USER MOD reduce.3.24.130724 H: found=0, std=0, add=808, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 810 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 11 GLN : amide:sc= -0.91! K(o=0.013!,f=-3.8) USER MOD Set 1.2: A 79 LYS NZ :NH3+ -179:sc= 0.923 (180deg=0) USER MOD Single : A 2 SER OG : rot -150:sc= 1.28 USER MOD Single : A 4 ASN :FLIP amide:sc= 0 F(o=-0.68,f=0) USER MOD Single : A 13 SER OG : rot 180:sc= 0 USER MOD Single : A 15 LYS NZ :NH3+ -171:sc= 1.25 (180deg=1.05) USER MOD Single : A 17 TYR OH : rot 180:sc= 0 USER MOD Single : A 19 THR OG1 : rot -175:sc= 1.17 USER MOD Single : A 26 LYS NZ :NH3+ -169:sc= -0.0306 (180deg=-0.191) USER MOD Single : A 29 SER OG : rot 64:sc= 0.561 USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 CYS SG : rot -30:sc= -2.97! USER MOD Single : A 35 GLN : amide:sc= 0 X(o=0,f=-0.29) USER MOD Single : A 39 SER OG : rot 17:sc= 0.237 USER MOD Single : A 41 SER OG : rot 37:sc= -1.12 USER MOD Single : A 46 GLN : amide:sc= -0.258 X(o=-0.26,f=0) USER MOD Single : A 53 SER OG : rot 16:sc= 0.0211 USER MOD Single : A 57 TYR OH : rot 180:sc= 0 USER MOD Single : A 59 LYS NZ :NH3+ 165:sc= -0.0095 (180deg=-0.261) USER MOD Single : A 61 MET CE :methyl -152:sc= -0.136 (180deg=-1.27) USER MOD Single : A 62 THR OG1 : rot -110:sc= -0.14 USER MOD Single : A 64 TYR OH : rot 180:sc= 0 USER MOD Single : A 66 LYS NZ :NH3+ 135:sc= -0.0503 (180deg=-0.274) USER MOD Single : A 67 ASN : amide:sc= -0.0711 X(o=-0.071,f=0.27) USER MOD Single : A 72 ASN : amide:sc= -0.334 K(o=-0.33,f=-3.1!) USER MOD Single : A 76 SER OG : rot 28:sc= 0.13 USER MOD Single : A 78 GLN : amide:sc= -1.25 K(o=-1.3,f=-3.1!) USER MOD Single : A 90 LYS NZ :NH3+ -176:sc= 0.687 (180deg=0.514) USER MOD Single : A 91 SER OG : rot 180:sc=-0.000605 USER MOD Single : A 94 LYS NZ :NH3+ -162:sc= -0.0927 (180deg=-0.467) USER MOD Single : A 98 TYR OH : rot 180:sc= 0 USER MOD Single : A 100 LYS NZ :NH3+ 176:sc= 1.28 (180deg=1.14) USER MOD Single : A 104 ASN :FLIP amide:sc= -0.498 F(o=-4!,f=-0.5) USER MOD Single : A 105 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 14 N SER A 2 -4.089 21.175 -2.317 1.00 0.00 N ATOM 15 CA SER A 2 -4.952 20.069 -2.673 1.00 0.00 C ATOM 16 C SER A 2 -4.186 19.090 -3.557 1.00 0.00 C ATOM 17 O SER A 2 -3.902 19.386 -4.717 1.00 0.00 O ATOM 18 CB SER A 2 -6.193 20.587 -3.397 1.00 0.00 C ATOM 19 OG SER A 2 -6.925 21.484 -2.574 1.00 0.00 O ATOM 0 HA SER A 2 -5.272 19.552 -1.768 1.00 0.00 H new ATOM 0 HB2 SER A 2 -5.898 21.091 -4.317 1.00 0.00 H new ATOM 0 HB3 SER A 2 -6.828 19.749 -3.682 1.00 0.00 H new ATOM 0 HG SER A 2 -7.876 21.436 -2.804 1.00 0.00 H new ATOM 25 N ARG A 3 -3.820 17.947 -2.997 1.00 0.00 N ATOM 26 CA ARG A 3 -3.026 16.970 -3.727 1.00 0.00 C ATOM 27 C ARG A 3 -3.910 15.914 -4.380 1.00 0.00 C ATOM 28 O ARG A 3 -5.026 15.641 -3.918 1.00 0.00 O ATOM 29 CB ARG A 3 -2.007 16.303 -2.799 1.00 0.00 C ATOM 30 CG ARG A 3 -0.958 17.255 -2.227 1.00 0.00 C ATOM 31 CD ARG A 3 -0.041 17.826 -3.302 1.00 0.00 C ATOM 32 NE ARG A 3 -0.689 18.863 -4.110 1.00 0.00 N ATOM 33 CZ ARG A 3 -0.549 18.980 -5.431 1.00 0.00 C ATOM 34 NH1 ARG A 3 0.229 18.133 -6.099 1.00 0.00 N ATOM 35 NH2 ARG A 3 -1.185 19.942 -6.083 1.00 0.00 N ATOM 0 H ARG A 3 -4.059 17.674 -2.044 1.00 0.00 H new ATOM 0 HA ARG A 3 -2.492 17.501 -4.515 1.00 0.00 H new ATOM 0 HB2 ARG A 3 -2.540 15.830 -1.974 1.00 0.00 H new ATOM 0 HB3 ARG A 3 -1.500 15.509 -3.347 1.00 0.00 H new ATOM 0 HG2 ARG A 3 -1.458 18.073 -1.709 1.00 0.00 H new ATOM 0 HG3 ARG A 3 -0.359 16.727 -1.485 1.00 0.00 H new ATOM 0 HD2 ARG A 3 0.849 18.243 -2.830 1.00 0.00 H new ATOM 0 HD3 ARG A 3 0.293 17.019 -3.955 1.00 0.00 H new ATOM 0 HE ARG A 3 -1.285 19.538 -3.631 1.00 0.00 H new ATOM 0 HH11 ARG A 3 0.721 17.391 -5.601 1.00 0.00 H new ATOM 0 HH12 ARG A 3 0.334 18.225 -7.109 1.00 0.00 H new ATOM 0 HH21 ARG A 3 -1.782 20.594 -5.575 1.00 0.00 H new ATOM 0 HH22 ARG A 3 -1.077 20.031 -7.093 1.00 0.00 H new ATOM 49 N ASN A 4 -3.401 15.339 -5.462 1.00 0.00 N ATOM 50 CA ASN A 4 -4.100 14.284 -6.186 1.00 0.00 C ATOM 51 C ASN A 4 -3.218 13.041 -6.274 1.00 0.00 C ATOM 52 O ASN A 4 -2.112 13.097 -6.810 1.00 0.00 O ATOM 53 CB ASN A 4 -4.454 14.739 -7.608 1.00 0.00 C ATOM 54 CG ASN A 4 -5.346 15.966 -7.664 1.00 0.00 C ATOM 55 OD1 ASN A 4 -6.250 16.102 -6.707 1.00 0.00 O flip ATOM 56 ND2 ASN A 4 -5.229 16.784 -8.577 1.00 0.00 N flip ATOM 0 H ASN A 4 -2.496 15.589 -5.861 1.00 0.00 H new ATOM 0 HA ASN A 4 -5.018 14.055 -5.644 1.00 0.00 H new ATOM 0 HB2 ASN A 4 -3.532 14.949 -8.151 1.00 0.00 H new ATOM 0 HB3 ASN A 4 -4.950 13.919 -8.127 1.00 0.00 H new ATOM 0 HD21 ASN A 4 -4.520 16.646 -9.298 1.00 0.00 H new ATOM 0 HD22 ASN A 4 -5.841 17.599 -8.613 1.00 0.00 H new ATOM 63 N PRO A 5 -3.688 11.906 -5.742 1.00 0.00 N ATOM 64 CA PRO A 5 -2.971 10.639 -5.816 1.00 0.00 C ATOM 65 C PRO A 5 -3.344 9.852 -7.069 1.00 0.00 C ATOM 66 O PRO A 5 -4.348 10.147 -7.716 1.00 0.00 O ATOM 67 CB PRO A 5 -3.461 9.920 -4.567 1.00 0.00 C ATOM 68 CG PRO A 5 -4.875 10.382 -4.404 1.00 0.00 C ATOM 69 CD PRO A 5 -4.961 11.761 -5.020 1.00 0.00 C ATOM 0 HA PRO A 5 -1.889 10.761 -5.867 1.00 0.00 H new ATOM 0 HB2 PRO A 5 -3.407 8.838 -4.684 1.00 0.00 H new ATOM 0 HB3 PRO A 5 -2.856 10.177 -3.697 1.00 0.00 H new ATOM 0 HG2 PRO A 5 -5.564 9.696 -4.896 1.00 0.00 H new ATOM 0 HG3 PRO A 5 -5.152 10.412 -3.350 1.00 0.00 H new ATOM 0 HD2 PRO A 5 -5.814 11.845 -5.693 1.00 0.00 H new ATOM 0 HD3 PRO A 5 -5.079 12.532 -4.259 1.00 0.00 H new ATOM 77 N GLU A 6 -2.540 8.851 -7.405 1.00 0.00 N ATOM 78 CA GLU A 6 -2.816 8.025 -8.571 1.00 0.00 C ATOM 79 C GLU A 6 -4.001 7.109 -8.294 1.00 0.00 C ATOM 80 O GLU A 6 -4.022 6.381 -7.296 1.00 0.00 O ATOM 81 CB GLU A 6 -1.576 7.215 -8.965 1.00 0.00 C ATOM 82 CG GLU A 6 -1.761 6.404 -10.238 1.00 0.00 C ATOM 83 CD GLU A 6 -0.457 5.850 -10.774 1.00 0.00 C ATOM 84 OE1 GLU A 6 -0.022 4.778 -10.315 1.00 0.00 O ATOM 85 OE2 GLU A 6 0.140 6.491 -11.662 1.00 0.00 O ATOM 0 H GLU A 6 -1.698 8.594 -6.890 1.00 0.00 H new ATOM 0 HA GLU A 6 -3.071 8.674 -9.409 1.00 0.00 H new ATOM 0 HB2 GLU A 6 -0.734 7.895 -9.096 1.00 0.00 H new ATOM 0 HB3 GLU A 6 -1.317 6.541 -8.148 1.00 0.00 H new ATOM 0 HG2 GLU A 6 -2.448 5.580 -10.042 1.00 0.00 H new ATOM 0 HG3 GLU A 6 -2.224 7.031 -10.999 1.00 0.00 H new ATOM 92 N VAL A 7 -4.989 7.168 -9.175 1.00 0.00 N ATOM 93 CA VAL A 7 -6.228 6.437 -8.990 1.00 0.00 C ATOM 94 C VAL A 7 -6.423 5.415 -10.106 1.00 0.00 C ATOM 95 O VAL A 7 -6.648 5.773 -11.264 1.00 0.00 O ATOM 96 CB VAL A 7 -7.435 7.402 -8.950 1.00 0.00 C ATOM 97 CG1 VAL A 7 -8.746 6.629 -8.870 1.00 0.00 C ATOM 98 CG2 VAL A 7 -7.308 8.363 -7.776 1.00 0.00 C ATOM 0 H VAL A 7 -4.953 7.721 -10.032 1.00 0.00 H new ATOM 0 HA VAL A 7 -6.166 5.912 -8.037 1.00 0.00 H new ATOM 0 HB VAL A 7 -7.440 7.981 -9.873 1.00 0.00 H new ATOM 0 HG11 VAL A 7 -9.580 7.330 -8.843 1.00 0.00 H new ATOM 0 HG12 VAL A 7 -8.842 5.984 -9.743 1.00 0.00 H new ATOM 0 HG13 VAL A 7 -8.755 6.020 -7.966 1.00 0.00 H new ATOM 0 HG21 VAL A 7 -8.166 9.036 -7.762 1.00 0.00 H new ATOM 0 HG22 VAL A 7 -7.275 7.797 -6.845 1.00 0.00 H new ATOM 0 HG23 VAL A 7 -6.392 8.945 -7.880 1.00 0.00 H new ATOM 108 N LEU A 8 -6.315 4.144 -9.748 1.00 0.00 N ATOM 109 CA LEU A 8 -6.519 3.056 -10.691 1.00 0.00 C ATOM 110 C LEU A 8 -7.951 2.551 -10.594 1.00 0.00 C ATOM 111 O LEU A 8 -8.550 2.598 -9.522 1.00 0.00 O ATOM 112 CB LEU A 8 -5.557 1.912 -10.381 1.00 0.00 C ATOM 113 CG LEU A 8 -4.081 2.294 -10.312 1.00 0.00 C ATOM 114 CD1 LEU A 8 -3.234 1.109 -9.878 1.00 0.00 C ATOM 115 CD2 LEU A 8 -3.598 2.823 -11.648 1.00 0.00 C ATOM 0 H LEU A 8 -6.085 3.840 -8.802 1.00 0.00 H new ATOM 0 HA LEU A 8 -6.331 3.423 -11.700 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -5.844 1.467 -9.428 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -5.680 1.141 -11.142 1.00 0.00 H new ATOM 0 HG LEU A 8 -3.975 3.084 -9.568 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -2.186 1.406 -9.836 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -3.555 0.774 -8.892 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -3.352 0.296 -10.594 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -2.543 3.089 -11.574 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -3.726 2.055 -12.411 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -4.176 3.706 -11.920 1.00 0.00 H new ATOM 127 N TRP A 9 -8.506 2.072 -11.699 1.00 0.00 N ATOM 128 CA TRP A 9 -9.847 1.509 -11.668 1.00 0.00 C ATOM 129 C TRP A 9 -9.915 0.185 -12.417 1.00 0.00 C ATOM 130 O TRP A 9 -9.077 -0.111 -13.272 1.00 0.00 O ATOM 131 CB TRP A 9 -10.876 2.495 -12.239 1.00 0.00 C ATOM 132 CG TRP A 9 -10.775 2.710 -13.721 1.00 0.00 C ATOM 133 CD1 TRP A 9 -9.877 3.501 -14.374 1.00 0.00 C ATOM 134 CD2 TRP A 9 -11.620 2.148 -14.731 1.00 0.00 C ATOM 135 NE1 TRP A 9 -10.106 3.461 -15.729 1.00 0.00 N ATOM 136 CE2 TRP A 9 -11.173 2.635 -15.973 1.00 0.00 C ATOM 137 CE3 TRP A 9 -12.711 1.274 -14.706 1.00 0.00 C ATOM 138 CZ2 TRP A 9 -11.777 2.277 -17.177 1.00 0.00 C ATOM 139 CZ3 TRP A 9 -13.311 0.923 -15.900 1.00 0.00 C ATOM 140 CH2 TRP A 9 -12.844 1.423 -17.122 1.00 0.00 C ATOM 0 H TRP A 9 -8.056 2.062 -12.614 1.00 0.00 H new ATOM 0 HA TRP A 9 -10.091 1.320 -10.623 1.00 0.00 H new ATOM 0 HB2 TRP A 9 -11.877 2.133 -12.004 1.00 0.00 H new ATOM 0 HB3 TRP A 9 -10.759 3.455 -11.736 1.00 0.00 H new ATOM 0 HD1 TRP A 9 -9.098 4.076 -13.896 1.00 0.00 H new ATOM 0 HE1 TRP A 9 -9.570 3.963 -16.437 1.00 0.00 H new ATOM 0 HE3 TRP A 9 -13.078 0.880 -13.770 1.00 0.00 H new ATOM 0 HZ2 TRP A 9 -11.415 2.660 -18.120 1.00 0.00 H new ATOM 0 HZ3 TRP A 9 -14.156 0.250 -15.891 1.00 0.00 H new ATOM 0 HH2 TRP A 9 -13.335 1.129 -18.038 1.00 0.00 H new ATOM 151 N ALA A 10 -10.925 -0.599 -12.076 1.00 0.00 N ATOM 152 CA ALA A 10 -11.186 -1.879 -12.718 1.00 0.00 C ATOM 153 C ALA A 10 -12.658 -2.245 -12.552 1.00 0.00 C ATOM 154 O ALA A 10 -13.181 -2.225 -11.442 1.00 0.00 O ATOM 155 CB ALA A 10 -10.296 -2.967 -12.131 1.00 0.00 C ATOM 0 H ALA A 10 -11.592 -0.364 -11.341 1.00 0.00 H new ATOM 0 HA ALA A 10 -10.958 -1.794 -13.780 1.00 0.00 H new ATOM 0 HB1 ALA A 10 -10.507 -3.916 -12.625 1.00 0.00 H new ATOM 0 HB2 ALA A 10 -9.250 -2.703 -12.284 1.00 0.00 H new ATOM 0 HB3 ALA A 10 -10.494 -3.062 -11.063 1.00 0.00 H new ATOM 161 N GLN A 11 -13.323 -2.586 -13.646 1.00 0.00 N ATOM 162 CA GLN A 11 -14.767 -2.796 -13.619 1.00 0.00 C ATOM 163 C GLN A 11 -15.121 -4.280 -13.498 1.00 0.00 C ATOM 164 O GLN A 11 -14.474 -5.137 -14.102 1.00 0.00 O ATOM 165 CB GLN A 11 -15.403 -2.205 -14.887 1.00 0.00 C ATOM 166 CG GLN A 11 -16.904 -2.426 -14.979 1.00 0.00 C ATOM 167 CD GLN A 11 -17.679 -1.680 -13.909 1.00 0.00 C ATOM 168 OE1 GLN A 11 -17.329 -0.567 -13.517 1.00 0.00 O ATOM 169 NE2 GLN A 11 -18.724 -2.308 -13.401 1.00 0.00 N ATOM 0 H GLN A 11 -12.891 -2.723 -14.560 1.00 0.00 H new ATOM 0 HA GLN A 11 -15.163 -2.288 -12.739 1.00 0.00 H new ATOM 0 HB2 GLN A 11 -15.200 -1.135 -14.919 1.00 0.00 H new ATOM 0 HB3 GLN A 11 -14.926 -2.647 -15.762 1.00 0.00 H new ATOM 0 HG2 GLN A 11 -17.253 -2.108 -15.961 1.00 0.00 H new ATOM 0 HG3 GLN A 11 -17.115 -3.492 -14.896 1.00 0.00 H new ATOM 0 HE21 GLN A 11 -18.985 -3.230 -13.751 1.00 0.00 H new ATOM 0 HE22 GLN A 11 -19.270 -1.871 -12.659 1.00 0.00 H new ATOM 178 N ARG A 12 -16.133 -4.570 -12.684 1.00 0.00 N ATOM 179 CA ARG A 12 -16.676 -5.918 -12.568 1.00 0.00 C ATOM 180 C ARG A 12 -18.145 -5.922 -12.985 1.00 0.00 C ATOM 181 O ARG A 12 -18.628 -4.965 -13.587 1.00 0.00 O ATOM 182 CB ARG A 12 -16.536 -6.440 -11.134 1.00 0.00 C ATOM 183 CG ARG A 12 -15.687 -7.696 -11.021 1.00 0.00 C ATOM 184 CD ARG A 12 -14.225 -7.413 -11.325 1.00 0.00 C ATOM 185 NE ARG A 12 -13.424 -8.634 -11.385 1.00 0.00 N ATOM 186 CZ ARG A 12 -12.713 -9.117 -10.364 1.00 0.00 C ATOM 187 NH1 ARG A 12 -12.790 -8.546 -9.167 1.00 0.00 N ATOM 188 NH2 ARG A 12 -11.940 -10.184 -10.540 1.00 0.00 N ATOM 0 H ARG A 12 -16.596 -3.882 -12.091 1.00 0.00 H new ATOM 0 HA ARG A 12 -16.112 -6.576 -13.228 1.00 0.00 H new ATOM 0 HB2 ARG A 12 -16.097 -5.659 -10.514 1.00 0.00 H new ATOM 0 HB3 ARG A 12 -17.529 -6.646 -10.733 1.00 0.00 H new ATOM 0 HG2 ARG A 12 -15.777 -8.107 -10.016 1.00 0.00 H new ATOM 0 HG3 ARG A 12 -16.062 -8.453 -11.710 1.00 0.00 H new ATOM 0 HD2 ARG A 12 -14.150 -6.885 -12.275 1.00 0.00 H new ATOM 0 HD3 ARG A 12 -13.819 -6.752 -10.560 1.00 0.00 H new ATOM 0 HE ARG A 12 -13.407 -9.151 -12.264 1.00 0.00 H new ATOM 0 HH11 ARG A 12 -13.394 -7.736 -9.026 1.00 0.00 H new ATOM 0 HH12 ARG A 12 -12.245 -8.918 -8.389 1.00 0.00 H new ATOM 0 HH21 ARG A 12 -11.891 -10.633 -11.455 1.00 0.00 H new ATOM 0 HH22 ARG A 12 -11.396 -10.554 -9.760 1.00 0.00 H new ATOM 202 N SER A 13 -18.853 -6.997 -12.676 1.00 0.00 N ATOM 203 CA SER A 13 -20.255 -7.117 -13.050 1.00 0.00 C ATOM 204 C SER A 13 -21.171 -6.492 -11.994 1.00 0.00 C ATOM 205 O SER A 13 -22.329 -6.174 -12.268 1.00 0.00 O ATOM 206 CB SER A 13 -20.602 -8.592 -13.240 1.00 0.00 C ATOM 207 OG SER A 13 -19.594 -9.252 -13.993 1.00 0.00 O ATOM 0 H SER A 13 -18.481 -7.799 -12.167 1.00 0.00 H new ATOM 0 HA SER A 13 -20.411 -6.577 -13.984 1.00 0.00 H new ATOM 0 HB2 SER A 13 -20.711 -9.073 -12.268 1.00 0.00 H new ATOM 0 HB3 SER A 13 -21.561 -8.682 -13.749 1.00 0.00 H new ATOM 0 HG SER A 13 -19.833 -10.196 -14.103 1.00 0.00 H new ATOM 213 N ASP A 14 -20.648 -6.315 -10.786 1.00 0.00 N ATOM 214 CA ASP A 14 -21.439 -5.779 -9.681 1.00 0.00 C ATOM 215 C ASP A 14 -20.873 -4.455 -9.171 1.00 0.00 C ATOM 216 O ASP A 14 -21.618 -3.506 -8.930 1.00 0.00 O ATOM 217 CB ASP A 14 -21.525 -6.800 -8.536 1.00 0.00 C ATOM 218 CG ASP A 14 -20.172 -7.152 -7.942 1.00 0.00 C ATOM 219 OD1 ASP A 14 -19.277 -7.594 -8.695 1.00 0.00 O ATOM 220 OD2 ASP A 14 -20.004 -7.015 -6.714 1.00 0.00 O ATOM 0 H ASP A 14 -19.681 -6.534 -10.546 1.00 0.00 H new ATOM 0 HA ASP A 14 -22.443 -5.586 -10.059 1.00 0.00 H new ATOM 0 HB2 ASP A 14 -22.166 -6.401 -7.750 1.00 0.00 H new ATOM 0 HB3 ASP A 14 -22.000 -7.709 -8.904 1.00 0.00 H new ATOM 225 N LYS A 15 -19.558 -4.381 -9.019 1.00 0.00 N ATOM 226 CA LYS A 15 -18.925 -3.177 -8.499 1.00 0.00 C ATOM 227 C LYS A 15 -17.670 -2.824 -9.286 1.00 0.00 C ATOM 228 O LYS A 15 -17.230 -3.579 -10.148 1.00 0.00 O ATOM 229 CB LYS A 15 -18.583 -3.338 -7.012 1.00 0.00 C ATOM 230 CG LYS A 15 -17.878 -4.641 -6.670 1.00 0.00 C ATOM 231 CD LYS A 15 -17.415 -4.654 -5.222 1.00 0.00 C ATOM 232 CE LYS A 15 -17.185 -6.070 -4.716 1.00 0.00 C ATOM 233 NZ LYS A 15 -18.465 -6.799 -4.509 1.00 0.00 N ATOM 0 H LYS A 15 -18.912 -5.136 -9.247 1.00 0.00 H new ATOM 0 HA LYS A 15 -19.639 -2.361 -8.610 1.00 0.00 H new ATOM 0 HB2 LYS A 15 -17.951 -2.505 -6.704 1.00 0.00 H new ATOM 0 HB3 LYS A 15 -19.503 -3.272 -6.430 1.00 0.00 H new ATOM 0 HG2 LYS A 15 -18.552 -5.479 -6.846 1.00 0.00 H new ATOM 0 HG3 LYS A 15 -17.021 -4.777 -7.330 1.00 0.00 H new ATOM 0 HD2 LYS A 15 -16.493 -4.081 -5.130 1.00 0.00 H new ATOM 0 HD3 LYS A 15 -18.160 -4.161 -4.598 1.00 0.00 H new ATOM 0 HE2 LYS A 15 -16.568 -6.615 -5.430 1.00 0.00 H new ATOM 0 HE3 LYS A 15 -16.631 -6.035 -3.778 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 -18.277 -7.699 -4.023 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 -19.105 -6.219 -3.929 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 -18.909 -6.989 -5.430 1.00 0.00 H new ATOM 247 N VAL A 16 -17.117 -1.662 -8.987 1.00 0.00 N ATOM 248 CA VAL A 16 -15.882 -1.215 -9.596 1.00 0.00 C ATOM 249 C VAL A 16 -14.807 -1.049 -8.521 1.00 0.00 C ATOM 250 O VAL A 16 -15.098 -0.628 -7.396 1.00 0.00 O ATOM 251 CB VAL A 16 -16.085 0.112 -10.375 1.00 0.00 C ATOM 252 CG1 VAL A 16 -16.619 1.209 -9.468 1.00 0.00 C ATOM 253 CG2 VAL A 16 -14.795 0.558 -11.050 1.00 0.00 C ATOM 0 H VAL A 16 -17.513 -1.004 -8.316 1.00 0.00 H new ATOM 0 HA VAL A 16 -15.558 -1.970 -10.313 1.00 0.00 H new ATOM 0 HB VAL A 16 -16.827 -0.077 -11.151 1.00 0.00 H new ATOM 0 HG11 VAL A 16 -16.750 2.125 -10.044 1.00 0.00 H new ATOM 0 HG12 VAL A 16 -17.578 0.902 -9.051 1.00 0.00 H new ATOM 0 HG13 VAL A 16 -15.912 1.388 -8.658 1.00 0.00 H new ATOM 0 HG21 VAL A 16 -14.969 1.490 -11.588 1.00 0.00 H new ATOM 0 HG22 VAL A 16 -14.024 0.713 -10.295 1.00 0.00 H new ATOM 0 HG23 VAL A 16 -14.467 -0.209 -11.751 1.00 0.00 H new ATOM 263 N TYR A 17 -13.582 -1.422 -8.859 1.00 0.00 N ATOM 264 CA TYR A 17 -12.459 -1.309 -7.943 1.00 0.00 C ATOM 265 C TYR A 17 -11.730 0.002 -8.168 1.00 0.00 C ATOM 266 O TYR A 17 -11.400 0.350 -9.301 1.00 0.00 O ATOM 267 CB TYR A 17 -11.474 -2.466 -8.139 1.00 0.00 C ATOM 268 CG TYR A 17 -11.931 -3.801 -7.582 1.00 0.00 C ATOM 269 CD1 TYR A 17 -13.217 -3.986 -7.090 1.00 0.00 C ATOM 270 CD2 TYR A 17 -11.057 -4.882 -7.550 1.00 0.00 C ATOM 271 CE1 TYR A 17 -13.618 -5.207 -6.581 1.00 0.00 C ATOM 272 CE2 TYR A 17 -11.452 -6.104 -7.046 1.00 0.00 C ATOM 273 CZ TYR A 17 -12.731 -6.262 -6.563 1.00 0.00 C ATOM 274 OH TYR A 17 -13.124 -7.479 -6.059 1.00 0.00 O ATOM 0 H TYR A 17 -13.340 -1.809 -9.771 1.00 0.00 H new ATOM 0 HA TYR A 17 -12.852 -1.344 -6.927 1.00 0.00 H new ATOM 0 HB2 TYR A 17 -11.281 -2.582 -9.206 1.00 0.00 H new ATOM 0 HB3 TYR A 17 -10.527 -2.200 -7.671 1.00 0.00 H new ATOM 0 HD1 TYR A 17 -13.915 -3.162 -7.105 1.00 0.00 H new ATOM 0 HD2 TYR A 17 -10.052 -4.763 -7.926 1.00 0.00 H new ATOM 0 HE1 TYR A 17 -14.620 -5.334 -6.200 1.00 0.00 H new ATOM 0 HE2 TYR A 17 -10.760 -6.933 -7.031 1.00 0.00 H new ATOM 0 HH TYR A 17 -12.380 -8.114 -6.121 1.00 0.00 H new ATOM 284 N LEU A 18 -11.494 0.726 -7.094 1.00 0.00 N ATOM 285 CA LEU A 18 -10.711 1.946 -7.148 1.00 0.00 C ATOM 286 C LEU A 18 -9.453 1.785 -6.315 1.00 0.00 C ATOM 287 O LEU A 18 -9.518 1.732 -5.089 1.00 0.00 O ATOM 288 CB LEU A 18 -11.521 3.143 -6.631 1.00 0.00 C ATOM 289 CG LEU A 18 -12.468 3.807 -7.639 1.00 0.00 C ATOM 290 CD1 LEU A 18 -11.731 4.168 -8.918 1.00 0.00 C ATOM 291 CD2 LEU A 18 -13.659 2.911 -7.944 1.00 0.00 C ATOM 0 H LEU A 18 -11.837 0.489 -6.163 1.00 0.00 H new ATOM 0 HA LEU A 18 -10.443 2.134 -8.187 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -12.109 2.814 -5.774 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -10.823 3.898 -6.268 1.00 0.00 H new ATOM 0 HG LEU A 18 -12.842 4.726 -7.188 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -12.423 4.637 -9.617 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -10.922 4.861 -8.688 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -11.318 3.265 -9.367 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -14.313 3.407 -8.661 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -13.307 1.969 -8.365 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -14.211 2.714 -7.025 1.00 0.00 H new ATOM 303 N THR A 19 -8.318 1.701 -6.975 1.00 0.00 N ATOM 304 CA THR A 19 -7.052 1.571 -6.282 1.00 0.00 C ATOM 305 C THR A 19 -6.390 2.934 -6.153 1.00 0.00 C ATOM 306 O THR A 19 -5.827 3.460 -7.114 1.00 0.00 O ATOM 307 CB THR A 19 -6.109 0.601 -7.017 1.00 0.00 C ATOM 308 OG1 THR A 19 -6.766 -0.654 -7.220 1.00 0.00 O ATOM 309 CG2 THR A 19 -4.825 0.377 -6.230 1.00 0.00 C ATOM 0 H THR A 19 -8.245 1.720 -7.992 1.00 0.00 H new ATOM 0 HA THR A 19 -7.250 1.165 -5.290 1.00 0.00 H new ATOM 0 HB THR A 19 -5.852 1.045 -7.978 1.00 0.00 H new ATOM 0 HG1 THR A 19 -6.139 -1.290 -7.623 1.00 0.00 H new ATOM 0 HG21 THR A 19 -4.180 -0.312 -6.775 1.00 0.00 H new ATOM 0 HG22 THR A 19 -4.309 1.328 -6.097 1.00 0.00 H new ATOM 0 HG23 THR A 19 -5.065 -0.045 -5.254 1.00 0.00 H new ATOM 317 N VAL A 20 -6.486 3.512 -4.972 1.00 0.00 N ATOM 318 CA VAL A 20 -5.916 4.817 -4.716 1.00 0.00 C ATOM 319 C VAL A 20 -4.560 4.675 -4.042 1.00 0.00 C ATOM 320 O VAL A 20 -4.449 4.118 -2.946 1.00 0.00 O ATOM 321 CB VAL A 20 -6.855 5.665 -3.834 1.00 0.00 C ATOM 322 CG1 VAL A 20 -6.254 7.037 -3.556 1.00 0.00 C ATOM 323 CG2 VAL A 20 -8.222 5.806 -4.487 1.00 0.00 C ATOM 0 H VAL A 20 -6.957 3.094 -4.170 1.00 0.00 H new ATOM 0 HA VAL A 20 -5.789 5.325 -5.672 1.00 0.00 H new ATOM 0 HB VAL A 20 -6.977 5.149 -2.882 1.00 0.00 H new ATOM 0 HG11 VAL A 20 -6.937 7.614 -2.932 1.00 0.00 H new ATOM 0 HG12 VAL A 20 -5.302 6.919 -3.039 1.00 0.00 H new ATOM 0 HG13 VAL A 20 -6.093 7.561 -4.498 1.00 0.00 H new ATOM 0 HG21 VAL A 20 -8.870 6.408 -3.849 1.00 0.00 H new ATOM 0 HG22 VAL A 20 -8.114 6.293 -5.456 1.00 0.00 H new ATOM 0 HG23 VAL A 20 -8.663 4.819 -4.624 1.00 0.00 H new ATOM 333 N ALA A 21 -3.525 5.164 -4.710 1.00 0.00 N ATOM 334 CA ALA A 21 -2.184 5.115 -4.159 1.00 0.00 C ATOM 335 C ALA A 21 -2.010 6.199 -3.107 1.00 0.00 C ATOM 336 O ALA A 21 -1.715 7.352 -3.423 1.00 0.00 O ATOM 337 CB ALA A 21 -1.140 5.266 -5.263 1.00 0.00 C ATOM 0 H ALA A 21 -3.590 5.597 -5.631 1.00 0.00 H new ATOM 0 HA ALA A 21 -2.039 4.143 -3.687 1.00 0.00 H new ATOM 0 HB1 ALA A 21 -0.142 5.226 -4.827 1.00 0.00 H new ATOM 0 HB2 ALA A 21 -1.254 4.457 -5.984 1.00 0.00 H new ATOM 0 HB3 ALA A 21 -1.279 6.223 -5.766 1.00 0.00 H new ATOM 343 N LEU A 22 -2.217 5.819 -1.856 1.00 0.00 N ATOM 344 CA LEU A 22 -2.164 6.754 -0.748 1.00 0.00 C ATOM 345 C LEU A 22 -1.706 6.031 0.518 1.00 0.00 C ATOM 346 O LEU A 22 -2.359 5.090 0.971 1.00 0.00 O ATOM 347 CB LEU A 22 -3.543 7.379 -0.536 1.00 0.00 C ATOM 348 CG LEU A 22 -3.573 8.598 0.382 1.00 0.00 C ATOM 349 CD1 LEU A 22 -2.725 9.717 -0.201 1.00 0.00 C ATOM 350 CD2 LEU A 22 -5.005 9.068 0.593 1.00 0.00 C ATOM 0 H LEU A 22 -2.425 4.859 -1.583 1.00 0.00 H new ATOM 0 HA LEU A 22 -1.450 7.546 -0.975 1.00 0.00 H new ATOM 0 HB2 LEU A 22 -3.947 7.666 -1.507 1.00 0.00 H new ATOM 0 HB3 LEU A 22 -4.209 6.620 -0.126 1.00 0.00 H new ATOM 0 HG LEU A 22 -3.157 8.316 1.350 1.00 0.00 H new ATOM 0 HD11 LEU A 22 -2.755 10.580 0.464 1.00 0.00 H new ATOM 0 HD12 LEU A 22 -1.695 9.376 -0.306 1.00 0.00 H new ATOM 0 HD13 LEU A 22 -3.116 9.998 -1.179 1.00 0.00 H new ATOM 0 HD21 LEU A 22 -5.009 9.938 1.250 1.00 0.00 H new ATOM 0 HD22 LEU A 22 -5.445 9.336 -0.367 1.00 0.00 H new ATOM 0 HD23 LEU A 22 -5.588 8.267 1.048 1.00 0.00 H new ATOM 362 N PRO A 23 -0.568 6.453 1.088 1.00 0.00 N ATOM 363 CA PRO A 23 0.028 5.784 2.250 1.00 0.00 C ATOM 364 C PRO A 23 -0.749 5.997 3.553 1.00 0.00 C ATOM 365 O PRO A 23 -0.943 5.054 4.324 1.00 0.00 O ATOM 366 CB PRO A 23 1.419 6.415 2.348 1.00 0.00 C ATOM 367 CG PRO A 23 1.282 7.752 1.706 1.00 0.00 C ATOM 368 CD PRO A 23 0.242 7.597 0.629 1.00 0.00 C ATOM 0 HA PRO A 23 0.033 4.702 2.118 1.00 0.00 H new ATOM 0 HB2 PRO A 23 1.739 6.507 3.386 1.00 0.00 H new ATOM 0 HB3 PRO A 23 2.165 5.807 1.837 1.00 0.00 H new ATOM 0 HG2 PRO A 23 0.979 8.504 2.434 1.00 0.00 H new ATOM 0 HG3 PRO A 23 2.232 8.081 1.285 1.00 0.00 H new ATOM 0 HD2 PRO A 23 -0.362 8.498 0.523 1.00 0.00 H new ATOM 0 HD3 PRO A 23 0.697 7.402 -0.342 1.00 0.00 H new ATOM 376 N ASP A 24 -1.199 7.224 3.808 1.00 0.00 N ATOM 377 CA ASP A 24 -1.799 7.544 5.101 1.00 0.00 C ATOM 378 C ASP A 24 -2.679 8.792 5.028 1.00 0.00 C ATOM 379 O ASP A 24 -2.222 9.865 4.625 1.00 0.00 O ATOM 380 CB ASP A 24 -0.691 7.753 6.128 1.00 0.00 C ATOM 381 CG ASP A 24 -1.211 7.883 7.540 1.00 0.00 C ATOM 382 OD1 ASP A 24 -1.533 9.013 7.962 1.00 0.00 O ATOM 383 OD2 ASP A 24 -1.280 6.853 8.240 1.00 0.00 O ATOM 0 H ASP A 24 -1.161 8.001 3.149 1.00 0.00 H new ATOM 0 HA ASP A 24 -2.437 6.710 5.396 1.00 0.00 H new ATOM 0 HB2 ASP A 24 0.005 6.916 6.079 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -0.129 8.650 5.870 1.00 0.00 H new ATOM 388 N ALA A 25 -3.931 8.649 5.441 1.00 0.00 N ATOM 389 CA ALA A 25 -4.878 9.755 5.416 1.00 0.00 C ATOM 390 C ALA A 25 -5.666 9.832 6.724 1.00 0.00 C ATOM 391 O ALA A 25 -5.508 8.983 7.602 1.00 0.00 O ATOM 392 CB ALA A 25 -5.819 9.608 4.231 1.00 0.00 C ATOM 0 H ALA A 25 -4.315 7.774 5.799 1.00 0.00 H new ATOM 0 HA ALA A 25 -4.319 10.685 5.308 1.00 0.00 H new ATOM 0 HB1 ALA A 25 -6.524 10.440 4.221 1.00 0.00 H new ATOM 0 HB2 ALA A 25 -5.242 9.609 3.306 1.00 0.00 H new ATOM 0 HB3 ALA A 25 -6.367 8.669 4.316 1.00 0.00 H new ATOM 398 N LYS A 26 -6.512 10.852 6.836 1.00 0.00 N ATOM 399 CA LYS A 26 -7.281 11.118 8.048 1.00 0.00 C ATOM 400 C LYS A 26 -8.637 11.707 7.687 1.00 0.00 C ATOM 401 O LYS A 26 -8.742 12.470 6.720 1.00 0.00 O ATOM 402 CB LYS A 26 -6.556 12.118 8.958 1.00 0.00 C ATOM 403 CG LYS A 26 -5.189 11.673 9.438 1.00 0.00 C ATOM 404 CD LYS A 26 -4.605 12.685 10.403 1.00 0.00 C ATOM 405 CE LYS A 26 -3.224 12.280 10.885 1.00 0.00 C ATOM 406 NZ LYS A 26 -3.223 10.952 11.550 1.00 0.00 N ATOM 0 H LYS A 26 -6.684 11.520 6.085 1.00 0.00 H new ATOM 0 HA LYS A 26 -7.401 10.170 8.573 1.00 0.00 H new ATOM 0 HB2 LYS A 26 -6.447 13.061 8.422 1.00 0.00 H new ATOM 0 HB3 LYS A 26 -7.183 12.316 9.827 1.00 0.00 H new ATOM 0 HG2 LYS A 26 -5.268 10.701 9.926 1.00 0.00 H new ATOM 0 HG3 LYS A 26 -4.521 11.549 8.585 1.00 0.00 H new ATOM 0 HD2 LYS A 26 -4.548 13.659 9.917 1.00 0.00 H new ATOM 0 HD3 LYS A 26 -5.270 12.795 11.260 1.00 0.00 H new ATOM 0 HE2 LYS A 26 -2.538 12.260 10.038 1.00 0.00 H new ATOM 0 HE3 LYS A 26 -2.850 13.032 11.580 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 -2.309 10.801 12.023 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 -3.987 10.916 12.254 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 -3.372 10.208 10.839 1.00 0.00 H new ATOM 420 N ASP A 27 -9.660 11.342 8.465 1.00 0.00 N ATOM 421 CA ASP A 27 -11.012 11.901 8.318 1.00 0.00 C ATOM 422 C ASP A 27 -11.459 11.847 6.860 1.00 0.00 C ATOM 423 O ASP A 27 -12.041 12.798 6.332 1.00 0.00 O ATOM 424 CB ASP A 27 -11.048 13.346 8.841 1.00 0.00 C ATOM 425 CG ASP A 27 -12.462 13.855 9.075 1.00 0.00 C ATOM 426 OD1 ASP A 27 -13.143 13.331 9.980 1.00 0.00 O ATOM 427 OD2 ASP A 27 -12.899 14.785 8.364 1.00 0.00 O ATOM 0 H ASP A 27 -9.578 10.653 9.213 1.00 0.00 H new ATOM 0 HA ASP A 27 -11.703 11.300 8.909 1.00 0.00 H new ATOM 0 HB2 ASP A 27 -10.487 13.404 9.774 1.00 0.00 H new ATOM 0 HB3 ASP A 27 -10.546 13.998 8.127 1.00 0.00 H new ATOM 432 N ILE A 28 -11.174 10.723 6.221 1.00 0.00 N ATOM 433 CA ILE A 28 -11.456 10.549 4.806 1.00 0.00 C ATOM 434 C ILE A 28 -12.950 10.699 4.541 1.00 0.00 C ATOM 435 O ILE A 28 -13.746 9.835 4.901 1.00 0.00 O ATOM 436 CB ILE A 28 -10.967 9.171 4.305 1.00 0.00 C ATOM 437 CG1 ILE A 28 -9.454 9.036 4.509 1.00 0.00 C ATOM 438 CG2 ILE A 28 -11.328 8.975 2.838 1.00 0.00 C ATOM 439 CD1 ILE A 28 -8.927 7.641 4.246 1.00 0.00 C ATOM 0 H ILE A 28 -10.744 9.912 6.665 1.00 0.00 H new ATOM 0 HA ILE A 28 -10.917 11.323 4.259 1.00 0.00 H new ATOM 0 HB ILE A 28 -11.466 8.395 4.886 1.00 0.00 H new ATOM 0 HG12 ILE A 28 -8.943 9.738 3.850 1.00 0.00 H new ATOM 0 HG13 ILE A 28 -9.207 9.321 5.532 1.00 0.00 H new ATOM 0 HG21 ILE A 28 -10.975 7.999 2.504 1.00 0.00 H new ATOM 0 HG22 ILE A 28 -12.410 9.030 2.719 1.00 0.00 H new ATOM 0 HG23 ILE A 28 -10.857 9.755 2.240 1.00 0.00 H new ATOM 0 HD11 ILE A 28 -7.850 7.622 4.410 1.00 0.00 H new ATOM 0 HD12 ILE A 28 -9.410 6.936 4.923 1.00 0.00 H new ATOM 0 HD13 ILE A 28 -9.142 7.359 3.215 1.00 0.00 H new ATOM 451 N SER A 29 -13.322 11.815 3.931 1.00 0.00 N ATOM 452 CA SER A 29 -14.711 12.105 3.652 1.00 0.00 C ATOM 453 C SER A 29 -14.969 12.060 2.154 1.00 0.00 C ATOM 454 O SER A 29 -14.254 12.686 1.368 1.00 0.00 O ATOM 455 CB SER A 29 -15.071 13.475 4.219 1.00 0.00 C ATOM 456 OG SER A 29 -14.799 13.522 5.609 1.00 0.00 O ATOM 0 H SER A 29 -12.672 12.536 3.620 1.00 0.00 H new ATOM 0 HA SER A 29 -15.338 11.350 4.127 1.00 0.00 H new ATOM 0 HB2 SER A 29 -14.502 14.249 3.704 1.00 0.00 H new ATOM 0 HB3 SER A 29 -16.126 13.683 4.041 1.00 0.00 H new ATOM 0 HG SER A 29 -13.837 13.409 5.758 1.00 0.00 H new ATOM 462 N VAL A 30 -15.975 11.304 1.759 1.00 0.00 N ATOM 463 CA VAL A 30 -16.290 11.144 0.356 1.00 0.00 C ATOM 464 C VAL A 30 -17.753 11.478 0.110 1.00 0.00 C ATOM 465 O VAL A 30 -18.642 10.801 0.625 1.00 0.00 O ATOM 466 CB VAL A 30 -16.025 9.695 -0.117 1.00 0.00 C ATOM 467 CG1 VAL A 30 -16.097 9.602 -1.632 1.00 0.00 C ATOM 468 CG2 VAL A 30 -14.686 9.178 0.391 1.00 0.00 C ATOM 0 H VAL A 30 -16.588 10.791 2.392 1.00 0.00 H new ATOM 0 HA VAL A 30 -15.649 11.823 -0.206 1.00 0.00 H new ATOM 0 HB VAL A 30 -16.805 9.062 0.305 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -15.908 8.575 -1.943 1.00 0.00 H new ATOM 0 HG12 VAL A 30 -17.088 9.906 -1.969 1.00 0.00 H new ATOM 0 HG13 VAL A 30 -15.347 10.259 -2.073 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -14.533 8.158 0.040 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -13.884 9.815 0.017 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -14.681 9.191 1.481 1.00 0.00 H new ATOM 478 N LYS A 31 -18.008 12.528 -0.659 1.00 0.00 N ATOM 479 CA LYS A 31 -19.368 12.845 -1.058 1.00 0.00 C ATOM 480 C LYS A 31 -19.587 12.282 -2.446 1.00 0.00 C ATOM 481 O LYS A 31 -18.827 12.604 -3.359 1.00 0.00 O ATOM 482 CB LYS A 31 -19.612 14.360 -1.066 1.00 0.00 C ATOM 483 CG LYS A 31 -19.260 15.062 0.237 1.00 0.00 C ATOM 484 CD LYS A 31 -20.154 14.617 1.381 1.00 0.00 C ATOM 485 CE LYS A 31 -19.831 15.379 2.656 1.00 0.00 C ATOM 486 NZ LYS A 31 -20.675 14.946 3.800 1.00 0.00 N ATOM 0 H LYS A 31 -17.297 13.168 -1.015 1.00 0.00 H new ATOM 0 HA LYS A 31 -20.066 12.407 -0.344 1.00 0.00 H new ATOM 0 HB2 LYS A 31 -19.029 14.805 -1.873 1.00 0.00 H new ATOM 0 HB3 LYS A 31 -20.662 14.545 -1.292 1.00 0.00 H new ATOM 0 HG2 LYS A 31 -18.219 14.858 0.489 1.00 0.00 H new ATOM 0 HG3 LYS A 31 -19.350 16.140 0.104 1.00 0.00 H new ATOM 0 HD2 LYS A 31 -21.199 14.776 1.113 1.00 0.00 H new ATOM 0 HD3 LYS A 31 -20.028 13.548 1.551 1.00 0.00 H new ATOM 0 HE2 LYS A 31 -18.780 15.234 2.907 1.00 0.00 H new ATOM 0 HE3 LYS A 31 -19.974 16.446 2.485 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 -20.419 15.493 4.647 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 -21.677 15.108 3.573 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 -20.520 13.934 3.982 1.00 0.00 H new ATOM 500 N CYS A 32 -20.577 11.406 -2.585 1.00 0.00 N ATOM 501 CA CYS A 32 -20.874 10.766 -3.867 1.00 0.00 C ATOM 502 C CYS A 32 -22.349 10.921 -4.256 1.00 0.00 C ATOM 503 O CYS A 32 -23.237 10.711 -3.426 1.00 0.00 O ATOM 504 CB CYS A 32 -20.531 9.278 -3.800 1.00 0.00 C ATOM 505 SG CYS A 32 -18.832 8.939 -3.296 1.00 0.00 S ATOM 0 H CYS A 32 -21.192 11.120 -1.823 1.00 0.00 H new ATOM 0 HA CYS A 32 -20.266 11.261 -4.625 1.00 0.00 H new ATOM 0 HB2 CYS A 32 -21.211 8.790 -3.101 1.00 0.00 H new ATOM 0 HB3 CYS A 32 -20.705 8.831 -4.779 1.00 0.00 H new ATOM 0 HG CYS A 32 -18.062 9.913 -3.682 1.00 0.00 H new ATOM 511 N GLU A 33 -22.615 11.308 -5.506 1.00 0.00 N ATOM 512 CA GLU A 33 -23.933 11.127 -6.072 1.00 0.00 C ATOM 513 C GLU A 33 -23.891 9.889 -6.946 1.00 0.00 C ATOM 514 O GLU A 33 -22.805 9.461 -7.338 1.00 0.00 O ATOM 515 CB GLU A 33 -24.339 12.347 -6.899 1.00 0.00 C ATOM 516 CG GLU A 33 -24.928 13.476 -6.075 1.00 0.00 C ATOM 517 CD GLU A 33 -26.339 13.178 -5.627 1.00 0.00 C ATOM 518 OE1 GLU A 33 -26.509 12.506 -4.596 1.00 0.00 O ATOM 519 OE2 GLU A 33 -27.289 13.605 -6.320 1.00 0.00 O ATOM 0 H GLU A 33 -21.937 11.743 -6.131 1.00 0.00 H new ATOM 0 HA GLU A 33 -24.670 11.010 -5.278 1.00 0.00 H new ATOM 0 HB2 GLU A 33 -23.465 12.718 -7.435 1.00 0.00 H new ATOM 0 HB3 GLU A 33 -25.067 12.040 -7.650 1.00 0.00 H new ATOM 0 HG2 GLU A 33 -24.300 13.652 -5.201 1.00 0.00 H new ATOM 0 HG3 GLU A 33 -24.921 14.394 -6.662 1.00 0.00 H new ATOM 526 N PRO A 34 -25.047 9.299 -7.285 1.00 0.00 N ATOM 527 CA PRO A 34 -25.109 8.147 -8.204 1.00 0.00 C ATOM 528 C PRO A 34 -24.693 8.533 -9.628 1.00 0.00 C ATOM 529 O PRO A 34 -24.952 7.805 -10.588 1.00 0.00 O ATOM 530 CB PRO A 34 -26.589 7.733 -8.170 1.00 0.00 C ATOM 531 CG PRO A 34 -27.169 8.411 -6.974 1.00 0.00 C ATOM 532 CD PRO A 34 -26.379 9.673 -6.790 1.00 0.00 C ATOM 0 HA PRO A 34 -24.430 7.348 -7.907 1.00 0.00 H new ATOM 0 HB2 PRO A 34 -27.103 8.039 -9.081 1.00 0.00 H new ATOM 0 HB3 PRO A 34 -26.691 6.650 -8.095 1.00 0.00 H new ATOM 0 HG2 PRO A 34 -28.226 8.631 -7.124 1.00 0.00 H new ATOM 0 HG3 PRO A 34 -27.098 7.774 -6.092 1.00 0.00 H new ATOM 0 HD2 PRO A 34 -26.803 10.502 -7.357 1.00 0.00 H new ATOM 0 HD3 PRO A 34 -26.350 9.983 -5.745 1.00 0.00 H new ATOM 540 N GLN A 35 -24.029 9.678 -9.736 1.00 0.00 N ATOM 541 CA GLN A 35 -23.642 10.254 -11.013 1.00 0.00 C ATOM 542 C GLN A 35 -22.464 11.232 -10.854 1.00 0.00 C ATOM 543 O GLN A 35 -22.082 11.903 -11.814 1.00 0.00 O ATOM 544 CB GLN A 35 -24.848 10.968 -11.626 1.00 0.00 C ATOM 545 CG GLN A 35 -25.445 12.031 -10.716 1.00 0.00 C ATOM 546 CD GLN A 35 -26.907 12.295 -11.012 1.00 0.00 C ATOM 547 OE1 GLN A 35 -27.360 12.154 -12.145 1.00 0.00 O ATOM 548 NE2 GLN A 35 -27.660 12.673 -9.990 1.00 0.00 N ATOM 0 H GLN A 35 -23.743 10.235 -8.931 1.00 0.00 H new ATOM 0 HA GLN A 35 -23.313 9.452 -11.674 1.00 0.00 H new ATOM 0 HB2 GLN A 35 -24.548 11.431 -12.566 1.00 0.00 H new ATOM 0 HB3 GLN A 35 -25.615 10.231 -11.864 1.00 0.00 H new ATOM 0 HG2 GLN A 35 -25.339 11.717 -9.678 1.00 0.00 H new ATOM 0 HG3 GLN A 35 -24.882 12.958 -10.828 1.00 0.00 H new ATOM 0 HE21 GLN A 35 -27.247 12.779 -9.064 1.00 0.00 H new ATOM 0 HE22 GLN A 35 -28.653 12.858 -10.129 1.00 0.00 H new ATOM 557 N GLY A 36 -21.874 11.312 -9.654 1.00 0.00 N ATOM 558 CA GLY A 36 -20.724 12.182 -9.460 1.00 0.00 C ATOM 559 C GLY A 36 -20.809 13.029 -8.204 1.00 0.00 C ATOM 560 O GLY A 36 -21.851 13.602 -7.910 1.00 0.00 O ATOM 0 H GLY A 36 -22.170 10.796 -8.826 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -19.821 11.573 -9.417 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -20.625 12.838 -10.325 1.00 0.00 H new ATOM 564 N LEU A 37 -19.760 13.002 -7.391 1.00 0.00 N ATOM 565 CA LEU A 37 -19.608 13.954 -6.289 1.00 0.00 C ATOM 566 C LEU A 37 -18.144 14.102 -5.840 1.00 0.00 C ATOM 567 O LEU A 37 -17.232 13.521 -6.434 1.00 0.00 O ATOM 568 CB LEU A 37 -20.560 13.702 -5.129 1.00 0.00 C ATOM 569 CG LEU A 37 -21.747 14.669 -5.027 1.00 0.00 C ATOM 570 CD1 LEU A 37 -22.527 14.416 -3.746 1.00 0.00 C ATOM 571 CD2 LEU A 37 -21.278 16.118 -5.083 1.00 0.00 C ATOM 0 H LEU A 37 -18.997 12.330 -7.472 1.00 0.00 H new ATOM 0 HA LEU A 37 -19.907 14.921 -6.694 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -20.947 12.687 -5.213 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -19.993 13.751 -4.199 1.00 0.00 H new ATOM 0 HG LEU A 37 -22.403 14.491 -5.879 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -23.366 15.110 -3.688 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -22.902 13.392 -3.744 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -21.873 14.564 -2.887 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -22.139 16.782 -5.009 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -20.597 16.312 -4.254 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -20.762 16.297 -6.026 1.00 0.00 H new ATOM 583 N PHE A 38 -17.947 14.917 -4.809 1.00 0.00 N ATOM 584 CA PHE A 38 -16.634 15.430 -4.416 1.00 0.00 C ATOM 585 C PHE A 38 -16.150 14.796 -3.101 1.00 0.00 C ATOM 586 O PHE A 38 -16.902 14.698 -2.141 1.00 0.00 O ATOM 587 CB PHE A 38 -16.744 16.959 -4.280 1.00 0.00 C ATOM 588 CG PHE A 38 -15.566 17.645 -3.639 1.00 0.00 C ATOM 589 CD1 PHE A 38 -14.281 17.182 -3.833 1.00 0.00 C ATOM 590 CD2 PHE A 38 -15.759 18.762 -2.843 1.00 0.00 C ATOM 591 CE1 PHE A 38 -13.202 17.817 -3.248 1.00 0.00 C ATOM 592 CE2 PHE A 38 -14.685 19.404 -2.256 1.00 0.00 C ATOM 593 CZ PHE A 38 -13.406 18.930 -2.459 1.00 0.00 C ATOM 0 H PHE A 38 -18.705 15.246 -4.212 1.00 0.00 H new ATOM 0 HA PHE A 38 -15.897 15.170 -5.176 1.00 0.00 H new ATOM 0 HB2 PHE A 38 -16.892 17.384 -5.273 1.00 0.00 H new ATOM 0 HB3 PHE A 38 -17.636 17.190 -3.698 1.00 0.00 H new ATOM 0 HD1 PHE A 38 -14.116 16.311 -4.450 1.00 0.00 H new ATOM 0 HD2 PHE A 38 -16.759 19.135 -2.679 1.00 0.00 H new ATOM 0 HE1 PHE A 38 -12.202 17.443 -3.408 1.00 0.00 H new ATOM 0 HE2 PHE A 38 -14.847 20.276 -1.639 1.00 0.00 H new ATOM 0 HZ PHE A 38 -12.565 19.430 -2.001 1.00 0.00 H new ATOM 603 N SER A 39 -14.889 14.376 -3.069 1.00 0.00 N ATOM 604 CA SER A 39 -14.297 13.773 -1.876 1.00 0.00 C ATOM 605 C SER A 39 -13.144 14.630 -1.339 1.00 0.00 C ATOM 606 O SER A 39 -12.310 15.114 -2.108 1.00 0.00 O ATOM 607 CB SER A 39 -13.793 12.370 -2.210 1.00 0.00 C ATOM 608 OG SER A 39 -13.271 11.719 -1.064 1.00 0.00 O ATOM 0 H SER A 39 -14.251 14.442 -3.862 1.00 0.00 H new ATOM 0 HA SER A 39 -15.062 13.713 -1.102 1.00 0.00 H new ATOM 0 HB2 SER A 39 -14.609 11.779 -2.626 1.00 0.00 H new ATOM 0 HB3 SER A 39 -13.021 12.433 -2.977 1.00 0.00 H new ATOM 0 HG SER A 39 -13.574 12.185 -0.257 1.00 0.00 H new ATOM 614 N PHE A 40 -13.092 14.799 -0.017 1.00 0.00 N ATOM 615 CA PHE A 40 -12.054 15.606 0.621 1.00 0.00 C ATOM 616 C PHE A 40 -11.514 14.919 1.879 1.00 0.00 C ATOM 617 O PHE A 40 -12.264 14.619 2.812 1.00 0.00 O ATOM 618 CB PHE A 40 -12.606 16.993 0.970 1.00 0.00 C ATOM 619 CG PHE A 40 -11.672 17.834 1.797 1.00 0.00 C ATOM 620 CD1 PHE A 40 -10.379 18.082 1.372 1.00 0.00 C ATOM 621 CD2 PHE A 40 -12.095 18.379 3.000 1.00 0.00 C ATOM 622 CE1 PHE A 40 -9.520 18.856 2.131 1.00 0.00 C ATOM 623 CE2 PHE A 40 -11.243 19.154 3.763 1.00 0.00 C ATOM 624 CZ PHE A 40 -9.953 19.393 3.329 1.00 0.00 C ATOM 0 H PHE A 40 -13.760 14.386 0.634 1.00 0.00 H new ATOM 0 HA PHE A 40 -11.229 15.716 -0.083 1.00 0.00 H new ATOM 0 HB2 PHE A 40 -12.835 17.524 0.046 1.00 0.00 H new ATOM 0 HB3 PHE A 40 -13.545 16.873 1.510 1.00 0.00 H new ATOM 0 HD1 PHE A 40 -10.036 17.666 0.436 1.00 0.00 H new ATOM 0 HD2 PHE A 40 -13.102 18.195 3.344 1.00 0.00 H new ATOM 0 HE1 PHE A 40 -8.513 19.041 1.788 1.00 0.00 H new ATOM 0 HE2 PHE A 40 -11.585 19.573 4.698 1.00 0.00 H new ATOM 0 HZ PHE A 40 -9.285 19.998 3.924 1.00 0.00 H new ATOM 634 N SER A 41 -10.217 14.634 1.880 1.00 0.00 N ATOM 635 CA SER A 41 -9.557 14.032 3.027 1.00 0.00 C ATOM 636 C SER A 41 -8.252 14.766 3.349 1.00 0.00 C ATOM 637 O SER A 41 -7.741 15.531 2.531 1.00 0.00 O ATOM 638 CB SER A 41 -9.296 12.548 2.766 1.00 0.00 C ATOM 639 OG SER A 41 -8.680 11.921 3.879 1.00 0.00 O ATOM 0 H SER A 41 -9.598 14.813 1.089 1.00 0.00 H new ATOM 0 HA SER A 41 -10.214 14.121 3.892 1.00 0.00 H new ATOM 0 HB2 SER A 41 -10.237 12.047 2.541 1.00 0.00 H new ATOM 0 HB3 SER A 41 -8.659 12.439 1.888 1.00 0.00 H new ATOM 0 HG SER A 41 -9.042 12.297 4.708 1.00 0.00 H new ATOM 645 N ALA A 42 -7.726 14.542 4.543 1.00 0.00 N ATOM 646 CA ALA A 42 -6.437 15.096 4.927 1.00 0.00 C ATOM 647 C ALA A 42 -5.384 13.999 4.931 1.00 0.00 C ATOM 648 O ALA A 42 -5.669 12.868 5.305 1.00 0.00 O ATOM 649 CB ALA A 42 -6.526 15.751 6.296 1.00 0.00 C ATOM 0 H ALA A 42 -8.174 13.978 5.265 1.00 0.00 H new ATOM 0 HA ALA A 42 -6.151 15.858 4.202 1.00 0.00 H new ATOM 0 HB1 ALA A 42 -5.553 16.160 6.568 1.00 0.00 H new ATOM 0 HB2 ALA A 42 -7.262 16.554 6.268 1.00 0.00 H new ATOM 0 HB3 ALA A 42 -6.827 15.009 7.036 1.00 0.00 H new ATOM 655 N LEU A 43 -4.171 14.324 4.507 1.00 0.00 N ATOM 656 CA LEU A 43 -3.092 13.345 4.467 1.00 0.00 C ATOM 657 C LEU A 43 -2.238 13.458 5.713 1.00 0.00 C ATOM 658 O LEU A 43 -1.552 14.464 5.915 1.00 0.00 O ATOM 659 CB LEU A 43 -2.219 13.546 3.233 1.00 0.00 C ATOM 660 CG LEU A 43 -2.977 13.617 1.912 1.00 0.00 C ATOM 661 CD1 LEU A 43 -2.016 13.833 0.753 1.00 0.00 C ATOM 662 CD2 LEU A 43 -3.797 12.355 1.706 1.00 0.00 C ATOM 0 H LEU A 43 -3.909 15.256 4.186 1.00 0.00 H new ATOM 0 HA LEU A 43 -3.540 12.352 4.421 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -1.648 14.466 3.357 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -1.500 12.729 3.178 1.00 0.00 H new ATOM 0 HG LEU A 43 -3.658 14.467 1.948 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -2.577 13.881 -0.181 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -1.474 14.767 0.899 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -1.308 13.006 0.709 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -4.333 12.420 0.759 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -3.135 11.489 1.690 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -4.513 12.249 2.521 1.00 0.00 H new ATOM 674 N GLY A 44 -2.248 12.402 6.513 1.00 0.00 N ATOM 675 CA GLY A 44 -1.630 12.445 7.828 1.00 0.00 C ATOM 676 C GLY A 44 -0.121 12.377 7.777 1.00 0.00 C ATOM 677 O GLY A 44 0.563 13.305 8.211 1.00 0.00 O ATOM 0 H GLY A 44 -2.676 11.507 6.275 1.00 0.00 H new ATOM 0 HA2 GLY A 44 -1.929 13.363 8.334 1.00 0.00 H new ATOM 0 HA3 GLY A 44 -2.005 11.615 8.426 1.00 0.00 H new ATOM 681 N ALA A 45 0.399 11.289 7.228 1.00 0.00 N ATOM 682 CA ALA A 45 1.844 11.086 7.131 1.00 0.00 C ATOM 683 C ALA A 45 2.481 12.035 6.120 1.00 0.00 C ATOM 684 O ALA A 45 3.692 12.009 5.909 1.00 0.00 O ATOM 685 CB ALA A 45 2.150 9.643 6.762 1.00 0.00 C ATOM 0 H ALA A 45 -0.158 10.528 6.840 1.00 0.00 H new ATOM 0 HA ALA A 45 2.274 11.305 8.108 1.00 0.00 H new ATOM 0 HB1 ALA A 45 3.229 9.506 6.693 1.00 0.00 H new ATOM 0 HB2 ALA A 45 1.748 8.979 7.527 1.00 0.00 H new ATOM 0 HB3 ALA A 45 1.692 9.408 5.801 1.00 0.00 H new ATOM 691 N GLN A 46 1.660 12.859 5.486 1.00 0.00 N ATOM 692 CA GLN A 46 2.155 13.834 4.526 1.00 0.00 C ATOM 693 C GLN A 46 2.037 15.247 5.094 1.00 0.00 C ATOM 694 O GLN A 46 2.845 16.120 4.783 1.00 0.00 O ATOM 695 CB GLN A 46 1.371 13.738 3.216 1.00 0.00 C ATOM 696 CG GLN A 46 1.372 12.351 2.586 1.00 0.00 C ATOM 697 CD GLN A 46 2.741 11.910 2.103 1.00 0.00 C ATOM 698 OE1 GLN A 46 3.117 12.161 0.960 1.00 0.00 O ATOM 699 NE2 GLN A 46 3.492 11.242 2.962 1.00 0.00 N ATOM 0 H GLN A 46 0.649 12.872 5.619 1.00 0.00 H new ATOM 0 HA GLN A 46 3.205 13.617 4.328 1.00 0.00 H new ATOM 0 HB2 GLN A 46 0.340 14.040 3.400 1.00 0.00 H new ATOM 0 HB3 GLN A 46 1.789 14.449 2.503 1.00 0.00 H new ATOM 0 HG2 GLN A 46 1.002 11.629 3.314 1.00 0.00 H new ATOM 0 HG3 GLN A 46 0.678 12.341 1.746 1.00 0.00 H new ATOM 0 HE21 GLN A 46 3.146 11.053 3.903 1.00 0.00 H new ATOM 0 HE22 GLN A 46 4.418 10.916 2.684 1.00 0.00 H new ATOM 708 N GLY A 47 1.025 15.458 5.934 1.00 0.00 N ATOM 709 CA GLY A 47 0.765 16.780 6.486 1.00 0.00 C ATOM 710 C GLY A 47 0.111 17.694 5.469 1.00 0.00 C ATOM 711 O GLY A 47 0.090 18.914 5.630 1.00 0.00 O ATOM 0 H GLY A 47 0.377 14.734 6.244 1.00 0.00 H new ATOM 0 HA2 GLY A 47 0.121 16.689 7.361 1.00 0.00 H new ATOM 0 HA3 GLY A 47 1.701 17.223 6.825 1.00 0.00 H new ATOM 715 N GLU A 48 -0.429 17.096 4.420 1.00 0.00 N ATOM 716 CA GLU A 48 -0.972 17.854 3.302 1.00 0.00 C ATOM 717 C GLU A 48 -2.452 17.535 3.113 1.00 0.00 C ATOM 718 O GLU A 48 -2.935 16.535 3.627 1.00 0.00 O ATOM 719 CB GLU A 48 -0.180 17.549 2.025 1.00 0.00 C ATOM 720 CG GLU A 48 -0.467 18.513 0.887 1.00 0.00 C ATOM 721 CD GLU A 48 -0.323 19.959 1.309 1.00 0.00 C ATOM 722 OE1 GLU A 48 0.809 20.479 1.288 1.00 0.00 O ATOM 723 OE2 GLU A 48 -1.344 20.578 1.673 1.00 0.00 O ATOM 0 H GLU A 48 -0.504 16.084 4.318 1.00 0.00 H new ATOM 0 HA GLU A 48 -0.880 18.918 3.518 1.00 0.00 H new ATOM 0 HB2 GLU A 48 0.886 17.576 2.253 1.00 0.00 H new ATOM 0 HB3 GLU A 48 -0.410 16.535 1.698 1.00 0.00 H new ATOM 0 HG2 GLU A 48 0.213 18.309 0.060 1.00 0.00 H new ATOM 0 HG3 GLU A 48 -1.478 18.344 0.517 1.00 0.00 H new ATOM 730 N ARG A 49 -3.174 18.386 2.403 1.00 0.00 N ATOM 731 CA ARG A 49 -4.587 18.133 2.132 1.00 0.00 C ATOM 732 C ARG A 49 -4.760 17.443 0.781 1.00 0.00 C ATOM 733 O ARG A 49 -3.912 17.558 -0.107 1.00 0.00 O ATOM 734 CB ARG A 49 -5.410 19.427 2.186 1.00 0.00 C ATOM 735 CG ARG A 49 -5.635 19.952 3.597 1.00 0.00 C ATOM 736 CD ARG A 49 -4.367 20.535 4.201 1.00 0.00 C ATOM 737 NE ARG A 49 -4.504 20.782 5.634 1.00 0.00 N ATOM 738 CZ ARG A 49 -4.017 21.852 6.260 1.00 0.00 C ATOM 739 NH1 ARG A 49 -3.385 22.804 5.581 1.00 0.00 N ATOM 740 NH2 ARG A 49 -4.163 21.961 7.573 1.00 0.00 N ATOM 0 H ARG A 49 -2.812 19.253 2.005 1.00 0.00 H new ATOM 0 HA ARG A 49 -4.960 17.470 2.912 1.00 0.00 H new ATOM 0 HB2 ARG A 49 -4.904 20.194 1.599 1.00 0.00 H new ATOM 0 HB3 ARG A 49 -6.377 19.252 1.715 1.00 0.00 H new ATOM 0 HG2 ARG A 49 -6.412 20.716 3.579 1.00 0.00 H new ATOM 0 HG3 ARG A 49 -5.999 19.143 4.230 1.00 0.00 H new ATOM 0 HD2 ARG A 49 -3.536 19.850 4.029 1.00 0.00 H new ATOM 0 HD3 ARG A 49 -4.121 21.468 3.695 1.00 0.00 H new ATOM 0 HE ARG A 49 -5.005 20.090 6.191 1.00 0.00 H new ATOM 0 HH11 ARG A 49 -3.269 22.719 4.571 1.00 0.00 H new ATOM 0 HH12 ARG A 49 -3.016 23.620 6.070 1.00 0.00 H new ATOM 0 HH21 ARG A 49 -4.645 21.229 8.095 1.00 0.00 H new ATOM 0 HH22 ARG A 49 -3.793 22.777 8.061 1.00 0.00 H new ATOM 754 N PHE A 50 -5.859 16.720 0.633 1.00 0.00 N ATOM 755 CA PHE A 50 -6.101 15.926 -0.561 1.00 0.00 C ATOM 756 C PHE A 50 -7.579 15.955 -0.939 1.00 0.00 C ATOM 757 O PHE A 50 -8.454 15.899 -0.075 1.00 0.00 O ATOM 758 CB PHE A 50 -5.607 14.493 -0.311 1.00 0.00 C ATOM 759 CG PHE A 50 -6.497 13.399 -0.831 1.00 0.00 C ATOM 760 CD1 PHE A 50 -6.458 13.020 -2.161 1.00 0.00 C ATOM 761 CD2 PHE A 50 -7.368 12.742 0.023 1.00 0.00 C ATOM 762 CE1 PHE A 50 -7.270 12.007 -2.627 1.00 0.00 C ATOM 763 CE2 PHE A 50 -8.182 11.728 -0.438 1.00 0.00 C ATOM 764 CZ PHE A 50 -8.134 11.361 -1.766 1.00 0.00 C ATOM 0 H PHE A 50 -6.602 16.667 1.330 1.00 0.00 H new ATOM 0 HA PHE A 50 -5.551 16.347 -1.403 1.00 0.00 H new ATOM 0 HB2 PHE A 50 -4.622 14.383 -0.766 1.00 0.00 H new ATOM 0 HB3 PHE A 50 -5.480 14.354 0.763 1.00 0.00 H new ATOM 0 HD1 PHE A 50 -5.785 13.522 -2.841 1.00 0.00 H new ATOM 0 HD2 PHE A 50 -7.410 13.028 1.064 1.00 0.00 H new ATOM 0 HE1 PHE A 50 -7.230 11.719 -3.667 1.00 0.00 H new ATOM 0 HE2 PHE A 50 -8.855 11.223 0.239 1.00 0.00 H new ATOM 0 HZ PHE A 50 -8.771 10.570 -2.132 1.00 0.00 H new ATOM 774 N GLU A 51 -7.861 16.046 -2.229 1.00 0.00 N ATOM 775 CA GLU A 51 -9.241 16.080 -2.686 1.00 0.00 C ATOM 776 C GLU A 51 -9.350 15.603 -4.125 1.00 0.00 C ATOM 777 O GLU A 51 -8.356 15.566 -4.852 1.00 0.00 O ATOM 778 CB GLU A 51 -9.824 17.492 -2.568 1.00 0.00 C ATOM 779 CG GLU A 51 -9.138 18.507 -3.463 1.00 0.00 C ATOM 780 CD GLU A 51 -9.850 19.842 -3.480 1.00 0.00 C ATOM 781 OE1 GLU A 51 -10.788 20.010 -4.289 1.00 0.00 O ATOM 782 OE2 GLU A 51 -9.476 20.735 -2.689 1.00 0.00 O ATOM 0 H GLU A 51 -7.162 16.097 -2.970 1.00 0.00 H new ATOM 0 HA GLU A 51 -9.813 15.407 -2.047 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -10.885 17.460 -2.815 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -9.748 17.823 -1.532 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -8.112 18.651 -3.124 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -9.086 18.114 -4.478 1.00 0.00 H new ATOM 789 N PHE A 52 -10.559 15.227 -4.518 1.00 0.00 N ATOM 790 CA PHE A 52 -10.849 14.840 -5.889 1.00 0.00 C ATOM 791 C PHE A 52 -12.354 14.744 -6.080 1.00 0.00 C ATOM 792 O PHE A 52 -13.083 14.412 -5.147 1.00 0.00 O ATOM 793 CB PHE A 52 -10.182 13.501 -6.251 1.00 0.00 C ATOM 794 CG PHE A 52 -10.749 12.306 -5.529 1.00 0.00 C ATOM 795 CD1 PHE A 52 -10.361 12.010 -4.234 1.00 0.00 C ATOM 796 CD2 PHE A 52 -11.665 11.477 -6.153 1.00 0.00 C ATOM 797 CE1 PHE A 52 -10.876 10.910 -3.575 1.00 0.00 C ATOM 798 CE2 PHE A 52 -12.184 10.376 -5.498 1.00 0.00 C ATOM 799 CZ PHE A 52 -11.788 10.094 -4.207 1.00 0.00 C ATOM 0 H PHE A 52 -11.365 15.182 -3.895 1.00 0.00 H new ATOM 0 HA PHE A 52 -10.441 15.601 -6.554 1.00 0.00 H new ATOM 0 HB2 PHE A 52 -10.278 13.340 -7.325 1.00 0.00 H new ATOM 0 HB3 PHE A 52 -9.116 13.570 -6.033 1.00 0.00 H new ATOM 0 HD1 PHE A 52 -9.647 12.646 -3.732 1.00 0.00 H new ATOM 0 HD2 PHE A 52 -11.978 11.693 -7.164 1.00 0.00 H new ATOM 0 HE1 PHE A 52 -10.564 10.690 -2.565 1.00 0.00 H new ATOM 0 HE2 PHE A 52 -12.898 9.737 -5.996 1.00 0.00 H new ATOM 0 HZ PHE A 52 -12.192 9.235 -3.693 1.00 0.00 H new ATOM 809 N SER A 53 -12.821 15.046 -7.277 1.00 0.00 N ATOM 810 CA SER A 53 -14.233 14.940 -7.580 1.00 0.00 C ATOM 811 C SER A 53 -14.435 13.993 -8.752 1.00 0.00 C ATOM 812 O SER A 53 -13.896 14.208 -9.836 1.00 0.00 O ATOM 813 CB SER A 53 -14.821 16.318 -7.889 1.00 0.00 C ATOM 814 OG SER A 53 -16.236 16.264 -7.967 1.00 0.00 O ATOM 0 H SER A 53 -12.243 15.366 -8.054 1.00 0.00 H new ATOM 0 HA SER A 53 -14.754 14.540 -6.710 1.00 0.00 H new ATOM 0 HB2 SER A 53 -14.523 17.026 -7.115 1.00 0.00 H new ATOM 0 HB3 SER A 53 -14.416 16.687 -8.831 1.00 0.00 H new ATOM 0 HG SER A 53 -16.554 15.431 -7.561 1.00 0.00 H new ATOM 820 N LEU A 54 -15.195 12.936 -8.525 1.00 0.00 N ATOM 821 CA LEU A 54 -15.434 11.948 -9.560 1.00 0.00 C ATOM 822 C LEU A 54 -16.866 12.025 -10.050 1.00 0.00 C ATOM 823 O LEU A 54 -17.798 11.738 -9.299 1.00 0.00 O ATOM 824 CB LEU A 54 -15.146 10.533 -9.046 1.00 0.00 C ATOM 825 CG LEU A 54 -13.681 10.223 -8.733 1.00 0.00 C ATOM 826 CD1 LEU A 54 -13.537 8.785 -8.262 1.00 0.00 C ATOM 827 CD2 LEU A 54 -12.803 10.475 -9.951 1.00 0.00 C ATOM 0 H LEU A 54 -15.655 12.741 -7.636 1.00 0.00 H new ATOM 0 HA LEU A 54 -14.759 12.166 -10.387 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -15.733 10.369 -8.143 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -15.498 9.818 -9.790 1.00 0.00 H new ATOM 0 HG LEU A 54 -13.352 10.888 -7.934 1.00 0.00 H new ATOM 0 HD11 LEU A 54 -12.490 8.577 -8.043 1.00 0.00 H new ATOM 0 HD12 LEU A 54 -14.133 8.636 -7.362 1.00 0.00 H new ATOM 0 HD13 LEU A 54 -13.885 8.110 -9.044 1.00 0.00 H new ATOM 0 HD21 LEU A 54 -11.766 10.248 -9.705 1.00 0.00 H new ATOM 0 HD22 LEU A 54 -13.129 9.837 -10.773 1.00 0.00 H new ATOM 0 HD23 LEU A 54 -12.885 11.520 -10.248 1.00 0.00 H new ATOM 839 N GLU A 55 -17.040 12.444 -11.293 1.00 0.00 N ATOM 840 CA GLU A 55 -18.336 12.362 -11.935 1.00 0.00 C ATOM 841 C GLU A 55 -18.506 10.979 -12.534 1.00 0.00 C ATOM 842 O GLU A 55 -17.563 10.428 -13.107 1.00 0.00 O ATOM 843 CB GLU A 55 -18.498 13.418 -13.023 1.00 0.00 C ATOM 844 CG GLU A 55 -18.905 14.787 -12.514 1.00 0.00 C ATOM 845 CD GLU A 55 -19.393 15.680 -13.634 1.00 0.00 C ATOM 846 OE1 GLU A 55 -20.304 15.256 -14.378 1.00 0.00 O ATOM 847 OE2 GLU A 55 -18.861 16.800 -13.790 1.00 0.00 O ATOM 0 H GLU A 55 -16.302 12.842 -11.873 1.00 0.00 H new ATOM 0 HA GLU A 55 -19.102 12.546 -11.182 1.00 0.00 H new ATOM 0 HB2 GLU A 55 -17.557 13.511 -13.565 1.00 0.00 H new ATOM 0 HB3 GLU A 55 -19.245 13.073 -13.738 1.00 0.00 H new ATOM 0 HG2 GLU A 55 -19.691 14.678 -11.767 1.00 0.00 H new ATOM 0 HG3 GLU A 55 -18.056 15.257 -12.017 1.00 0.00 H new ATOM 854 N LEU A 56 -19.696 10.420 -12.409 1.00 0.00 N ATOM 855 CA LEU A 56 -19.943 9.063 -12.867 1.00 0.00 C ATOM 856 C LEU A 56 -20.807 9.056 -14.123 1.00 0.00 C ATOM 857 O LEU A 56 -21.925 9.566 -14.126 1.00 0.00 O ATOM 858 CB LEU A 56 -20.603 8.217 -11.768 1.00 0.00 C ATOM 859 CG LEU A 56 -19.706 7.829 -10.576 1.00 0.00 C ATOM 860 CD1 LEU A 56 -18.379 7.264 -11.054 1.00 0.00 C ATOM 861 CD2 LEU A 56 -19.482 9.002 -9.639 1.00 0.00 C ATOM 0 H LEU A 56 -20.505 10.883 -11.995 1.00 0.00 H new ATOM 0 HA LEU A 56 -18.977 8.621 -13.109 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -21.464 8.765 -11.385 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -20.984 7.302 -12.222 1.00 0.00 H new ATOM 0 HG LEU A 56 -20.228 7.053 -10.016 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -17.765 6.998 -10.193 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -18.559 6.376 -11.659 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -17.860 8.012 -11.653 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -18.845 8.690 -8.811 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -18.999 9.814 -10.182 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -20.441 9.345 -9.250 1.00 0.00 H new ATOM 873 N TYR A 57 -20.261 8.494 -15.193 1.00 0.00 N ATOM 874 CA TYR A 57 -21.008 8.302 -16.430 1.00 0.00 C ATOM 875 C TYR A 57 -21.975 7.142 -16.260 1.00 0.00 C ATOM 876 O TYR A 57 -23.111 7.177 -16.734 1.00 0.00 O ATOM 877 CB TYR A 57 -20.047 8.022 -17.590 1.00 0.00 C ATOM 878 CG TYR A 57 -20.730 7.767 -18.920 1.00 0.00 C ATOM 879 CD1 TYR A 57 -21.113 8.818 -19.744 1.00 0.00 C ATOM 880 CD2 TYR A 57 -20.993 6.470 -19.352 1.00 0.00 C ATOM 881 CE1 TYR A 57 -21.737 8.587 -20.955 1.00 0.00 C ATOM 882 CE2 TYR A 57 -21.617 6.231 -20.562 1.00 0.00 C ATOM 883 CZ TYR A 57 -21.987 7.293 -21.359 1.00 0.00 C ATOM 884 OH TYR A 57 -22.612 7.062 -22.568 1.00 0.00 O ATOM 0 H TYR A 57 -19.298 8.161 -15.229 1.00 0.00 H new ATOM 0 HA TYR A 57 -21.569 9.209 -16.656 1.00 0.00 H new ATOM 0 HB2 TYR A 57 -19.371 8.870 -17.699 1.00 0.00 H new ATOM 0 HB3 TYR A 57 -19.434 7.156 -17.338 1.00 0.00 H new ATOM 0 HD1 TYR A 57 -20.920 9.834 -19.432 1.00 0.00 H new ATOM 0 HD2 TYR A 57 -20.704 5.635 -18.730 1.00 0.00 H new ATOM 0 HE1 TYR A 57 -22.028 9.417 -21.582 1.00 0.00 H new ATOM 0 HE2 TYR A 57 -21.813 5.218 -20.881 1.00 0.00 H new ATOM 0 HH TYR A 57 -22.713 6.097 -22.705 1.00 0.00 H new ATOM 894 N GLY A 58 -21.504 6.114 -15.571 1.00 0.00 N ATOM 895 CA GLY A 58 -22.338 4.976 -15.276 1.00 0.00 C ATOM 896 C GLY A 58 -23.000 5.124 -13.929 1.00 0.00 C ATOM 897 O GLY A 58 -22.336 5.461 -12.950 1.00 0.00 O ATOM 0 H GLY A 58 -20.552 6.051 -15.210 1.00 0.00 H new ATOM 0 HA2 GLY A 58 -23.099 4.869 -16.049 1.00 0.00 H new ATOM 0 HA3 GLY A 58 -21.737 4.067 -15.292 1.00 0.00 H new ATOM 901 N LYS A 59 -24.300 4.867 -13.880 1.00 0.00 N ATOM 902 CA LYS A 59 -25.074 5.055 -12.663 1.00 0.00 C ATOM 903 C LYS A 59 -24.562 4.171 -11.533 1.00 0.00 C ATOM 904 O LYS A 59 -24.296 2.978 -11.725 1.00 0.00 O ATOM 905 CB LYS A 59 -26.552 4.775 -12.924 1.00 0.00 C ATOM 906 CG LYS A 59 -27.198 5.763 -13.880 1.00 0.00 C ATOM 907 CD LYS A 59 -27.124 7.184 -13.340 1.00 0.00 C ATOM 908 CE LYS A 59 -27.822 8.175 -14.258 1.00 0.00 C ATOM 909 NZ LYS A 59 -29.264 7.857 -14.427 1.00 0.00 N ATOM 0 H LYS A 59 -24.842 4.526 -14.674 1.00 0.00 H new ATOM 0 HA LYS A 59 -24.958 6.094 -12.354 1.00 0.00 H new ATOM 0 HB2 LYS A 59 -26.657 3.769 -13.329 1.00 0.00 H new ATOM 0 HB3 LYS A 59 -27.090 4.794 -11.976 1.00 0.00 H new ATOM 0 HG2 LYS A 59 -26.701 5.713 -14.849 1.00 0.00 H new ATOM 0 HG3 LYS A 59 -28.240 5.487 -14.042 1.00 0.00 H new ATOM 0 HD2 LYS A 59 -27.581 7.221 -12.351 1.00 0.00 H new ATOM 0 HD3 LYS A 59 -26.080 7.473 -13.220 1.00 0.00 H new ATOM 0 HE2 LYS A 59 -27.718 9.181 -13.852 1.00 0.00 H new ATOM 0 HE3 LYS A 59 -27.334 8.173 -15.232 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 -29.754 8.676 -14.840 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 -29.367 7.037 -15.059 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 -29.681 7.634 -13.501 1.00 0.00 H new ATOM 923 N ILE A 60 -24.420 4.768 -10.364 1.00 0.00 N ATOM 924 CA ILE A 60 -23.921 4.066 -9.197 1.00 0.00 C ATOM 925 C ILE A 60 -25.082 3.599 -8.333 1.00 0.00 C ATOM 926 O ILE A 60 -26.146 4.220 -8.326 1.00 0.00 O ATOM 927 CB ILE A 60 -23.008 4.978 -8.348 1.00 0.00 C ATOM 928 CG1 ILE A 60 -21.964 5.676 -9.221 1.00 0.00 C ATOM 929 CG2 ILE A 60 -22.321 4.195 -7.242 1.00 0.00 C ATOM 930 CD1 ILE A 60 -21.065 4.717 -9.975 1.00 0.00 C ATOM 0 H ILE A 60 -24.646 5.749 -10.197 1.00 0.00 H new ATOM 0 HA ILE A 60 -23.345 3.210 -9.547 1.00 0.00 H new ATOM 0 HB ILE A 60 -23.643 5.736 -7.890 1.00 0.00 H new ATOM 0 HG12 ILE A 60 -22.474 6.322 -9.936 1.00 0.00 H new ATOM 0 HG13 ILE A 60 -21.349 6.320 -8.592 1.00 0.00 H new ATOM 0 HG21 ILE A 60 -21.686 4.865 -6.663 1.00 0.00 H new ATOM 0 HG22 ILE A 60 -23.073 3.752 -6.589 1.00 0.00 H new ATOM 0 HG23 ILE A 60 -21.711 3.405 -7.680 1.00 0.00 H new ATOM 0 HD11 ILE A 60 -20.350 5.282 -10.573 1.00 0.00 H new ATOM 0 HD12 ILE A 60 -20.528 4.088 -9.265 1.00 0.00 H new ATOM 0 HD13 ILE A 60 -21.670 4.090 -10.630 1.00 0.00 H new ATOM 942 N MET A 61 -24.869 2.519 -7.596 1.00 0.00 N ATOM 943 CA MET A 61 -25.877 2.024 -6.675 1.00 0.00 C ATOM 944 C MET A 61 -25.885 2.918 -5.448 1.00 0.00 C ATOM 945 O MET A 61 -26.926 3.144 -4.838 1.00 0.00 O ATOM 946 CB MET A 61 -25.598 0.574 -6.263 1.00 0.00 C ATOM 947 CG MET A 61 -26.644 0.006 -5.320 1.00 0.00 C ATOM 948 SD MET A 61 -26.285 -1.685 -4.809 1.00 0.00 S ATOM 949 CE MET A 61 -26.483 -2.562 -6.361 1.00 0.00 C ATOM 0 H MET A 61 -24.009 1.971 -7.619 1.00 0.00 H new ATOM 0 HA MET A 61 -26.848 2.042 -7.169 1.00 0.00 H new ATOM 0 HB2 MET A 61 -25.549 -0.048 -7.157 1.00 0.00 H new ATOM 0 HB3 MET A 61 -24.620 0.521 -5.784 1.00 0.00 H new ATOM 0 HG2 MET A 61 -26.712 0.640 -4.436 1.00 0.00 H new ATOM 0 HG3 MET A 61 -27.618 0.034 -5.808 1.00 0.00 H new ATOM 0 HE1 MET A 61 -26.787 -3.590 -6.162 1.00 0.00 H new ATOM 0 HE2 MET A 61 -27.246 -2.068 -6.963 1.00 0.00 H new ATOM 0 HE3 MET A 61 -25.537 -2.562 -6.902 1.00 0.00 H new ATOM 959 N THR A 62 -24.695 3.410 -5.101 1.00 0.00 N ATOM 960 CA THR A 62 -24.512 4.387 -4.027 1.00 0.00 C ATOM 961 C THR A 62 -24.660 3.752 -2.639 1.00 0.00 C ATOM 962 O THR A 62 -23.980 4.152 -1.692 1.00 0.00 O ATOM 963 CB THR A 62 -25.494 5.567 -4.195 1.00 0.00 C ATOM 964 OG1 THR A 62 -25.491 6.002 -5.563 1.00 0.00 O ATOM 965 CG2 THR A 62 -25.111 6.738 -3.306 1.00 0.00 C ATOM 0 H THR A 62 -23.825 3.140 -5.560 1.00 0.00 H new ATOM 0 HA THR A 62 -23.492 4.765 -4.101 1.00 0.00 H new ATOM 0 HB THR A 62 -26.487 5.222 -3.906 1.00 0.00 H new ATOM 0 HG1 THR A 62 -25.065 6.882 -5.625 1.00 0.00 H new ATOM 0 HG21 THR A 62 -25.823 7.551 -3.449 1.00 0.00 H new ATOM 0 HG22 THR A 62 -25.125 6.423 -2.263 1.00 0.00 H new ATOM 0 HG23 THR A 62 -24.110 7.081 -3.568 1.00 0.00 H new ATOM 973 N GLU A 63 -25.538 2.761 -2.534 1.00 0.00 N ATOM 974 CA GLU A 63 -25.778 2.055 -1.282 1.00 0.00 C ATOM 975 C GLU A 63 -24.497 1.391 -0.774 1.00 0.00 C ATOM 976 O GLU A 63 -23.996 1.722 0.303 1.00 0.00 O ATOM 977 CB GLU A 63 -26.866 1.000 -1.489 1.00 0.00 C ATOM 978 CG GLU A 63 -27.380 0.389 -0.199 1.00 0.00 C ATOM 979 CD GLU A 63 -28.021 1.418 0.705 1.00 0.00 C ATOM 980 OE1 GLU A 63 -29.138 1.873 0.392 1.00 0.00 O ATOM 981 OE2 GLU A 63 -27.410 1.783 1.730 1.00 0.00 O ATOM 0 H GLU A 63 -26.103 2.425 -3.314 1.00 0.00 H new ATOM 0 HA GLU A 63 -26.106 2.777 -0.534 1.00 0.00 H new ATOM 0 HB2 GLU A 63 -27.701 1.453 -2.024 1.00 0.00 H new ATOM 0 HB3 GLU A 63 -26.473 0.206 -2.125 1.00 0.00 H new ATOM 0 HG2 GLU A 63 -28.106 -0.390 -0.432 1.00 0.00 H new ATOM 0 HG3 GLU A 63 -26.555 -0.091 0.327 1.00 0.00 H new ATOM 988 N TYR A 64 -23.969 0.456 -1.554 1.00 0.00 N ATOM 989 CA TYR A 64 -22.747 -0.234 -1.179 1.00 0.00 C ATOM 990 C TYR A 64 -21.528 0.584 -1.579 1.00 0.00 C ATOM 991 O TYR A 64 -21.232 0.746 -2.765 1.00 0.00 O ATOM 992 CB TYR A 64 -22.683 -1.622 -1.816 1.00 0.00 C ATOM 993 CG TYR A 64 -23.677 -2.600 -1.235 1.00 0.00 C ATOM 994 CD1 TYR A 64 -23.454 -3.183 0.004 1.00 0.00 C ATOM 995 CD2 TYR A 64 -24.835 -2.937 -1.921 1.00 0.00 C ATOM 996 CE1 TYR A 64 -24.358 -4.074 0.545 1.00 0.00 C ATOM 997 CE2 TYR A 64 -25.746 -3.829 -1.390 1.00 0.00 C ATOM 998 CZ TYR A 64 -25.502 -4.394 -0.154 1.00 0.00 C ATOM 999 OH TYR A 64 -26.408 -5.279 0.384 1.00 0.00 O ATOM 0 H TYR A 64 -24.367 0.161 -2.445 1.00 0.00 H new ATOM 0 HA TYR A 64 -22.749 -0.355 -0.096 1.00 0.00 H new ATOM 0 HB2 TYR A 64 -22.861 -1.529 -2.887 1.00 0.00 H new ATOM 0 HB3 TYR A 64 -21.677 -2.023 -1.693 1.00 0.00 H new ATOM 0 HD1 TYR A 64 -22.558 -2.935 0.554 1.00 0.00 H new ATOM 0 HD2 TYR A 64 -25.027 -2.494 -2.887 1.00 0.00 H new ATOM 0 HE1 TYR A 64 -24.170 -4.518 1.511 1.00 0.00 H new ATOM 0 HE2 TYR A 64 -26.642 -4.083 -1.937 1.00 0.00 H new ATOM 0 HH TYR A 64 -27.159 -5.395 -0.235 1.00 0.00 H new ATOM 1009 N ARG A 65 -20.846 1.119 -0.576 1.00 0.00 N ATOM 1010 CA ARG A 65 -19.639 1.899 -0.784 1.00 0.00 C ATOM 1011 C ARG A 65 -18.754 1.813 0.456 1.00 0.00 C ATOM 1012 O ARG A 65 -19.217 2.037 1.576 1.00 0.00 O ATOM 1013 CB ARG A 65 -19.987 3.361 -1.101 1.00 0.00 C ATOM 1014 CG ARG A 65 -20.701 4.090 0.032 1.00 0.00 C ATOM 1015 CD ARG A 65 -21.159 5.475 -0.391 1.00 0.00 C ATOM 1016 NE ARG A 65 -21.619 6.265 0.751 1.00 0.00 N ATOM 1017 CZ ARG A 65 -22.870 6.696 0.910 1.00 0.00 C ATOM 1018 NH1 ARG A 65 -23.813 6.363 0.032 1.00 0.00 N ATOM 1019 NH2 ARG A 65 -23.184 7.438 1.963 1.00 0.00 N ATOM 0 H ARG A 65 -21.115 1.023 0.403 1.00 0.00 H new ATOM 0 HA ARG A 65 -19.096 1.491 -1.636 1.00 0.00 H new ATOM 0 HB2 ARG A 65 -19.070 3.898 -1.343 1.00 0.00 H new ATOM 0 HB3 ARG A 65 -20.616 3.389 -1.990 1.00 0.00 H new ATOM 0 HG2 ARG A 65 -21.562 3.505 0.355 1.00 0.00 H new ATOM 0 HG3 ARG A 65 -20.033 4.174 0.889 1.00 0.00 H new ATOM 0 HD2 ARG A 65 -20.338 5.994 -0.886 1.00 0.00 H new ATOM 0 HD3 ARG A 65 -21.965 5.385 -1.120 1.00 0.00 H new ATOM 0 HE ARG A 65 -20.938 6.501 1.473 1.00 0.00 H new ATOM 0 HH11 ARG A 65 -23.580 5.775 -0.768 1.00 0.00 H new ATOM 0 HH12 ARG A 65 -24.769 6.696 0.159 1.00 0.00 H new ATOM 0 HH21 ARG A 65 -22.469 7.678 2.649 1.00 0.00 H new ATOM 0 HH22 ARG A 65 -24.141 7.769 2.087 1.00 0.00 H new ATOM 1033 N LYS A 66 -17.493 1.464 0.262 1.00 0.00 N ATOM 1034 CA LYS A 66 -16.552 1.364 1.370 1.00 0.00 C ATOM 1035 C LYS A 66 -15.125 1.312 0.843 1.00 0.00 C ATOM 1036 O LYS A 66 -14.901 0.966 -0.317 1.00 0.00 O ATOM 1037 CB LYS A 66 -16.826 0.112 2.208 1.00 0.00 C ATOM 1038 CG LYS A 66 -16.094 0.104 3.541 1.00 0.00 C ATOM 1039 CD LYS A 66 -15.955 -1.299 4.087 1.00 0.00 C ATOM 1040 CE LYS A 66 -15.256 -1.303 5.436 1.00 0.00 C ATOM 1041 NZ LYS A 66 -15.996 -0.506 6.450 1.00 0.00 N ATOM 0 H LYS A 66 -17.095 1.245 -0.651 1.00 0.00 H new ATOM 0 HA LYS A 66 -16.679 2.245 1.999 1.00 0.00 H new ATOM 0 HB2 LYS A 66 -17.898 0.033 2.390 1.00 0.00 H new ATOM 0 HB3 LYS A 66 -16.534 -0.769 1.637 1.00 0.00 H new ATOM 0 HG2 LYS A 66 -15.106 0.547 3.418 1.00 0.00 H new ATOM 0 HG3 LYS A 66 -16.634 0.723 4.258 1.00 0.00 H new ATOM 0 HD2 LYS A 66 -16.942 -1.752 4.186 1.00 0.00 H new ATOM 0 HD3 LYS A 66 -15.392 -1.911 3.382 1.00 0.00 H new ATOM 0 HE2 LYS A 66 -15.152 -2.330 5.787 1.00 0.00 H new ATOM 0 HE3 LYS A 66 -14.249 -0.901 5.324 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 -16.042 -1.037 7.343 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 -15.504 0.396 6.609 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 -16.960 -0.319 6.108 1.00 0.00 H new ATOM 1055 N ASN A 67 -14.170 1.643 1.696 1.00 0.00 N ATOM 1056 CA ASN A 67 -12.766 1.637 1.317 1.00 0.00 C ATOM 1057 C ASN A 67 -11.937 0.832 2.310 1.00 0.00 C ATOM 1058 O ASN A 67 -12.083 0.971 3.526 1.00 0.00 O ATOM 1059 CB ASN A 67 -12.222 3.070 1.181 1.00 0.00 C ATOM 1060 CG ASN A 67 -12.630 3.996 2.319 1.00 0.00 C ATOM 1061 OD1 ASN A 67 -12.870 3.565 3.451 1.00 0.00 O ATOM 1062 ND2 ASN A 67 -12.706 5.287 2.027 1.00 0.00 N ATOM 0 H ASN A 67 -14.343 1.921 2.662 1.00 0.00 H new ATOM 0 HA ASN A 67 -12.686 1.156 0.342 1.00 0.00 H new ATOM 0 HB2 ASN A 67 -11.134 3.032 1.129 1.00 0.00 H new ATOM 0 HB3 ASN A 67 -12.571 3.493 0.239 1.00 0.00 H new ATOM 0 HD21 ASN A 67 -12.969 5.958 2.748 1.00 0.00 H new ATOM 0 HD22 ASN A 67 -12.501 5.609 1.081 1.00 0.00 H new ATOM 1069 N VAL A 68 -11.092 -0.032 1.783 1.00 0.00 N ATOM 1070 CA VAL A 68 -10.225 -0.858 2.606 1.00 0.00 C ATOM 1071 C VAL A 68 -8.772 -0.477 2.369 1.00 0.00 C ATOM 1072 O VAL A 68 -8.262 -0.615 1.257 1.00 0.00 O ATOM 1073 CB VAL A 68 -10.413 -2.364 2.306 1.00 0.00 C ATOM 1074 CG1 VAL A 68 -9.525 -3.215 3.207 1.00 0.00 C ATOM 1075 CG2 VAL A 68 -11.875 -2.766 2.454 1.00 0.00 C ATOM 0 H VAL A 68 -10.986 -0.182 0.780 1.00 0.00 H new ATOM 0 HA VAL A 68 -10.495 -0.682 3.647 1.00 0.00 H new ATOM 0 HB VAL A 68 -10.114 -2.541 1.273 1.00 0.00 H new ATOM 0 HG11 VAL A 68 -9.676 -4.269 2.976 1.00 0.00 H new ATOM 0 HG12 VAL A 68 -8.480 -2.953 3.040 1.00 0.00 H new ATOM 0 HG13 VAL A 68 -9.783 -3.032 4.250 1.00 0.00 H new ATOM 0 HG21 VAL A 68 -11.984 -3.829 2.238 1.00 0.00 H new ATOM 0 HG22 VAL A 68 -12.206 -2.567 3.473 1.00 0.00 H new ATOM 0 HG23 VAL A 68 -12.483 -2.190 1.756 1.00 0.00 H new ATOM 1085 N GLY A 69 -8.116 0.028 3.404 1.00 0.00 N ATOM 1086 CA GLY A 69 -6.725 0.398 3.275 1.00 0.00 C ATOM 1087 C GLY A 69 -5.810 -0.615 3.911 1.00 0.00 C ATOM 1088 O GLY A 69 -5.721 -0.712 5.136 1.00 0.00 O ATOM 0 H GLY A 69 -8.522 0.187 4.326 1.00 0.00 H new ATOM 0 HA2 GLY A 69 -6.474 0.501 2.219 1.00 0.00 H new ATOM 0 HA3 GLY A 69 -6.565 1.372 3.737 1.00 0.00 H new ATOM 1092 N LEU A 70 -5.139 -1.380 3.077 1.00 0.00 N ATOM 1093 CA LEU A 70 -4.209 -2.389 3.548 1.00 0.00 C ATOM 1094 C LEU A 70 -2.818 -2.064 3.018 1.00 0.00 C ATOM 1095 O LEU A 70 -1.920 -1.678 3.768 1.00 0.00 O ATOM 1096 CB LEU A 70 -4.673 -3.773 3.070 1.00 0.00 C ATOM 1097 CG LEU A 70 -4.058 -4.986 3.781 1.00 0.00 C ATOM 1098 CD1 LEU A 70 -4.878 -6.233 3.485 1.00 0.00 C ATOM 1099 CD2 LEU A 70 -2.616 -5.213 3.351 1.00 0.00 C ATOM 0 H LEU A 70 -5.220 -1.323 2.062 1.00 0.00 H new ATOM 0 HA LEU A 70 -4.176 -2.398 4.637 1.00 0.00 H new ATOM 0 HB2 LEU A 70 -5.756 -3.826 3.180 1.00 0.00 H new ATOM 0 HB3 LEU A 70 -4.456 -3.856 2.005 1.00 0.00 H new ATOM 0 HG LEU A 70 -4.067 -4.783 4.852 1.00 0.00 H new ATOM 0 HD11 LEU A 70 -4.435 -7.089 3.993 1.00 0.00 H new ATOM 0 HD12 LEU A 70 -5.899 -6.090 3.839 1.00 0.00 H new ATOM 0 HD13 LEU A 70 -4.889 -6.415 2.410 1.00 0.00 H new ATOM 0 HD21 LEU A 70 -2.212 -6.080 3.874 1.00 0.00 H new ATOM 0 HD22 LEU A 70 -2.580 -5.389 2.276 1.00 0.00 H new ATOM 0 HD23 LEU A 70 -2.021 -4.333 3.594 1.00 0.00 H new ATOM 1111 N ARG A 71 -2.668 -2.203 1.711 1.00 0.00 N ATOM 1112 CA ARG A 71 -1.439 -1.845 1.021 1.00 0.00 C ATOM 1113 C ARG A 71 -1.617 -0.471 0.379 1.00 0.00 C ATOM 1114 O ARG A 71 -0.667 0.141 -0.104 1.00 0.00 O ATOM 1115 CB ARG A 71 -1.128 -2.913 -0.037 1.00 0.00 C ATOM 1116 CG ARG A 71 0.074 -2.617 -0.922 1.00 0.00 C ATOM 1117 CD ARG A 71 1.377 -2.558 -0.141 1.00 0.00 C ATOM 1118 NE ARG A 71 2.515 -2.344 -1.029 1.00 0.00 N ATOM 1119 CZ ARG A 71 3.715 -1.931 -0.631 1.00 0.00 C ATOM 1120 NH1 ARG A 71 3.961 -1.719 0.656 1.00 0.00 N ATOM 1121 NH2 ARG A 71 4.672 -1.744 -1.528 1.00 0.00 N ATOM 0 H ARG A 71 -3.396 -2.568 1.097 1.00 0.00 H new ATOM 0 HA ARG A 71 -0.604 -1.799 1.720 1.00 0.00 H new ATOM 0 HB2 ARG A 71 -0.962 -3.864 0.468 1.00 0.00 H new ATOM 0 HB3 ARG A 71 -2.005 -3.038 -0.672 1.00 0.00 H new ATOM 0 HG2 ARG A 71 0.151 -3.385 -1.692 1.00 0.00 H new ATOM 0 HG3 ARG A 71 -0.082 -1.667 -1.433 1.00 0.00 H new ATOM 0 HD2 ARG A 71 1.328 -1.753 0.593 1.00 0.00 H new ATOM 0 HD3 ARG A 71 1.514 -3.487 0.413 1.00 0.00 H new ATOM 0 HE ARG A 71 2.381 -2.524 -2.024 1.00 0.00 H new ATOM 0 HH11 ARG A 71 3.227 -1.873 1.348 1.00 0.00 H new ATOM 0 HH12 ARG A 71 4.884 -1.402 0.953 1.00 0.00 H new ATOM 0 HH21 ARG A 71 4.486 -1.917 -2.516 1.00 0.00 H new ATOM 0 HH22 ARG A 71 5.595 -1.427 -1.231 1.00 0.00 H new ATOM 1135 N ASN A 72 -2.856 0.006 0.424 1.00 0.00 N ATOM 1136 CA ASN A 72 -3.268 1.243 -0.217 1.00 0.00 C ATOM 1137 C ASN A 72 -4.755 1.417 0.022 1.00 0.00 C ATOM 1138 O ASN A 72 -5.368 0.574 0.676 1.00 0.00 O ATOM 1139 CB ASN A 72 -2.962 1.231 -1.728 1.00 0.00 C ATOM 1140 CG ASN A 72 -3.453 -0.023 -2.443 1.00 0.00 C ATOM 1141 OD1 ASN A 72 -4.429 -0.654 -2.043 1.00 0.00 O ATOM 1142 ND2 ASN A 72 -2.763 -0.402 -3.510 1.00 0.00 N ATOM 0 H ASN A 72 -3.614 -0.467 0.917 1.00 0.00 H new ATOM 0 HA ASN A 72 -2.710 2.076 0.210 1.00 0.00 H new ATOM 0 HB2 ASN A 72 -3.421 2.105 -2.190 1.00 0.00 H new ATOM 0 HB3 ASN A 72 -1.886 1.323 -1.872 1.00 0.00 H new ATOM 0 HD21 ASN A 72 -3.038 -1.239 -4.024 1.00 0.00 H new ATOM 0 HD22 ASN A 72 -1.958 0.143 -3.817 1.00 0.00 H new ATOM 1149 N ILE A 73 -5.336 2.484 -0.497 1.00 0.00 N ATOM 1150 CA ILE A 73 -6.750 2.742 -0.283 1.00 0.00 C ATOM 1151 C ILE A 73 -7.574 2.178 -1.434 1.00 0.00 C ATOM 1152 O ILE A 73 -7.635 2.768 -2.514 1.00 0.00 O ATOM 1153 CB ILE A 73 -7.041 4.253 -0.132 1.00 0.00 C ATOM 1154 CG1 ILE A 73 -6.216 4.851 1.012 1.00 0.00 C ATOM 1155 CG2 ILE A 73 -8.527 4.493 0.104 1.00 0.00 C ATOM 1156 CD1 ILE A 73 -6.497 4.231 2.365 1.00 0.00 C ATOM 0 H ILE A 73 -4.856 3.181 -1.066 1.00 0.00 H new ATOM 0 HA ILE A 73 -7.032 2.246 0.646 1.00 0.00 H new ATOM 0 HB ILE A 73 -6.754 4.748 -1.060 1.00 0.00 H new ATOM 0 HG12 ILE A 73 -5.157 4.733 0.783 1.00 0.00 H new ATOM 0 HG13 ILE A 73 -6.413 5.922 1.067 1.00 0.00 H new ATOM 0 HG21 ILE A 73 -8.711 5.562 0.208 1.00 0.00 H new ATOM 0 HG22 ILE A 73 -9.097 4.107 -0.741 1.00 0.00 H new ATOM 0 HG23 ILE A 73 -8.838 3.981 1.015 1.00 0.00 H new ATOM 0 HD11 ILE A 73 -5.874 4.709 3.121 1.00 0.00 H new ATOM 0 HD12 ILE A 73 -7.548 4.372 2.619 1.00 0.00 H new ATOM 0 HD13 ILE A 73 -6.272 3.165 2.330 1.00 0.00 H new ATOM 1168 N ILE A 74 -8.174 1.018 -1.214 1.00 0.00 N ATOM 1169 CA ILE A 74 -9.042 0.424 -2.216 1.00 0.00 C ATOM 1170 C ILE A 74 -10.487 0.821 -1.943 1.00 0.00 C ATOM 1171 O ILE A 74 -11.039 0.509 -0.889 1.00 0.00 O ATOM 1172 CB ILE A 74 -8.921 -1.114 -2.233 1.00 0.00 C ATOM 1173 CG1 ILE A 74 -7.460 -1.520 -2.458 1.00 0.00 C ATOM 1174 CG2 ILE A 74 -9.810 -1.707 -3.317 1.00 0.00 C ATOM 1175 CD1 ILE A 74 -7.212 -3.013 -2.374 1.00 0.00 C ATOM 0 H ILE A 74 -8.076 0.474 -0.357 1.00 0.00 H new ATOM 0 HA ILE A 74 -8.732 0.796 -3.192 1.00 0.00 H new ATOM 0 HB ILE A 74 -9.251 -1.503 -1.270 1.00 0.00 H new ATOM 0 HG12 ILE A 74 -7.142 -1.164 -3.438 1.00 0.00 H new ATOM 0 HG13 ILE A 74 -6.836 -1.017 -1.719 1.00 0.00 H new ATOM 0 HG21 ILE A 74 -9.712 -2.793 -3.314 1.00 0.00 H new ATOM 0 HG22 ILE A 74 -10.848 -1.436 -3.125 1.00 0.00 H new ATOM 0 HG23 ILE A 74 -9.507 -1.318 -4.289 1.00 0.00 H new ATOM 0 HD11 ILE A 74 -6.155 -3.216 -2.545 1.00 0.00 H new ATOM 0 HD12 ILE A 74 -7.496 -3.374 -1.386 1.00 0.00 H new ATOM 0 HD13 ILE A 74 -7.807 -3.524 -3.131 1.00 0.00 H new ATOM 1187 N PHE A 75 -11.091 1.505 -2.894 1.00 0.00 N ATOM 1188 CA PHE A 75 -12.451 1.987 -2.741 1.00 0.00 C ATOM 1189 C PHE A 75 -13.403 1.151 -3.590 1.00 0.00 C ATOM 1190 O PHE A 75 -13.315 1.146 -4.816 1.00 0.00 O ATOM 1191 CB PHE A 75 -12.521 3.469 -3.135 1.00 0.00 C ATOM 1192 CG PHE A 75 -13.806 4.161 -2.757 1.00 0.00 C ATOM 1193 CD1 PHE A 75 -14.599 3.678 -1.728 1.00 0.00 C ATOM 1194 CD2 PHE A 75 -14.208 5.306 -3.422 1.00 0.00 C ATOM 1195 CE1 PHE A 75 -15.770 4.325 -1.373 1.00 0.00 C ATOM 1196 CE2 PHE A 75 -15.378 5.956 -3.074 1.00 0.00 C ATOM 1197 CZ PHE A 75 -16.160 5.464 -2.049 1.00 0.00 C ATOM 0 H PHE A 75 -10.659 1.741 -3.787 1.00 0.00 H new ATOM 0 HA PHE A 75 -12.754 1.890 -1.699 1.00 0.00 H new ATOM 0 HB2 PHE A 75 -11.689 3.995 -2.666 1.00 0.00 H new ATOM 0 HB3 PHE A 75 -12.383 3.551 -4.213 1.00 0.00 H new ATOM 0 HD1 PHE A 75 -14.300 2.786 -1.197 1.00 0.00 H new ATOM 0 HD2 PHE A 75 -13.600 5.697 -4.224 1.00 0.00 H new ATOM 0 HE1 PHE A 75 -16.378 3.939 -0.568 1.00 0.00 H new ATOM 0 HE2 PHE A 75 -15.679 6.848 -3.604 1.00 0.00 H new ATOM 0 HZ PHE A 75 -17.075 5.969 -1.776 1.00 0.00 H new ATOM 1207 N SER A 76 -14.293 0.425 -2.932 1.00 0.00 N ATOM 1208 CA SER A 76 -15.264 -0.403 -3.625 1.00 0.00 C ATOM 1209 C SER A 76 -16.568 0.360 -3.834 1.00 0.00 C ATOM 1210 O SER A 76 -17.200 0.803 -2.872 1.00 0.00 O ATOM 1211 CB SER A 76 -15.516 -1.699 -2.843 1.00 0.00 C ATOM 1212 OG SER A 76 -15.843 -1.439 -1.485 1.00 0.00 O ATOM 0 H SER A 76 -14.362 0.393 -1.915 1.00 0.00 H new ATOM 0 HA SER A 76 -14.860 -0.663 -4.604 1.00 0.00 H new ATOM 0 HB2 SER A 76 -16.327 -2.255 -3.312 1.00 0.00 H new ATOM 0 HB3 SER A 76 -14.628 -2.330 -2.889 1.00 0.00 H new ATOM 0 HG SER A 76 -16.268 -0.559 -1.414 1.00 0.00 H new ATOM 1218 N ILE A 77 -16.950 0.532 -5.092 1.00 0.00 N ATOM 1219 CA ILE A 77 -18.174 1.240 -5.432 1.00 0.00 C ATOM 1220 C ILE A 77 -19.101 0.332 -6.233 1.00 0.00 C ATOM 1221 O ILE A 77 -18.730 -0.149 -7.304 1.00 0.00 O ATOM 1222 CB ILE A 77 -17.872 2.512 -6.254 1.00 0.00 C ATOM 1223 CG1 ILE A 77 -16.908 3.429 -5.497 1.00 0.00 C ATOM 1224 CG2 ILE A 77 -19.158 3.252 -6.576 1.00 0.00 C ATOM 1225 CD1 ILE A 77 -16.543 4.686 -6.259 1.00 0.00 C ATOM 0 H ILE A 77 -16.426 0.189 -5.897 1.00 0.00 H new ATOM 0 HA ILE A 77 -18.659 1.532 -4.501 1.00 0.00 H new ATOM 0 HB ILE A 77 -17.399 2.211 -7.188 1.00 0.00 H new ATOM 0 HG12 ILE A 77 -17.358 3.709 -4.545 1.00 0.00 H new ATOM 0 HG13 ILE A 77 -15.997 2.875 -5.268 1.00 0.00 H new ATOM 0 HG21 ILE A 77 -18.928 4.146 -7.156 1.00 0.00 H new ATOM 0 HG22 ILE A 77 -19.816 2.604 -7.155 1.00 0.00 H new ATOM 0 HG23 ILE A 77 -19.655 3.538 -5.649 1.00 0.00 H new ATOM 0 HD11 ILE A 77 -15.857 5.287 -5.662 1.00 0.00 H new ATOM 0 HD12 ILE A 77 -16.063 4.415 -7.199 1.00 0.00 H new ATOM 0 HD13 ILE A 77 -17.445 5.262 -6.465 1.00 0.00 H new ATOM 1237 N GLN A 78 -20.297 0.089 -5.713 1.00 0.00 N ATOM 1238 CA GLN A 78 -21.252 -0.791 -6.380 1.00 0.00 C ATOM 1239 C GLN A 78 -21.972 -0.048 -7.504 1.00 0.00 C ATOM 1240 O GLN A 78 -22.389 1.099 -7.335 1.00 0.00 O ATOM 1241 CB GLN A 78 -22.280 -1.317 -5.378 1.00 0.00 C ATOM 1242 CG GLN A 78 -22.805 -2.704 -5.713 1.00 0.00 C ATOM 1243 CD GLN A 78 -22.012 -3.808 -5.035 1.00 0.00 C ATOM 1244 OE1 GLN A 78 -20.829 -3.651 -4.734 1.00 0.00 O ATOM 1245 NE2 GLN A 78 -22.655 -4.943 -4.805 1.00 0.00 N ATOM 0 H GLN A 78 -20.630 0.487 -4.835 1.00 0.00 H new ATOM 0 HA GLN A 78 -20.701 -1.630 -6.804 1.00 0.00 H new ATOM 0 HB2 GLN A 78 -21.829 -1.339 -4.386 1.00 0.00 H new ATOM 0 HB3 GLN A 78 -23.118 -0.622 -5.332 1.00 0.00 H new ATOM 0 HG2 GLN A 78 -23.850 -2.775 -5.412 1.00 0.00 H new ATOM 0 HG3 GLN A 78 -22.773 -2.849 -6.793 1.00 0.00 H new ATOM 0 HE21 GLN A 78 -23.636 -5.036 -5.069 1.00 0.00 H new ATOM 0 HE22 GLN A 78 -22.169 -5.724 -4.364 1.00 0.00 H new ATOM 1254 N LYS A 79 -22.128 -0.708 -8.644 1.00 0.00 N ATOM 1255 CA LYS A 79 -22.823 -0.119 -9.784 1.00 0.00 C ATOM 1256 C LYS A 79 -24.327 -0.254 -9.575 1.00 0.00 C ATOM 1257 O LYS A 79 -24.767 -1.120 -8.821 1.00 0.00 O ATOM 1258 CB LYS A 79 -22.413 -0.825 -11.082 1.00 0.00 C ATOM 1259 CG LYS A 79 -20.907 -0.946 -11.267 1.00 0.00 C ATOM 1260 CD LYS A 79 -20.276 0.318 -11.837 1.00 0.00 C ATOM 1261 CE LYS A 79 -20.579 0.475 -13.322 1.00 0.00 C ATOM 1262 NZ LYS A 79 -19.511 1.236 -14.032 1.00 0.00 N ATOM 0 H LYS A 79 -21.782 -1.654 -8.805 1.00 0.00 H new ATOM 0 HA LYS A 79 -22.554 0.934 -9.863 1.00 0.00 H new ATOM 0 HB2 LYS A 79 -22.853 -1.822 -11.096 1.00 0.00 H new ATOM 0 HB3 LYS A 79 -22.831 -0.280 -11.928 1.00 0.00 H new ATOM 0 HG2 LYS A 79 -20.445 -1.175 -10.307 1.00 0.00 H new ATOM 0 HG3 LYS A 79 -20.694 -1.784 -11.931 1.00 0.00 H new ATOM 0 HD2 LYS A 79 -20.648 1.187 -11.295 1.00 0.00 H new ATOM 0 HD3 LYS A 79 -19.197 0.287 -11.686 1.00 0.00 H new ATOM 0 HE2 LYS A 79 -20.686 -0.510 -13.776 1.00 0.00 H new ATOM 0 HE3 LYS A 79 -21.533 0.988 -13.445 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 -19.764 1.335 -15.036 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 -19.414 2.179 -13.605 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 -18.609 0.725 -13.951 1.00 0.00 H new ATOM 1276 N GLU A 80 -25.113 0.598 -10.228 1.00 0.00 N ATOM 1277 CA GLU A 80 -26.563 0.549 -10.081 1.00 0.00 C ATOM 1278 C GLU A 80 -27.108 -0.781 -10.591 1.00 0.00 C ATOM 1279 O GLU A 80 -27.949 -1.404 -9.941 1.00 0.00 O ATOM 1280 CB GLU A 80 -27.234 1.708 -10.823 1.00 0.00 C ATOM 1281 CG GLU A 80 -28.737 1.775 -10.595 1.00 0.00 C ATOM 1282 CD GLU A 80 -29.411 2.884 -11.379 1.00 0.00 C ATOM 1283 OE1 GLU A 80 -29.721 2.666 -12.567 1.00 0.00 O ATOM 1284 OE2 GLU A 80 -29.644 3.970 -10.806 1.00 0.00 O ATOM 0 H GLU A 80 -24.773 1.324 -10.859 1.00 0.00 H new ATOM 0 HA GLU A 80 -26.792 0.643 -9.020 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -26.782 2.647 -10.502 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -27.039 1.609 -11.891 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -29.183 0.820 -10.872 1.00 0.00 H new ATOM 0 HG3 GLU A 80 -28.931 1.921 -9.532 1.00 0.00 H new ATOM 1427 N LEU A 88 -16.633 4.536 -15.549 1.00 0.00 N ATOM 1428 CA LEU A 88 -17.241 5.237 -14.433 1.00 0.00 C ATOM 1429 C LEU A 88 -17.011 6.735 -14.567 1.00 0.00 C ATOM 1430 O LEU A 88 -17.860 7.526 -14.186 1.00 0.00 O ATOM 1431 CB LEU A 88 -16.715 4.721 -13.078 1.00 0.00 C ATOM 1432 CG LEU A 88 -15.249 5.026 -12.739 1.00 0.00 C ATOM 1433 CD1 LEU A 88 -14.984 4.768 -11.262 1.00 0.00 C ATOM 1434 CD2 LEU A 88 -14.305 4.186 -13.582 1.00 0.00 C ATOM 0 HA LEU A 88 -18.313 5.040 -14.458 1.00 0.00 H new ATOM 0 HB2 LEU A 88 -17.340 5.141 -12.290 1.00 0.00 H new ATOM 0 HB3 LEU A 88 -16.851 3.640 -13.051 1.00 0.00 H new ATOM 0 HG LEU A 88 -15.067 6.078 -12.961 1.00 0.00 H new ATOM 0 HD11 LEU A 88 -13.941 4.988 -11.036 1.00 0.00 H new ATOM 0 HD12 LEU A 88 -15.629 5.408 -10.659 1.00 0.00 H new ATOM 0 HD13 LEU A 88 -15.192 3.723 -11.032 1.00 0.00 H new ATOM 0 HD21 LEU A 88 -13.274 4.424 -13.320 1.00 0.00 H new ATOM 0 HD22 LEU A 88 -14.493 3.129 -13.394 1.00 0.00 H new ATOM 0 HD23 LEU A 88 -14.470 4.402 -14.638 1.00 0.00 H new ATOM 1446 N LEU A 89 -15.876 7.116 -15.136 1.00 0.00 N ATOM 1447 CA LEU A 89 -15.562 8.522 -15.350 1.00 0.00 C ATOM 1448 C LEU A 89 -16.528 9.154 -16.343 1.00 0.00 C ATOM 1449 O LEU A 89 -16.591 8.760 -17.501 1.00 0.00 O ATOM 1450 CB LEU A 89 -14.119 8.703 -15.829 1.00 0.00 C ATOM 1451 CG LEU A 89 -13.066 8.857 -14.725 1.00 0.00 C ATOM 1452 CD1 LEU A 89 -13.409 10.032 -13.819 1.00 0.00 C ATOM 1453 CD2 LEU A 89 -12.928 7.580 -13.907 1.00 0.00 C ATOM 0 H LEU A 89 -15.156 6.470 -15.458 1.00 0.00 H new ATOM 0 HA LEU A 89 -15.670 9.029 -14.391 1.00 0.00 H new ATOM 0 HB2 LEU A 89 -13.850 7.845 -16.445 1.00 0.00 H new ATOM 0 HB3 LEU A 89 -14.077 9.583 -16.471 1.00 0.00 H new ATOM 0 HG LEU A 89 -12.108 9.052 -15.206 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -12.651 10.126 -13.042 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -13.440 10.949 -14.408 1.00 0.00 H new ATOM 0 HD13 LEU A 89 -14.382 9.864 -13.358 1.00 0.00 H new ATOM 0 HD21 LEU A 89 -12.174 7.723 -13.133 1.00 0.00 H new ATOM 0 HD22 LEU A 89 -13.884 7.341 -13.442 1.00 0.00 H new ATOM 0 HD23 LEU A 89 -12.627 6.761 -14.560 1.00 0.00 H new ATOM 1465 N LYS A 90 -17.305 10.111 -15.851 1.00 0.00 N ATOM 1466 CA LYS A 90 -18.267 10.849 -16.666 1.00 0.00 C ATOM 1467 C LYS A 90 -17.621 11.384 -17.935 1.00 0.00 C ATOM 1468 O LYS A 90 -18.207 11.330 -19.016 1.00 0.00 O ATOM 1469 CB LYS A 90 -18.827 12.011 -15.851 1.00 0.00 C ATOM 1470 CG LYS A 90 -19.951 12.794 -16.506 1.00 0.00 C ATOM 1471 CD LYS A 90 -21.279 12.073 -16.388 1.00 0.00 C ATOM 1472 CE LYS A 90 -22.442 13.052 -16.447 1.00 0.00 C ATOM 1473 NZ LYS A 90 -22.444 13.989 -15.285 1.00 0.00 N ATOM 0 H LYS A 90 -17.287 10.399 -14.873 1.00 0.00 H new ATOM 0 HA LYS A 90 -19.068 10.169 -16.954 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -19.187 11.622 -14.898 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -18.012 12.699 -15.627 1.00 0.00 H new ATOM 0 HG2 LYS A 90 -20.028 13.777 -16.042 1.00 0.00 H new ATOM 0 HG3 LYS A 90 -19.717 12.956 -17.558 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -21.373 11.344 -17.192 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -21.313 11.519 -15.450 1.00 0.00 H new ATOM 0 HE2 LYS A 90 -22.388 13.624 -17.374 1.00 0.00 H new ATOM 0 HE3 LYS A 90 -23.381 12.499 -16.468 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 -23.289 14.594 -15.328 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 -22.453 13.444 -14.399 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 -21.591 14.583 -15.317 1.00 0.00 H new ATOM 1487 N SER A 91 -16.428 11.928 -17.791 1.00 0.00 N ATOM 1488 CA SER A 91 -15.700 12.430 -18.935 1.00 0.00 C ATOM 1489 C SER A 91 -14.206 12.184 -18.787 1.00 0.00 C ATOM 1490 O SER A 91 -13.445 13.102 -18.487 1.00 0.00 O ATOM 1491 CB SER A 91 -15.980 13.922 -19.131 1.00 0.00 C ATOM 1492 OG SER A 91 -17.370 14.157 -19.285 1.00 0.00 O ATOM 0 H SER A 91 -15.947 12.032 -16.898 1.00 0.00 H new ATOM 0 HA SER A 91 -16.043 11.890 -19.817 1.00 0.00 H new ATOM 0 HB2 SER A 91 -15.604 14.483 -18.275 1.00 0.00 H new ATOM 0 HB3 SER A 91 -15.446 14.285 -20.009 1.00 0.00 H new ATOM 0 HG SER A 91 -17.528 15.116 -19.407 1.00 0.00 H new ATOM 1498 N GLU A 92 -13.784 10.939 -18.973 1.00 0.00 N ATOM 1499 CA GLU A 92 -12.354 10.642 -18.992 1.00 0.00 C ATOM 1500 C GLU A 92 -11.786 10.896 -20.385 1.00 0.00 C ATOM 1501 O GLU A 92 -10.610 10.652 -20.646 1.00 0.00 O ATOM 1502 CB GLU A 92 -12.036 9.214 -18.523 1.00 0.00 C ATOM 1503 CG GLU A 92 -12.454 8.110 -19.479 1.00 0.00 C ATOM 1504 CD GLU A 92 -13.948 7.904 -19.528 1.00 0.00 C ATOM 1505 OE1 GLU A 92 -14.473 7.176 -18.664 1.00 0.00 O ATOM 1506 OE2 GLU A 92 -14.587 8.443 -20.451 1.00 0.00 O ATOM 0 H GLU A 92 -14.395 10.134 -19.110 1.00 0.00 H new ATOM 0 HA GLU A 92 -11.875 11.313 -18.279 1.00 0.00 H new ATOM 0 HB2 GLU A 92 -10.963 9.136 -18.351 1.00 0.00 H new ATOM 0 HB3 GLU A 92 -12.526 9.046 -17.564 1.00 0.00 H new ATOM 0 HG2 GLU A 92 -12.093 8.348 -20.480 1.00 0.00 H new ATOM 0 HG3 GLU A 92 -11.974 7.178 -19.180 1.00 0.00 H new ATOM 1513 N GLU A 93 -12.649 11.373 -21.281 1.00 0.00 N ATOM 1514 CA GLU A 93 -12.218 11.898 -22.572 1.00 0.00 C ATOM 1515 C GLU A 93 -11.239 13.048 -22.357 1.00 0.00 C ATOM 1516 O GLU A 93 -10.275 13.217 -23.104 1.00 0.00 O ATOM 1517 CB GLU A 93 -13.431 12.380 -23.369 1.00 0.00 C ATOM 1518 CG GLU A 93 -14.273 11.255 -23.941 1.00 0.00 C ATOM 1519 CD GLU A 93 -13.618 10.612 -25.142 1.00 0.00 C ATOM 1520 OE1 GLU A 93 -13.857 11.087 -26.271 1.00 0.00 O ATOM 1521 OE2 GLU A 93 -12.853 9.641 -24.974 1.00 0.00 O ATOM 0 H GLU A 93 -13.658 11.406 -21.133 1.00 0.00 H new ATOM 0 HA GLU A 93 -11.720 11.108 -23.134 1.00 0.00 H new ATOM 0 HB2 GLU A 93 -14.056 12.998 -22.724 1.00 0.00 H new ATOM 0 HB3 GLU A 93 -13.089 13.016 -24.185 1.00 0.00 H new ATOM 0 HG2 GLU A 93 -14.441 10.501 -23.172 1.00 0.00 H new ATOM 0 HG3 GLU A 93 -15.251 11.643 -24.226 1.00 0.00 H new ATOM 1528 N LYS A 94 -11.512 13.834 -21.328 1.00 0.00 N ATOM 1529 CA LYS A 94 -10.598 14.859 -20.863 1.00 0.00 C ATOM 1530 C LYS A 94 -10.172 14.503 -19.440 1.00 0.00 C ATOM 1531 O LYS A 94 -10.742 14.992 -18.462 1.00 0.00 O ATOM 1532 CB LYS A 94 -11.265 16.238 -20.905 1.00 0.00 C ATOM 1533 CG LYS A 94 -10.372 17.377 -20.433 1.00 0.00 C ATOM 1534 CD LYS A 94 -11.146 18.683 -20.336 1.00 0.00 C ATOM 1535 CE LYS A 94 -10.306 19.799 -19.730 1.00 0.00 C ATOM 1536 NZ LYS A 94 -9.779 19.431 -18.388 1.00 0.00 N ATOM 0 H LYS A 94 -12.378 13.777 -20.791 1.00 0.00 H new ATOM 0 HA LYS A 94 -9.723 14.904 -21.512 1.00 0.00 H new ATOM 0 HB2 LYS A 94 -11.587 16.443 -21.926 1.00 0.00 H new ATOM 0 HB3 LYS A 94 -12.162 16.214 -20.287 1.00 0.00 H new ATOM 0 HG2 LYS A 94 -9.948 17.130 -19.460 1.00 0.00 H new ATOM 0 HG3 LYS A 94 -9.537 17.497 -21.123 1.00 0.00 H new ATOM 0 HD2 LYS A 94 -11.482 18.980 -21.329 1.00 0.00 H new ATOM 0 HD3 LYS A 94 -12.039 18.531 -19.730 1.00 0.00 H new ATOM 0 HE2 LYS A 94 -9.474 20.030 -20.396 1.00 0.00 H new ATOM 0 HE3 LYS A 94 -10.909 20.703 -19.648 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 -9.483 20.291 -17.884 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 -10.522 18.949 -17.843 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 -8.963 18.795 -18.498 1.00 0.00 H new ATOM 1550 N PRO A 95 -9.194 13.600 -19.308 1.00 0.00 N ATOM 1551 CA PRO A 95 -8.842 13.007 -18.032 1.00 0.00 C ATOM 1552 C PRO A 95 -7.757 13.765 -17.284 1.00 0.00 C ATOM 1553 O PRO A 95 -7.084 14.638 -17.838 1.00 0.00 O ATOM 1554 CB PRO A 95 -8.327 11.635 -18.456 1.00 0.00 C ATOM 1555 CG PRO A 95 -7.672 11.871 -19.782 1.00 0.00 C ATOM 1556 CD PRO A 95 -8.344 13.079 -20.394 1.00 0.00 C ATOM 0 HA PRO A 95 -9.683 12.999 -17.339 1.00 0.00 H new ATOM 0 HB2 PRO A 95 -7.619 11.235 -17.730 1.00 0.00 H new ATOM 0 HB3 PRO A 95 -9.140 10.914 -18.538 1.00 0.00 H new ATOM 0 HG2 PRO A 95 -6.603 12.044 -19.659 1.00 0.00 H new ATOM 0 HG3 PRO A 95 -7.782 11.000 -20.428 1.00 0.00 H new ATOM 0 HD2 PRO A 95 -7.614 13.820 -20.720 1.00 0.00 H new ATOM 0 HD3 PRO A 95 -8.935 12.807 -21.269 1.00 0.00 H new ATOM 1564 N ALA A 96 -7.601 13.419 -16.019 1.00 0.00 N ATOM 1565 CA ALA A 96 -6.514 13.934 -15.213 1.00 0.00 C ATOM 1566 C ALA A 96 -5.382 12.912 -15.190 1.00 0.00 C ATOM 1567 O ALA A 96 -5.634 11.712 -15.310 1.00 0.00 O ATOM 1568 CB ALA A 96 -6.998 14.241 -13.809 1.00 0.00 C ATOM 0 H ALA A 96 -8.221 12.777 -15.526 1.00 0.00 H new ATOM 0 HA ALA A 96 -6.144 14.863 -15.647 1.00 0.00 H new ATOM 0 HB1 ALA A 96 -6.170 14.627 -13.215 1.00 0.00 H new ATOM 0 HB2 ALA A 96 -7.792 14.987 -13.853 1.00 0.00 H new ATOM 0 HB3 ALA A 96 -7.381 13.330 -13.349 1.00 0.00 H new ATOM 1574 N PRO A 97 -4.127 13.362 -15.028 1.00 0.00 N ATOM 1575 CA PRO A 97 -2.939 12.491 -15.126 1.00 0.00 C ATOM 1576 C PRO A 97 -2.886 11.378 -14.074 1.00 0.00 C ATOM 1577 O PRO A 97 -2.040 10.485 -14.152 1.00 0.00 O ATOM 1578 CB PRO A 97 -1.765 13.458 -14.937 1.00 0.00 C ATOM 1579 CG PRO A 97 -2.347 14.642 -14.244 1.00 0.00 C ATOM 1580 CD PRO A 97 -3.753 14.763 -14.751 1.00 0.00 C ATOM 0 HA PRO A 97 -2.935 11.955 -16.075 1.00 0.00 H new ATOM 0 HB2 PRO A 97 -0.972 13.004 -14.343 1.00 0.00 H new ATOM 0 HB3 PRO A 97 -1.326 13.738 -15.895 1.00 0.00 H new ATOM 0 HG2 PRO A 97 -2.332 14.508 -13.162 1.00 0.00 H new ATOM 0 HG3 PRO A 97 -1.774 15.543 -14.462 1.00 0.00 H new ATOM 0 HD2 PRO A 97 -4.411 15.218 -14.011 1.00 0.00 H new ATOM 0 HD3 PRO A 97 -3.807 15.380 -15.648 1.00 0.00 H new ATOM 1588 N TYR A 98 -3.781 11.421 -13.096 1.00 0.00 N ATOM 1589 CA TYR A 98 -3.800 10.399 -12.062 1.00 0.00 C ATOM 1590 C TYR A 98 -4.798 9.294 -12.384 1.00 0.00 C ATOM 1591 O TYR A 98 -4.836 8.279 -11.698 1.00 0.00 O ATOM 1592 CB TYR A 98 -4.093 11.001 -10.679 1.00 0.00 C ATOM 1593 CG TYR A 98 -5.418 11.730 -10.552 1.00 0.00 C ATOM 1594 CD1 TYR A 98 -6.605 11.036 -10.350 1.00 0.00 C ATOM 1595 CD2 TYR A 98 -5.476 13.117 -10.612 1.00 0.00 C ATOM 1596 CE1 TYR A 98 -7.807 11.700 -10.213 1.00 0.00 C ATOM 1597 CE2 TYR A 98 -6.677 13.788 -10.476 1.00 0.00 C ATOM 1598 CZ TYR A 98 -7.838 13.076 -10.279 1.00 0.00 C ATOM 1599 OH TYR A 98 -9.034 13.739 -10.146 1.00 0.00 O ATOM 0 H TYR A 98 -4.494 12.143 -12.998 1.00 0.00 H new ATOM 0 HA TYR A 98 -2.804 9.957 -12.035 1.00 0.00 H new ATOM 0 HB2 TYR A 98 -4.066 10.200 -9.940 1.00 0.00 H new ATOM 0 HB3 TYR A 98 -3.291 11.694 -10.426 1.00 0.00 H new ATOM 0 HD1 TYR A 98 -6.586 9.957 -10.299 1.00 0.00 H new ATOM 0 HD2 TYR A 98 -4.568 13.680 -10.767 1.00 0.00 H new ATOM 0 HE1 TYR A 98 -8.719 11.144 -10.055 1.00 0.00 H new ATOM 0 HE2 TYR A 98 -6.704 14.867 -10.524 1.00 0.00 H new ATOM 0 HH TYR A 98 -8.882 14.705 -10.215 1.00 0.00 H new ATOM 1609 N ILE A 99 -5.600 9.488 -13.426 1.00 0.00 N ATOM 1610 CA ILE A 99 -6.572 8.483 -13.825 1.00 0.00 C ATOM 1611 C ILE A 99 -5.911 7.430 -14.690 1.00 0.00 C ATOM 1612 O ILE A 99 -5.368 7.720 -15.758 1.00 0.00 O ATOM 1613 CB ILE A 99 -7.794 9.106 -14.538 1.00 0.00 C ATOM 1614 CG1 ILE A 99 -8.711 9.712 -13.483 1.00 0.00 C ATOM 1615 CG2 ILE A 99 -8.545 8.073 -15.369 1.00 0.00 C ATOM 1616 CD1 ILE A 99 -9.350 11.018 -13.902 1.00 0.00 C ATOM 0 H ILE A 99 -5.595 10.328 -14.005 1.00 0.00 H new ATOM 0 HA ILE A 99 -6.948 8.006 -12.920 1.00 0.00 H new ATOM 0 HB ILE A 99 -7.450 9.878 -15.226 1.00 0.00 H new ATOM 0 HG12 ILE A 99 -9.496 8.995 -13.244 1.00 0.00 H new ATOM 0 HG13 ILE A 99 -8.139 9.875 -12.569 1.00 0.00 H new ATOM 0 HG21 ILE A 99 -9.397 8.547 -15.855 1.00 0.00 H new ATOM 0 HG22 ILE A 99 -7.878 7.661 -16.126 1.00 0.00 H new ATOM 0 HG23 ILE A 99 -8.897 7.271 -14.721 1.00 0.00 H new ATOM 0 HD11 ILE A 99 -9.988 11.385 -13.098 1.00 0.00 H new ATOM 0 HD12 ILE A 99 -8.573 11.752 -14.113 1.00 0.00 H new ATOM 0 HD13 ILE A 99 -9.951 10.858 -14.797 1.00 0.00 H new ATOM 1628 N LYS A 100 -5.948 6.209 -14.199 1.00 0.00 N ATOM 1629 CA LYS A 100 -5.245 5.111 -14.836 1.00 0.00 C ATOM 1630 C LYS A 100 -5.933 3.783 -14.514 1.00 0.00 C ATOM 1631 O LYS A 100 -6.780 3.714 -13.626 1.00 0.00 O ATOM 1632 CB LYS A 100 -3.792 5.123 -14.348 1.00 0.00 C ATOM 1633 CG LYS A 100 -2.833 4.267 -15.152 1.00 0.00 C ATOM 1634 CD LYS A 100 -1.404 4.454 -14.671 1.00 0.00 C ATOM 1635 CE LYS A 100 -0.939 5.896 -14.830 1.00 0.00 C ATOM 1636 NZ LYS A 100 0.419 6.105 -14.265 1.00 0.00 N ATOM 0 H LYS A 100 -6.460 5.949 -13.356 1.00 0.00 H new ATOM 0 HA LYS A 100 -5.260 5.227 -15.920 1.00 0.00 H new ATOM 0 HB2 LYS A 100 -3.431 6.151 -14.358 1.00 0.00 H new ATOM 0 HB3 LYS A 100 -3.771 4.787 -13.311 1.00 0.00 H new ATOM 0 HG2 LYS A 100 -3.116 3.218 -15.065 1.00 0.00 H new ATOM 0 HG3 LYS A 100 -2.903 4.530 -16.208 1.00 0.00 H new ATOM 0 HD2 LYS A 100 -1.332 4.162 -13.623 1.00 0.00 H new ATOM 0 HD3 LYS A 100 -0.742 3.794 -15.232 1.00 0.00 H new ATOM 0 HE2 LYS A 100 -0.938 6.163 -15.887 1.00 0.00 H new ATOM 0 HE3 LYS A 100 -1.645 6.562 -14.334 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 0.727 7.080 -14.453 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 0.397 5.941 -13.238 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 1.085 5.440 -14.708 1.00 0.00 H new ATOM 1650 N VAL A 101 -5.581 2.735 -15.244 1.00 0.00 N ATOM 1651 CA VAL A 101 -6.216 1.435 -15.059 1.00 0.00 C ATOM 1652 C VAL A 101 -5.423 0.569 -14.071 1.00 0.00 C ATOM 1653 O VAL A 101 -4.193 0.498 -14.132 1.00 0.00 O ATOM 1654 CB VAL A 101 -6.383 0.697 -16.412 1.00 0.00 C ATOM 1655 CG1 VAL A 101 -5.038 0.462 -17.086 1.00 0.00 C ATOM 1656 CG2 VAL A 101 -7.140 -0.612 -16.225 1.00 0.00 C ATOM 0 H VAL A 101 -4.862 2.757 -15.968 1.00 0.00 H new ATOM 0 HA VAL A 101 -7.207 1.610 -14.641 1.00 0.00 H new ATOM 0 HB VAL A 101 -6.971 1.337 -17.070 1.00 0.00 H new ATOM 0 HG11 VAL A 101 -5.191 -0.057 -18.032 1.00 0.00 H new ATOM 0 HG12 VAL A 101 -4.552 1.420 -17.272 1.00 0.00 H new ATOM 0 HG13 VAL A 101 -4.407 -0.145 -16.437 1.00 0.00 H new ATOM 0 HG21 VAL A 101 -7.245 -1.112 -17.188 1.00 0.00 H new ATOM 0 HG22 VAL A 101 -6.589 -1.256 -15.540 1.00 0.00 H new ATOM 0 HG23 VAL A 101 -8.128 -0.405 -15.814 1.00 0.00 H new ATOM 1666 N ASP A 102 -6.136 -0.062 -13.146 1.00 0.00 N ATOM 1667 CA ASP A 102 -5.518 -0.908 -12.129 1.00 0.00 C ATOM 1668 C ASP A 102 -4.956 -2.197 -12.723 1.00 0.00 C ATOM 1669 O ASP A 102 -5.702 -3.081 -13.137 1.00 0.00 O ATOM 1670 CB ASP A 102 -6.535 -1.248 -11.040 1.00 0.00 C ATOM 1671 CG ASP A 102 -5.962 -2.173 -9.992 1.00 0.00 C ATOM 1672 OD1 ASP A 102 -5.217 -1.695 -9.115 1.00 0.00 O ATOM 1673 OD2 ASP A 102 -6.244 -3.380 -10.050 1.00 0.00 O ATOM 0 H ASP A 102 -7.152 -0.003 -13.078 1.00 0.00 H new ATOM 0 HA ASP A 102 -4.688 -0.347 -11.699 1.00 0.00 H new ATOM 0 HB2 ASP A 102 -6.875 -0.329 -10.564 1.00 0.00 H new ATOM 0 HB3 ASP A 102 -7.409 -1.714 -11.495 1.00 0.00 H new ATOM 1678 N TRP A 103 -3.638 -2.272 -12.810 1.00 0.00 N ATOM 1679 CA TRP A 103 -2.957 -3.500 -13.213 1.00 0.00 C ATOM 1680 C TRP A 103 -2.837 -4.475 -12.042 1.00 0.00 C ATOM 1681 O TRP A 103 -2.505 -5.646 -12.229 1.00 0.00 O ATOM 1682 CB TRP A 103 -1.569 -3.181 -13.777 1.00 0.00 C ATOM 1683 CG TRP A 103 -0.726 -2.341 -12.867 1.00 0.00 C ATOM 1684 CD1 TRP A 103 0.018 -2.769 -11.804 1.00 0.00 C ATOM 1685 CD2 TRP A 103 -0.538 -0.926 -12.945 1.00 0.00 C ATOM 1686 NE1 TRP A 103 0.646 -1.702 -11.211 1.00 0.00 N ATOM 1687 CE2 TRP A 103 0.324 -0.560 -11.896 1.00 0.00 C ATOM 1688 CE3 TRP A 103 -1.020 0.068 -13.800 1.00 0.00 C ATOM 1689 CZ2 TRP A 103 0.716 0.758 -11.682 1.00 0.00 C ATOM 1690 CZ3 TRP A 103 -0.630 1.375 -13.587 1.00 0.00 C ATOM 1691 CH2 TRP A 103 0.231 1.710 -12.535 1.00 0.00 C ATOM 0 H TRP A 103 -3.011 -1.493 -12.606 1.00 0.00 H new ATOM 0 HA TRP A 103 -3.555 -3.974 -13.991 1.00 0.00 H new ATOM 0 HB2 TRP A 103 -1.046 -4.115 -13.982 1.00 0.00 H new ATOM 0 HB3 TRP A 103 -1.684 -2.665 -14.730 1.00 0.00 H new ATOM 0 HD1 TRP A 103 0.100 -3.795 -11.478 1.00 0.00 H new ATOM 0 HE1 TRP A 103 1.254 -1.751 -10.393 1.00 0.00 H new ATOM 0 HE3 TRP A 103 -1.686 -0.182 -14.613 1.00 0.00 H new ATOM 0 HZ2 TRP A 103 1.380 1.019 -10.871 1.00 0.00 H new ATOM 0 HZ3 TRP A 103 -0.995 2.152 -14.243 1.00 0.00 H new ATOM 0 HH2 TRP A 103 0.518 2.742 -12.394 1.00 0.00 H new ATOM 1702 N ASN A 104 -3.118 -3.990 -10.839 1.00 0.00 N ATOM 1703 CA ASN A 104 -2.828 -4.739 -9.619 1.00 0.00 C ATOM 1704 C ASN A 104 -3.806 -5.896 -9.415 1.00 0.00 C ATOM 1705 O ASN A 104 -3.392 -7.034 -9.209 1.00 0.00 O ATOM 1706 CB ASN A 104 -2.849 -3.793 -8.413 1.00 0.00 C ATOM 1707 CG ASN A 104 -2.434 -4.475 -7.119 1.00 0.00 C ATOM 1708 OD1 ASN A 104 -3.407 -4.977 -6.376 1.00 0.00 O flip ATOM 1709 ND2 ASN A 104 -1.251 -4.531 -6.780 1.00 0.00 N flip ATOM 0 H ASN A 104 -3.548 -3.079 -10.680 1.00 0.00 H new ATOM 0 HA ASN A 104 -1.834 -5.174 -9.718 1.00 0.00 H new ATOM 0 HB2 ASN A 104 -2.182 -2.953 -8.605 1.00 0.00 H new ATOM 0 HB3 ASN A 104 -3.852 -3.383 -8.296 1.00 0.00 H new ATOM 0 HD21 ASN A 104 -0.529 -4.132 -7.380 1.00 0.00 H new ATOM 0 HD22 ASN A 104 -0.993 -4.976 -5.899 1.00 0.00 H new ATOM 1716 N LYS A 105 -5.097 -5.606 -9.477 1.00 0.00 N ATOM 1717 CA LYS A 105 -6.129 -6.617 -9.268 1.00 0.00 C ATOM 1718 C LYS A 105 -6.961 -6.817 -10.528 1.00 0.00 C ATOM 1719 O LYS A 105 -8.047 -7.400 -10.473 1.00 0.00 O ATOM 1720 CB LYS A 105 -7.038 -6.248 -8.092 1.00 0.00 C ATOM 1721 CG LYS A 105 -6.338 -6.304 -6.745 1.00 0.00 C ATOM 1722 CD LYS A 105 -7.330 -6.319 -5.593 1.00 0.00 C ATOM 1723 CE LYS A 105 -6.615 -6.423 -4.253 1.00 0.00 C ATOM 1724 NZ LYS A 105 -7.554 -6.720 -3.138 1.00 0.00 N ATOM 0 H LYS A 105 -5.459 -4.673 -9.672 1.00 0.00 H new ATOM 0 HA LYS A 105 -5.624 -7.553 -9.032 1.00 0.00 H new ATOM 0 HB2 LYS A 105 -7.430 -5.243 -8.247 1.00 0.00 H new ATOM 0 HB3 LYS A 105 -7.892 -6.925 -8.077 1.00 0.00 H new ATOM 0 HG2 LYS A 105 -5.712 -7.195 -6.697 1.00 0.00 H new ATOM 0 HG3 LYS A 105 -5.676 -5.444 -6.643 1.00 0.00 H new ATOM 0 HD2 LYS A 105 -7.933 -5.411 -5.617 1.00 0.00 H new ATOM 0 HD3 LYS A 105 -8.014 -7.160 -5.709 1.00 0.00 H new ATOM 0 HE2 LYS A 105 -5.858 -7.205 -4.307 1.00 0.00 H new ATOM 0 HE3 LYS A 105 -6.093 -5.488 -4.048 1.00 0.00 H new ATOM 0 HZ1 LYS A 105 -7.024 -6.782 -2.245 1.00 0.00 H new ATOM 0 HZ2 LYS A 105 -8.262 -5.961 -3.069 1.00 0.00 H new ATOM 0 HZ3 LYS A 105 -8.033 -7.625 -3.320 1.00 0.00 H new ATOM 1738 N TRP A 106 -6.441 -6.335 -11.655 1.00 0.00 N ATOM 1739 CA TRP A 106 -7.127 -6.415 -12.934 1.00 0.00 C ATOM 1740 C TRP A 106 -7.669 -7.816 -13.193 1.00 0.00 C ATOM 1741 O TRP A 106 -6.963 -8.817 -13.037 1.00 0.00 O ATOM 1742 CB TRP A 106 -6.165 -6.036 -14.054 1.00 0.00 C ATOM 1743 CG TRP A 106 -6.871 -5.528 -15.261 1.00 0.00 C ATOM 1744 CD1 TRP A 106 -7.541 -4.353 -15.347 1.00 0.00 C ATOM 1745 CD2 TRP A 106 -6.985 -6.161 -16.540 1.00 0.00 C ATOM 1746 NE1 TRP A 106 -8.075 -4.203 -16.605 1.00 0.00 N ATOM 1747 CE2 TRP A 106 -7.747 -5.303 -17.359 1.00 0.00 C ATOM 1748 CE3 TRP A 106 -6.519 -7.366 -17.076 1.00 0.00 C ATOM 1749 CZ2 TRP A 106 -8.054 -5.612 -18.682 1.00 0.00 C ATOM 1750 CZ3 TRP A 106 -6.826 -7.674 -18.389 1.00 0.00 C ATOM 1751 CH2 TRP A 106 -7.586 -6.801 -19.179 1.00 0.00 C ATOM 0 H TRP A 106 -5.530 -5.878 -11.703 1.00 0.00 H new ATOM 0 HA TRP A 106 -7.968 -5.722 -12.906 1.00 0.00 H new ATOM 0 HB2 TRP A 106 -5.474 -5.274 -13.693 1.00 0.00 H new ATOM 0 HB3 TRP A 106 -5.567 -6.906 -14.326 1.00 0.00 H new ATOM 0 HD1 TRP A 106 -7.641 -3.638 -14.544 1.00 0.00 H new ATOM 0 HE1 TRP A 106 -8.625 -3.406 -16.926 1.00 0.00 H new ATOM 0 HE3 TRP A 106 -5.930 -8.044 -16.476 1.00 0.00 H new ATOM 0 HZ2 TRP A 106 -8.639 -4.940 -19.293 1.00 0.00 H new ATOM 0 HZ3 TRP A 106 -6.474 -8.603 -18.813 1.00 0.00 H new ATOM 0 HH2 TRP A 106 -7.808 -7.071 -20.201 1.00 0.00 H new