -17.977 1.00 0.00 H new ATOM 0 HG21 VAL A 44 -1.118 9.923 -16.511 1.00 0.00 H new ATOM 0 HG22 VAL A 44 -2.118 9.297 -17.843 1.00 0.00 H new ATOM 0 HG23 VAL A 44 -2.863 9.671 -16.270 1.00 0.00 H new ATOM 721 N ILE A 45 -4.608 7.870 -17.988 1.00 0.00 N ATOM 722 CA ILE A 45 -5.290 8.250 -19.198 1.00 0.00 C ATOM 723 C ILE A 45 -5.338 9.771 -19.293 1.00 0.00 C ATOM 724 O ILE A 45 -6.092 10.424 -18.567 1.00 0.00 O ATOM 725 CB ILE A 45 -6.731 7.690 -19.181 1.00 0.00 C ATOM 726 CG1 ILE A 45 -6.728 6.186 -18.870 1.00 0.00 C ATOM 727 CG2 ILE A 45 -7.457 7.967 -20.497 1.00 0.00 C ATOM 728 CD1 ILE A 45 -5.971 5.337 -19.870 1.00 0.00 C ATOM 0 H ILE A 45 -5.105 8.120 -17.133 1.00 0.00 H new ATOM 0 HA ILE A 45 -4.756 7.845 -20.058 1.00 0.00 H new ATOM 0 HB ILE A 45 -7.274 8.206 -18.389 1.00 0.00 H new ATOM 0 HG12 ILE A 45 -6.294 6.034 -17.882 1.00 0.00 H new ATOM 0 HG13 ILE A 45 -7.759 5.836 -18.823 1.00 0.00 H new ATOM 0 HG21 ILE A 45 -8.467 7.559 -20.448 1.00 0.00 H new ATOM 0 HG22 ILE A 45 -7.508 9.043 -20.665 1.00 0.00 H new ATOM 0 HG23 ILE A 45 -6.915 7.497 -21.318 1.00 0.00 H new ATOM 0 HD11 ILE A 45 -6.022 4.290 -19.571 1.00 0.00 H new ATOM 0 HD12 ILE A 45 -6.417 5.454 -20.858 1.00 0.00 H new ATOM 0 HD13 ILE A 45 -4.929 5.655 -19.902 1.00 0.00 H new ATOM 740 N ASP A 46 -4.513 10.335 -20.164 1.00 0.00 N ATOM 741 CA ASP A 46 -4.490 11.783 -20.362 1.00 0.00 C ATOM 742 C ASP A 46 -5.683 12.181 -21.227 1.00 0.00 C ATOM 743 O ASP A 46 -5.660 12.003 -22.448 1.00 0.00 O ATOM 744 CB ASP A 46 -3.180 12.207 -21.036 1.00 0.00 C ATOM 745 CG ASP A 46 -2.991 13.717 -21.075 1.00 0.00 C ATOM 746 OD1 ASP A 46 -3.954 14.458 -20.772 1.00 0.00 O ATOM 747 OD2 ASP A 46 -1.873 14.160 -21.409 1.00 0.00 O ATOM 0 H ASP A 46 -3.852 9.817 -20.744 1.00 0.00 H new ATOM 0 HA ASP A 46 -4.553 12.285 -19.397 1.00 0.00 H new ATOM 0 HB2 ASP A 46 -2.342 11.755 -20.505 1.00 0.00 H new ATOM 0 HB3 ASP A 46 -3.159 11.818 -22.054 1.00 0.00 H new ATOM 752 N VAL A 47 -6.714 12.727 -20.594 1.00 0.00 N ATOM 753 CA VAL A 47 -7.937 13.105 -21.301 1.00 0.00 C ATOM 754 C VAL A 47 -7.741 14.259 -22.294 1.00 0.00 C ATOM 755 O VAL A 47 -8.409 14.300 -23.321 1.00 0.00 O ATOM 756 CB VAL A 47 -9.071 13.447 -20.307 1.00 0.00 C ATOM 757 CG1 VAL A 47 -9.342 12.266 -19.383 1.00 0.00 C ATOM 758 CG2 VAL A 47 -8.745 14.693 -19.498 1.00 0.00 C ATOM 0 H VAL A 47 -6.730 12.919 -19.592 1.00 0.00 H new ATOM 0 HA VAL A 47 -8.219 12.231 -21.888 1.00 0.00 H new ATOM 0 HB VAL A 47 -9.971 13.654 -20.886 1.00 0.00 H new ATOM 0 HG11 VAL A 47 -10.143 12.523 -18.689 1.00 0.00 H new ATOM 0 HG12 VAL A 47 -9.639 11.401 -19.976 1.00 0.00 H new ATOM 0 HG13 VAL A 47 -8.438 12.028 -18.822 1.00 0.00 H new ATOM 0 HG21 VAL A 47 -9.563 14.904 -18.810 1.00 0.00 H new ATOM 0 HG22 VAL A 47 -7.828 14.530 -18.932 1.00 0.00 H new ATOM 0 HG23 VAL A 47 -8.610 15.539 -20.172 1.00 0.00 H new ATOM 768 N LEU A 48 -6.856 15.205 -21.990 1.00 0.00 N ATOM 769 CA LEU A 48 -6.608 16.327 -22.899 1.00 0.00 C ATOM 770 C LEU A 48 -5.848 15.883 -24.145 1.00 0.00 C ATOM 771 O LEU A 48 -6.109 16.365 -25.245 1.00 0.00 O ATOM 772 CB LEU A 48 -5.864 17.469 -22.202 1.00 0.00 C ATOM 773 CG LEU A 48 -6.682 18.238 -21.160 1.00 0.00 C ATOM 774 CD1 LEU A 48 -5.810 19.258 -20.443 1.00 0.00 C ATOM 775 CD2 LEU A 48 -7.871 18.925 -21.816 1.00 0.00 C ATOM 0 H LEU A 48 -6.303 15.221 -21.133 1.00 0.00 H new ATOM 0 HA LEU A 48 -7.584 16.699 -23.209 1.00 0.00 H new ATOM 0 HB2 LEU A 48 -4.978 17.061 -21.716 1.00 0.00 H new ATOM 0 HB3 LEU A 48 -5.517 18.172 -22.960 1.00 0.00 H new ATOM 0 HG LEU A 48 -7.056 17.526 -20.425 1.00 0.00 H new ATOM 0 HD11 LEU A 48 -6.408 19.795 -19.707 1.00 0.00 H new ATOM 0 HD12 LEU A 48 -4.989 18.746 -19.940 1.00 0.00 H new ATOM 0 HD13 LEU A 48 -5.407 19.965 -21.168 1.00 0.00 H new ATOM 0 HD21 LEU A 48 -8.441 19.466 -21.061 1.00 0.00 H new ATOM 0 HD22 LEU A 48 -7.515 19.624 -22.573 1.00 0.00 H new ATOM 0 HD23 LEU A 48 -8.510 18.177 -22.285 1.00 0.00 H new ATOM 787 N LYS A 49 -4.897 14.968 -23.959 1.00 0.00 N ATOM 788 CA LYS A 49 -4.096 14.457 -25.070 1.00 0.00 C ATOM 789 C LYS A 49 -4.943 13.569 -25.973 1.00 0.00 C ATOM 790 O LYS A 49 -4.838 13.625 -27.200 1.00 0.00 O ATOM 791 CB LYS A 49 -2.893 13.677 -24.542 1.00 0.00 C ATOM 792 CG LYS A 49 -1.924 13.234 -25.626 1.00 0.00 C ATOM 793 CD LYS A 49 -0.630 12.706 -25.029 1.00 0.00 C ATOM 794 CE LYS A 49 -0.826 11.349 -24.369 1.00 0.00 C ATOM 795 NZ LYS A 49 -1.163 10.291 -25.361 1.00 0.00 N ATOM 0 H LYS A 49 -4.663 14.566 -23.051 1.00 0.00 H new ATOM 0 HA LYS A 49 -3.736 15.304 -25.654 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -2.359 14.296 -23.821 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -3.249 12.798 -24.005 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -2.388 12.459 -26.237 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -1.706 14.073 -26.287 1.00 0.00 H new ATOM 0 HD2 LYS A 49 0.125 12.624 -25.811 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -0.252 13.417 -24.294 1.00 0.00 H new ATOM 0 HE2 LYS A 49 0.083 11.070 -23.836 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -1.622 11.418 -23.627 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -0.747 9.387 -25.059 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -2.196 10.192 -25.426 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -0.781 10.554 -26.292 1.00 0.00 H new ATOM 809 N ASN A 50 -5.788 12.750 -25.356 1.00 0.00 N ATOM 810 CA ASN A 50 -6.669 11.854 -26.097 1.00 0.00 C ATOM 811 C ASN A 50 -8.107 12.001 -25.620 1.00 0.00 C ATOM 812 O ASN A 50 -8.633 11.126 -24.927 1.00 0.00 O ATOM 813 CB ASN A 50 -6.225 10.399 -25.943 1.00 0.00 C ATOM 814 CG ASN A 50 -4.829 10.145 -26.483 1.00 0.00 C ATOM 815 OD1 ASN A 50 -3.916 9.795 -25.735 1.00 0.00 O ATOM 816 ND2 ASN A 50 -4.656 10.315 -27.787 1.00 0.00 N ATOM 0 H ASN A 50 -5.882 12.688 -24.342 1.00 0.00 H new ATOM 0 HA ASN A 50 -6.611 12.129 -27.150 1.00 0.00 H new ATOM 0 HB2 ASN A 50 -6.256 10.125 -24.888 1.00 0.00 H new ATOM 0 HB3 ASN A 50 -6.933 9.752 -26.462 1.00 0.00 H new ATOM 0 HD21 ASN A 50 -3.740 10.155 -28.205 1.00 0.00 H new ATOM 0 HD22 ASN A 50 -5.439 10.606 -28.372 1.00 0.00 H new ATOM 823 N PRO A 51 -8.762 13.114 -25.990 1.00 0.00 N ATOM 824 CA PRO A 51 -10.148 13.384 -25.602 1.00 0.00 C ATOM 825 C PRO A 51 -11.125 12.340 -26.129 1.00 0.00 C ATOM 826 O PRO A 51 -12.214 12.168 -25.583 1.00 0.00 O ATOM 827 CB PRO A 51 -10.437 14.765 -26.202 1.00 0.00 C ATOM 828 CG PRO A 51 -9.395 14.959 -27.252 1.00 0.00 C ATOM 829 CD PRO A 51 -8.188 14.213 -26.785 1.00 0.00 C ATOM 0 HA PRO A 51 -10.274 13.350 -24.520 1.00 0.00 H new ATOM 0 HB2 PRO A 51 -11.439 14.807 -26.629 1.00 0.00 H new ATOM 0 HB3 PRO A 51 -10.381 15.544 -25.442 1.00 0.00 H new ATOM 0 HG2 PRO A 51 -9.738 14.581 -28.215 1.00 0.00 H new ATOM 0 HG3 PRO A 51 -9.171 16.017 -27.387 1.00 0.00 H new ATOM 0 HD2 PRO A 51 -7.596 13.840 -27.621 1.00 0.00 H new ATOM 0 HD3 PRO A 51 -7.531 14.844 -26.186 1.00 0.00 H new ATOM 837 N GLN A 52 -10.734 11.646 -27.197 1.00 0.00 N ATOM 838 CA GLN A 52 -11.562 10.595 -27.774 1.00 0.00 C ATOM 839 C GLN A 52 -11.733 9.482 -26.760 1.00 0.00 C ATOM 840 O GLN A 52 -12.824 8.948 -26.589 1.00 0.00 O ATOM 841 CB GLN A 52 -10.916 10.035 -29.046 1.00 0.00 C ATOM 842 CG GLN A 52 -10.871 11.025 -30.201 1.00 0.00 C ATOM 843 CD GLN A 52 -9.565 11.796 -30.262 1.00 0.00 C ATOM 844 OE1 GLN A 52 -8.855 11.921 -29.262 1.00 0.00 O ATOM 845 NE2 GLN A 52 -9.239 12.318 -31.437 1.00 0.00 N ATOM 0 H GLN A 52 -9.847 11.795 -27.679 1.00 0.00 H new ATOM 0 HA GLN A 52 -12.534 11.015 -28.035 1.00 0.00 H new ATOM 0 HB2 GLN A 52 -9.900 9.714 -28.815 1.00 0.00 H new ATOM 0 HB3 GLN A 52 -11.466 9.148 -29.361 1.00 0.00 H new ATOM 0 HG2 GLN A 52 -11.016 10.489 -31.139 1.00 0.00 H new ATOM 0 HG3 GLN A 52 -11.699 11.728 -30.104 1.00 0.00 H new ATOM 0 HE21 GLN A 52 -9.855 12.191 -32.240 1.00 0.00 H new ATOM 0 HE22 GLN A 52 -8.372 12.846 -31.538 1.00 0.00 H new ATOM 854 N LEU A 53 -10.646 9.163 -26.064 1.00 0.00 N ATOM 855 CA LEU A 53 -10.673 8.119 -25.055 1.00 0.00 C ATOM 856 C LEU A 53 -11.463 8.592 -23.843 1.00 0.00 C ATOM 857 O LEU A 53 -12.171 7.811 -23.204 1.00 0.00 O ATOM 858 CB LEU A 53 -9.256 7.700 -24.662 1.00 0.00 C ATOM 859 CG LEU A 53 -8.468 7.000 -25.771 1.00 0.00 C ATOM 860 CD1 LEU A 53 -7.028 6.765 -25.340 1.00 0.00 C ATOM 861 CD2 LEU A 53 -9.135 5.687 -26.155 1.00 0.00 C ATOM 0 H LEU A 53 -9.739 9.614 -26.183 1.00 0.00 H new ATOM 0 HA LEU A 53 -11.168 7.242 -25.471 1.00 0.00 H new ATOM 0 HB2 LEU A 53 -8.704 8.585 -24.345 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -9.314 7.035 -23.800 1.00 0.00 H new ATOM 0 HG LEU A 53 -8.460 7.649 -26.647 1.00 0.00 H new ATOM 0 HD11 LEU A 53 -6.485 6.266 -26.143 1.00 0.00 H new ATOM 0 HD12 LEU A 53 -6.553 7.721 -25.120 1.00 0.00 H new ATOM 0 HD13 LEU A 53 -7.013 6.139 -24.448 1.00 0.00 H new ATOM 0 HD21 LEU A 53 -8.560 5.204 -26.945 1.00 0.00 H new ATOM 0 HD22 LEU A 53 -9.177 5.032 -25.285 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -10.146 5.883 -26.511 1.00 0.00 H new ATOM 873 N ALA A 54 -11.328 9.885 -23.529 1.00 0.00 N ATOM 874 CA ALA A 54 -12.039 10.481 -22.407 1.00 0.00 C ATOM 875 C ALA A 54 -13.539 10.430 -22.647 1.00 0.00 C ATOM 876 O ALA A 54 -14.312 10.136 -21.743 1.00 0.00 O ATOM 877 CB ALA A 54 -11.592 11.920 -22.205 1.00 0.00 C ATOM 0 H ALA A 54 -10.731 10.535 -24.041 1.00 0.00 H new ATOM 0 HA ALA A 54 -11.808 9.911 -21.507 1.00 0.00 H new ATOM 0 HB1 ALA A 54 -12.131 12.354 -21.363 1.00 0.00 H new ATOM 0 HB2 ALA A 54 -10.522 11.943 -22.001 1.00 0.00 H new ATOM 0 HB3 ALA A 54 -11.802 12.496 -23.106 1.00 0.00 H new ATOM 883 N GLU A 55 -13.937 10.734 -23.881 1.00 0.00 N ATOM 884 CA GLU A 55 -15.340 10.704 -24.277 1.00 0.00 C ATOM 885 C GLU A 55 -15.862 9.273 -24.254 1.00 0.00 C ATOM 886 O GLU A 55 -17.002 9.027 -23.859 1.00 0.00 O ATOM 887 CB GLU A 55 -15.533 11.313 -25.669 1.00 0.00 C ATOM 888 CG GLU A 55 -16.992 11.384 -26.104 1.00 0.00 C ATOM 889 CD GLU A 55 -17.170 12.025 -27.467 1.00 0.00 C ATOM 890 OE1 GLU A 55 -16.153 12.412 -28.081 1.00 0.00 O ATOM 891 OE2 GLU A 55 -18.327 12.142 -27.919 1.00 0.00 O ATOM 0 H GLU A 55 -13.299 11.006 -24.629 1.00 0.00 H new ATOM 0 HA GLU A 55 -15.906 11.302 -23.563 1.00 0.00 H new ATOM 0 HB2 GLU A 55 -15.110 12.317 -25.679 1.00 0.00 H new ATOM 0 HB3 GLU A 55 -14.974 10.724 -26.396 1.00 0.00 H new ATOM 0 HG2 GLU A 55 -17.409 10.377 -26.124 1.00 0.00 H new ATOM 0 HG3 GLU A 55 -17.559 11.950 -25.365 1.00 0.00 H new ATOM 898 N GLU A 56 -15.018 8.337 -24.680 1.00 0.00 N ATOM 899 CA GLU A 56 -15.390 6.928 -24.705 1.00 0.00 C ATOM 900 C GLU A 56 -15.713 6.436 -23.293 1.00 0.00 C ATOM 901 O GLU A 56 -16.657 5.672 -23.098 1.00 0.00 O ATOM 902 CB GLU A 56 -14.259 6.091 -25.314 1.00 0.00 C ATOM 903 CG GLU A 56 -14.044 6.334 -26.804 1.00 0.00 C ATOM 904 CD GLU A 56 -15.273 6.027 -27.637 1.00 0.00 C ATOM 905 OE1 GLU A 56 -15.848 4.931 -27.465 1.00 0.00 O ATOM 906 OE2 GLU A 56 -15.662 6.882 -28.459 1.00 0.00 O ATOM 0 H GLU A 56 -14.073 8.530 -25.012 1.00 0.00 H new ATOM 0 HA GLU A 56 -16.280 6.815 -25.323 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -13.332 6.309 -24.783 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -14.476 5.035 -25.156 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -13.757 7.374 -26.959 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -13.214 5.719 -27.151 1.00 0.00 H new ATOM 913 N ASP A 57 -14.929 6.879 -22.308 1.00 0.00 N ATOM 914 CA ASP A 57 -15.175 6.492 -20.918 1.00 0.00 C ATOM 915 C ASP A 57 -15.982 7.569 -20.186 1.00 0.00 C ATOM 916 O ASP A 57 -16.148 7.503 -18.967 1.00 0.00 O ATOM 917 CB ASP A 57 -13.868 6.179 -20.175 1.00 0.00 C ATOM 918 CG ASP A 57 -13.227 4.881 -20.625 1.00 0.00 C ATOM 919 OD1 ASP A 57 -13.905 4.082 -21.304 1.00 0.00 O ATOM 920 OD2 ASP A 57 -12.039 4.665 -20.295 1.00 0.00 O ATOM 0 H ASP A 57 -14.129 7.497 -22.444 1.00 0.00 H new ATOM 0 HA ASP A 57 -15.766 5.576 -20.932 1.00 0.00 H new ATOM 0 HB2 ASP A 57 -13.165 6.997 -20.328 1.00 0.00 H new ATOM 0 HB3 ASP A 57 -14.068 6.127 -19.105 1.00 0.00 H new ATOM 925 N LYS A 58 -16.476 8.546 -20.953 1.00 0.00 N ATOM 926 CA LYS A 58 -17.304 9.644 -20.434 1.00 0.00 C ATOM 927 C LYS A 58 -16.679 10.350 -19.230 1.00 0.00 C ATOM 928 O LYS A 58 -17.320 10.518 -18.189 1.00 0.00 O ATOM 929 CB LYS A 58 -18.708 9.138 -20.093 1.00 0.00 C ATOM 930 CG LYS A 58 -19.486 8.664 -21.312 1.00 0.00 C ATOM 931 CD LYS A 58 -20.878 8.184 -20.935 1.00 0.00 C ATOM 932 CE LYS A 58 -21.667 7.742 -22.158 1.00 0.00 C ATOM 933 NZ LYS A 58 -21.030 6.581 -22.842 1.00 0.00 N ATOM 0 H LYS A 58 -16.313 8.599 -21.958 1.00 0.00 H new ATOM 0 HA LYS A 58 -17.370 10.388 -21.228 1.00 0.00 H new ATOM 0 HB2 LYS A 58 -18.628 8.318 -19.379 1.00 0.00 H new ATOM 0 HB3 LYS A 58 -19.265 9.935 -19.602 1.00 0.00 H new ATOM 0 HG2 LYS A 58 -19.564 9.477 -22.034 1.00 0.00 H new ATOM 0 HG3 LYS A 58 -18.942 7.856 -21.800 1.00 0.00 H new ATOM 0 HD2 LYS A 58 -20.800 7.354 -20.232 1.00 0.00 H new ATOM 0 HD3 LYS A 58 -21.414 8.984 -20.425 1.00 0.00 H new ATOM 0 HE2 LYS A 58 -22.681 7.475 -21.859 1.00 0.00 H new ATOM 0 HE3 LYS A 58 -21.749 8.574 -22.857 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 -21.691 6.183 -23.539 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 -20.165 6.895 -23.326 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 -20.789 5.853 -22.139 1.00 0.00 H new ATOM 947 N ILE A 59 -15.432 10.771 -19.381 1.00 0.00 N ATOM 948 CA ILE A 59 -14.728 11.469 -18.314 1.00 0.00 C ATOM 949 C ILE A 59 -14.988 12.972 -18.396 1.00 0.00 C ATOM 950 O ILE A 59 -14.492 13.650 -19.297 1.00 0.00 O ATOM 951 CB ILE A 59 -13.208 11.200 -18.393 1.00 0.00 C ATOM 952 CG1 ILE A 59 -12.931 9.695 -18.352 1.00 0.00 C ATOM 953 CG2 ILE A 59 -12.470 11.913 -17.267 1.00 0.00 C ATOM 954 CD1 ILE A 59 -13.422 9.017 -17.090 1.00 0.00 C ATOM 0 H ILE A 59 -14.886 10.642 -20.233 1.00 0.00 H new ATOM 0 HA ILE A 59 -15.103 11.093 -17.362 1.00 0.00 H new ATOM 0 HB ILE A 59 -12.840 11.595 -19.340 1.00 0.00 H new ATOM 0 HG12 ILE A 59 -13.404 9.224 -19.214 1.00 0.00 H new ATOM 0 HG13 ILE A 59 -11.858 9.530 -18.448 1.00 0.00 H new ATOM 0 HG21 ILE A 59 -11.402 11.708 -17.345 1.00 0.00 H new ATOM 0 HG22 ILE A 59 -12.640 12.987 -17.344 1.00 0.00 H new ATOM 0 HG23 ILE A 59 -12.839 11.555 -16.306 1.00 0.00 H new ATOM 0 HD11 ILE A 59 -13.190 7.953 -17.135 1.00 0.00 H new ATOM 0 HD12 ILE A 59 -12.930 9.460 -16.224 1.00 0.00 H new ATOM 0 HD13 ILE A 59 -14.500 9.150 -17.002 1.00 0.00 H new ATOM 966 N LEU A 60 -15.778 13.486 -17.455 1.00 0.00 N ATOM 967 CA LEU A 60 -16.111 14.909 -17.430 1.00 0.00 C ATOM 968 C LEU A 60 -15.375 15.652 -16.313 1.00 0.00 C ATOM 969 O LEU A 60 -15.447 16.877 -16.227 1.00 0.00 O ATOM 970 CB LEU A 60 -17.622 15.094 -17.265 1.00 0.00 C ATOM 971 CG LEU A 60 -18.482 14.467 -18.367 1.00 0.00 C ATOM 972 CD1 LEU A 60 -19.961 14.645 -18.055 1.00 0.00 C ATOM 973 CD2 LEU A 60 -18.147 15.075 -19.721 1.00 0.00 C ATOM 0 H LEU A 60 -16.198 12.941 -16.702 1.00 0.00 H new ATOM 0 HA LEU A 60 -15.789 15.334 -18.381 1.00 0.00 H new ATOM 0 HB2 LEU A 60 -17.921 14.669 -16.307 1.00 0.00 H new ATOM 0 HB3 LEU A 60 -17.838 16.161 -17.221 1.00 0.00 H new ATOM 0 HG LEU A 60 -18.263 13.400 -18.407 1.00 0.00 H new ATOM 0 HD11 LEU A 60 -20.557 14.194 -18.848 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -20.194 14.161 -17.106 1.00 0.00 H new ATOM 0 HD13 LEU A 60 -20.193 15.708 -17.987 1.00 0.00 H new ATOM 0 HD21 LEU A 60 -18.769 14.616 -20.490 1.00 0.00 H new ATOM 0 HD22 LEU A 60 -18.336 16.148 -19.695 1.00 0.00 H new ATOM 0 HD23 LEU A 60 -17.096 14.897 -19.950 1.00 0.00 H new ATOM 985 N ALA A 61 -14.668 14.913 -15.462 1.00 0.00 N ATOM 986 CA ALA A 61 -13.936 15.524 -14.357 1.00 0.00 C ATOM 987 C ALA A 61 -12.608 14.817 -14.120 1.00 0.00 C ATOM 988 O ALA A 61 -12.532 13.595 -14.189 1.00 0.00 O ATOM 989 CB ALA A 61 -14.778 15.498 -13.087 1.00 0.00 C ATOM 0 H ALA A 61 -14.587 13.898 -15.516 1.00 0.00 H new ATOM 0 HA ALA A 61 -13.726 16.560 -14.624 1.00 0.00 H new ATOM 0 HB1 ALA A 61 -14.220 15.957 -12.271 1.00 0.00 H new ATOM 0 HB2 ALA A 61 -15.702 16.053 -13.252 1.00 0.00 H new ATOM 0 HB3 ALA A 61 -15.015 14.466 -12.829 1.00 0.00 H new ATOM 995 N THR A 62 -11.571 15.597 -13.827 1.00 0.00 N ATOM 996 CA THR A 62 -10.242 15.066 -13.573 1.00 0.00 C ATOM 997 C THR A 62 -9.625 15.728 -12.342 1.00 0.00 C ATOM 998 O THR A 62 -9.905 16.894 -12.054 1.00 0.00 O ATOM 999 CB THR A 62 -9.295 15.314 -14.768 1.00 0.00 C ATOM 1000 OG1 THR A 62 -9.256 16.713 -15.072 1.00 0.00 O ATOM 1001 CG2 THR A 62 -9.722 14.538 -16.005 1.00 0.00 C ATOM 0 H THR A 62 -11.632 16.613 -13.760 1.00 0.00 H new ATOM 0 HA THR A 62 -10.357 13.994 -13.414 1.00 0.00 H new ATOM 0 HB THR A 62 -8.304 14.964 -14.480 1.00 0.00 H new ATOM 0 HG1 THR A 62 -9.708 16.875 -15.926 1.00 0.00 H new ATOM 0 HG21 THR A 62 -9.028 14.742 -16.820 1.00 0.00 H new ATOM 0 HG22 THR A 62 -9.718 13.471 -15.784 1.00 0.00 H new ATOM 0 HG23 THR A 62 -10.726 14.844 -16.298 1.00 0.00 H new ATOM 1009 N PRO A 63 -8.774 14.999 -11.605 1.00 0.00 N ATOM 1010 CA PRO A 63 -8.453 13.605 -11.914 1.00 0.00 C ATOM 1011 C PRO A 63 -9.576 12.640 -11.525 1.00 0.00 C ATOM 1012 O PRO A 63 -10.340 12.889 -10.593 1.00 0.00 O ATOM 1013 CB PRO A 63 -7.196 13.343 -11.091 1.00 0.00 C ATOM 1014 CG PRO A 63 -7.289 14.276 -9.937 1.00 0.00 C ATOM 1015 CD PRO A 63 -8.033 15.492 -10.427 1.00 0.00 C ATOM 0 HA PRO A 63 -8.316 13.445 -12.983 1.00 0.00 H new ATOM 0 HB2 PRO A 63 -7.152 12.306 -10.757 1.00 0.00 H new ATOM 0 HB3 PRO A 63 -6.295 13.528 -11.676 1.00 0.00 H new ATOM 0 HG2 PRO A 63 -7.814 13.810 -9.103 1.00 0.00 H new ATOM 0 HG3 PRO A 63 -6.297 14.548 -9.577 1.00 0.00 H new ATOM 0 HD2 PRO A 63 -8.707 15.883 -9.665 1.00 0.00 H new ATOM 0 HD3 PRO A 63 -7.350 16.299 -10.693 1.00 0.00 H new ATOM 1023 N THR A 64 -9.656 11.538 -12.252 1.00 0.00 N ATOM 1024 CA THR A 64 -10.653 10.505 -11.995 1.00 0.00 C ATOM 1025 C THR A 64 -9.958 9.188 -11.674 1.00 0.00 C ATOM 1026 O THR A 64 -9.129 8.712 -12.448 1.00 0.00 O ATOM 1027 CB THR A 64 -11.581 10.273 -13.204 1.00 0.00 C ATOM 1028 OG1 THR A 64 -11.381 11.296 -14.183 1.00 0.00 O ATOM 1029 CG2 THR A 64 -13.046 10.239 -12.781 1.00 0.00 C ATOM 0 H THR A 64 -9.035 11.332 -13.035 1.00 0.00 H new ATOM 0 HA THR A 64 -11.256 10.849 -11.155 1.00 0.00 H new ATOM 0 HB THR A 64 -11.330 9.305 -13.637 1.00 0.00 H new ATOM 0 HG1 THR A 64 -11.947 12.067 -13.970 1.00 0.00 H new ATOM 0 HG21 THR A 64 -13.674 10.074 -13.657 1.00 0.00 H new ATOM 0 HG22 THR A 64 -13.200 9.430 -12.067 1.00 0.00 H new ATOM 0 HG23 THR A 64 -13.313 11.189 -12.317 1.00 0.00 H new ATOM 1037 N LEU A 65 -10.292 8.601 -10.534 1.00 0.00 N ATOM 1038 CA LEU A 65 -9.695 7.337 -10.128 1.00 0.00 C ATOM 1039 C LEU A 65 -10.703 6.209 -10.326 1.00 0.00 C ATOM 1040 O LEU A 65 -11.763 6.204 -9.706 1.00 0.00 O ATOM 1041 CB LEU A 65 -9.266 7.412 -8.658 1.00 0.00 C ATOM 1042 CG LEU A 65 -8.590 6.154 -8.103 1.00 0.00 C ATOM 1043 CD1 LEU A 65 -7.302 5.862 -8.859 1.00 0.00 C ATOM 1044 CD2 LEU A 65 -8.310 6.312 -6.616 1.00 0.00 C ATOM 0 H LEU A 65 -10.972 8.979 -9.875 1.00 0.00 H new ATOM 0 HA LEU A 65 -8.815 7.139 -10.740 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -8.583 8.253 -8.540 1.00 0.00 H new ATOM 0 HB3 LEU A 65 -10.146 7.628 -8.052 1.00 0.00 H new ATOM 0 HG LEU A 65 -9.268 5.311 -8.239 1.00 0.00 H new ATOM 0 HD11 LEU A 65 -6.836 4.965 -8.451 1.00 0.00 H new ATOM 0 HD12 LEU A 65 -7.527 5.706 -9.914 1.00 0.00 H new ATOM 0 HD13 LEU A 65 -6.619 6.705 -8.754 1.00 0.00 H new ATOM 0 HD21 LEU A 65 -7.830 5.409 -6.238 1.00 0.00 H new ATOM 0 HD22 LEU A 65 -7.652 7.166 -6.458 1.00 0.00 H new ATOM 0 HD23 LEU A 65 -9.248 6.474 -6.084 1.00 0.00 H new ATOM 1056 N ALA A 66 -10.379 5.254 -11.193 1.00 0.00 N ATOM 1057 CA ALA A 66 -11.288 4.143 -11.454 1.00 0.00 C ATOM 1058 C ALA A 66 -10.545 2.830 -11.649 1.00 0.00 C ATOM 1059 O ALA A 66 -9.497 2.774 -12.287 1.00 0.00 O ATOM 1060 CB ALA A 66 -12.145 4.424 -12.678 1.00 0.00 C ATOM 0 H ALA A 66 -9.506 5.226 -11.720 1.00 0.00 H new ATOM 0 HA ALA A 66 -11.926 4.046 -10.575 1.00 0.00 H new ATOM 0 HB1 ALA A 66 -12.815 3.583 -12.854 1.00 0.00 H new ATOM 0 HB2 ALA A 66 -12.732 5.327 -12.511 1.00 0.00 H new ATOM 0 HB3 ALA A 66 -11.503 4.564 -13.547 1.00 0.00 H new ATOM 1066 N LYS A 67 -11.113 1.773 -11.088 1.00 0.00 N ATOM 1067 CA LYS A 67 -10.558 0.442 -11.211 1.00 0.00 C ATOM 1068 C LYS A 67 -11.364 -0.302 -12.260 1.00 0.00 C ATOM 1069 O LYS A 67 -12.499 -0.709 -12.009 1.00 0.00 O ATOM 1070 CB LYS A 67 -10.613 -0.281 -9.858 1.00 0.00 C ATOM 1071 CG LYS A 67 -10.331 -1.777 -9.935 1.00 0.00 C ATOM 1072 CD LYS A 67 -10.178 -2.405 -8.553 1.00 0.00 C ATOM 1073 CE LYS A 67 -11.483 -3.007 -8.039 1.00 0.00 C ATOM 1074 NZ LYS A 67 -12.024 -4.039 -8.966 1.00 0.00 N ATOM 0 H LYS A 67 -11.970 1.818 -10.537 1.00 0.00 H new ATOM 0 HA LYS A 67 -9.512 0.488 -11.514 1.00 0.00 H new ATOM 0 HB2 LYS A 67 -9.891 0.179 -9.184 1.00 0.00 H new ATOM 0 HB3 LYS A 67 -11.599 -0.131 -9.419 1.00 0.00 H new ATOM 0 HG2 LYS A 67 -11.142 -2.271 -10.469 1.00 0.00 H new ATOM 0 HG3 LYS A 67 -9.421 -1.945 -10.511 1.00 0.00 H new ATOM 0 HD2 LYS A 67 -9.414 -3.181 -8.592 1.00 0.00 H new ATOM 0 HD3 LYS A 67 -9.828 -1.649 -7.850 1.00 0.00 H new ATOM 0 HE2 LYS A 67 -11.315 -3.453 -7.058 1.00 0.00 H new ATOM 0 HE3 LYS A 67 -12.221 -2.215 -7.908 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 -12.930 -3.713 -9.358 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 -11.349 -4.198 -9.741 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 -12.171 -4.928 -8.447 1.00 0.00 H new ATOM 1088 N VAL A 68 -10.791 -0.461 -13.439 1.00 0.00 N ATOM 1089 CA VAL A 68 -11.485 -1.126 -14.527 1.00 0.00 C ATOM 1090 C VAL A 68 -11.436 -2.643 -14.396 1.00 0.00 C ATOM 1091 O VAL A 68 -12.345 -3.340 -14.845 1.00 0.00 O ATOM 1092 CB VAL A 68 -10.917 -0.702 -15.896 1.00 0.00 C ATOM 1093 CG1 VAL A 68 -11.162 0.781 -16.136 1.00 0.00 C ATOM 1094 CG2 VAL A 68 -9.432 -1.023 -15.996 1.00 0.00 C ATOM 0 H VAL A 68 -9.850 -0.140 -13.667 1.00 0.00 H new ATOM 0 HA VAL A 68 -12.528 -0.814 -14.465 1.00 0.00 H new ATOM 0 HB VAL A 68 -11.435 -1.270 -16.669 1.00 0.00 H new ATOM 0 HG11 VAL A 68 -10.755 1.065 -17.107 1.00 0.00 H new ATOM 0 HG12 VAL A 68 -12.234 0.980 -16.120 1.00 0.00 H new ATOM 0 HG13 VAL A 68 -10.673 1.362 -15.354 1.00 0.00 H new ATOM 0 HG21 VAL A 68 -9.058 -0.713 -16.972 1.00 0.00 H new ATOM 0 HG22 VAL A 68 -8.891 -0.490 -15.214 1.00 0.00 H new ATOM 0 HG23 VAL A 68 -9.283 -2.096 -15.874 1.00 0.00 H new ATOM 1104 N LEU A 69 -10.380 -3.151 -13.772 1.00 0.00 N ATOM 1105 CA LEU A 69 -10.231 -4.595 -13.602 1.00 0.00 C ATOM 1106 C LEU A 69 -9.770 -4.944 -12.191 1.00 0.00 C ATOM 1107 O LEU A 69 -8.904 -4.266 -11.639 1.00 0.00 O ATOM 1108 CB LEU A 69 -9.226 -5.153 -14.619 1.00 0.00 C ATOM 1109 CG LEU A 69 -9.615 -4.998 -16.093 1.00 0.00 C ATOM 1110 CD1 LEU A 69 -8.458 -5.397 -16.994 1.00 0.00 C ATOM 1111 CD2 LEU A 69 -10.847 -5.833 -16.414 1.00 0.00 C ATOM 0 H LEU A 69 -9.621 -2.594 -13.379 1.00 0.00 H new ATOM 0 HA LEU A 69 -11.209 -5.047 -13.769 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -8.267 -4.660 -14.462 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -9.077 -6.213 -14.411 1.00 0.00 H new ATOM 0 HG LEU A 69 -9.852 -3.950 -16.275 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -8.752 -5.281 -18.037 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -7.598 -4.760 -16.786 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -8.192 -6.437 -16.806 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -11.107 -5.709 -17.465 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -10.637 -6.884 -16.214 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -11.681 -5.505 -15.793 1.00 0.00 H new ATOM 1123 N PRO A 70 -10.326 -6.014 -11.586 1.00 0.00 N ATOM 1124 CA PRO A 70 -11.382 -6.849 -12.189 1.00 0.00 C ATOM 1125 C PRO A 70 -12.730 -6.125 -12.264 1.00 0.00 C ATOM 1126 O PRO A 70 -12.998 -5.229 -11.466 1.00 0.00 O ATOM 1127 CB PRO A 70 -11.484 -8.052 -11.234 1.00 0.00 C ATOM 1128 CG PRO A 70 -10.267 -7.978 -10.375 1.00 0.00 C ATOM 1129 CD PRO A 70 -9.947 -6.519 -10.261 1.00 0.00 C ATOM 0 HA PRO A 70 -11.140 -7.119 -13.217 1.00 0.00 H new ATOM 0 HB2 PRO A 70 -12.392 -8.002 -10.634 1.00 0.00 H new ATOM 0 HB3 PRO A 70 -11.519 -8.991 -11.787 1.00 0.00 H new ATOM 0 HG2 PRO A 70 -10.451 -8.417 -9.395 1.00 0.00 H new ATOM 0 HG3 PRO A 70 -9.438 -8.528 -10.820 1.00 0.00 H new ATOM 0 HD2 PRO A 70 -10.515 -6.039 -9.464 1.00 0.00 H new ATOM 0 HD3 PRO A 70 -8.892 -6.349 -10.047 1.00 0.00 H new ATOM 1137 N PRO A 71 -13.591 -6.496 -13.230 1.00 0.00 N ATOM 1138 CA PRO A 71 -14.920 -5.887 -13.385 1.00 0.00 C ATOM 1139 C PRO A 71 -15.863 -6.280 -12.242 1.00 0.00 C ATOM 1140 O PRO A 71 -15.672 -7.321 -11.609 1.00 0.00 O ATOM 1141 CB PRO A 71 -15.418 -6.460 -14.717 1.00 0.00 C ATOM 1142 CG PRO A 71 -14.695 -7.754 -14.856 1.00 0.00 C ATOM 1143 CD PRO A 71 -13.336 -7.521 -14.260 1.00 0.00 C ATOM 0 HA PRO A 71 -14.883 -4.798 -13.366 1.00 0.00 H new ATOM 0 HB2 PRO A 71 -16.498 -6.607 -14.707 1.00 0.00 H new ATOM 0 HB3 PRO A 71 -15.195 -5.789 -15.547 1.00 0.00 H new ATOM 0 HG2 PRO A 71 -15.220 -8.555 -14.335 1.00 0.00 H new ATOM 0 HG3 PRO A 71 -14.619 -8.051 -15.902 1.00 0.00 H new ATOM 0 HD2 PRO A 71 -12.924 -8.433 -13.827 1.00 0.00 H new ATOM 0 HD3 PRO A 71 -12.623 -7.172 -15.007 1.00 0.00 H new ATOM 1151 N PRO A 72 -16.906 -5.470 -11.956 1.00 0.00 N ATOM 1152 CA PRO A 72 -17.211 -4.220 -12.679 1.00 0.00 C ATOM 1153 C PRO A 72 -16.253 -3.076 -12.347 1.00 0.00 C ATOM 1154 O PRO A 72 -15.494 -3.143 -11.380 1.00 0.00 O ATOM 1155 CB PRO A 72 -18.626 -3.885 -12.205 1.00 0.00 C ATOM 1156 CG PRO A 72 -18.701 -4.463 -10.836 1.00 0.00 C ATOM 1157 CD PRO A 72 -17.888 -5.729 -10.882 1.00 0.00 C ATOM 0 HA PRO A 72 -17.114 -4.348 -13.757 1.00 0.00 H new ATOM 0 HB2 PRO A 72 -18.797 -2.809 -12.192 1.00 0.00 H new ATOM 0 HB3 PRO A 72 -19.379 -4.320 -12.862 1.00 0.00 H new ATOM 0 HG2 PRO A 72 -18.303 -3.769 -10.096 1.00 0.00 H new ATOM 0 HG3 PRO A 72 -19.733 -4.671 -10.555 1.00 0.00 H new ATOM 0 HD2 PRO A 72 -17.398 -5.926 -9.929 1.00 0.00 H new ATOM 0 HD3 PRO A 72 -18.509 -6.597 -11.106 1.00 0.00 H new ATOM 1165 N VAL A 73 -16.302 -2.026 -13.164 1.00 0.00 N ATOM 1166 CA VAL A 73 -15.441 -0.863 -12.981 1.00 0.00 C ATOM 1167 C VAL A 73 -15.846 -0.061 -11.742 1.00 0.00 C ATOM 1168 O VAL A 73 -17.008 0.322 -11.584 1.00 0.00 O ATOM 1169 CB VAL A 73 -15.484 0.057 -14.224 1.00 0.00 C ATOM 1170 CG1 VAL A 73 -14.612 1.290 -14.029 1.00 0.00 C ATOM 1171 CG2 VAL A 73 -15.066 -0.710 -15.471 1.00 0.00 C ATOM 0 H VAL A 73 -16.933 -1.958 -13.963 1.00 0.00 H new ATOM 0 HA VAL A 73 -14.425 -1.233 -12.844 1.00 0.00 H new ATOM 0 HB VAL A 73 -16.511 0.396 -14.356 1.00 0.00 H new ATOM 0 HG11 VAL A 73 -14.663 1.916 -14.920 1.00 0.00 H new ATOM 0 HG12 VAL A 73 -14.968 1.855 -13.167 1.00 0.00 H new ATOM 0 HG13 VAL A 73 -13.580 0.983 -13.861 1.00 0.00 H new ATOM 0 HG21 VAL A 73 -15.102 -0.047 -16.335 1.00 0.00 H new ATOM 0 HG22 VAL A 73 -14.051 -1.085 -15.344 1.00 0.00 H new ATOM 0 HG23 VAL A 73 -15.745 -1.548 -15.628 1.00 0.00 H new ATOM 1181 N ARG A 74 -14.874 0.187 -10.870 1.00 0.00 N ATOM 1182 CA ARG A 74 -15.100 0.942 -9.643 1.00 0.00 C ATOM 1183 C ARG A 74 -14.518 2.342 -9.760 1.00 0.00 C ATOM 1184 O ARG A 74 -13.309 2.512 -9.864 1.00 0.00 O ATOM 1185 CB ARG A 74 -14.468 0.201 -8.457 1.00 0.00 C ATOM 1186 CG ARG A 74 -14.434 0.998 -7.157 1.00 0.00 C ATOM 1187 CD ARG A 74 -15.833 1.345 -6.664 1.00 0.00 C ATOM 1188 NE ARG A 74 -15.801 2.056 -5.389 1.00 0.00 N ATOM 1189 CZ ARG A 74 -16.869 2.613 -4.825 1.00 0.00 C ATOM 1190 NH1 ARG A 74 -18.050 2.543 -5.427 1.00 0.00 N ATOM 1191 NH2 ARG A 74 -16.757 3.241 -3.662 1.00 0.00 N ATOM 0 H ARG A 74 -13.912 -0.128 -10.993 1.00 0.00 H new ATOM 0 HA ARG A 74 -16.174 1.032 -9.478 1.00 0.00 H new ATOM 0 HB2 ARG A 74 -15.020 -0.723 -8.287 1.00 0.00 H new ATOM 0 HB3 ARG A 74 -13.449 -0.080 -8.722 1.00 0.00 H new ATOM 0 HG2 ARG A 74 -13.912 0.422 -6.392 1.00 0.00 H new ATOM 0 HG3 ARG A 74 -13.865 1.915 -7.309 1.00 0.00 H new ATOM 0 HD2 ARG A 74 -16.338 1.959 -7.409 1.00 0.00 H new ATOM 0 HD3 ARG A 74 -16.417 0.431 -6.555 1.00 0.00 H new ATOM 0 HE ARG A 74 -14.908 2.130 -4.903 1.00 0.00 H new ATOM 0 HH11 ARG A 74 -18.138 2.062 -6.322 1.00 0.00 H new ATOM 0 HH12 ARG A 74 -18.869 2.970 -4.994 1.00 0.00 H new ATOM 0 HH21 ARG A 74 -15.850 3.298 -3.198 1.00 0.00 H new ATOM 0 HH22 ARG A 74 -17.578 3.667 -3.232 1.00 0.00 H new ATOM 1205 N ARG A 75 -15.384 3.347 -9.732 1.00 0.00 N ATOM 1206 CA ARG A 75 -14.929 4.722 -9.824 1.00 0.00 C ATOM 1207 C ARG A 75 -14.949 5.390 -8.462 1.00 0.00 C ATOM 1208 O ARG A 75 -15.987 5.467 -7.803 1.00 0.00 O ATOM 1209 CB ARG A 75 -15.777 5.529 -10.802 1.00 0.00 C ATOM 1210 CG ARG A 75 -15.546 5.168 -12.256 1.00 0.00 C ATOM 1211 CD ARG A 75 -16.438 5.981 -13.174 1.00 0.00 C ATOM 1212 NE ARG A 75 -17.845 5.612 -13.047 1.00 0.00 N ATOM 1213 CZ ARG A 75 -18.830 6.231 -13.692 1.00 0.00 C ATOM 1214 NH1 ARG A 75 -18.560 7.241 -14.509 1.00 0.00 N ATOM 1215 NH2 ARG A 75 -20.086 5.837 -13.519 1.00 0.00 N ATOM 0 H ARG A 75 -16.394 3.235 -9.647 1.00 0.00 H new ATOM 0 HA ARG A 75 -13.905 4.697 -10.195 1.00 0.00 H new ATOM 0 HB2 ARG A 75 -16.830 5.380 -10.563 1.00 0.00 H new ATOM 0 HB3 ARG A 75 -15.565 6.589 -10.663 1.00 0.00 H new ATOM 0 HG2 ARG A 75 -14.501 5.341 -12.514 1.00 0.00 H new ATOM 0 HG3 ARG A 75 -15.740 4.106 -12.404 1.00 0.00 H new ATOM 0 HD2 ARG A 75 -16.320 7.041 -12.947 1.00 0.00 H new ATOM 0 HD3 ARG A 75 -16.119 5.839 -14.207 1.00 0.00 H new ATOM 0 HE ARG A 75 -18.086 4.837 -12.430 1.00 0.00 H new ATOM 0 HH11 ARG A 75 -17.595 7.544 -14.644 1.00 0.00 H new ATOM 0 HH12 ARG A 75 -19.317 7.714 -15.003 1.00 0.00 H new ATOM 0 HH21 ARG A 75 -20.295 5.060 -12.892 1.00 0.00 H new ATOM 0 HH22 ARG A 75 -20.842 6.311 -14.013 1.00 0.00 H new ATOM 1229 N ILE A 76 -13.792 5.870 -8.051 1.00 0.00 N ATOM 1230 CA ILE A 76 -13.651 6.553 -6.778 1.00 0.00 C ATOM 1231 C ILE A 76 -13.599 8.062 -7.016 1.00 0.00 C ATOM 1232 O ILE A 76 -12.671 8.567 -7.650 1.00 0.00 O ATOM 1233 CB ILE A 76 -12.380 6.095 -6.041 1.00 0.00 C ATOM 1234 CG1 ILE A 76 -12.411 4.577 -5.859 1.00 0.00 C ATOM 1235 CG2 ILE A 76 -12.252 6.795 -4.693 1.00 0.00 C ATOM 1236 CD1 ILE A 76 -11.161 4.021 -5.232 1.00 0.00 C ATOM 0 H ILE A 76 -12.927 5.799 -8.586 1.00 0.00 H new ATOM 0 HA ILE A 76 -14.510 6.306 -6.154 1.00 0.00 H new ATOM 0 HB ILE A 76 -11.510 6.364 -6.640 1.00 0.00 H new ATOM 0 HG12 ILE A 76 -13.268 4.311 -5.240 1.00 0.00 H new ATOM 0 HG13 ILE A 76 -12.561 4.106 -6.830 1.00 0.00 H new ATOM 0 HG21 ILE A 76 -11.346 6.455 -4.191 1.00 0.00 H new ATOM 0 HG22 ILE A 76 -12.199 7.873 -4.846 1.00 0.00 H new ATOM 0 HG23 ILE A 76 -13.119 6.558 -4.076 1.00 0.00 H new ATOM 0 HD11 ILE A 76 -11.253 2.939 -5.134 1.00 0.00 H new ATOM 0 HD12 ILE A 76 -10.303 4.256 -5.861 1.00 0.00 H new ATOM 0 HD13 ILE A 76 -11.020 4.464 -4.246 1.00 0.00 H new ATOM 1248 N ILE A 77 -14.596 8.781 -6.511 1.00 0.00 N ATOM 1249 CA ILE A 77 -14.656 10.225 -6.693 1.00 0.00 C ATOM 1250 C ILE A 77 -14.439 10.951 -5.371 1.00 0.00 C ATOM 1251 O ILE A 77 -15.161 10.726 -4.398 1.00 0.00 O ATOM 1252 CB ILE A 77 -16.001 10.669 -7.311 1.00 0.00 C ATOM 1253 CG1 ILE A 77 -16.329 9.828 -8.548 1.00 0.00 C ATOM 1254 CG2 ILE A 77 -15.963 12.149 -7.678 1.00 0.00 C ATOM 1255 CD1 ILE A 77 -17.453 8.841 -8.329 1.00 0.00 C ATOM 0 H ILE A 77 -15.370 8.389 -5.975 1.00 0.00 H new ATOM 0 HA ILE A 77 -13.856 10.490 -7.384 1.00 0.00 H new ATOM 0 HB ILE A 77 -16.783 10.515 -6.567 1.00 0.00 H new ATOM 0 HG12 ILE A 77 -16.596 10.493 -9.369 1.00 0.00 H new ATOM 0 HG13 ILE A 77 -15.435 9.285 -8.855 1.00 0.00 H new ATOM 0 HG21 ILE A 77 -16.920 12.441 -8.111 1.00 0.00 H new ATOM 0 HG22 ILE A 77 -15.774 12.741 -6.783 1.00 0.00 H new ATOM 0 HG23 ILE A 77 -15.168 12.324 -8.403 1.00 0.00 H new ATOM 0 HD11 ILE A 77 -17.630 8.281 -9.247 1.00 0.00 H new ATOM 0 HD12 ILE A 77 -17.181 8.151 -7.530 1.00 0.00 H new ATOM 0 HD13 ILE A 77 -18.360 9.378 -8.052 1.00 0.00 H new ATOM 1267 N GLY A 78 -13.433 11.815 -5.343 1.00 0.00 N ATOM 1268 CA GLY A 78 -13.120 12.567 -4.146 1.00 0.00 C ATOM 1269 C GLY A 78 -11.767 13.230 -4.252 1.00 0.00 C ATOM 1270 O GLY A 78 -11.203 13.315 -5.343 1.00 0.00 O ATOM 0 H GLY A 78 -12.823 12.009 -6.137 1.00 0.00 H new ATOM 0 HA2 GLY A 78 -13.886 13.324 -3.979 1.00 0.00 H new ATOM 0 HA3 GLY A 78 -13.135 11.902 -3.282 1.00 0.00 H new ATOM 1274 N ASP A 79 -11.239 13.709 -3.133 1.00 0.00 N ATOM 1275 CA ASP A 79 -9.933 14.354 -3.137 1.00 0.00 C ATOM 1276 C ASP A 79 -8.837 13.307 -2.954 1.00 0.00 C ATOM 1277 O ASP A 79 -8.515 12.924 -1.830 1.00 0.00 O ATOM 1278 CB ASP A 79 -9.846 15.405 -2.026 1.00 0.00 C ATOM 1279 CG ASP A 79 -8.556 16.201 -2.074 1.00 0.00 C ATOM 1280 OD1 ASP A 79 -7.877 16.174 -3.125 1.00 0.00 O ATOM 1281 OD2 ASP A 79 -8.221 16.850 -1.063 1.00 0.00 O ATOM 0 H ASP A 79 -11.690 13.664 -2.219 1.00 0.00 H new ATOM 0 HA ASP A 79 -9.795 14.854 -4.096 1.00 0.00 H new ATOM 0 HB2 ASP A 79 -10.692 16.087 -2.109 1.00 0.00 H new ATOM 0 HB3 ASP A 79 -9.928 14.912 -1.057 1.00 0.00 H new ATOM 1286 N LEU A 80 -8.260 12.858 -4.065 1.00 0.00 N ATOM 1287 CA LEU A 80 -7.207 11.846 -4.021 1.00 0.00 C ATOM 1288 C LEU A 80 -5.819 12.475 -3.906 1.00 0.00 C ATOM 1289 O LEU A 80 -4.809 11.798 -4.085 1.00 0.00 O ATOM 1290 CB LEU A 80 -7.265 10.921 -5.247 1.00 0.00 C ATOM 1291 CG LEU A 80 -7.739 11.562 -6.557 1.00 0.00 C ATOM 1292 CD1 LEU A 80 -6.862 11.110 -7.713 1.00 0.00 C ATOM 1293 CD2 LEU A 80 -9.194 11.208 -6.830 1.00 0.00 C ATOM 0 H LEU A 80 -8.502 13.177 -5.003 1.00 0.00 H new ATOM 0 HA LEU A 80 -7.385 11.249 -3.127 1.00 0.00 H new ATOM 0 HB2 LEU A 80 -6.271 10.505 -5.409 1.00 0.00 H new ATOM 0 HB3 LEU A 80 -7.926 10.086 -5.015 1.00 0.00 H new ATOM 0 HG LEU A 80 -7.659 12.645 -6.459 1.00 0.00 H new ATOM 0 HD11 LEU A 80 -7.210 11.573 -8.636 1.00 0.00 H new ATOM 0 HD12 LEU A 80 -5.830 11.407 -7.525 1.00 0.00 H new ATOM 0 HD13 LEU A 80 -6.916 10.025 -7.808 1.00 0.00 H new ATOM 0 HD21 LEU A 80 -9.512 11.672 -7.764 1.00 0.00 H new ATOM 0 HD22 LEU A 80 -9.296 10.126 -6.909 1.00 0.00 H new ATOM 0 HD23 LEU A 80 -9.817 11.573 -6.013 1.00 0.00 H new ATOM 1305 N SER A 81 -5.768 13.774 -3.636 1.00 0.00 N ATOM 1306 CA SER A 81 -4.492 14.466 -3.479 1.00 0.00 C ATOM 1307 C SER A 81 -3.840 14.068 -2.152 1.00 0.00 C ATOM 1308 O SER A 81 -2.632 14.210 -1.970 1.00 0.00 O ATOM 1309 CB SER A 81 -4.691 15.980 -3.541 1.00 0.00 C ATOM 1310 OG SER A 81 -5.272 16.368 -4.775 1.00 0.00 O ATOM 0 H SER A 81 -6.590 14.368 -3.522 1.00 0.00 H new ATOM 0 HA SER A 81 -3.834 14.174 -4.297 1.00 0.00 H new ATOM 0 HB2 SER A 81 -5.330 16.300 -2.718 1.00 0.00 H new ATOM 0 HB3 SER A 81 -3.732 16.482 -3.413 1.00 0.00 H new ATOM 0 HG SER A 81 -6.243 16.448 -4.669 1.00 0.00 H new ATOM 1316 N ASN A 82 -4.665 13.585 -1.227 1.00 0.00 N ATOM 1317 CA ASN A 82 -4.197 13.143 0.083 1.00 0.00 C ATOM 1318 C ASN A 82 -3.735 11.689 0.008 1.00 0.00 C ATOM 1319 O ASN A 82 -4.497 10.810 -0.402 1.00 0.00 O ATOM 1320 CB ASN A 82 -5.313 13.299 1.122 1.00 0.00 C ATOM 1321 CG ASN A 82 -4.873 12.962 2.540 1.00 0.00 C ATOM 1322 OD1 ASN A 82 -3.714 12.626 2.789 1.00 0.00 O ATOM 1323 ND2 ASN A 82 -5.804 13.048 3.480 1.00 0.00 N ATOM 0 H ASN A 82 -5.671 13.489 -1.363 1.00 0.00 H new ATOM 0 HA ASN A 82 -3.353 13.762 0.387 1.00 0.00 H new ATOM 0 HB2 ASN A 82 -5.680 14.325 1.098 1.00 0.00 H new ATOM 0 HB3 ASN A 82 -6.148 12.655 0.846 1.00 0.00 H new ATOM 0 HD21 ASN A 82 -5.571 12.832 4.449 1.00 0.00 H new ATOM 0 HD22 ASN A 82 -6.753 13.330 3.234 1.00 0.00 H new ATOM 1330 N ARG A 83 -2.488 11.447 0.409 1.00 0.00 N ATOM 1331 CA ARG A 83 -1.913 10.103 0.363 1.00 0.00 C ATOM 1332 C ARG A 83 -2.696 9.123 1.234 1.00 0.00 C ATOM 1333 O ARG A 83 -2.853 7.960 0.862 1.00 0.00 O ATOM 1334 CB ARG A 83 -0.437 10.117 0.770 1.00 0.00 C ATOM 1335 CG ARG A 83 0.479 10.782 -0.246 1.00 0.00 C ATOM 1336 CD ARG A 83 1.944 10.562 0.097 1.00 0.00 C ATOM 1337 NE ARG A 83 2.320 11.210 1.354 1.00 0.00 N ATOM 1338 CZ ARG A 83 2.739 12.471 1.443 1.00 0.00 C ATOM 1339 NH1 ARG A 83 2.838 13.220 0.352 1.00 0.00 N ATOM 1340 NH2 ARG A 83 3.060 12.980 2.626 1.00 0.00 N ATOM 0 H ARG A 83 -1.857 12.163 0.769 1.00 0.00 H new ATOM 0 HA ARG A 83 -1.982 9.762 -0.670 1.00 0.00 H new ATOM 0 HB2 ARG A 83 -0.339 10.633 1.725 1.00 0.00 H new ATOM 0 HB3 ARG A 83 -0.104 9.091 0.927 1.00 0.00 H new ATOM 0 HG2 ARG A 83 0.273 10.383 -1.239 1.00 0.00 H new ATOM 0 HG3 ARG A 83 0.269 11.851 -0.282 1.00 0.00 H new ATOM 0 HD2 ARG A 83 2.142 9.493 0.168 1.00 0.00 H new ATOM 0 HD3 ARG A 83 2.567 10.949 -0.710 1.00 0.00 H new ATOM 0 HE ARG A 83 2.257 10.663 2.213 1.00 0.00 H new ATOM 0 HH11 ARG A 83 2.593 12.830 -0.558 1.00 0.00 H new ATOM 0 HH12 ARG A 83 3.159 14.185 0.424 1.00 0.00 H new ATOM 0 HH21 ARG A 83 2.986 12.406 3.466 1.00 0.00 H new ATOM 0 HH22 ARG A 83 3.381 13.946 2.696 1.00 0.00 H new ATOM 1354 N GLU A 84 -3.183 9.576 2.390 1.00 0.00 N ATOM 1355 CA GLU A 84 -3.954 8.708 3.278 1.00 0.00 C ATOM 1356 C GLU A 84 -5.206 8.162 2.600 1.00 0.00 C ATOM 1357 O GLU A 84 -5.465 6.963 2.668 1.00 0.00 O ATOM 1358 CB GLU A 84 -4.340 9.454 4.554 1.00 0.00 C ATOM 1359 CG GLU A 84 -3.356 9.241 5.692 1.00 0.00 C ATOM 1360 CD GLU A 84 -3.469 10.298 6.772 1.00 0.00 C ATOM 1361 OE1 GLU A 84 -4.547 10.918 6.889 1.00 0.00 O ATOM 1362 OE2 GLU A 84 -2.477 10.509 7.500 1.00 0.00 O ATOM 0 H GLU A 84 -3.059 10.530 2.730 1.00 0.00 H new ATOM 0 HA GLU A 84 -3.316 7.862 3.531 1.00 0.00 H new ATOM 0 HB2 GLU A 84 -4.410 10.520 4.337 1.00 0.00 H new ATOM 0 HB3 GLU A 84 -5.330 9.128 4.872 1.00 0.00 H new ATOM 0 HG2 GLU A 84 -3.524 8.258 6.133 1.00 0.00 H new ATOM 0 HG3 GLU A 84 -2.341 9.242 5.294 1.00 0.00 H new ATOM 1369 N LYS A 85 -5.979 9.026 1.940 1.00 0.00 N ATOM 1370 CA LYS A 85 -7.190 8.569 1.258 1.00 0.00 C ATOM 1371 C LYS A 85 -6.843 7.608 0.128 1.00 0.00 C ATOM 1372 O LYS A 85 -7.546 6.621 -0.084 1.00 0.00 O ATOM 1373 CB LYS A 85 -8.031 9.736 0.733 1.00 0.00 C ATOM 1374 CG LYS A 85 -8.722 10.543 1.820 1.00 0.00 C ATOM 1375 CD LYS A 85 -9.546 11.674 1.221 1.00 0.00 C ATOM 1376 CE LYS A 85 -10.200 12.522 2.300 1.00 0.00 C ATOM 1377 NZ LYS A 85 -11.160 11.735 3.121 1.00 0.00 N ATOM 0 H LYS A 85 -5.794 10.026 1.864 1.00 0.00 H new ATOM 0 HA LYS A 85 -7.794 8.040 1.995 1.00 0.00 H new ATOM 0 HB2 LYS A 85 -7.389 10.401 0.155 1.00 0.00 H new ATOM 0 HB3 LYS A 85 -8.786 9.347 0.049 1.00 0.00 H new ATOM 0 HG2 LYS A 85 -9.367 9.890 2.408 1.00 0.00 H new ATOM 0 HG3 LYS A 85 -7.977 10.953 2.502 1.00 0.00 H new ATOM 0 HD2 LYS A 85 -8.906 12.302 0.601 1.00 0.00 H new ATOM 0 HD3 LYS A 85 -10.314 11.259 0.568 1.00 0.00 H new ATOM 0 HE2 LYS A 85 -9.430 12.943 2.947 1.00 0.00 H new ATOM 0 HE3 LYS A 85 -10.721 13.360 1.837 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 -11.706 12.379 3.729 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 -11.809 11.216 2.495 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 -10.637 11.059 3.714 1.00 0.00 H new ATOM 1391 N VAL A 86 -5.763 7.898 -0.595 1.00 0.00 N ATOM 1392 CA VAL A 86 -5.320 7.023 -1.671 1.00 0.00 C ATOM 1393 C VAL A 86 -4.950 5.650 -1.115 1.00 0.00 C ATOM 1394 O VAL A 86 -5.335 4.623 -1.672 1.00 0.00 O ATOM 1395 CB VAL A 86 -4.133 7.631 -2.457 1.00 0.00 C ATOM 1396 CG1 VAL A 86 -3.544 6.619 -3.428 1.00 0.00 C ATOM 1397 CG2 VAL A 86 -4.601 8.866 -3.201 1.00 0.00 C ATOM 0 H VAL A 86 -5.184 8.726 -0.455 1.00 0.00 H new ATOM 0 HA VAL A 86 -6.148 6.912 -2.371 1.00 0.00 H new ATOM 0 HB VAL A 86 -3.350 7.908 -1.750 1.00 0.00 H new ATOM 0 HG11 VAL A 86 -2.712 7.073 -3.967 1.00 0.00 H new ATOM 0 HG12 VAL A 86 -3.187 5.750 -2.876 1.00 0.00 H new ATOM 0 HG13 VAL A 86 -4.310 6.308 -4.139 1.00 0.00 H new ATOM 0 HG21 VAL A 86 -3.766 9.295 -3.755 1.00 0.00 H new ATOM 0 HG22 VAL A 86 -5.395 8.593 -3.896 1.00 0.00 H new ATOM 0 HG23 VAL A 86 -4.979 9.599 -2.488 1.00 0.00 H new ATOM 1407 N LEU A 87 -4.226 5.637 0.000 1.00 0.00 N ATOM 1408 CA LEU A 87 -3.833 4.387 0.642 1.00 0.00 C ATOM 1409 C LEU A 87 -5.043 3.638 1.182 1.00 0.00 C ATOM 1410 O LEU A 87 -5.144 2.429 1.008 1.00 0.00 O ATOM 1411 CB LEU A 87 -2.849 4.645 1.779 1.00 0.00 C ATOM 1412 CG LEU A 87 -1.384 4.382 1.449 1.00 0.00 C ATOM 1413 CD1 LEU A 87 -0.481 5.024 2.495 1.00 0.00 C ATOM 1414 CD2 LEU A 87 -1.132 2.881 1.363 1.00 0.00 C ATOM 0 H LEU A 87 -3.900 6.477 0.477 1.00 0.00 H new ATOM 0 HA LEU A 87 -3.350 3.773 -0.118 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -2.952 5.683 2.097 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -3.130 4.022 2.628 1.00 0.00 H new ATOM 0 HG LEU A 87 -1.152 4.828 0.482 1.00 0.00 H new ATOM 0 HD11 LEU A 87 0.562 4.827 2.246 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -0.653 6.100 2.513 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -0.705 4.604 3.476 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -0.083 2.701 1.127 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -1.374 2.416 2.319 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -1.759 2.451 0.582 1.00 0.00 H new ATOM 1426 N ILE A 88 -5.951 4.353 1.835 1.00 0.00 N ATOM 1427 CA ILE A 88 -7.148 3.732 2.391 1.00 0.00 C ATOM 1428 C ILE A 88 -8.012 3.112 1.289 1.00 0.00 C ATOM 1429 O ILE A 88 -8.436 1.960 1.400 1.00 0.00 O ATOM 1430 CB ILE A 88 -7.969 4.753 3.207 1.00 0.00 C ATOM 1431 CG1 ILE A 88 -7.200 5.110 4.484 1.00 0.00 C ATOM 1432 CG2 ILE A 88 -9.352 4.203 3.542 1.00 0.00 C ATOM 1433 CD1 ILE A 88 -7.737 6.324 5.205 1.00 0.00 C ATOM 0 H ILE A 88 -5.883 5.358 1.992 1.00 0.00 H new ATOM 0 HA ILE A 88 -6.826 2.934 3.060 1.00 0.00 H new ATOM 0 HB ILE A 88 -8.114 5.653 2.609 1.00 0.00 H new ATOM 0 HG12 ILE A 88 -7.225 4.257 5.162 1.00 0.00 H new ATOM 0 HG13 ILE A 88 -6.154 5.284 4.230 1.00 0.00 H new ATOM 0 HG21 ILE A 88 -9.908 4.943 4.117 1.00 0.00 H new ATOM 0 HG22 ILE A 88 -9.889 3.982 2.620 1.00 0.00 H new ATOM 0 HG23 ILE A 88 -9.248 3.291 4.129 1.00 0.00 H new ATOM 0 HD11 ILE A 88 -7.140 6.511 6.097 1.00 0.00 H new ATOM 0 HD12 ILE A 88 -7.686 7.191 4.546 1.00 0.00 H new ATOM 0 HD13 ILE A 88 -8.773 6.147 5.493 1.00 0.00 H new ATOM 1445 N ALA A 89 -8.256 3.875 0.224 1.00 0.00 N ATOM 1446 CA ALA A 89 -9.058 3.385 -0.895 1.00 0.00 C ATOM 1447 C ALA A 89 -8.376 2.214 -1.601 1.00 0.00 C ATOM 1448 O ALA A 89 -9.024 1.225 -1.938 1.00 0.00 O ATOM 1449 CB ALA A 89 -9.351 4.511 -1.874 1.00 0.00 C ATOM 0 H ALA A 89 -7.912 4.829 0.113 1.00 0.00 H new ATOM 0 HA ALA A 89 -10.004 3.020 -0.494 1.00 0.00 H new ATOM 0 HB1 ALA A 89 -9.949 4.128 -2.701 1.00 0.00 H new ATOM 0 HB2 ALA A 89 -9.901 5.302 -1.364 1.00 0.00 H new ATOM 0 HB3 ALA A 89 -8.413 4.911 -2.259 1.00 0.00 H new ATOM 1455 N LEU A 90 -7.062 2.327 -1.804 1.00 0.00 N ATOM 1456 CA LEU A 90 -6.290 1.274 -2.465 1.00 0.00 C ATOM 1457 C LEU A 90 -6.208 0.025 -1.587 1.00 0.00 C ATOM 1458 O LEU A 90 -6.267 -1.097 -2.091 1.00 0.00 O ATOM 1459 CB LEU A 90 -4.882 1.774 -2.821 1.00 0.00 C ATOM 1460 CG LEU A 90 -4.691 2.278 -4.258 1.00 0.00 C ATOM 1461 CD1 LEU A 90 -5.807 3.229 -4.672 1.00 0.00 C ATOM 1462 CD2 LEU A 90 -3.340 2.961 -4.388 1.00 0.00 C ATOM 0 H LEU A 90 -6.511 3.137 -1.520 1.00 0.00 H new ATOM 0 HA LEU A 90 -6.805 1.009 -3.388 1.00 0.00 H new ATOM 0 HB2 LEU A 90 -4.620 2.581 -2.136 1.00 0.00 H new ATOM 0 HB3 LEU A 90 -4.175 0.964 -2.644 1.00 0.00 H new ATOM 0 HG LEU A 90 -4.728 1.418 -4.926 1.00 0.00 H new ATOM 0 HD11 LEU A 90 -5.638 3.565 -5.695 1.00 0.00 H new ATOM 0 HD12 LEU A 90 -6.765 2.713 -4.613 1.00 0.00 H new ATOM 0 HD13 LEU A 90 -5.817 4.090 -4.004 1.00 0.00 H new ATOM 0 HD21 LEU A 90 -3.209 3.317 -5.410 1.00 0.00 H new ATOM 0 HD22 LEU A 90 -3.292 3.805 -3.701 1.00 0.00 H new ATOM 0 HD23 LEU A 90 -2.549 2.251 -4.147 1.00 0.00 H new ATOM 1474 N ARG A 91 -6.068 0.226 -0.277 1.00 0.00 N ATOM 1475 CA ARG A 91 -5.993 -0.881 0.677 1.00 0.00 C ATOM 1476 C ARG A 91 -7.281 -1.703 0.649 1.00 0.00 C ATOM 1477 O ARG A 91 -7.239 -2.932 0.594 1.00 0.00 O ATOM 1478 CB ARG A 91 -5.756 -0.344 2.093 1.00 0.00 C ATOM 1479 CG ARG A 91 -5.598 -1.434 3.144 1.00 0.00 C ATOM 1480 CD ARG A 91 -5.315 -0.847 4.517 1.00 0.00 C ATOM 1481 NE ARG A 91 -5.175 -1.884 5.537 1.00 0.00 N ATOM 1482 CZ ARG A 91 -4.920 -1.631 6.818 1.00 0.00 C ATOM 1483 NH1 ARG A 91 -4.775 -0.380 7.233 1.00 0.00 N ATOM 1484 NH2 ARG A 91 -4.811 -2.631 7.683 1.00 0.00 N ATOM 0 H ARG A 91 -6.004 1.150 0.150 1.00 0.00 H new ATOM 0 HA ARG A 91 -5.159 -1.522 0.391 1.00 0.00 H new ATOM 0 HB2 ARG A 91 -4.861 0.278 2.091 1.00 0.00 H new ATOM 0 HB3 ARG A 91 -6.591 0.299 2.372 1.00 0.00 H new ATOM 0 HG2 ARG A 91 -6.506 -2.036 3.185 1.00 0.00 H new ATOM 0 HG3 ARG A 91 -4.785 -2.102 2.858 1.00 0.00 H new ATOM 0 HD2 ARG A 91 -4.402 -0.253 4.476 1.00 0.00 H new ATOM 0 HD3 ARG A 91 -6.123 -0.171 4.796 1.00 0.00 H new ATOM 0 HE ARG A 91 -5.279 -2.857 5.250 1.00 0.00 H new ATOM 0 HH11 ARG A 91 -4.859 0.390 6.570 1.00 0.00 H new ATOM 0 HH12 ARG A 91 -4.580 -0.188 8.216 1.00 0.00 H new ATOM 0 HH21 ARG A 91 -4.923 -3.594 7.366 1.00 0.00 H new ATOM 0 HH22 ARG A 91 -4.615 -2.437 8.665 1.00 0.00 H new ATOM 1498 N LEU A 92 -8.421 -1.016 0.677 1.00 0.00 N ATOM 1499 CA LEU A 92 -9.724 -1.680 0.649 1.00 0.00 C ATOM 1500 C LEU A 92 -9.934 -2.419 -0.673 1.00 0.00 C ATOM 1501 O LEU A 92 -10.479 -3.523 -0.701 1.00 0.00 O ATOM 1502 CB LEU A 92 -10.847 -0.661 0.870 1.00 0.00 C ATOM 1503 CG LEU A 92 -10.926 -0.075 2.281 1.00 0.00 C ATOM 1504 CD1 LEU A 92 -11.914 1.082 2.323 1.00 0.00 C ATOM 1505 CD2 LEU A 92 -11.317 -1.149 3.287 1.00 0.00 C ATOM 0 H LEU A 92 -8.470 0.002 0.719 1.00 0.00 H new ATOM 0 HA LEU A 92 -9.748 -2.412 1.456 1.00 0.00 H new ATOM 0 HB2 LEU A 92 -10.719 0.157 0.161 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -11.799 -1.138 0.638 1.00 0.00 H new ATOM 0 HG LEU A 92 -9.940 0.304 2.551 1.00 0.00 H new ATOM 0 HD11 LEU A 92 -11.958 1.487 3.334 1.00 0.00 H new ATOM 0 HD12 LEU A 92 -11.591 1.862 1.634 1.00 0.00 H new ATOM 0 HD13 LEU A 92 -12.902 0.727 2.031 1.00 0.00 H new ATOM 0 HD21 LEU A 92 -11.368 -0.712 4.284 1.00 0.00 H new ATOM 0 HD22 LEU A 92 -12.291 -1.560 3.021 1.00 0.00 H new ATOM 0 HD23 LEU A 92 -10.573 -1.945 3.277 1.00 0.00 H new ATOM 1517 N LEU A 93 -9.499 -1.795 -1.762 1.00 0.00 N ATOM 1518 CA LEU A 93 -9.622 -2.383 -3.095 1.00 0.00 C ATOM 1519 C LEU A 93 -8.755 -3.633 -3.231 1.00 0.00 C ATOM 1520 O LEU A 93 -9.162 -4.622 -3.843 1.00 0.00 O ATOM 1521 CB LEU A 93 -9.231 -1.370 -4.173 1.00 0.00 C ATOM 1522 CG LEU A 93 -10.207 -0.210 -4.377 1.00 0.00 C ATOM 1523 CD1 LEU A 93 -9.609 0.819 -5.322 1.00 0.00 C ATOM 1524 CD2 LEU A 93 -11.540 -0.719 -4.909 1.00 0.00 C ATOM 0 H LEU A 93 -9.055 -0.877 -1.749 1.00 0.00 H new ATOM 0 HA LEU A 93 -10.666 -2.666 -3.231 1.00 0.00 H new ATOM 0 HB2 LEU A 93 -8.253 -0.958 -3.922 1.00 0.00 H new ATOM 0 HB3 LEU A 93 -9.120 -1.899 -5.120 1.00 0.00 H new ATOM 0 HG LEU A 93 -10.387 0.268 -3.414 1.00 0.00 H new ATOM 0 HD11 LEU A 93 -10.313 1.640 -5.459 1.00 0.00 H new ATOM 0 HD12 LEU A 93 -8.681 1.204 -4.900 1.00 0.00 H new ATOM 0 HD13 LEU A 93 -9.404 0.352 -6.285 1.00 0.00 H new ATOM 0 HD21 LEU A 93 -12.221 0.121 -5.048 1.00 0.00 H new ATOM 0 HD22 LEU A 93 -11.383 -1.220 -5.864 1.00 0.00 H new ATOM 0 HD23 LEU A 93 -11.971 -1.422 -4.197 1.00 0.00 H new ATOM 1536 N ALA A 94 -7.552 -3.575 -2.657 1.00 0.00 N ATOM 1537 CA ALA A 94 -6.616 -4.691 -2.706 1.00 0.00 C ATOM 1538 C ALA A 94 -7.153 -5.830 -1.876 1.00 0.00 C ATOM 1539 O ALA A 94 -6.995 -7.005 -2.214 1.00 0.00 O ATOM 1540 CB ALA A 94 -5.237 -4.271 -2.223 1.00 0.00 C ATOM 0 H ALA A 94 -7.205 -2.760 -2.151 1.00 0.00 H new ATOM 0 HA ALA A 94 -6.511 -5.020 -3.740 1.00 0.00 H new ATOM 0 HB1 ALA A 94 -4.560 -5.124 -2.271 1.00 0.00 H new ATOM 0 HB2 ALA A 94 -4.857 -3.470 -2.858 1.00 0.00 H new ATOM 0 HB3 ALA A 94 -5.304 -3.918 -1.194 1.00 0.00 H new ATOM 1546 N GLU A 95 -7.787 -5.455 -0.778 1.00 0.00 N ATOM 1547 CA GLU A 95 -8.385 -6.395 0.138 1.00 0.00 C ATOM 1548 C GLU A 95 -9.479 -7.200 -0.563 1.00 0.00 C ATOM 1549 O GLU A 95 -9.628 -8.402 -0.335 1.00 0.00 O ATOM 1550 CB GLU A 95 -8.948 -5.615 1.325 1.00 0.00 C ATOM 1551 CG GLU A 95 -9.615 -6.480 2.359 1.00 0.00 C ATOM 1552 CD GLU A 95 -10.087 -5.702 3.572 1.00 0.00 C ATOM 1553 OE1 GLU A 95 -9.888 -4.467 3.603 1.00 0.00 O ATOM 1554 OE2 GLU A 95 -10.655 -6.326 4.492 1.00 0.00 O ATOM 0 H GLU A 95 -7.899 -4.480 -0.500 1.00 0.00 H new ATOM 0 HA GLU A 95 -7.637 -7.105 0.492 1.00 0.00 H new ATOM 0 HB2 GLU A 95 -8.139 -5.058 1.798 1.00 0.00 H new ATOM 0 HB3 GLU A 95 -9.668 -4.883 0.958 1.00 0.00 H new ATOM 0 HG2 GLU A 95 -10.467 -6.986 1.905 1.00 0.00 H new ATOM 0 HG3 GLU A 95 -8.918 -7.254 2.680 1.00 0.00 H new ATOM 1561 N GLU A 96 -10.243 -6.515 -1.413 1.00 0.00 N ATOM 1562 CA GLU A 96 -11.319 -7.142 -2.171 1.00 0.00 C ATOM 1563 C GLU A 96 -10.770 -8.234 -3.085 1.00 0.00 C ATOM 1564 O GLU A 96 -11.371 -9.300 -3.230 1.00 0.00 O ATOM 1565 CB GLU A 96 -12.035 -6.086 -3.022 1.00 0.00 C ATOM 1566 CG GLU A 96 -12.848 -5.087 -2.209 1.00 0.00 C ATOM 1567 CD GLU A 96 -13.935 -5.746 -1.382 1.00 0.00 C ATOM 1568 OE1 GLU A 96 -14.700 -6.557 -1.944 1.00 0.00 O ATOM 1569 OE2 GLU A 96 -14.017 -5.454 -0.171 1.00 0.00 O ATOM 0 H GLU A 96 -10.133 -5.517 -1.593 1.00 0.00 H new ATOM 0 HA GLU A 96 -12.020 -7.590 -1.467 1.00 0.00 H new ATOM 0 HB2 GLU A 96 -11.294 -5.544 -3.610 1.00 0.00 H new ATOM 0 HB3 GLU A 96 -12.696 -6.589 -3.728 1.00 0.00 H new ATOM 0 HG2 GLU A 96 -12.180 -4.535 -1.548 1.00 0.00 H new ATOM 0 HG3 GLU A 96 -13.301 -4.361 -2.883 1.00 0.00 H new ATOM 1576 N ILE A 97 -9.624 -7.949 -3.692 1.00 0.00 N ATOM 1577 CA ILE A 97 -8.965 -8.882 -4.597 1.00 0.00 C ATOM 1578 C ILE A 97 -8.534 -10.144 -3.853 1.00 0.00 C ATOM 1579 O ILE A 97 -8.760 -11.260 -4.322 1.00 0.00 O ATOM 1580 CB ILE A 97 -7.740 -8.209 -5.246 1.00 0.00 C ATOM 1581 CG1 ILE A 97 -8.207 -7.041 -6.098 1.00 0.00 C ATOM 1582 CG2 ILE A 97 -6.946 -9.200 -6.093 1.00 0.00 C ATOM 1583 CD1 ILE A 97 -7.089 -6.126 -6.498 1.00 0.00 C ATOM 0 H ILE A 97 -9.127 -7.067 -3.571 1.00 0.00 H new ATOM 0 HA ILE A 97 -9.673 -9.166 -5.375 1.00 0.00 H new ATOM 0 HB ILE A 97 -7.079 -7.849 -4.458 1.00 0.00 H new ATOM 0 HG12 ILE A 97 -8.694 -7.424 -6.995 1.00 0.00 H new ATOM 0 HG13 ILE A 97 -8.956 -6.472 -5.546 1.00 0.00 H new ATOM 0 HG21 ILE A 97 -6.089 -8.694 -6.537 1.00 0.00 H new ATOM 0 HG22 ILE A 97 -6.598 -10.019 -5.464 1.00 0.00 H new ATOM 0 HG23 ILE A 97 -7.583 -9.595 -6.884 1.00 0.00 H new ATOM 0 HD11 ILE A 97 -7.485 -5.312 -7.105 1.00 0.00 H new ATOM 0 HD12 ILE A 97 -6.617 -5.717 -5.605 1.00 0.00 H new ATOM 0 HD13 ILE A 97 -6.352 -6.683 -7.076 1.00 0.00 H new ATOM 1595 N GLY A 98 -7.912 -9.951 -2.689 1.00 0.00 N ATOM 1596 CA GLY A 98 -7.465 -11.074 -1.877 1.00 0.00 C ATOM 1597 C GLY A 98 -8.619 -11.927 -1.378 1.00 0.00 C ATOM 1598 O GLY A 98 -8.494 -13.145 -1.264 1.00 0.00 O ATOM 0 H GLY A 98 -7.709 -9.033 -2.293 1.00 0.00 H new ATOM 0 HA2 GLY A 98 -6.786 -11.694 -2.462 1.00 0.00 H new ATOM 0 HA3 GLY A 98 -6.899 -10.699 -1.024 1.00 0.00 H new ATOM 1602 N ASP A 99 -9.734 -11.271 -1.057 1.00 0.00 N ATOM 1603 CA ASP A 99 -10.930 -11.959 -0.570 1.00 0.00 C ATOM 1604 C ASP A 99 -11.510 -12.891 -1.634 1.00 0.00 C ATOM 1605 O ASP A 99 -11.958 -13.996 -1.326 1.00 0.00 O ATOM 1606 CB ASP A 99 -11.990 -10.943 -0.138 1.00 0.00 C ATOM 1607 CG ASP A 99 -13.190 -11.599 0.515 1.00 0.00 C ATOM 1608 OD1 ASP A 99 -13.026 -12.181 1.606 1.00 0.00 O ATOM 1609 OD2 ASP A 99 -14.296 -11.524 -0.062 1.00 0.00 O ATOM 0 H ASP A 99 -9.834 -10.258 -1.126 1.00 0.00 H new ATOM 0 HA ASP A 99 -10.637 -12.562 0.289 1.00 0.00 H new ATOM 0 HB2 ASP A 99 -11.545 -10.232 0.558 1.00 0.00 H new ATOM 0 HB3 ASP A 99 -12.319 -10.374 -1.008 1.00 0.00 H new ATOM 1614 N TYR A 100 -11.509 -12.427 -2.882 1.00 0.00 N ATOM 1615 CA TYR A 100 -12.037 -13.203 -3.991 1.00 0.00 C ATOM 1616 C TYR A 100 -11.135 -14.393 -4.291 1.00 0.00 C ATOM 1617 O TYR A 100 -9.931 -14.247 -4.494 1.00 0.00 O ATOM 1618 CB TYR A 100 -12.179 -12.317 -5.234 1.00 0.00 C ATOM 1619 CG TYR A 100 -12.706 -13.043 -6.454 1.00 0.00 C ATOM 1620 CD1 TYR A 100 -14.055 -13.365 -6.565 1.00 0.00 C ATOM 1621 CD2 TYR A 100 -11.859 -13.406 -7.494 1.00 0.00 C ATOM 1622 CE1 TYR A 100 -14.541 -14.026 -7.675 1.00 0.00 C ATOM 1623 CE2 TYR A 100 -12.338 -14.068 -8.608 1.00 0.00 C ATOM 1624 CZ TYR A 100 -13.678 -14.376 -8.693 1.00 0.00 C ATOM 1625 OH TYR A 100 -14.160 -15.035 -9.801 1.00 0.00 O ATOM 0 H TYR A 100 -11.145 -11.512 -3.147 1.00 0.00 H new ATOM 0 HA TYR A 100 -13.021 -13.580 -3.712 1.00 0.00 H new ATOM 0 HB2 TYR A 100 -12.847 -11.488 -5.001 1.00 0.00 H new ATOM 0 HB3 TYR A 100 -11.207 -11.886 -5.473 1.00 0.00 H new ATOM 0 HD1 TYR A 100 -14.733 -13.093 -5.770 1.00 0.00 H new ATOM 0 HD2 TYR A 100 -10.808 -13.166 -7.430 1.00 0.00 H new ATOM 0 HE1 TYR A 100 -15.591 -14.268 -7.746 1.00 0.00 H new ATOM 0 HE2 TYR A 100 -11.666 -14.342 -9.408 1.00 0.00 H new ATOM 0 HH TYR A 100 -13.424 -15.208 -10.425 1.00 0.00 H new ATOM 1635 N LYS A 101 -11.736 -15.567 -4.323 1.00 0.00 N ATOM 1636 CA LYS A 101 -11.003 -16.792 -4.601 1.00 0.00 C ATOM 1637 C LYS A 101 -11.403 -17.363 -5.957 1.00 0.00 C ATOM 1638 O LYS A 101 -12.564 -17.272 -6.358 1.00 0.00 O ATOM 1639 CB LYS A 101 -11.259 -17.831 -3.502 1.00 0.00 C ATOM 1640 CG LYS A 101 -10.866 -17.364 -2.107 1.00 0.00 C ATOM 1641 CD LYS A 101 -9.369 -17.124 -1.994 1.00 0.00 C ATOM 1642 CE LYS A 101 -8.966 -16.784 -0.569 1.00 0.00 C ATOM 1643 NZ LYS A 101 -9.554 -15.494 -0.117 1.00 0.00 N ATOM 0 H LYS A 101 -12.734 -15.701 -4.159 1.00 0.00 H new ATOM 0 HA LYS A 101 -9.940 -16.553 -4.622 1.00 0.00 H new ATOM 0 HB2 LYS A 101 -12.317 -18.092 -3.502 1.00 0.00 H new ATOM 0 HB3 LYS A 101 -10.706 -18.740 -3.739 1.00 0.00 H new ATOM 0 HG2 LYS A 101 -11.401 -16.445 -1.867 1.00 0.00 H new ATOM 0 HG3 LYS A 101 -11.171 -18.111 -1.374 1.00 0.00 H new ATOM 0 HD2 LYS A 101 -8.831 -18.013 -2.323 1.00 0.00 H new ATOM 0 HD3 LYS A 101 -9.078 -16.311 -2.659 1.00 0.00 H new ATOM 0 HE2 LYS A 101 -9.287 -17.583 0.099 1.00 0.00 H new ATOM 0 HE3 LYS A 101 -7.879 -16.730 -0.502 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 -9.296 -15.324 0.876 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 -9.188 -14.720 -0.707 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 -10.590 -15.535 -0.204 1.00 0.00 H new ATOM 1657 N ASP A 102 -10.432 -17.942 -6.662 1.00 0.00 N ATOM 1658 CA ASP A 102 -10.678 -18.537 -7.978 1.00 0.00 C ATOM 1659 C ASP A 102 -11.653 -19.707 -7.881 1.00 0.00 C ATOM 1660 O ASP A 102 -12.542 -19.859 -8.717 1.00 0.00 O ATOM 1661 CB ASP A 102 -9.364 -19.007 -8.608 1.00 0.00 C ATOM 1662 CG ASP A 102 -9.554 -19.535 -10.016 1.00 0.00 C ATOM 1663 OD1 ASP A 102 -9.885 -18.732 -10.912 1.00 0.00 O ATOM 1664 OD2 ASP A 102 -9.369 -20.753 -10.221 1.00 0.00 O ATOM 0 H ASP A 102 -9.465 -18.013 -6.344 1.00 0.00 H new ATOM 0 HA ASP A 102 -11.123 -17.769 -8.611 1.00 0.00 H new ATOM 0 HB2 ASP A 102 -8.656 -18.178 -8.626 1.00 0.00 H new ATOM 0 HB3 ASP A 102 -8.925 -19.787 -7.986 1.00 0.00 H new ATOM 1669 N ASP A 103 -11.474 -20.534 -6.855 1.00 0.00 N ATOM 1670 CA ASP A 103 -12.332 -21.694 -6.638 1.00 0.00 C ATOM 1671 C ASP A 103 -12.323 -22.082 -5.164 1.00 0.00 C ATOM 1672 O ASP A 103 -11.420 -21.691 -4.424 1.00 0.00 O ATOM 1673 CB ASP A 103 -11.865 -22.874 -7.500 1.00 0.00 C ATOM 1674 CG ASP A 103 -12.996 -23.814 -7.870 1.00 0.00 C ATOM 1675 OD1 ASP A 103 -14.111 -23.647 -7.329 1.00 0.00 O ATOM 1676 OD2 ASP A 103 -12.768 -24.716 -8.701 1.00 0.00 O ATOM 0 H ASP A 103 -10.738 -20.421 -6.158 1.00 0.00 H new ATOM 0 HA ASP A 103 -13.350 -21.435 -6.929 1.00 0.00 H new ATOM 0 HB2 ASP A 103 -11.403 -22.493 -8.411 1.00 0.00 H new ATOM 0 HB3 ASP A 103 -11.098 -23.430 -6.962 1.00 0.00 H new ATOM 1681 N ASP A 104 -13.331 -22.842 -4.744 1.00 0.00 N ATOM 1682 CA ASP A 104 -13.443 -23.282 -3.351 1.00 0.00 C ATOM 1683 C ASP A 104 -12.323 -24.254 -2.981 1.00 0.00 C ATOM 1684 O ASP A 104 -11.902 -24.319 -1.827 1.00 0.00 O ATOM 1685 CB ASP A 104 -14.804 -23.942 -3.108 1.00 0.00 C ATOM 1686 CG ASP A 104 -15.062 -24.213 -1.639 1.00 0.00 C ATOM 1687 OD1 ASP A 104 -15.143 -23.239 -0.863 1.00 0.00 O ATOM 1688 OD2 ASP A 104 -15.187 -25.399 -1.268 1.00 0.00 O ATOM 0 H ASP A 104 -14.085 -23.168 -5.348 1.00 0.00 H new ATOM 0 HA ASP A 104 -13.352 -22.400 -2.718 1.00 0.00 H new ATOM 0 HB2 ASP A 104 -15.592 -23.298 -3.500 1.00 0.00 H new ATOM 0 HB3 ASP A 104 -14.854 -24.880 -3.662 1.00 0.00 H new ATOM 1693 N ASP A 105 -11.849 -25.007 -3.967 1.00 0.00 N ATOM 1694 CA ASP A 105 -10.781 -25.976 -3.751 1.00 0.00 C ATOM 1695 C ASP A 105 -10.028 -26.229 -5.053 1.00 0.00 C ATOM 1696 O ASP A 105 -10.527 -25.911 -6.133 1.00 0.00 O ATOM 1697 CB ASP A 105 -11.352 -27.293 -3.210 1.00 0.00 C ATOM 1698 CG ASP A 105 -10.349 -28.070 -2.379 1.00 0.00 C ATOM 1699 OD1 ASP A 105 -9.195 -27.607 -2.249 1.00 0.00 O ATOM 1700 OD2 ASP A 105 -10.717 -29.144 -1.858 1.00 0.00 O ATOM 0 H ASP A 105 -12.189 -24.965 -4.928 1.00 0.00 H new ATOM 0 HA ASP A 105 -10.088 -25.568 -3.015 1.00 0.00 H new ATOM 0 HB2 ASP A 105 -12.232 -27.080 -2.604 1.00 0.00 H new ATOM 0 HB3 ASP A 105 -11.682 -27.911 -4.045 1.00 0.00 H new ATOM 1705 N LYS A 106 -8.833 -26.794 -4.946 1.00 0.00 N ATOM 1706 CA LYS A 106 -8.017 -27.087 -6.120 1.00 0.00 C ATOM 1707 C LYS A 106 -8.393 -28.440 -6.719 1.00 0.00 C ATOM 1708 O LYS A 106 -8.966 -29.273 -5.984 1.00 0.00 O ATOM 1709 CB LYS A 106 -6.532 -27.071 -5.754 1.00 0.00 C ATOM 1710 CG LYS A 106 -5.931 -25.674 -5.693 1.00 0.00 C ATOM 1711 CD LYS A 106 -4.501 -25.697 -5.171 1.00 0.00 C ATOM 1712 CE LYS A 106 -3.548 -26.339 -6.168 1.00 0.00 C ATOM 1713 NZ LYS A 106 -3.425 -25.537 -7.417 1.00 0.00 N ATOM 1714 OXT LYS A 106 -8.109 -28.657 -7.915 1.00 0.00 O ATOM 0 H LYS A 106 -8.406 -27.059 -4.059 1.00 0.00 H new ATOM 0 HA LYS A 106 -8.206 -26.315 -6.865 1.00 0.00 H new ATOM 0 HB2 LYS A 106 -6.400 -27.556 -4.787 1.00 0.00 H new ATOM 0 HB3 LYS A 106 -5.981 -27.662 -6.485 1.00 0.00 H new ATOM 0 HG2 LYS A 106 -5.948 -25.227 -6.687 1.00 0.00 H new ATOM 0 HG3 LYS A 106 -6.543 -25.043 -5.049 1.00 0.00 H new ATOM 0 HD2 LYS A 106 -4.175 -24.679 -4.959 1.00 0.00 H new ATOM 0 HD3 LYS A 106 -4.466 -26.245 -4.229 1.00 0.00 H new ATOM 0 HE2 LYS A 106 -2.565 -26.450 -5.710 1.00 0.00 H new ATOM 0 HE3 LYS A 106 -3.901 -27.341 -6.413 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 -2.605 -25.869 -7.963 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 -4.288 -25.647 -7.987 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 -3.296 -24.534 -7.174 1.00 0.00 H new TER 1728 LYS A 106