USER MOD reduce.3.24.130724 H: found=0, std=0, add=711, rem=0, adj=15 USER MOD reduce.3.24.130724 removed 709 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 Single : A 1 GLY N :NH3+ -124:sc= 0.0723 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 11 THR OG1 : rot 142:sc= 1.18 USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 19 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 20 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 23 GLN : amide:sc= -0.0531 K(o=-0.053,f=-2!) USER MOD Single : A 24 SER OG : rot 81:sc= 0.187 USER MOD Single : A 25 LYS NZ :NH3+ 168:sc=-0.00605 (180deg=-0.132) USER MOD Single : A 28 THR OG1 : rot -106:sc= 1.74 USER MOD Single : A 29 GLN : amide:sc= 1.15 K(o=1.1,f=-0.58) USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 THR OG1 : rot 86:sc= 1.27 USER MOD Single : A 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 ASN : amide:sc= -0.278 X(o=-0.28,f=-0.28) USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 GLN : amide:sc= 1.1 K(o=1.1,f=-0.076) USER MOD Single : A 46 TYR OH : rot 180:sc= 0 USER MOD Single : A 48 SER OG : rot 180:sc= 0 USER MOD Single : A 54 ASN : amide:sc= -0.378 K(o=-0.38,f=-4.2!) USER MOD Single : A 55 ASN : amide:sc= 0.0524 K(o=0.052,f=-2.2) USER MOD Single : A 56 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 85 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 86 SER OG : rot 180:sc= 0 USER MOD Single : A 89 SER OG : rot 180:sc= 0 USER MOD Single : A 90 SER OG : rot -8:sc= 1.22 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -5.142 -27.144 -0.864 1.00 0.00 N ATOM 2 CA GLY A 1 -5.696 -27.429 -2.195 1.00 0.00 C ATOM 3 C GLY A 1 -5.169 -26.460 -3.245 1.00 0.00 C ATOM 4 O GLY A 1 -4.356 -25.576 -2.952 1.00 0.00 O ATOM 0 H1 GLY A 1 -4.676 -27.996 -0.492 1.00 0.00 H new ATOM 0 H2 GLY A 1 -4.447 -26.373 -0.935 1.00 0.00 H new ATOM 0 H3 GLY A 1 -5.909 -26.861 -0.222 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -5.444 -28.450 -2.483 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -6.784 -27.368 -2.157 1.00 0.00 H new ATOM 8 N SER A 2 -5.619 -26.642 -4.488 1.00 0.00 N ATOM 9 CA SER A 2 -5.154 -25.866 -5.627 1.00 0.00 C ATOM 10 C SER A 2 -5.688 -24.433 -5.574 1.00 0.00 C ATOM 11 O SER A 2 -6.727 -24.158 -4.964 1.00 0.00 O ATOM 12 CB SER A 2 -5.616 -26.570 -6.908 1.00 0.00 C ATOM 13 OG SER A 2 -4.824 -26.185 -8.010 1.00 0.00 O ATOM 0 H SER A 2 -6.323 -27.340 -4.729 1.00 0.00 H new ATOM 0 HA SER A 2 -4.066 -25.803 -5.607 1.00 0.00 H new ATOM 0 HB2 SER A 2 -5.559 -27.650 -6.774 1.00 0.00 H new ATOM 0 HB3 SER A 2 -6.661 -26.328 -7.104 1.00 0.00 H new ATOM 0 HG SER A 2 -5.136 -26.648 -8.815 1.00 0.00 H new ATOM 19 N SER A 3 -5.016 -23.535 -6.294 1.00 0.00 N ATOM 20 CA SER A 3 -5.453 -22.178 -6.559 1.00 0.00 C ATOM 21 C SER A 3 -5.210 -21.849 -8.026 1.00 0.00 C ATOM 22 O SER A 3 -4.089 -21.498 -8.406 1.00 0.00 O ATOM 23 CB SER A 3 -4.726 -21.175 -5.654 1.00 0.00 C ATOM 24 OG SER A 3 -5.101 -21.328 -4.299 1.00 0.00 O ATOM 0 H SER A 3 -4.116 -23.749 -6.723 1.00 0.00 H new ATOM 0 HA SER A 3 -6.518 -22.103 -6.342 1.00 0.00 H new ATOM 0 HB2 SER A 3 -3.649 -21.311 -5.751 1.00 0.00 H new ATOM 0 HB3 SER A 3 -4.950 -20.160 -5.982 1.00 0.00 H new ATOM 0 HG SER A 3 -4.618 -20.675 -3.750 1.00 0.00 H new ATOM 30 N GLY A 4 -6.261 -21.917 -8.836 1.00 0.00 N ATOM 31 CA GLY A 4 -6.315 -21.352 -10.173 1.00 0.00 C ATOM 32 C GLY A 4 -7.595 -20.540 -10.338 1.00 0.00 C ATOM 33 O GLY A 4 -8.482 -20.620 -9.476 1.00 0.00 O ATOM 0 H GLY A 4 -7.127 -22.384 -8.567 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -5.446 -20.717 -10.345 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -6.280 -22.149 -10.916 1.00 0.00 H new ATOM 37 N SER A 5 -7.700 -19.754 -11.412 1.00 0.00 N ATOM 38 CA SER A 5 -8.918 -19.009 -11.724 1.00 0.00 C ATOM 39 C SER A 5 -8.993 -18.606 -13.201 1.00 0.00 C ATOM 40 O SER A 5 -10.077 -18.706 -13.776 1.00 0.00 O ATOM 41 CB SER A 5 -9.031 -17.769 -10.819 1.00 0.00 C ATOM 42 OG SER A 5 -10.392 -17.413 -10.668 1.00 0.00 O ATOM 0 H SER A 5 -6.946 -19.618 -12.086 1.00 0.00 H new ATOM 0 HA SER A 5 -9.762 -19.672 -11.532 1.00 0.00 H new ATOM 0 HB2 SER A 5 -8.589 -17.976 -9.845 1.00 0.00 H new ATOM 0 HB3 SER A 5 -8.473 -16.938 -11.252 1.00 0.00 H new ATOM 0 HG SER A 5 -10.462 -16.624 -10.090 1.00 0.00 H new ATOM 48 N SER A 6 -7.874 -18.180 -13.807 1.00 0.00 N ATOM 49 CA SER A 6 -7.734 -17.776 -15.207 1.00 0.00 C ATOM 50 C SER A 6 -8.957 -17.000 -15.727 1.00 0.00 C ATOM 51 O SER A 6 -9.793 -17.517 -16.477 1.00 0.00 O ATOM 52 CB SER A 6 -7.376 -19.004 -16.048 1.00 0.00 C ATOM 53 OG SER A 6 -6.186 -19.604 -15.552 1.00 0.00 O ATOM 0 H SER A 6 -6.993 -18.105 -13.299 1.00 0.00 H new ATOM 0 HA SER A 6 -6.916 -17.061 -15.293 1.00 0.00 H new ATOM 0 HB2 SER A 6 -8.194 -19.724 -16.022 1.00 0.00 H new ATOM 0 HB3 SER A 6 -7.240 -18.714 -17.090 1.00 0.00 H new ATOM 0 HG SER A 6 -5.965 -20.390 -16.095 1.00 0.00 H new ATOM 59 N GLY A 7 -9.067 -15.736 -15.316 1.00 0.00 N ATOM 60 CA GLY A 7 -10.126 -14.822 -15.715 1.00 0.00 C ATOM 61 C GLY A 7 -9.551 -13.439 -16.000 1.00 0.00 C ATOM 62 O GLY A 7 -8.337 -13.209 -15.912 1.00 0.00 O ATOM 0 H GLY A 7 -8.397 -15.311 -14.675 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -10.630 -15.204 -16.603 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -10.876 -14.756 -14.926 1.00 0.00 H new ATOM 66 N ASP A 8 -10.413 -12.502 -16.380 1.00 0.00 N ATOM 67 CA ASP A 8 -10.015 -11.162 -16.795 1.00 0.00 C ATOM 68 C ASP A 8 -11.102 -10.173 -16.389 1.00 0.00 C ATOM 69 O ASP A 8 -12.284 -10.540 -16.378 1.00 0.00 O ATOM 70 CB ASP A 8 -9.799 -11.148 -18.312 1.00 0.00 C ATOM 71 CG ASP A 8 -8.766 -10.097 -18.687 1.00 0.00 C ATOM 72 OD1 ASP A 8 -9.121 -8.896 -18.728 1.00 0.00 O ATOM 73 OD2 ASP A 8 -7.618 -10.493 -18.979 1.00 0.00 O ATOM 0 H ASP A 8 -11.421 -12.654 -16.409 1.00 0.00 H new ATOM 0 HA ASP A 8 -9.082 -10.874 -16.310 1.00 0.00 H new ATOM 0 HB2 ASP A 8 -9.467 -12.130 -18.648 1.00 0.00 H new ATOM 0 HB3 ASP A 8 -10.741 -10.939 -18.819 1.00 0.00 H new ATOM 78 N ARG A 9 -10.728 -8.945 -16.018 1.00 0.00 N ATOM 79 CA ARG A 9 -11.651 -7.884 -15.605 1.00 0.00 C ATOM 80 C ARG A 9 -10.925 -6.564 -15.388 1.00 0.00 C ATOM 81 O ARG A 9 -9.752 -6.560 -14.992 1.00 0.00 O ATOM 82 CB ARG A 9 -12.351 -8.253 -14.303 1.00 0.00 C ATOM 83 CG ARG A 9 -13.829 -7.882 -14.417 1.00 0.00 C ATOM 84 CD ARG A 9 -14.464 -8.175 -13.072 1.00 0.00 C ATOM 85 NE ARG A 9 -15.796 -8.777 -13.210 1.00 0.00 N ATOM 86 CZ ARG A 9 -16.014 -10.071 -13.479 1.00 0.00 C ATOM 87 NH1 ARG A 9 -15.008 -10.941 -13.550 1.00 0.00 N ATOM 88 NH2 ARG A 9 -17.258 -10.473 -13.712 1.00 0.00 N ATOM 0 H ARG A 9 -9.751 -8.654 -15.996 1.00 0.00 H new ATOM 0 HA ARG A 9 -12.379 -7.773 -16.409 1.00 0.00 H new ATOM 0 HB2 ARG A 9 -12.244 -9.320 -14.106 1.00 0.00 H new ATOM 0 HB3 ARG A 9 -11.893 -7.726 -13.466 1.00 0.00 H new ATOM 0 HG2 ARG A 9 -13.944 -6.830 -14.677 1.00 0.00 H new ATOM 0 HG3 ARG A 9 -14.312 -8.459 -15.206 1.00 0.00 H new ATOM 0 HD2 ARG A 9 -13.819 -8.848 -12.506 1.00 0.00 H new ATOM 0 HD3 ARG A 9 -14.542 -7.251 -12.499 1.00 0.00 H new ATOM 0 HE ARG A 9 -16.608 -8.171 -13.093 1.00 0.00 H new ATOM 0 HH11 ARG A 9 -14.050 -10.626 -13.398 1.00 0.00 H new ATOM 0 HH12 ARG A 9 -15.196 -11.922 -13.756 1.00 0.00 H new ATOM 0 HH21 ARG A 9 -18.025 -9.801 -13.684 1.00 0.00 H new ATOM 0 HH22 ARG A 9 -17.447 -11.454 -13.919 1.00 0.00 H new ATOM 102 N VAL A 10 -11.662 -5.459 -15.489 1.00 0.00 N ATOM 103 CA VAL A 10 -11.275 -4.178 -14.912 1.00 0.00 C ATOM 104 C VAL A 10 -11.273 -4.292 -13.373 1.00 0.00 C ATOM 105 O VAL A 10 -11.908 -5.190 -12.806 1.00 0.00 O ATOM 106 CB VAL A 10 -12.226 -3.096 -15.479 1.00 0.00 C ATOM 107 CG1 VAL A 10 -13.639 -3.171 -14.883 1.00 0.00 C ATOM 108 CG2 VAL A 10 -11.682 -1.671 -15.321 1.00 0.00 C ATOM 0 H VAL A 10 -12.555 -5.431 -15.980 1.00 0.00 H new ATOM 0 HA VAL A 10 -10.261 -3.885 -15.183 1.00 0.00 H new ATOM 0 HB VAL A 10 -12.287 -3.321 -16.544 1.00 0.00 H new ATOM 0 HG11 VAL A 10 -14.260 -2.388 -15.319 1.00 0.00 H new ATOM 0 HG12 VAL A 10 -14.076 -4.145 -15.104 1.00 0.00 H new ATOM 0 HG13 VAL A 10 -13.586 -3.033 -13.803 1.00 0.00 H new ATOM 0 HG21 VAL A 10 -12.396 -0.961 -15.738 1.00 0.00 H new ATOM 0 HG22 VAL A 10 -11.531 -1.454 -14.263 1.00 0.00 H new ATOM 0 HG23 VAL A 10 -10.732 -1.583 -15.849 1.00 0.00 H new ATOM 118 N THR A 11 -10.613 -3.360 -12.690 1.00 0.00 N ATOM 119 CA THR A 11 -10.751 -3.124 -11.256 1.00 0.00 C ATOM 120 C THR A 11 -10.862 -1.616 -11.011 1.00 0.00 C ATOM 121 O THR A 11 -10.699 -0.804 -11.933 1.00 0.00 O ATOM 122 CB THR A 11 -9.621 -3.833 -10.481 1.00 0.00 C ATOM 123 OG1 THR A 11 -9.772 -3.629 -9.092 1.00 0.00 O ATOM 124 CG2 THR A 11 -8.209 -3.397 -10.888 1.00 0.00 C ATOM 0 H THR A 11 -9.946 -2.728 -13.134 1.00 0.00 H new ATOM 0 HA THR A 11 -11.668 -3.566 -10.867 1.00 0.00 H new ATOM 0 HB THR A 11 -9.718 -4.888 -10.737 1.00 0.00 H new ATOM 0 HG1 THR A 11 -9.524 -4.447 -8.612 1.00 0.00 H new ATOM 0 HG21 THR A 11 -7.475 -3.943 -10.296 1.00 0.00 H new ATOM 0 HG22 THR A 11 -8.053 -3.610 -11.946 1.00 0.00 H new ATOM 0 HG23 THR A 11 -8.094 -2.327 -10.713 1.00 0.00 H new ATOM 132 N LEU A 12 -11.205 -1.245 -9.779 1.00 0.00 N ATOM 133 CA LEU A 12 -11.266 0.131 -9.300 1.00 0.00 C ATOM 134 C LEU A 12 -9.852 0.711 -9.242 1.00 0.00 C ATOM 135 O LEU A 12 -8.878 -0.042 -9.181 1.00 0.00 O ATOM 136 CB LEU A 12 -11.894 0.147 -7.893 1.00 0.00 C ATOM 137 CG LEU A 12 -13.417 0.375 -7.890 1.00 0.00 C ATOM 138 CD1 LEU A 12 -14.206 -0.822 -8.420 1.00 0.00 C ATOM 139 CD2 LEU A 12 -13.880 0.665 -6.461 1.00 0.00 C ATOM 0 H LEU A 12 -11.458 -1.923 -9.060 1.00 0.00 H new ATOM 0 HA LEU A 12 -11.873 0.733 -9.976 1.00 0.00 H new ATOM 0 HB2 LEU A 12 -11.678 -0.800 -7.399 1.00 0.00 H new ATOM 0 HB3 LEU A 12 -11.418 0.930 -7.303 1.00 0.00 H new ATOM 0 HG LEU A 12 -13.610 1.217 -8.555 1.00 0.00 H new ATOM 0 HD11 LEU A 12 -15.272 -0.597 -8.391 1.00 0.00 H new ATOM 0 HD12 LEU A 12 -13.906 -1.029 -9.447 1.00 0.00 H new ATOM 0 HD13 LEU A 12 -14.003 -1.695 -7.800 1.00 0.00 H new ATOM 0 HD21 LEU A 12 -14.958 0.827 -6.454 1.00 0.00 H new ATOM 0 HD22 LEU A 12 -13.636 -0.183 -5.820 1.00 0.00 H new ATOM 0 HD23 LEU A 12 -13.376 1.557 -6.089 1.00 0.00 H new ATOM 151 N GLU A 13 -9.739 2.042 -9.162 1.00 0.00 N ATOM 152 CA GLU A 13 -8.435 2.691 -9.034 1.00 0.00 C ATOM 153 C GLU A 13 -7.708 2.188 -7.789 1.00 0.00 C ATOM 154 O GLU A 13 -6.510 1.957 -7.846 1.00 0.00 O ATOM 155 CB GLU A 13 -8.522 4.221 -8.948 1.00 0.00 C ATOM 156 CG GLU A 13 -9.297 4.902 -10.082 1.00 0.00 C ATOM 157 CD GLU A 13 -10.759 5.081 -9.683 1.00 0.00 C ATOM 158 OE1 GLU A 13 -11.031 5.947 -8.812 1.00 0.00 O ATOM 159 OE2 GLU A 13 -11.631 4.359 -10.217 1.00 0.00 O ATOM 0 H GLU A 13 -10.531 2.685 -9.184 1.00 0.00 H new ATOM 0 HA GLU A 13 -7.888 2.432 -9.941 1.00 0.00 H new ATOM 0 HB2 GLU A 13 -8.989 4.488 -8.000 1.00 0.00 H new ATOM 0 HB3 GLU A 13 -7.510 4.625 -8.929 1.00 0.00 H new ATOM 0 HG2 GLU A 13 -8.852 5.871 -10.307 1.00 0.00 H new ATOM 0 HG3 GLU A 13 -9.230 4.303 -10.990 1.00 0.00 H new ATOM 166 N VAL A 14 -8.417 1.997 -6.673 1.00 0.00 N ATOM 167 CA VAL A 14 -7.850 1.478 -5.434 1.00 0.00 C ATOM 168 C VAL A 14 -7.196 0.122 -5.696 1.00 0.00 C ATOM 169 O VAL A 14 -5.998 -0.001 -5.483 1.00 0.00 O ATOM 170 CB VAL A 14 -8.927 1.485 -4.334 1.00 0.00 C ATOM 171 CG1 VAL A 14 -8.542 0.707 -3.081 1.00 0.00 C ATOM 172 CG2 VAL A 14 -9.142 2.920 -3.856 1.00 0.00 C ATOM 0 H VAL A 14 -9.414 2.203 -6.608 1.00 0.00 H new ATOM 0 HA VAL A 14 -7.049 2.117 -5.062 1.00 0.00 H new ATOM 0 HB VAL A 14 -9.805 1.026 -4.789 1.00 0.00 H new ATOM 0 HG11 VAL A 14 -9.354 0.761 -2.355 1.00 0.00 H new ATOM 0 HG12 VAL A 14 -8.357 -0.335 -3.342 1.00 0.00 H new ATOM 0 HG13 VAL A 14 -7.639 1.138 -2.648 1.00 0.00 H new ATOM 0 HG21 VAL A 14 -9.904 2.934 -3.076 1.00 0.00 H new ATOM 0 HG22 VAL A 14 -8.207 3.314 -3.457 1.00 0.00 H new ATOM 0 HG23 VAL A 14 -9.468 3.537 -4.693 1.00 0.00 H new ATOM 182 N GLY A 15 -7.927 -0.876 -6.195 1.00 0.00 N ATOM 183 CA GLY A 15 -7.376 -2.187 -6.494 1.00 0.00 C ATOM 184 C GLY A 15 -6.199 -2.115 -7.463 1.00 0.00 C ATOM 185 O GLY A 15 -5.220 -2.837 -7.276 1.00 0.00 O ATOM 0 H GLY A 15 -8.922 -0.791 -6.402 1.00 0.00 H new ATOM 0 HA2 GLY A 15 -7.052 -2.662 -5.568 1.00 0.00 H new ATOM 0 HA3 GLY A 15 -8.156 -2.818 -6.920 1.00 0.00 H new ATOM 189 N LYS A 16 -6.259 -1.233 -8.469 1.00 0.00 N ATOM 190 CA LYS A 16 -5.150 -1.021 -9.391 1.00 0.00 C ATOM 191 C LYS A 16 -3.927 -0.506 -8.632 1.00 0.00 C ATOM 192 O LYS A 16 -2.885 -1.159 -8.683 1.00 0.00 O ATOM 193 CB LYS A 16 -5.566 -0.077 -10.532 1.00 0.00 C ATOM 194 CG LYS A 16 -4.550 -0.073 -11.692 1.00 0.00 C ATOM 195 CD LYS A 16 -5.070 -0.785 -12.950 1.00 0.00 C ATOM 196 CE LYS A 16 -5.321 -2.286 -12.754 1.00 0.00 C ATOM 197 NZ LYS A 16 -6.034 -2.869 -13.910 1.00 0.00 N ATOM 0 H LYS A 16 -7.075 -0.652 -8.661 1.00 0.00 H new ATOM 0 HA LYS A 16 -4.877 -1.972 -9.848 1.00 0.00 H new ATOM 0 HB2 LYS A 16 -6.543 -0.377 -10.910 1.00 0.00 H new ATOM 0 HB3 LYS A 16 -5.672 0.935 -10.142 1.00 0.00 H new ATOM 0 HG2 LYS A 16 -4.298 0.957 -11.943 1.00 0.00 H new ATOM 0 HG3 LYS A 16 -3.630 -0.555 -11.363 1.00 0.00 H new ATOM 0 HD2 LYS A 16 -5.998 -0.310 -13.268 1.00 0.00 H new ATOM 0 HD3 LYS A 16 -4.350 -0.649 -13.757 1.00 0.00 H new ATOM 0 HE2 LYS A 16 -4.370 -2.800 -12.614 1.00 0.00 H new ATOM 0 HE3 LYS A 16 -5.905 -2.443 -11.847 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 -6.188 -3.884 -13.747 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 -6.952 -2.394 -14.028 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 -5.464 -2.740 -14.770 1.00 0.00 H new ATOM 211 N VAL A 17 -4.038 0.641 -7.954 1.00 0.00 N ATOM 212 CA VAL A 17 -2.945 1.321 -7.257 1.00 0.00 C ATOM 213 C VAL A 17 -2.380 0.425 -6.150 1.00 0.00 C ATOM 214 O VAL A 17 -1.163 0.406 -5.957 1.00 0.00 O ATOM 215 CB VAL A 17 -3.417 2.696 -6.715 1.00 0.00 C ATOM 216 CG1 VAL A 17 -2.314 3.383 -5.897 1.00 0.00 C ATOM 217 CG2 VAL A 17 -3.827 3.663 -7.850 1.00 0.00 C ATOM 0 H VAL A 17 -4.925 1.138 -7.874 1.00 0.00 H new ATOM 0 HA VAL A 17 -2.137 1.514 -7.963 1.00 0.00 H new ATOM 0 HB VAL A 17 -4.282 2.483 -6.086 1.00 0.00 H new ATOM 0 HG11 VAL A 17 -2.677 4.344 -5.532 1.00 0.00 H new ATOM 0 HG12 VAL A 17 -2.042 2.752 -5.051 1.00 0.00 H new ATOM 0 HG13 VAL A 17 -1.439 3.541 -6.527 1.00 0.00 H new ATOM 0 HG21 VAL A 17 -4.150 4.612 -7.421 1.00 0.00 H new ATOM 0 HG22 VAL A 17 -2.975 3.834 -8.508 1.00 0.00 H new ATOM 0 HG23 VAL A 17 -4.646 3.226 -8.422 1.00 0.00 H new ATOM 227 N ILE A 18 -3.237 -0.333 -5.450 1.00 0.00 N ATOM 228 CA ILE A 18 -2.820 -1.373 -4.519 1.00 0.00 C ATOM 229 C ILE A 18 -1.888 -2.282 -5.283 1.00 0.00 C ATOM 230 O ILE A 18 -0.702 -2.294 -4.979 1.00 0.00 O ATOM 231 CB ILE A 18 -4.008 -2.144 -3.886 1.00 0.00 C ATOM 232 CG1 ILE A 18 -4.676 -1.197 -2.874 1.00 0.00 C ATOM 233 CG2 ILE A 18 -3.514 -3.435 -3.168 1.00 0.00 C ATOM 234 CD1 ILE A 18 -6.103 -1.554 -2.470 1.00 0.00 C ATOM 0 H ILE A 18 -4.250 -0.234 -5.521 1.00 0.00 H new ATOM 0 HA ILE A 18 -2.315 -0.925 -3.663 1.00 0.00 H new ATOM 0 HB ILE A 18 -4.713 -2.452 -4.658 1.00 0.00 H new ATOM 0 HG12 ILE A 18 -4.061 -1.166 -1.974 1.00 0.00 H new ATOM 0 HG13 ILE A 18 -4.679 -0.191 -3.294 1.00 0.00 H new ATOM 0 HG21 ILE A 18 -4.366 -3.958 -2.732 1.00 0.00 H new ATOM 0 HG22 ILE A 18 -3.019 -4.086 -3.889 1.00 0.00 H new ATOM 0 HG23 ILE A 18 -2.811 -3.166 -2.379 1.00 0.00 H new ATOM 0 HD11 ILE A 18 -6.473 -0.820 -1.754 1.00 0.00 H new ATOM 0 HD12 ILE A 18 -6.742 -1.554 -3.353 1.00 0.00 H new ATOM 0 HD13 ILE A 18 -6.115 -2.544 -2.013 1.00 0.00 H new ATOM 246 N GLN A 19 -2.414 -3.029 -6.254 1.00 0.00 N ATOM 247 CA GLN A 19 -1.687 -4.102 -6.893 1.00 0.00 C ATOM 248 C GLN A 19 -0.395 -3.580 -7.530 1.00 0.00 C ATOM 249 O GLN A 19 0.605 -4.296 -7.542 1.00 0.00 O ATOM 250 CB GLN A 19 -2.602 -4.755 -7.927 1.00 0.00 C ATOM 251 CG GLN A 19 -2.071 -6.110 -8.398 1.00 0.00 C ATOM 252 CD GLN A 19 -2.828 -6.555 -9.633 1.00 0.00 C ATOM 253 OE1 GLN A 19 -2.541 -6.076 -10.731 1.00 0.00 O ATOM 254 NE2 GLN A 19 -3.776 -7.460 -9.513 1.00 0.00 N ATOM 0 H GLN A 19 -3.360 -2.899 -6.613 1.00 0.00 H new ATOM 0 HA GLN A 19 -1.393 -4.847 -6.154 1.00 0.00 H new ATOM 0 HB2 GLN A 19 -3.596 -4.886 -7.499 1.00 0.00 H new ATOM 0 HB3 GLN A 19 -2.709 -4.091 -8.785 1.00 0.00 H new ATOM 0 HG2 GLN A 19 -1.006 -6.037 -8.619 1.00 0.00 H new ATOM 0 HG3 GLN A 19 -2.182 -6.850 -7.606 1.00 0.00 H new ATOM 0 HE21 GLN A 19 -4.000 -7.845 -8.596 1.00 0.00 H new ATOM 0 HE22 GLN A 19 -4.287 -7.776 -10.337 1.00 0.00 H new ATOM 263 N GLN A 20 -0.397 -2.349 -8.048 1.00 0.00 N ATOM 264 CA GLN A 20 0.749 -1.651 -8.594 1.00 0.00 C ATOM 265 C GLN A 20 1.850 -1.555 -7.540 1.00 0.00 C ATOM 266 O GLN A 20 2.865 -2.249 -7.656 1.00 0.00 O ATOM 267 CB GLN A 20 0.289 -0.261 -9.063 1.00 0.00 C ATOM 268 CG GLN A 20 -0.463 -0.257 -10.405 1.00 0.00 C ATOM 269 CD GLN A 20 0.319 0.482 -11.483 1.00 0.00 C ATOM 270 OE1 GLN A 20 0.522 1.692 -11.390 1.00 0.00 O ATOM 271 NE2 GLN A 20 0.758 -0.189 -12.532 1.00 0.00 N ATOM 0 H GLN A 20 -1.249 -1.790 -8.096 1.00 0.00 H new ATOM 0 HA GLN A 20 1.162 -2.193 -9.445 1.00 0.00 H new ATOM 0 HB2 GLN A 20 -0.356 0.171 -8.298 1.00 0.00 H new ATOM 0 HB3 GLN A 20 1.161 0.387 -9.148 1.00 0.00 H new ATOM 0 HG2 GLN A 20 -0.644 -1.283 -10.725 1.00 0.00 H new ATOM 0 HG3 GLN A 20 -1.438 0.213 -10.275 1.00 0.00 H new ATOM 0 HE21 GLN A 20 0.587 -1.192 -12.604 1.00 0.00 H new ATOM 0 HE22 GLN A 20 1.268 0.296 -13.270 1.00 0.00 H new ATOM 280 N GLY A 21 1.634 -0.750 -6.494 1.00 0.00 N ATOM 281 CA GLY A 21 2.677 -0.474 -5.517 1.00 0.00 C ATOM 282 C GLY A 21 3.006 -1.704 -4.678 1.00 0.00 C ATOM 283 O GLY A 21 4.155 -1.914 -4.301 1.00 0.00 O ATOM 0 H GLY A 21 0.747 -0.282 -6.308 1.00 0.00 H new ATOM 0 HA2 GLY A 21 3.576 -0.134 -6.031 1.00 0.00 H new ATOM 0 HA3 GLY A 21 2.357 0.337 -4.863 1.00 0.00 H new ATOM 287 N ARG A 22 2.013 -2.559 -4.425 1.00 0.00 N ATOM 288 CA ARG A 22 2.160 -3.846 -3.790 1.00 0.00 C ATOM 289 C ARG A 22 3.199 -4.659 -4.560 1.00 0.00 C ATOM 290 O ARG A 22 4.222 -5.008 -3.972 1.00 0.00 O ATOM 291 CB ARG A 22 0.764 -4.497 -3.675 1.00 0.00 C ATOM 292 CG ARG A 22 0.867 -5.980 -3.386 1.00 0.00 C ATOM 293 CD ARG A 22 -0.274 -6.665 -2.629 1.00 0.00 C ATOM 294 NE ARG A 22 -1.087 -7.475 -3.542 1.00 0.00 N ATOM 295 CZ ARG A 22 -0.723 -8.559 -4.238 1.00 0.00 C ATOM 296 NH1 ARG A 22 0.451 -9.149 -4.040 1.00 0.00 N ATOM 297 NH2 ARG A 22 -1.556 -9.044 -5.146 1.00 0.00 N ATOM 0 H ARG A 22 1.045 -2.352 -4.673 1.00 0.00 H new ATOM 0 HA ARG A 22 2.541 -3.774 -2.771 1.00 0.00 H new ATOM 0 HB2 ARG A 22 0.198 -4.009 -2.882 1.00 0.00 H new ATOM 0 HB3 ARG A 22 0.212 -4.343 -4.602 1.00 0.00 H new ATOM 0 HG2 ARG A 22 0.986 -6.495 -4.340 1.00 0.00 H new ATOM 0 HG3 ARG A 22 1.784 -6.143 -2.819 1.00 0.00 H new ATOM 0 HD2 ARG A 22 0.134 -7.296 -1.840 1.00 0.00 H new ATOM 0 HD3 ARG A 22 -0.899 -5.914 -2.146 1.00 0.00 H new ATOM 0 HE ARG A 22 -2.054 -7.174 -3.662 1.00 0.00 H new ATOM 0 HH11 ARG A 22 1.098 -8.777 -3.345 1.00 0.00 H new ATOM 0 HH12 ARG A 22 0.705 -9.974 -4.583 1.00 0.00 H new ATOM 0 HH21 ARG A 22 -2.457 -8.592 -5.305 1.00 0.00 H new ATOM 0 HH22 ARG A 22 -1.297 -9.869 -5.687 1.00 0.00 H new ATOM 311 N GLN A 23 2.965 -4.970 -5.837 1.00 0.00 N ATOM 312 CA GLN A 23 3.877 -5.775 -6.617 1.00 0.00 C ATOM 313 C GLN A 23 5.228 -5.088 -6.779 1.00 0.00 C ATOM 314 O GLN A 23 6.244 -5.776 -6.700 1.00 0.00 O ATOM 315 CB GLN A 23 3.248 -6.040 -7.984 1.00 0.00 C ATOM 316 CG GLN A 23 2.186 -7.150 -7.982 1.00 0.00 C ATOM 317 CD GLN A 23 2.797 -8.553 -7.967 1.00 0.00 C ATOM 318 OE1 GLN A 23 3.912 -8.781 -7.500 1.00 0.00 O ATOM 319 NE2 GLN A 23 2.076 -9.548 -8.449 1.00 0.00 N ATOM 0 H GLN A 23 2.137 -4.666 -6.349 1.00 0.00 H new ATOM 0 HA GLN A 23 4.054 -6.716 -6.097 1.00 0.00 H new ATOM 0 HB2 GLN A 23 2.794 -5.118 -8.348 1.00 0.00 H new ATOM 0 HB3 GLN A 23 4.036 -6.307 -8.689 1.00 0.00 H new ATOM 0 HG2 GLN A 23 1.542 -7.029 -7.111 1.00 0.00 H new ATOM 0 HG3 GLN A 23 1.553 -7.043 -8.863 1.00 0.00 H new ATOM 0 HE21 GLN A 23 1.151 -9.366 -8.838 1.00 0.00 H new ATOM 0 HE22 GLN A 23 2.444 -10.499 -8.433 1.00 0.00 H new ATOM 328 N SER A 24 5.273 -3.768 -6.958 1.00 0.00 N ATOM 329 CA SER A 24 6.530 -3.060 -7.176 1.00 0.00 C ATOM 330 C SER A 24 7.338 -2.886 -5.886 1.00 0.00 C ATOM 331 O SER A 24 8.457 -2.382 -5.941 1.00 0.00 O ATOM 332 CB SER A 24 6.256 -1.730 -7.874 1.00 0.00 C ATOM 333 OG SER A 24 5.574 -1.977 -9.095 1.00 0.00 O ATOM 0 H SER A 24 4.449 -3.167 -6.956 1.00 0.00 H new ATOM 0 HA SER A 24 7.156 -3.669 -7.828 1.00 0.00 H new ATOM 0 HB2 SER A 24 5.656 -1.085 -7.232 1.00 0.00 H new ATOM 0 HB3 SER A 24 7.192 -1.206 -8.066 1.00 0.00 H new ATOM 0 HG SER A 24 4.620 -2.111 -8.915 1.00 0.00 H new ATOM 339 N LYS A 25 6.822 -3.331 -4.736 1.00 0.00 N ATOM 340 CA LYS A 25 7.588 -3.509 -3.506 1.00 0.00 C ATOM 341 C LYS A 25 7.645 -4.986 -3.096 1.00 0.00 C ATOM 342 O LYS A 25 8.030 -5.279 -1.967 1.00 0.00 O ATOM 343 CB LYS A 25 7.047 -2.570 -2.426 1.00 0.00 C ATOM 344 CG LYS A 25 7.177 -1.103 -2.849 1.00 0.00 C ATOM 345 CD LYS A 25 6.841 -0.178 -1.686 1.00 0.00 C ATOM 346 CE LYS A 25 7.901 -0.211 -0.586 1.00 0.00 C ATOM 347 NZ LYS A 25 9.170 0.386 -1.036 1.00 0.00 N ATOM 0 H LYS A 25 5.838 -3.582 -4.636 1.00 0.00 H new ATOM 0 HA LYS A 25 8.629 -3.228 -3.668 1.00 0.00 H new ATOM 0 HB2 LYS A 25 6.000 -2.803 -2.229 1.00 0.00 H new ATOM 0 HB3 LYS A 25 7.590 -2.732 -1.495 1.00 0.00 H new ATOM 0 HG2 LYS A 25 8.192 -0.907 -3.195 1.00 0.00 H new ATOM 0 HG3 LYS A 25 6.510 -0.900 -3.687 1.00 0.00 H new ATOM 0 HD2 LYS A 25 6.738 0.842 -2.056 1.00 0.00 H new ATOM 0 HD3 LYS A 25 5.877 -0.464 -1.266 1.00 0.00 H new ATOM 0 HE2 LYS A 25 7.535 0.327 0.288 1.00 0.00 H new ATOM 0 HE3 LYS A 25 8.073 -1.242 -0.277 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 9.794 0.533 -0.217 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 9.633 -0.252 -1.714 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 8.980 1.300 -1.495 1.00 0.00 H new ATOM 361 N GLY A 26 7.251 -5.885 -4.008 1.00 0.00 N ATOM 362 CA GLY A 26 7.292 -7.337 -3.912 1.00 0.00 C ATOM 363 C GLY A 26 6.227 -7.945 -3.008 1.00 0.00 C ATOM 364 O GLY A 26 6.225 -9.154 -2.790 1.00 0.00 O ATOM 0 H GLY A 26 6.865 -5.583 -4.902 1.00 0.00 H new ATOM 0 HA2 GLY A 26 7.183 -7.757 -4.912 1.00 0.00 H new ATOM 0 HA3 GLY A 26 8.274 -7.636 -3.546 1.00 0.00 H new ATOM 368 N LEU A 27 5.331 -7.142 -2.446 1.00 0.00 N ATOM 369 CA LEU A 27 4.564 -7.497 -1.261 1.00 0.00 C ATOM 370 C LEU A 27 3.512 -8.532 -1.640 1.00 0.00 C ATOM 371 O LEU A 27 2.767 -8.355 -2.609 1.00 0.00 O ATOM 372 CB LEU A 27 3.939 -6.232 -0.640 1.00 0.00 C ATOM 373 CG LEU A 27 4.975 -5.126 -0.373 1.00 0.00 C ATOM 374 CD1 LEU A 27 4.319 -3.796 -0.006 1.00 0.00 C ATOM 375 CD2 LEU A 27 5.963 -5.563 0.704 1.00 0.00 C ATOM 0 H LEU A 27 5.115 -6.213 -2.807 1.00 0.00 H new ATOM 0 HA LEU A 27 5.215 -7.938 -0.506 1.00 0.00 H new ATOM 0 HB2 LEU A 27 3.168 -5.848 -1.308 1.00 0.00 H new ATOM 0 HB3 LEU A 27 3.447 -6.497 0.296 1.00 0.00 H new ATOM 0 HG LEU A 27 5.522 -4.964 -1.302 1.00 0.00 H new ATOM 0 HD11 LEU A 27 5.090 -3.047 0.173 1.00 0.00 H new ATOM 0 HD12 LEU A 27 3.678 -3.468 -0.825 1.00 0.00 H new ATOM 0 HD13 LEU A 27 3.720 -3.922 0.896 1.00 0.00 H new ATOM 0 HD21 LEU A 27 6.687 -4.767 0.878 1.00 0.00 H new ATOM 0 HD22 LEU A 27 5.425 -5.772 1.628 1.00 0.00 H new ATOM 0 HD23 LEU A 27 6.484 -6.462 0.376 1.00 0.00 H new ATOM 387 N THR A 28 3.427 -9.631 -0.893 1.00 0.00 N ATOM 388 CA THR A 28 2.305 -10.547 -1.048 1.00 0.00 C ATOM 389 C THR A 28 1.025 -9.864 -0.548 1.00 0.00 C ATOM 390 O THR A 28 1.074 -8.817 0.112 1.00 0.00 O ATOM 391 CB THR A 28 2.573 -11.875 -0.322 1.00 0.00 C ATOM 392 OG1 THR A 28 2.449 -11.712 1.066 1.00 0.00 O ATOM 393 CG2 THR A 28 3.947 -12.477 -0.623 1.00 0.00 C ATOM 0 H THR A 28 4.110 -9.904 -0.187 1.00 0.00 H new ATOM 0 HA THR A 28 2.176 -10.792 -2.102 1.00 0.00 H new ATOM 0 HB THR A 28 1.822 -12.568 -0.701 1.00 0.00 H new ATOM 0 HG1 THR A 28 3.339 -11.716 1.477 1.00 0.00 H new ATOM 0 HG21 THR A 28 4.063 -13.412 -0.075 1.00 0.00 H new ATOM 0 HG22 THR A 28 4.033 -12.670 -1.692 1.00 0.00 H new ATOM 0 HG23 THR A 28 4.725 -11.778 -0.316 1.00 0.00 H new ATOM 401 N GLN A 29 -0.133 -10.487 -0.790 1.00 0.00 N ATOM 402 CA GLN A 29 -1.365 -10.050 -0.138 1.00 0.00 C ATOM 403 C GLN A 29 -1.244 -10.195 1.393 1.00 0.00 C ATOM 404 O GLN A 29 -1.828 -9.390 2.113 1.00 0.00 O ATOM 405 CB GLN A 29 -2.574 -10.811 -0.722 1.00 0.00 C ATOM 406 CG GLN A 29 -2.831 -10.405 -2.190 1.00 0.00 C ATOM 407 CD GLN A 29 -3.865 -11.253 -2.932 1.00 0.00 C ATOM 408 OE1 GLN A 29 -4.106 -12.406 -2.586 1.00 0.00 O ATOM 409 NE2 GLN A 29 -4.455 -10.740 -3.996 1.00 0.00 N ATOM 0 H GLN A 29 -0.240 -11.281 -1.421 1.00 0.00 H new ATOM 0 HA GLN A 29 -1.530 -8.991 -0.338 1.00 0.00 H new ATOM 0 HB2 GLN A 29 -2.394 -11.885 -0.665 1.00 0.00 H new ATOM 0 HB3 GLN A 29 -3.461 -10.604 -0.124 1.00 0.00 H new ATOM 0 HG2 GLN A 29 -3.157 -9.365 -2.210 1.00 0.00 H new ATOM 0 HG3 GLN A 29 -1.888 -10.454 -2.734 1.00 0.00 H new ATOM 0 HE21 GLN A 29 -4.252 -9.782 -4.280 1.00 0.00 H new ATOM 0 HE22 GLN A 29 -5.114 -11.302 -4.534 1.00 0.00 H new ATOM 418 N LYS A 30 -0.466 -11.159 1.909 1.00 0.00 N ATOM 419 CA LYS A 30 -0.202 -11.314 3.341 1.00 0.00 C ATOM 420 C LYS A 30 0.702 -10.218 3.883 1.00 0.00 C ATOM 421 O LYS A 30 0.471 -9.767 5.002 1.00 0.00 O ATOM 422 CB LYS A 30 0.407 -12.684 3.631 1.00 0.00 C ATOM 423 CG LYS A 30 -0.665 -13.774 3.749 1.00 0.00 C ATOM 424 CD LYS A 30 -0.030 -15.113 3.403 1.00 0.00 C ATOM 425 CE LYS A 30 -1.044 -16.254 3.479 1.00 0.00 C ATOM 426 NZ LYS A 30 -0.360 -17.547 3.307 1.00 0.00 N ATOM 0 H LYS A 30 0.001 -11.859 1.333 1.00 0.00 H new ATOM 0 HA LYS A 30 -1.162 -11.231 3.851 1.00 0.00 H new ATOM 0 HB2 LYS A 30 1.105 -12.946 2.836 1.00 0.00 H new ATOM 0 HB3 LYS A 30 0.981 -12.638 4.557 1.00 0.00 H new ATOM 0 HG2 LYS A 30 -1.072 -13.797 4.760 1.00 0.00 H new ATOM 0 HG3 LYS A 30 -1.496 -13.563 3.076 1.00 0.00 H new ATOM 0 HD2 LYS A 30 0.392 -15.067 2.399 1.00 0.00 H new ATOM 0 HD3 LYS A 30 0.795 -15.313 4.087 1.00 0.00 H new ATOM 0 HE2 LYS A 30 -1.559 -16.231 4.439 1.00 0.00 H new ATOM 0 HE3 LYS A 30 -1.803 -16.129 2.707 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 -1.056 -18.318 3.360 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 0.112 -17.570 2.380 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 0.348 -17.668 4.059 1.00 0.00 H new ATOM 440 N ASP A 31 1.719 -9.791 3.140 1.00 0.00 N ATOM 441 CA ASP A 31 2.633 -8.734 3.577 1.00 0.00 C ATOM 442 C ASP A 31 1.828 -7.444 3.700 1.00 0.00 C ATOM 443 O ASP A 31 1.841 -6.789 4.739 1.00 0.00 O ATOM 444 CB ASP A 31 3.815 -8.553 2.609 1.00 0.00 C ATOM 445 CG ASP A 31 4.840 -9.685 2.701 1.00 0.00 C ATOM 446 OD1 ASP A 31 4.526 -10.787 2.197 1.00 0.00 O ATOM 447 OD2 ASP A 31 5.960 -9.476 3.218 1.00 0.00 O ATOM 0 H ASP A 31 1.935 -10.167 2.217 1.00 0.00 H new ATOM 0 HA ASP A 31 3.068 -9.008 4.538 1.00 0.00 H new ATOM 0 HB2 ASP A 31 3.436 -8.495 1.589 1.00 0.00 H new ATOM 0 HB3 ASP A 31 4.309 -7.605 2.820 1.00 0.00 H new ATOM 452 N LEU A 32 1.043 -7.119 2.667 1.00 0.00 N ATOM 453 CA LEU A 32 0.149 -5.964 2.658 1.00 0.00 C ATOM 454 C LEU A 32 -0.821 -6.018 3.844 1.00 0.00 C ATOM 455 O LEU A 32 -0.974 -5.031 4.557 1.00 0.00 O ATOM 456 CB LEU A 32 -0.621 -5.939 1.323 1.00 0.00 C ATOM 457 CG LEU A 32 -0.952 -4.547 0.766 1.00 0.00 C ATOM 458 CD1 LEU A 32 -1.575 -3.587 1.782 1.00 0.00 C ATOM 459 CD2 LEU A 32 0.299 -3.911 0.151 1.00 0.00 C ATOM 0 H LEU A 32 1.013 -7.661 1.803 1.00 0.00 H new ATOM 0 HA LEU A 32 0.736 -5.051 2.755 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -0.035 -6.477 0.578 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -1.553 -6.488 1.453 1.00 0.00 H new ATOM 0 HG LEU A 32 -1.714 -4.712 0.004 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -1.775 -2.629 1.302 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -2.508 -4.008 2.156 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -0.885 -3.439 2.613 1.00 0.00 H new ATOM 0 HD21 LEU A 32 0.051 -2.924 -0.240 1.00 0.00 H new ATOM 0 HD22 LEU A 32 1.071 -3.815 0.914 1.00 0.00 H new ATOM 0 HD23 LEU A 32 0.666 -4.541 -0.659 1.00 0.00 H new ATOM 471 N ALA A 33 -1.452 -7.173 4.071 1.00 0.00 N ATOM 472 CA ALA A 33 -2.381 -7.379 5.173 1.00 0.00 C ATOM 473 C ALA A 33 -1.710 -7.116 6.520 1.00 0.00 C ATOM 474 O ALA A 33 -2.232 -6.354 7.332 1.00 0.00 O ATOM 475 CB ALA A 33 -2.912 -8.807 5.102 1.00 0.00 C ATOM 0 H ALA A 33 -1.327 -7.998 3.485 1.00 0.00 H new ATOM 0 HA ALA A 33 -3.207 -6.674 5.084 1.00 0.00 H new ATOM 0 HB1 ALA A 33 -3.610 -8.977 5.922 1.00 0.00 H new ATOM 0 HB2 ALA A 33 -3.425 -8.958 4.152 1.00 0.00 H new ATOM 0 HB3 ALA A 33 -2.081 -9.508 5.181 1.00 0.00 H new ATOM 481 N THR A 34 -0.546 -7.727 6.741 1.00 0.00 N ATOM 482 CA THR A 34 0.270 -7.566 7.937 1.00 0.00 C ATOM 483 C THR A 34 0.575 -6.079 8.159 1.00 0.00 C ATOM 484 O THR A 34 0.371 -5.561 9.256 1.00 0.00 O ATOM 485 CB THR A 34 1.554 -8.393 7.763 1.00 0.00 C ATOM 486 OG1 THR A 34 1.257 -9.763 7.526 1.00 0.00 O ATOM 487 CG2 THR A 34 2.453 -8.301 8.993 1.00 0.00 C ATOM 0 H THR A 34 -0.134 -8.370 6.065 1.00 0.00 H new ATOM 0 HA THR A 34 -0.260 -7.925 8.820 1.00 0.00 H new ATOM 0 HB THR A 34 2.075 -7.975 6.902 1.00 0.00 H new ATOM 0 HG1 THR A 34 1.104 -9.904 6.568 1.00 0.00 H new ATOM 0 HG21 THR A 34 3.351 -8.898 8.833 1.00 0.00 H new ATOM 0 HG22 THR A 34 2.734 -7.261 9.161 1.00 0.00 H new ATOM 0 HG23 THR A 34 1.917 -8.678 9.864 1.00 0.00 H new ATOM 495 N LYS A 35 1.006 -5.377 7.108 1.00 0.00 N ATOM 496 CA LYS A 35 1.323 -3.953 7.114 1.00 0.00 C ATOM 497 C LYS A 35 0.146 -3.056 7.498 1.00 0.00 C ATOM 498 O LYS A 35 0.370 -1.880 7.790 1.00 0.00 O ATOM 499 CB LYS A 35 1.824 -3.577 5.718 1.00 0.00 C ATOM 500 CG LYS A 35 3.316 -3.889 5.539 1.00 0.00 C ATOM 501 CD LYS A 35 3.731 -3.759 4.072 1.00 0.00 C ATOM 502 CE LYS A 35 5.165 -4.228 3.795 1.00 0.00 C ATOM 503 NZ LYS A 35 6.210 -3.389 4.410 1.00 0.00 N ATOM 0 H LYS A 35 1.148 -5.806 6.194 1.00 0.00 H new ATOM 0 HA LYS A 35 2.082 -3.788 7.879 1.00 0.00 H new ATOM 0 HB2 LYS A 35 1.248 -4.119 4.968 1.00 0.00 H new ATOM 0 HB3 LYS A 35 1.653 -2.515 5.545 1.00 0.00 H new ATOM 0 HG2 LYS A 35 3.909 -3.209 6.150 1.00 0.00 H new ATOM 0 HG3 LYS A 35 3.525 -4.899 5.892 1.00 0.00 H new ATOM 0 HD2 LYS A 35 3.043 -4.338 3.456 1.00 0.00 H new ATOM 0 HD3 LYS A 35 3.633 -2.717 3.766 1.00 0.00 H new ATOM 0 HE2 LYS A 35 5.276 -5.250 4.158 1.00 0.00 H new ATOM 0 HE3 LYS A 35 5.324 -4.253 2.717 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 7.147 -3.774 4.175 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 6.134 -2.417 4.047 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 6.087 -3.383 5.443 1.00 0.00 H new ATOM 517 N ILE A 36 -1.085 -3.564 7.482 1.00 0.00 N ATOM 518 CA ILE A 36 -2.267 -2.835 7.925 1.00 0.00 C ATOM 519 C ILE A 36 -2.994 -3.581 9.045 1.00 0.00 C ATOM 520 O ILE A 36 -4.143 -3.268 9.348 1.00 0.00 O ATOM 521 CB ILE A 36 -3.169 -2.487 6.732 1.00 0.00 C ATOM 522 CG1 ILE A 36 -3.848 -3.714 6.108 1.00 0.00 C ATOM 523 CG2 ILE A 36 -2.400 -1.688 5.674 1.00 0.00 C ATOM 524 CD1 ILE A 36 -4.794 -3.318 4.981 1.00 0.00 C ATOM 0 H ILE A 36 -1.290 -4.508 7.155 1.00 0.00 H new ATOM 0 HA ILE A 36 -1.953 -1.886 8.360 1.00 0.00 H new ATOM 0 HB ILE A 36 -3.970 -1.862 7.128 1.00 0.00 H new ATOM 0 HG12 ILE A 36 -3.089 -4.395 5.724 1.00 0.00 H new ATOM 0 HG13 ILE A 36 -4.402 -4.254 6.876 1.00 0.00 H new ATOM 0 HG21 ILE A 36 -3.063 -1.455 4.841 1.00 0.00 H new ATOM 0 HG22 ILE A 36 -2.032 -0.761 6.114 1.00 0.00 H new ATOM 0 HG23 ILE A 36 -1.558 -2.278 5.313 1.00 0.00 H new ATOM 0 HD11 ILE A 36 -5.256 -4.212 4.563 1.00 0.00 H new ATOM 0 HD12 ILE A 36 -5.568 -2.657 5.371 1.00 0.00 H new ATOM 0 HD13 ILE A 36 -4.235 -2.801 4.201 1.00 0.00 H new ATOM 536 N ASN A 37 -2.336 -4.560 9.667 1.00 0.00 N ATOM 537 CA ASN A 37 -2.871 -5.373 10.766 1.00 0.00 C ATOM 538 C ASN A 37 -4.177 -6.119 10.408 1.00 0.00 C ATOM 539 O ASN A 37 -4.839 -6.663 11.292 1.00 0.00 O ATOM 540 CB ASN A 37 -3.031 -4.483 12.015 1.00 0.00 C ATOM 541 CG ASN A 37 -3.264 -5.284 13.284 1.00 0.00 C ATOM 542 OD1 ASN A 37 -2.346 -5.921 13.792 1.00 0.00 O ATOM 543 ND2 ASN A 37 -4.435 -5.202 13.893 1.00 0.00 N ATOM 0 H ASN A 37 -1.383 -4.820 9.413 1.00 0.00 H new ATOM 0 HA ASN A 37 -2.155 -6.168 10.975 1.00 0.00 H new ATOM 0 HB2 ASN A 37 -2.137 -3.871 12.136 1.00 0.00 H new ATOM 0 HB3 ASN A 37 -3.867 -3.800 11.864 1.00 0.00 H new ATOM 0 HD21 ASN A 37 -4.578 -5.669 14.788 1.00 0.00 H new ATOM 0 HD22 ASN A 37 -5.195 -4.672 13.467 1.00 0.00 H new ATOM 550 N GLU A 38 -4.558 -6.197 9.132 1.00 0.00 N ATOM 551 CA GLU A 38 -5.822 -6.737 8.626 1.00 0.00 C ATOM 552 C GLU A 38 -5.550 -8.096 7.953 1.00 0.00 C ATOM 553 O GLU A 38 -4.473 -8.665 8.170 1.00 0.00 O ATOM 554 CB GLU A 38 -6.500 -5.685 7.727 1.00 0.00 C ATOM 555 CG GLU A 38 -8.025 -5.845 7.661 1.00 0.00 C ATOM 556 CD GLU A 38 -8.791 -4.568 8.019 1.00 0.00 C ATOM 557 OE1 GLU A 38 -8.665 -4.099 9.178 1.00 0.00 O ATOM 558 OE2 GLU A 38 -9.604 -4.069 7.205 1.00 0.00 O ATOM 0 H GLU A 38 -3.956 -5.865 8.378 1.00 0.00 H new ATOM 0 HA GLU A 38 -6.534 -6.938 9.427 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -6.261 -4.689 8.099 1.00 0.00 H new ATOM 0 HB3 GLU A 38 -6.089 -5.757 6.720 1.00 0.00 H new ATOM 0 HG2 GLU A 38 -8.306 -6.158 6.655 1.00 0.00 H new ATOM 0 HG3 GLU A 38 -8.328 -6.643 8.339 1.00 0.00 H new ATOM 565 N LYS A 39 -6.518 -8.703 7.252 1.00 0.00 N ATOM 566 CA LYS A 39 -6.361 -10.041 6.675 1.00 0.00 C ATOM 567 C LYS A 39 -6.091 -10.009 5.170 1.00 0.00 C ATOM 568 O LYS A 39 -6.608 -9.136 4.476 1.00 0.00 O ATOM 569 CB LYS A 39 -7.632 -10.841 6.962 1.00 0.00 C ATOM 570 CG LYS A 39 -7.852 -11.059 8.471 1.00 0.00 C ATOM 571 CD LYS A 39 -6.829 -12.048 9.068 1.00 0.00 C ATOM 572 CE LYS A 39 -6.985 -12.174 10.587 1.00 0.00 C ATOM 573 NZ LYS A 39 -5.804 -12.820 11.198 1.00 0.00 N ATOM 0 H LYS A 39 -7.428 -8.280 7.071 1.00 0.00 H new ATOM 0 HA LYS A 39 -5.491 -10.510 7.135 1.00 0.00 H new ATOM 0 HB2 LYS A 39 -8.491 -10.318 6.543 1.00 0.00 H new ATOM 0 HB3 LYS A 39 -7.572 -11.807 6.462 1.00 0.00 H new ATOM 0 HG2 LYS A 39 -7.778 -10.103 8.990 1.00 0.00 H new ATOM 0 HG3 LYS A 39 -8.861 -11.435 8.640 1.00 0.00 H new ATOM 0 HD2 LYS A 39 -6.957 -13.027 8.606 1.00 0.00 H new ATOM 0 HD3 LYS A 39 -5.819 -11.714 8.832 1.00 0.00 H new ATOM 0 HE2 LYS A 39 -7.127 -11.185 11.023 1.00 0.00 H new ATOM 0 HE3 LYS A 39 -7.879 -12.755 10.816 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 -5.940 -12.891 12.227 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 -5.684 -13.773 10.798 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 -4.956 -12.252 10.999 1.00 0.00 H new ATOM 587 N PRO A 40 -5.347 -10.992 4.630 1.00 0.00 N ATOM 588 CA PRO A 40 -5.026 -11.068 3.207 1.00 0.00 C ATOM 589 C PRO A 40 -6.237 -11.400 2.342 1.00 0.00 C ATOM 590 O PRO A 40 -6.175 -11.210 1.124 1.00 0.00 O ATOM 591 CB PRO A 40 -3.931 -12.126 3.101 1.00 0.00 C ATOM 592 CG PRO A 40 -4.161 -13.032 4.305 1.00 0.00 C ATOM 593 CD PRO A 40 -4.715 -12.081 5.356 1.00 0.00 C ATOM 0 HA PRO A 40 -4.693 -10.102 2.828 1.00 0.00 H new ATOM 0 HB2 PRO A 40 -4.004 -12.681 2.166 1.00 0.00 H new ATOM 0 HB3 PRO A 40 -2.939 -11.675 3.127 1.00 0.00 H new ATOM 0 HG2 PRO A 40 -4.864 -13.834 4.077 1.00 0.00 H new ATOM 0 HG3 PRO A 40 -3.236 -13.504 4.636 1.00 0.00 H new ATOM 0 HD2 PRO A 40 -5.434 -12.589 5.999 1.00 0.00 H new ATOM 0 HD3 PRO A 40 -3.919 -11.708 6.001 1.00 0.00 H new ATOM 601 N GLN A 41 -7.328 -11.854 2.964 1.00 0.00 N ATOM 602 CA GLN A 41 -8.631 -11.932 2.340 1.00 0.00 C ATOM 603 C GLN A 41 -9.011 -10.561 1.791 1.00 0.00 C ATOM 604 O GLN A 41 -9.222 -10.442 0.587 1.00 0.00 O ATOM 605 CB GLN A 41 -9.656 -12.435 3.369 1.00 0.00 C ATOM 606 CG GLN A 41 -11.066 -12.506 2.772 1.00 0.00 C ATOM 607 CD GLN A 41 -11.191 -13.512 1.638 1.00 0.00 C ATOM 608 OE1 GLN A 41 -10.867 -14.690 1.787 1.00 0.00 O ATOM 609 NE2 GLN A 41 -11.678 -13.079 0.495 1.00 0.00 N ATOM 0 H GLN A 41 -7.320 -12.180 3.930 1.00 0.00 H new ATOM 0 HA GLN A 41 -8.614 -12.635 1.507 1.00 0.00 H new ATOM 0 HB2 GLN A 41 -9.361 -13.422 3.725 1.00 0.00 H new ATOM 0 HB3 GLN A 41 -9.659 -11.772 4.234 1.00 0.00 H new ATOM 0 HG2 GLN A 41 -11.773 -12.767 3.559 1.00 0.00 H new ATOM 0 HG3 GLN A 41 -11.347 -11.519 2.405 1.00 0.00 H new ATOM 0 HE21 GLN A 41 -11.941 -12.099 0.391 1.00 0.00 H new ATOM 0 HE22 GLN A 41 -11.793 -13.723 -0.287 1.00 0.00 H new ATOM 618 N VAL A 42 -9.099 -9.542 2.658 1.00 0.00 N ATOM 619 CA VAL A 42 -9.618 -8.255 2.223 1.00 0.00 C ATOM 620 C VAL A 42 -8.726 -7.713 1.117 1.00 0.00 C ATOM 621 O VAL A 42 -9.253 -7.233 0.128 1.00 0.00 O ATOM 622 CB VAL A 42 -9.873 -7.249 3.372 1.00 0.00 C ATOM 623 CG1 VAL A 42 -10.478 -7.942 4.598 1.00 0.00 C ATOM 624 CG2 VAL A 42 -8.667 -6.416 3.829 1.00 0.00 C ATOM 0 H VAL A 42 -8.823 -9.588 3.639 1.00 0.00 H new ATOM 0 HA VAL A 42 -10.619 -8.411 1.820 1.00 0.00 H new ATOM 0 HB VAL A 42 -10.573 -6.544 2.924 1.00 0.00 H new ATOM 0 HG11 VAL A 42 -10.644 -7.207 5.386 1.00 0.00 H new ATOM 0 HG12 VAL A 42 -11.428 -8.402 4.324 1.00 0.00 H new ATOM 0 HG13 VAL A 42 -9.793 -8.710 4.957 1.00 0.00 H new ATOM 0 HG21 VAL A 42 -8.970 -5.750 4.637 1.00 0.00 H new ATOM 0 HG22 VAL A 42 -7.879 -7.081 4.183 1.00 0.00 H new ATOM 0 HG23 VAL A 42 -8.295 -5.825 2.992 1.00 0.00 H new ATOM 634 N ILE A 43 -7.397 -7.843 1.225 1.00 0.00 N ATOM 635 CA ILE A 43 -6.483 -7.318 0.204 1.00 0.00 C ATOM 636 C ILE A 43 -6.852 -7.855 -1.181 1.00 0.00 C ATOM 637 O ILE A 43 -6.961 -7.086 -2.137 1.00 0.00 O ATOM 638 CB ILE A 43 -5.011 -7.619 0.555 1.00 0.00 C ATOM 639 CG1 ILE A 43 -4.640 -7.150 1.971 1.00 0.00 C ATOM 640 CG2 ILE A 43 -4.063 -7.000 -0.492 1.00 0.00 C ATOM 641 CD1 ILE A 43 -4.862 -5.657 2.238 1.00 0.00 C ATOM 0 H ILE A 43 -6.933 -8.306 2.007 1.00 0.00 H new ATOM 0 HA ILE A 43 -6.591 -6.234 0.182 1.00 0.00 H new ATOM 0 HB ILE A 43 -4.893 -8.702 0.537 1.00 0.00 H new ATOM 0 HG12 ILE A 43 -5.223 -7.723 2.692 1.00 0.00 H new ATOM 0 HG13 ILE A 43 -3.591 -7.384 2.152 1.00 0.00 H new ATOM 0 HG21 ILE A 43 -3.030 -7.224 -0.225 1.00 0.00 H new ATOM 0 HG22 ILE A 43 -4.283 -7.418 -1.474 1.00 0.00 H new ATOM 0 HG23 ILE A 43 -4.205 -5.920 -0.517 1.00 0.00 H new ATOM 0 HD11 ILE A 43 -4.572 -5.423 3.262 1.00 0.00 H new ATOM 0 HD12 ILE A 43 -4.257 -5.070 1.547 1.00 0.00 H new ATOM 0 HD13 ILE A 43 -5.915 -5.414 2.095 1.00 0.00 H new ATOM 653 N ALA A 44 -7.077 -9.166 -1.275 1.00 0.00 N ATOM 654 CA ALA A 44 -7.499 -9.799 -2.515 1.00 0.00 C ATOM 655 C ALA A 44 -8.820 -9.218 -3.041 1.00 0.00 C ATOM 656 O ALA A 44 -9.045 -9.140 -4.251 1.00 0.00 O ATOM 657 CB ALA A 44 -7.647 -11.299 -2.263 1.00 0.00 C ATOM 0 H ALA A 44 -6.971 -9.813 -0.494 1.00 0.00 H new ATOM 0 HA ALA A 44 -6.745 -9.609 -3.278 1.00 0.00 H new ATOM 0 HB1 ALA A 44 -7.963 -11.793 -3.182 1.00 0.00 H new ATOM 0 HB2 ALA A 44 -6.690 -11.710 -1.941 1.00 0.00 H new ATOM 0 HB3 ALA A 44 -8.393 -11.466 -1.486 1.00 0.00 H new ATOM 663 N ASP A 45 -9.737 -8.858 -2.149 1.00 0.00 N ATOM 664 CA ASP A 45 -11.060 -8.344 -2.489 1.00 0.00 C ATOM 665 C ASP A 45 -10.990 -6.870 -2.881 1.00 0.00 C ATOM 666 O ASP A 45 -11.652 -6.466 -3.841 1.00 0.00 O ATOM 667 CB ASP A 45 -12.032 -8.591 -1.327 1.00 0.00 C ATOM 668 CG ASP A 45 -12.242 -10.080 -1.047 1.00 0.00 C ATOM 669 OD1 ASP A 45 -12.161 -10.901 -2.001 1.00 0.00 O ATOM 670 OD2 ASP A 45 -12.428 -10.418 0.140 1.00 0.00 O ATOM 0 H ASP A 45 -9.577 -8.917 -1.143 1.00 0.00 H new ATOM 0 HA ASP A 45 -11.439 -8.881 -3.359 1.00 0.00 H new ATOM 0 HB2 ASP A 45 -11.650 -8.106 -0.429 1.00 0.00 H new ATOM 0 HB3 ASP A 45 -12.992 -8.128 -1.556 1.00 0.00 H new ATOM 675 N TYR A 46 -10.153 -6.079 -2.206 1.00 0.00 N ATOM 676 CA TYR A 46 -9.819 -4.708 -2.566 1.00 0.00 C ATOM 677 C TYR A 46 -9.224 -4.693 -3.980 1.00 0.00 C ATOM 678 O TYR A 46 -9.578 -3.820 -4.768 1.00 0.00 O ATOM 679 CB TYR A 46 -8.846 -4.094 -1.534 1.00 0.00 C ATOM 680 CG TYR A 46 -9.472 -3.406 -0.324 1.00 0.00 C ATOM 681 CD1 TYR A 46 -9.755 -2.028 -0.351 1.00 0.00 C ATOM 682 CD2 TYR A 46 -9.681 -4.107 0.875 1.00 0.00 C ATOM 683 CE1 TYR A 46 -10.236 -1.378 0.800 1.00 0.00 C ATOM 684 CE2 TYR A 46 -10.185 -3.481 2.021 1.00 0.00 C ATOM 685 CZ TYR A 46 -10.470 -2.107 1.986 1.00 0.00 C ATOM 686 OH TYR A 46 -10.866 -1.470 3.121 1.00 0.00 O ATOM 0 H TYR A 46 -9.673 -6.392 -1.362 1.00 0.00 H new ATOM 0 HA TYR A 46 -10.721 -4.096 -2.558 1.00 0.00 H new ATOM 0 HB2 TYR A 46 -8.189 -4.886 -1.173 1.00 0.00 H new ATOM 0 HB3 TYR A 46 -8.217 -3.369 -2.050 1.00 0.00 H new ATOM 0 HD1 TYR A 46 -9.602 -1.466 -1.261 1.00 0.00 H new ATOM 0 HD2 TYR A 46 -9.446 -5.160 0.914 1.00 0.00 H new ATOM 0 HE1 TYR A 46 -10.427 -0.315 0.776 1.00 0.00 H new ATOM 0 HE2 TYR A 46 -10.353 -4.050 2.924 1.00 0.00 H new ATOM 0 HH TYR A 46 -10.982 -2.125 3.840 1.00 0.00 H new ATOM 696 N GLU A 47 -8.387 -5.674 -4.336 1.00 0.00 N ATOM 697 CA GLU A 47 -7.739 -5.760 -5.643 1.00 0.00 C ATOM 698 C GLU A 47 -8.695 -6.095 -6.790 1.00 0.00 C ATOM 699 O GLU A 47 -8.483 -5.592 -7.898 1.00 0.00 O ATOM 700 CB GLU A 47 -6.592 -6.773 -5.607 1.00 0.00 C ATOM 701 CG GLU A 47 -5.334 -6.106 -5.042 1.00 0.00 C ATOM 702 CD GLU A 47 -4.115 -7.009 -5.135 1.00 0.00 C ATOM 703 OE1 GLU A 47 -4.215 -8.255 -5.222 1.00 0.00 O ATOM 704 OE2 GLU A 47 -2.992 -6.484 -5.148 1.00 0.00 O ATOM 0 H GLU A 47 -8.139 -6.441 -3.711 1.00 0.00 H new ATOM 0 HA GLU A 47 -7.352 -4.762 -5.847 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -6.869 -7.629 -4.992 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -6.396 -7.151 -6.610 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -5.141 -5.180 -5.584 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -5.505 -5.835 -4.000 1.00 0.00 H new ATOM 711 N SER A 48 -9.749 -6.891 -6.571 1.00 0.00 N ATOM 712 CA SER A 48 -10.814 -7.013 -7.571 1.00 0.00 C ATOM 713 C SER A 48 -11.667 -5.737 -7.566 1.00 0.00 C ATOM 714 O SER A 48 -12.243 -5.371 -8.594 1.00 0.00 O ATOM 715 CB SER A 48 -11.702 -8.225 -7.272 1.00 0.00 C ATOM 716 OG SER A 48 -12.453 -8.647 -8.409 1.00 0.00 O ATOM 0 H SER A 48 -9.886 -7.449 -5.728 1.00 0.00 H new ATOM 0 HA SER A 48 -10.359 -7.150 -8.552 1.00 0.00 H new ATOM 0 HB2 SER A 48 -11.080 -9.050 -6.925 1.00 0.00 H new ATOM 0 HB3 SER A 48 -12.386 -7.978 -6.460 1.00 0.00 H new ATOM 0 HG SER A 48 -13.002 -9.423 -8.169 1.00 0.00 H new ATOM 722 N GLY A 49 -11.768 -5.068 -6.418 1.00 0.00 N ATOM 723 CA GLY A 49 -12.632 -3.916 -6.222 1.00 0.00 C ATOM 724 C GLY A 49 -13.939 -4.311 -5.543 1.00 0.00 C ATOM 725 O GLY A 49 -14.865 -3.507 -5.489 1.00 0.00 O ATOM 0 H GLY A 49 -11.238 -5.321 -5.584 1.00 0.00 H new ATOM 0 HA2 GLY A 49 -12.116 -3.171 -5.616 1.00 0.00 H new ATOM 0 HA3 GLY A 49 -12.846 -3.452 -7.185 1.00 0.00 H new ATOM 729 N ARG A 50 -14.038 -5.539 -5.030 1.00 0.00 N ATOM 730 CA ARG A 50 -15.190 -6.026 -4.290 1.00 0.00 C ATOM 731 C ARG A 50 -15.340 -5.237 -3.000 1.00 0.00 C ATOM 732 O ARG A 50 -16.379 -4.604 -2.796 1.00 0.00 O ATOM 733 CB ARG A 50 -15.037 -7.529 -4.000 1.00 0.00 C ATOM 734 CG ARG A 50 -15.341 -8.392 -5.231 1.00 0.00 C ATOM 735 CD ARG A 50 -16.661 -9.159 -5.039 1.00 0.00 C ATOM 736 NE ARG A 50 -17.187 -9.671 -6.309 1.00 0.00 N ATOM 737 CZ ARG A 50 -17.830 -8.980 -7.254 1.00 0.00 C ATOM 738 NH1 ARG A 50 -18.148 -7.702 -7.067 1.00 0.00 N ATOM 739 NH2 ARG A 50 -18.148 -9.592 -8.385 1.00 0.00 N ATOM 0 H ARG A 50 -13.298 -6.235 -5.123 1.00 0.00 H new ATOM 0 HA ARG A 50 -16.090 -5.887 -4.889 1.00 0.00 H new ATOM 0 HB2 ARG A 50 -14.021 -7.730 -3.660 1.00 0.00 H new ATOM 0 HB3 ARG A 50 -15.707 -7.810 -3.187 1.00 0.00 H new ATOM 0 HG2 ARG A 50 -15.406 -7.761 -6.118 1.00 0.00 H new ATOM 0 HG3 ARG A 50 -14.526 -9.096 -5.399 1.00 0.00 H new ATOM 0 HD2 ARG A 50 -16.501 -9.989 -4.351 1.00 0.00 H new ATOM 0 HD3 ARG A 50 -17.399 -8.502 -4.579 1.00 0.00 H new ATOM 0 HE ARG A 50 -17.046 -10.665 -6.491 1.00 0.00 H new ATOM 0 HH11 ARG A 50 -17.901 -7.238 -6.193 1.00 0.00 H new ATOM 0 HH12 ARG A 50 -18.639 -7.187 -7.797 1.00 0.00 H new ATOM 0 HH21 ARG A 50 -17.902 -10.572 -8.521 1.00 0.00 H new ATOM 0 HH22 ARG A 50 -18.639 -9.083 -9.120 1.00 0.00 H new ATOM 753 N ALA A 51 -14.313 -5.313 -2.147 1.00 0.00 N ATOM 754 CA ALA A 51 -14.326 -4.759 -0.803 1.00 0.00 C ATOM 755 C ALA A 51 -14.609 -3.259 -0.857 1.00 0.00 C ATOM 756 O ALA A 51 -14.127 -2.559 -1.759 1.00 0.00 O ATOM 757 CB ALA A 51 -12.986 -5.044 -0.122 1.00 0.00 C ATOM 0 H ALA A 51 -13.434 -5.773 -2.384 1.00 0.00 H new ATOM 0 HA ALA A 51 -15.118 -5.229 -0.220 1.00 0.00 H new ATOM 0 HB1 ALA A 51 -12.995 -4.629 0.886 1.00 0.00 H new ATOM 0 HB2 ALA A 51 -12.826 -6.121 -0.070 1.00 0.00 H new ATOM 0 HB3 ALA A 51 -12.181 -4.585 -0.696 1.00 0.00 H new ATOM 763 N ILE A 52 -15.398 -2.776 0.103 1.00 0.00 N ATOM 764 CA ILE A 52 -15.823 -1.388 0.180 1.00 0.00 C ATOM 765 C ILE A 52 -14.603 -0.588 0.651 1.00 0.00 C ATOM 766 O ILE A 52 -14.042 -0.935 1.694 1.00 0.00 O ATOM 767 CB ILE A 52 -17.036 -1.201 1.109 1.00 0.00 C ATOM 768 CG1 ILE A 52 -18.320 -1.842 0.541 1.00 0.00 C ATOM 769 CG2 ILE A 52 -17.330 0.301 1.283 1.00 0.00 C ATOM 770 CD1 ILE A 52 -18.304 -3.357 0.383 1.00 0.00 C ATOM 0 H ILE A 52 -15.764 -3.353 0.860 1.00 0.00 H new ATOM 0 HA ILE A 52 -16.164 -1.035 -0.793 1.00 0.00 H new ATOM 0 HB ILE A 52 -16.778 -1.683 2.052 1.00 0.00 H new ATOM 0 HG12 ILE A 52 -19.153 -1.574 1.191 1.00 0.00 H new ATOM 0 HG13 ILE A 52 -18.522 -1.398 -0.434 1.00 0.00 H new ATOM 0 HG21 ILE A 52 -18.189 0.430 1.941 1.00 0.00 H new ATOM 0 HG22 ILE A 52 -16.461 0.794 1.720 1.00 0.00 H new ATOM 0 HG23 ILE A 52 -17.548 0.744 0.311 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -19.259 -3.690 -0.024 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -17.500 -3.644 -0.295 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -18.141 -3.822 1.355 1.00 0.00 H new ATOM 782 N PRO A 53 -14.152 0.441 -0.081 1.00 0.00 N ATOM 783 CA PRO A 53 -12.980 1.197 0.314 1.00 0.00 C ATOM 784 C PRO A 53 -13.264 1.981 1.605 1.00 0.00 C ATOM 785 O PRO A 53 -14.097 2.895 1.608 1.00 0.00 O ATOM 786 CB PRO A 53 -12.623 2.080 -0.888 1.00 0.00 C ATOM 787 CG PRO A 53 -13.581 1.686 -2.009 1.00 0.00 C ATOM 788 CD PRO A 53 -14.719 0.951 -1.313 1.00 0.00 C ATOM 0 HA PRO A 53 -12.127 0.564 0.557 1.00 0.00 H new ATOM 0 HB2 PRO A 53 -12.729 3.136 -0.640 1.00 0.00 H new ATOM 0 HB3 PRO A 53 -11.587 1.926 -1.190 1.00 0.00 H new ATOM 0 HG2 PRO A 53 -13.946 2.563 -2.543 1.00 0.00 H new ATOM 0 HG3 PRO A 53 -13.089 1.048 -2.743 1.00 0.00 H new ATOM 0 HD2 PRO A 53 -15.555 1.621 -1.113 1.00 0.00 H new ATOM 0 HD3 PRO A 53 -15.101 0.141 -1.934 1.00 0.00 H new ATOM 796 N ASN A 54 -12.567 1.637 2.695 1.00 0.00 N ATOM 797 CA ASN A 54 -12.703 2.262 4.011 1.00 0.00 C ATOM 798 C ASN A 54 -11.509 3.188 4.231 1.00 0.00 C ATOM 799 O ASN A 54 -10.384 2.700 4.297 1.00 0.00 O ATOM 800 CB ASN A 54 -12.773 1.194 5.121 1.00 0.00 C ATOM 801 CG ASN A 54 -12.838 1.793 6.531 1.00 0.00 C ATOM 802 OD1 ASN A 54 -12.837 3.005 6.736 1.00 0.00 O ATOM 803 ND2 ASN A 54 -12.897 0.955 7.553 1.00 0.00 N ATOM 0 H ASN A 54 -11.871 0.891 2.682 1.00 0.00 H new ATOM 0 HA ASN A 54 -13.629 2.835 4.051 1.00 0.00 H new ATOM 0 HB2 ASN A 54 -13.650 0.567 4.959 1.00 0.00 H new ATOM 0 HB3 ASN A 54 -11.900 0.546 5.048 1.00 0.00 H new ATOM 0 HD21 ASN A 54 -12.941 1.315 8.506 1.00 0.00 H new ATOM 0 HD22 ASN A 54 -12.898 -0.052 7.388 1.00 0.00 H new ATOM 810 N ASN A 55 -11.739 4.499 4.369 1.00 0.00 N ATOM 811 CA ASN A 55 -10.703 5.532 4.497 1.00 0.00 C ATOM 812 C ASN A 55 -9.615 5.181 5.513 1.00 0.00 C ATOM 813 O ASN A 55 -8.450 5.483 5.267 1.00 0.00 O ATOM 814 CB ASN A 55 -11.330 6.884 4.878 1.00 0.00 C ATOM 815 CG ASN A 55 -10.434 8.079 4.544 1.00 0.00 C ATOM 816 OD1 ASN A 55 -10.709 8.804 3.590 1.00 0.00 O ATOM 817 ND2 ASN A 55 -9.375 8.346 5.292 1.00 0.00 N ATOM 0 H ASN A 55 -12.683 4.884 4.396 1.00 0.00 H new ATOM 0 HA ASN A 55 -10.227 5.596 3.519 1.00 0.00 H new ATOM 0 HB2 ASN A 55 -12.282 6.995 4.358 1.00 0.00 H new ATOM 0 HB3 ASN A 55 -11.547 6.888 5.946 1.00 0.00 H new ATOM 0 HD21 ASN A 55 -8.789 9.152 5.076 1.00 0.00 H new ATOM 0 HD22 ASN A 55 -9.145 7.745 6.084 1.00 0.00 H new ATOM 824 N GLN A 56 -9.977 4.575 6.650 1.00 0.00 N ATOM 825 CA GLN A 56 -9.003 4.230 7.681 1.00 0.00 C ATOM 826 C GLN A 56 -7.997 3.218 7.143 1.00 0.00 C ATOM 827 O GLN A 56 -6.788 3.422 7.256 1.00 0.00 O ATOM 828 CB GLN A 56 -9.711 3.680 8.929 1.00 0.00 C ATOM 829 CG GLN A 56 -8.714 3.374 10.064 1.00 0.00 C ATOM 830 CD GLN A 56 -9.446 2.980 11.341 1.00 0.00 C ATOM 831 OE1 GLN A 56 -10.281 2.082 11.334 1.00 0.00 O ATOM 832 NE2 GLN A 56 -9.184 3.619 12.462 1.00 0.00 N ATOM 0 H GLN A 56 -10.937 4.315 6.875 1.00 0.00 H new ATOM 0 HA GLN A 56 -8.464 5.134 7.965 1.00 0.00 H new ATOM 0 HB2 GLN A 56 -10.448 4.404 9.278 1.00 0.00 H new ATOM 0 HB3 GLN A 56 -10.255 2.772 8.668 1.00 0.00 H new ATOM 0 HG2 GLN A 56 -8.047 2.568 9.759 1.00 0.00 H new ATOM 0 HG3 GLN A 56 -8.092 4.249 10.252 1.00 0.00 H new ATOM 0 HE21 GLN A 56 -8.490 4.367 12.473 1.00 0.00 H new ATOM 0 HE22 GLN A 56 -9.675 3.366 13.320 1.00 0.00 H new ATOM 841 N VAL A 57 -8.507 2.118 6.591 1.00 0.00 N ATOM 842 CA VAL A 57 -7.714 1.031 6.045 1.00 0.00 C ATOM 843 C VAL A 57 -6.914 1.567 4.862 1.00 0.00 C ATOM 844 O VAL A 57 -5.713 1.326 4.807 1.00 0.00 O ATOM 845 CB VAL A 57 -8.630 -0.153 5.681 1.00 0.00 C ATOM 846 CG1 VAL A 57 -7.806 -1.376 5.267 1.00 0.00 C ATOM 847 CG2 VAL A 57 -9.512 -0.558 6.870 1.00 0.00 C ATOM 0 H VAL A 57 -9.511 1.959 6.512 1.00 0.00 H new ATOM 0 HA VAL A 57 -7.004 0.649 6.778 1.00 0.00 H new ATOM 0 HB VAL A 57 -9.255 0.176 4.851 1.00 0.00 H new ATOM 0 HG11 VAL A 57 -8.476 -2.198 5.015 1.00 0.00 H new ATOM 0 HG12 VAL A 57 -7.195 -1.127 4.399 1.00 0.00 H new ATOM 0 HG13 VAL A 57 -7.159 -1.675 6.092 1.00 0.00 H new ATOM 0 HG21 VAL A 57 -10.147 -1.396 6.583 1.00 0.00 H new ATOM 0 HG22 VAL A 57 -8.880 -0.852 7.708 1.00 0.00 H new ATOM 0 HG23 VAL A 57 -10.136 0.286 7.165 1.00 0.00 H new ATOM 857 N LEU A 58 -7.530 2.374 3.992 1.00 0.00 N ATOM 858 CA LEU A 58 -6.852 3.008 2.871 1.00 0.00 C ATOM 859 C LEU A 58 -5.629 3.777 3.360 1.00 0.00 C ATOM 860 O LEU A 58 -4.547 3.553 2.831 1.00 0.00 O ATOM 861 CB LEU A 58 -7.825 3.899 2.085 1.00 0.00 C ATOM 862 CG LEU A 58 -8.888 3.097 1.311 1.00 0.00 C ATOM 863 CD1 LEU A 58 -9.975 4.040 0.805 1.00 0.00 C ATOM 864 CD2 LEU A 58 -8.322 2.353 0.097 1.00 0.00 C ATOM 0 H LEU A 58 -8.522 2.604 4.052 1.00 0.00 H new ATOM 0 HA LEU A 58 -6.499 2.239 2.184 1.00 0.00 H new ATOM 0 HB2 LEU A 58 -8.323 4.580 2.775 1.00 0.00 H new ATOM 0 HB3 LEU A 58 -7.260 4.513 1.384 1.00 0.00 H new ATOM 0 HG LEU A 58 -9.279 2.360 2.012 1.00 0.00 H new ATOM 0 HD11 LEU A 58 -10.726 3.470 0.258 1.00 0.00 H new ATOM 0 HD12 LEU A 58 -10.445 4.541 1.651 1.00 0.00 H new ATOM 0 HD13 LEU A 58 -9.532 4.785 0.144 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -9.124 1.809 -0.402 1.00 0.00 H new ATOM 0 HD22 LEU A 58 -7.883 3.070 -0.597 1.00 0.00 H new ATOM 0 HD23 LEU A 58 -7.556 1.650 0.425 1.00 0.00 H new ATOM 876 N GLY A 59 -5.754 4.612 4.398 1.00 0.00 N ATOM 877 CA GLY A 59 -4.623 5.343 4.970 1.00 0.00 C ATOM 878 C GLY A 59 -3.488 4.428 5.448 1.00 0.00 C ATOM 879 O GLY A 59 -2.311 4.777 5.339 1.00 0.00 O ATOM 0 H GLY A 59 -6.642 4.798 4.863 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -4.232 6.035 4.224 1.00 0.00 H new ATOM 0 HA3 GLY A 59 -4.974 5.943 5.809 1.00 0.00 H new ATOM 883 N LYS A 60 -3.819 3.240 5.962 1.00 0.00 N ATOM 884 CA LYS A 60 -2.833 2.238 6.370 1.00 0.00 C ATOM 885 C LYS A 60 -2.161 1.650 5.131 1.00 0.00 C ATOM 886 O LYS A 60 -0.940 1.489 5.114 1.00 0.00 O ATOM 887 CB LYS A 60 -3.503 1.146 7.223 1.00 0.00 C ATOM 888 CG LYS A 60 -4.162 1.693 8.500 1.00 0.00 C ATOM 889 CD LYS A 60 -5.251 0.776 9.048 1.00 0.00 C ATOM 890 CE LYS A 60 -4.775 -0.514 9.673 1.00 0.00 C ATOM 891 NZ LYS A 60 -4.454 -0.414 11.109 1.00 0.00 N ATOM 0 H LYS A 60 -4.785 2.946 6.107 1.00 0.00 H new ATOM 0 HA LYS A 60 -2.066 2.708 6.985 1.00 0.00 H new ATOM 0 HB2 LYS A 60 -4.257 0.637 6.623 1.00 0.00 H new ATOM 0 HB3 LYS A 60 -2.757 0.400 7.498 1.00 0.00 H new ATOM 0 HG2 LYS A 60 -3.398 1.837 9.264 1.00 0.00 H new ATOM 0 HG3 LYS A 60 -4.591 2.673 8.290 1.00 0.00 H new ATOM 0 HD2 LYS A 60 -5.823 1.329 9.793 1.00 0.00 H new ATOM 0 HD3 LYS A 60 -5.936 0.533 8.236 1.00 0.00 H new ATOM 0 HE2 LYS A 60 -5.544 -1.275 9.537 1.00 0.00 H new ATOM 0 HE3 LYS A 60 -3.889 -0.857 9.138 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 -4.136 -1.340 11.459 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 -3.698 0.287 11.248 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 -5.301 -0.118 11.634 1.00 0.00 H new ATOM 905 N ILE A 61 -2.944 1.314 4.103 1.00 0.00 N ATOM 906 CA ILE A 61 -2.467 0.778 2.830 1.00 0.00 C ATOM 907 C ILE A 61 -1.519 1.776 2.172 1.00 0.00 C ATOM 908 O ILE A 61 -0.539 1.359 1.560 1.00 0.00 O ATOM 909 CB ILE A 61 -3.661 0.414 1.918 1.00 0.00 C ATOM 910 CG1 ILE A 61 -4.372 -0.823 2.489 1.00 0.00 C ATOM 911 CG2 ILE A 61 -3.252 0.162 0.450 1.00 0.00 C ATOM 912 CD1 ILE A 61 -5.553 -1.254 1.627 1.00 0.00 C ATOM 0 H ILE A 61 -3.959 1.411 4.137 1.00 0.00 H new ATOM 0 HA ILE A 61 -1.908 -0.141 3.006 1.00 0.00 H new ATOM 0 HB ILE A 61 -4.334 1.272 1.905 1.00 0.00 H new ATOM 0 HG12 ILE A 61 -3.661 -1.646 2.567 1.00 0.00 H new ATOM 0 HG13 ILE A 61 -4.721 -0.606 3.499 1.00 0.00 H new ATOM 0 HG21 ILE A 61 -4.136 -0.089 -0.136 1.00 0.00 H new ATOM 0 HG22 ILE A 61 -2.789 1.060 0.042 1.00 0.00 H new ATOM 0 HG23 ILE A 61 -2.542 -0.664 0.407 1.00 0.00 H new ATOM 0 HD11 ILE A 61 -6.025 -2.132 2.069 1.00 0.00 H new ATOM 0 HD12 ILE A 61 -6.278 -0.442 1.571 1.00 0.00 H new ATOM 0 HD13 ILE A 61 -5.202 -1.497 0.624 1.00 0.00 H new ATOM 924 N GLU A 62 -1.756 3.078 2.308 1.00 0.00 N ATOM 925 CA GLU A 62 -0.834 4.063 1.744 1.00 0.00 C ATOM 926 C GLU A 62 0.588 3.806 2.247 1.00 0.00 C ATOM 927 O GLU A 62 1.499 3.632 1.443 1.00 0.00 O ATOM 928 CB GLU A 62 -1.221 5.515 2.079 1.00 0.00 C ATOM 929 CG GLU A 62 -2.578 6.009 1.580 1.00 0.00 C ATOM 930 CD GLU A 62 -3.010 7.328 2.228 1.00 0.00 C ATOM 931 OE1 GLU A 62 -2.201 8.011 2.902 1.00 0.00 O ATOM 932 OE2 GLU A 62 -4.190 7.705 2.051 1.00 0.00 O ATOM 0 H GLU A 62 -2.562 3.472 2.794 1.00 0.00 H new ATOM 0 HA GLU A 62 -0.889 3.945 0.662 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -1.198 5.629 3.163 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -0.452 6.172 1.672 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -2.536 6.139 0.499 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -3.332 5.248 1.781 1.00 0.00 H new ATOM 939 N ARG A 63 0.787 3.688 3.566 1.00 0.00 N ATOM 940 CA ARG A 63 2.112 3.426 4.149 1.00 0.00 C ATOM 941 C ARG A 63 2.600 1.995 3.896 1.00 0.00 C ATOM 942 O ARG A 63 3.755 1.670 4.193 1.00 0.00 O ATOM 943 CB ARG A 63 2.113 3.731 5.656 1.00 0.00 C ATOM 944 CG ARG A 63 1.478 5.086 5.986 1.00 0.00 C ATOM 945 CD ARG A 63 1.857 5.532 7.401 1.00 0.00 C ATOM 946 NE ARG A 63 0.959 6.591 7.889 1.00 0.00 N ATOM 947 CZ ARG A 63 0.972 7.095 9.129 1.00 0.00 C ATOM 948 NH1 ARG A 63 1.914 6.739 10.000 1.00 0.00 N ATOM 949 NH2 ARG A 63 0.037 7.964 9.490 1.00 0.00 N ATOM 0 H ARG A 63 0.041 3.771 4.256 1.00 0.00 H new ATOM 0 HA ARG A 63 2.810 4.095 3.646 1.00 0.00 H new ATOM 0 HB2 ARG A 63 1.573 2.944 6.182 1.00 0.00 H new ATOM 0 HB3 ARG A 63 3.139 3.716 6.025 1.00 0.00 H new ATOM 0 HG2 ARG A 63 1.807 5.833 5.264 1.00 0.00 H new ATOM 0 HG3 ARG A 63 0.394 5.016 5.900 1.00 0.00 H new ATOM 0 HD2 ARG A 63 1.815 4.678 8.077 1.00 0.00 H new ATOM 0 HD3 ARG A 63 2.885 5.893 7.407 1.00 0.00 H new ATOM 0 HE ARG A 63 0.275 6.969 7.233 1.00 0.00 H new ATOM 0 HH11 ARG A 63 2.638 6.075 9.725 1.00 0.00 H new ATOM 0 HH12 ARG A 63 1.912 7.131 10.942 1.00 0.00 H new ATOM 0 HH21 ARG A 63 -0.684 8.243 8.825 1.00 0.00 H new ATOM 0 HH22 ARG A 63 0.039 8.353 10.433 1.00 0.00 H new ATOM 963 N ALA A 64 1.740 1.129 3.357 1.00 0.00 N ATOM 964 CA ALA A 64 2.111 -0.211 2.937 1.00 0.00 C ATOM 965 C ALA A 64 2.920 -0.167 1.634 1.00 0.00 C ATOM 966 O ALA A 64 3.867 -0.943 1.497 1.00 0.00 O ATOM 967 CB ALA A 64 0.858 -1.078 2.773 1.00 0.00 C ATOM 0 H ALA A 64 0.756 1.347 3.201 1.00 0.00 H new ATOM 0 HA ALA A 64 2.741 -0.656 3.707 1.00 0.00 H new ATOM 0 HB1 ALA A 64 1.148 -2.080 2.458 1.00 0.00 H new ATOM 0 HB2 ALA A 64 0.328 -1.135 3.724 1.00 0.00 H new ATOM 0 HB3 ALA A 64 0.205 -0.636 2.020 1.00 0.00 H new ATOM 973 N ILE A 65 2.560 0.726 0.698 1.00 0.00 N ATOM 974 CA ILE A 65 3.136 0.772 -0.654 1.00 0.00 C ATOM 975 C ILE A 65 3.827 2.104 -0.989 1.00 0.00 C ATOM 976 O ILE A 65 4.488 2.213 -2.023 1.00 0.00 O ATOM 977 CB ILE A 65 2.063 0.428 -1.704 1.00 0.00 C ATOM 978 CG1 ILE A 65 1.003 1.540 -1.844 1.00 0.00 C ATOM 979 CG2 ILE A 65 1.415 -0.932 -1.400 1.00 0.00 C ATOM 980 CD1 ILE A 65 0.014 1.266 -2.973 1.00 0.00 C ATOM 0 H ILE A 65 1.853 1.443 0.861 1.00 0.00 H new ATOM 0 HA ILE A 65 3.923 0.018 -0.679 1.00 0.00 H new ATOM 0 HB ILE A 65 2.567 0.356 -2.668 1.00 0.00 H new ATOM 0 HG12 ILE A 65 0.459 1.639 -0.905 1.00 0.00 H new ATOM 0 HG13 ILE A 65 1.502 2.492 -2.025 1.00 0.00 H new ATOM 0 HG21 ILE A 65 0.661 -1.153 -2.155 1.00 0.00 H new ATOM 0 HG22 ILE A 65 2.179 -1.710 -1.412 1.00 0.00 H new ATOM 0 HG23 ILE A 65 0.945 -0.900 -0.417 1.00 0.00 H new ATOM 0 HD11 ILE A 65 -0.710 2.079 -3.028 1.00 0.00 H new ATOM 0 HD12 ILE A 65 0.552 1.195 -3.918 1.00 0.00 H new ATOM 0 HD13 ILE A 65 -0.507 0.328 -2.780 1.00 0.00 H new ATOM 992 N GLY A 66 3.647 3.114 -0.141 1.00 0.00 N ATOM 993 CA GLY A 66 4.174 4.460 -0.273 1.00 0.00 C ATOM 994 C GLY A 66 3.567 5.224 -1.436 1.00 0.00 C ATOM 995 O GLY A 66 4.253 6.072 -2.008 1.00 0.00 O ATOM 0 H GLY A 66 3.094 3.002 0.708 1.00 0.00 H new ATOM 0 HA2 GLY A 66 3.989 5.009 0.651 1.00 0.00 H new ATOM 0 HA3 GLY A 66 5.255 4.410 -0.403 1.00 0.00 H new ATOM 999 N LEU A 67 2.289 4.986 -1.748 1.00 0.00 N ATOM 1000 CA LEU A 67 1.519 5.788 -2.695 1.00 0.00 C ATOM 1001 C LEU A 67 0.201 6.215 -2.053 1.00 0.00 C ATOM 1002 O LEU A 67 -0.192 5.668 -1.024 1.00 0.00 O ATOM 1003 CB LEU A 67 1.233 5.018 -4.001 1.00 0.00 C ATOM 1004 CG LEU A 67 2.445 4.456 -4.768 1.00 0.00 C ATOM 1005 CD1 LEU A 67 1.933 3.620 -5.949 1.00 0.00 C ATOM 1006 CD2 LEU A 67 3.387 5.549 -5.291 1.00 0.00 C ATOM 0 H LEU A 67 1.755 4.218 -1.341 1.00 0.00 H new ATOM 0 HA LEU A 67 2.114 6.665 -2.949 1.00 0.00 H new ATOM 0 HB2 LEU A 67 0.568 4.187 -3.764 1.00 0.00 H new ATOM 0 HB3 LEU A 67 0.687 5.682 -4.672 1.00 0.00 H new ATOM 0 HG LEU A 67 3.022 3.849 -4.070 1.00 0.00 H new ATOM 0 HD11 LEU A 67 2.780 3.215 -6.502 1.00 0.00 H new ATOM 0 HD12 LEU A 67 1.318 2.801 -5.576 1.00 0.00 H new ATOM 0 HD13 LEU A 67 1.336 4.250 -6.609 1.00 0.00 H new ATOM 0 HD21 LEU A 67 4.220 5.088 -5.822 1.00 0.00 H new ATOM 0 HD22 LEU A 67 2.842 6.204 -5.970 1.00 0.00 H new ATOM 0 HD23 LEU A 67 3.769 6.132 -4.453 1.00 0.00 H new ATOM 1018 N LYS A 68 -0.468 7.197 -2.658 1.00 0.00 N ATOM 1019 CA LYS A 68 -1.792 7.679 -2.298 1.00 0.00 C ATOM 1020 C LYS A 68 -2.827 6.718 -2.850 1.00 0.00 C ATOM 1021 O LYS A 68 -2.698 6.262 -3.985 1.00 0.00 O ATOM 1022 CB LYS A 68 -2.029 9.081 -2.882 1.00 0.00 C ATOM 1023 CG LYS A 68 -1.188 10.116 -2.131 1.00 0.00 C ATOM 1024 CD LYS A 68 -1.528 11.552 -2.532 1.00 0.00 C ATOM 1025 CE LYS A 68 -0.579 12.471 -1.755 1.00 0.00 C ATOM 1026 NZ LYS A 68 -1.007 13.882 -1.784 1.00 0.00 N ATOM 0 H LYS A 68 -0.076 7.701 -3.454 1.00 0.00 H new ATOM 0 HA LYS A 68 -1.873 7.737 -1.213 1.00 0.00 H new ATOM 0 HB2 LYS A 68 -1.770 9.090 -3.941 1.00 0.00 H new ATOM 0 HB3 LYS A 68 -3.086 9.339 -2.810 1.00 0.00 H new ATOM 0 HG2 LYS A 68 -1.343 9.996 -1.059 1.00 0.00 H new ATOM 0 HG3 LYS A 68 -0.132 9.929 -2.324 1.00 0.00 H new ATOM 0 HD2 LYS A 68 -1.406 11.691 -3.606 1.00 0.00 H new ATOM 0 HD3 LYS A 68 -2.567 11.782 -2.296 1.00 0.00 H new ATOM 0 HE2 LYS A 68 -0.519 12.134 -0.720 1.00 0.00 H new ATOM 0 HE3 LYS A 68 0.424 12.390 -2.175 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 -0.332 14.461 -1.245 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 -1.039 14.215 -2.769 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 -1.952 13.967 -1.359 1.00 0.00 H new ATOM 1040 N LEU A 69 -3.868 6.472 -2.065 1.00 0.00 N ATOM 1041 CA LEU A 69 -4.980 5.561 -2.311 1.00 0.00 C ATOM 1042 C LEU A 69 -6.306 6.325 -2.318 1.00 0.00 C ATOM 1043 O LEU A 69 -7.354 5.717 -2.538 1.00 0.00 O ATOM 1044 CB LEU A 69 -4.989 4.483 -1.210 1.00 0.00 C ATOM 1045 CG LEU A 69 -4.061 3.279 -1.425 1.00 0.00 C ATOM 1046 CD1 LEU A 69 -4.500 2.390 -2.584 1.00 0.00 C ATOM 1047 CD2 LEU A 69 -2.595 3.622 -1.658 1.00 0.00 C ATOM 0 H LEU A 69 -3.965 6.943 -1.166 1.00 0.00 H new ATOM 0 HA LEU A 69 -4.858 5.090 -3.286 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -4.720 4.957 -0.266 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -6.009 4.113 -1.102 1.00 0.00 H new ATOM 0 HG LEU A 69 -4.147 2.754 -0.474 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -3.805 1.556 -2.687 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -5.501 2.006 -2.389 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -4.508 2.971 -3.506 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -2.024 2.704 -1.799 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -2.504 4.246 -2.547 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -2.206 4.162 -0.795 1.00 0.00 H new ATOM 1059 N ARG A 70 -6.299 7.638 -2.069 1.00 0.00 N ATOM 1060 CA ARG A 70 -7.475 8.494 -2.107 1.00 0.00 C ATOM 1061 C ARG A 70 -7.097 9.835 -2.724 1.00 0.00 C ATOM 1062 O ARG A 70 -5.918 10.160 -2.880 1.00 0.00 O ATOM 1063 CB ARG A 70 -8.056 8.701 -0.697 1.00 0.00 C ATOM 1064 CG ARG A 70 -8.120 7.414 0.139 1.00 0.00 C ATOM 1065 CD ARG A 70 -9.142 7.486 1.268 1.00 0.00 C ATOM 1066 NE ARG A 70 -10.568 7.609 0.881 1.00 0.00 N ATOM 1067 CZ ARG A 70 -11.298 7.134 -0.147 1.00 0.00 C ATOM 1068 NH1 ARG A 70 -10.794 6.578 -1.247 1.00 0.00 N ATOM 1069 NH2 ARG A 70 -12.614 7.219 -0.056 1.00 0.00 N ATOM 0 H ARG A 70 -5.446 8.144 -1.829 1.00 0.00 H new ATOM 0 HA ARG A 70 -8.242 8.013 -2.714 1.00 0.00 H new ATOM 0 HB2 ARG A 70 -7.450 9.437 -0.169 1.00 0.00 H new ATOM 0 HB3 ARG A 70 -9.060 9.117 -0.785 1.00 0.00 H new ATOM 0 HG2 ARG A 70 -8.366 6.576 -0.513 1.00 0.00 H new ATOM 0 HG3 ARG A 70 -7.135 7.212 0.560 1.00 0.00 H new ATOM 0 HD2 ARG A 70 -9.034 6.591 1.880 1.00 0.00 H new ATOM 0 HD3 ARG A 70 -8.888 8.337 1.900 1.00 0.00 H new ATOM 0 HE ARG A 70 -11.113 8.174 1.532 1.00 0.00 H new ATOM 0 HH11 ARG A 70 -9.784 6.487 -1.356 1.00 0.00 H new ATOM 0 HH12 ARG A 70 -11.418 6.243 -1.981 1.00 0.00 H new ATOM 0 HH21 ARG A 70 -13.042 7.633 0.772 1.00 0.00 H new ATOM 0 HH22 ARG A 70 -13.201 6.870 -0.814 1.00 0.00 H new ATOM 1083 N GLY A 71 -8.110 10.644 -3.021 1.00 0.00 N ATOM 1084 CA GLY A 71 -7.946 11.855 -3.803 1.00 0.00 C ATOM 1085 C GLY A 71 -7.795 11.504 -5.278 1.00 0.00 C ATOM 1086 O GLY A 71 -7.498 10.366 -5.650 1.00 0.00 O ATOM 0 H GLY A 71 -9.070 10.473 -2.722 1.00 0.00 H new ATOM 0 HA2 GLY A 71 -8.807 12.508 -3.662 1.00 0.00 H new ATOM 0 HA3 GLY A 71 -7.069 12.404 -3.459 1.00 0.00 H new ATOM 1090 N LYS A 72 -7.956 12.505 -6.139 1.00 0.00 N ATOM 1091 CA LYS A 72 -7.753 12.351 -7.578 1.00 0.00 C ATOM 1092 C LYS A 72 -6.258 12.356 -7.928 1.00 0.00 C ATOM 1093 O LYS A 72 -5.909 12.242 -9.103 1.00 0.00 O ATOM 1094 CB LYS A 72 -8.604 13.400 -8.332 1.00 0.00 C ATOM 1095 CG LYS A 72 -9.591 12.711 -9.294 1.00 0.00 C ATOM 1096 CD LYS A 72 -10.816 13.559 -9.662 1.00 0.00 C ATOM 1097 CE LYS A 72 -11.852 13.529 -8.530 1.00 0.00 C ATOM 1098 NZ LYS A 72 -13.183 13.982 -8.976 1.00 0.00 N ATOM 0 H LYS A 72 -8.231 13.447 -5.859 1.00 0.00 H new ATOM 0 HA LYS A 72 -8.106 11.375 -7.912 1.00 0.00 H new ATOM 0 HB2 LYS A 72 -9.153 14.012 -7.617 1.00 0.00 H new ATOM 0 HB3 LYS A 72 -7.952 14.071 -8.891 1.00 0.00 H new ATOM 0 HG2 LYS A 72 -9.061 12.444 -10.209 1.00 0.00 H new ATOM 0 HG3 LYS A 72 -9.932 11.780 -8.840 1.00 0.00 H new ATOM 0 HD2 LYS A 72 -10.509 14.587 -9.855 1.00 0.00 H new ATOM 0 HD3 LYS A 72 -11.263 13.182 -10.582 1.00 0.00 H new ATOM 0 HE2 LYS A 72 -11.929 12.515 -8.138 1.00 0.00 H new ATOM 0 HE3 LYS A 72 -11.511 14.163 -7.711 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 -13.848 13.944 -8.177 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 -13.118 14.959 -9.326 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 -13.523 13.363 -9.739 1.00 0.00 H new ATOM 1112 N ASP A 73 -5.378 12.427 -6.924 1.00 0.00 N ATOM 1113 CA ASP A 73 -3.930 12.269 -7.017 1.00 0.00 C ATOM 1114 C ASP A 73 -3.520 10.823 -6.663 1.00 0.00 C ATOM 1115 O ASP A 73 -2.383 10.618 -6.237 1.00 0.00 O ATOM 1116 CB ASP A 73 -3.191 13.296 -6.119 1.00 0.00 C ATOM 1117 CG ASP A 73 -3.554 14.766 -6.351 1.00 0.00 C ATOM 1118 OD1 ASP A 73 -3.035 15.388 -7.314 1.00 0.00 O ATOM 1119 OD2 ASP A 73 -4.333 15.307 -5.535 1.00 0.00 O ATOM 0 H ASP A 73 -5.681 12.608 -5.967 1.00 0.00 H new ATOM 0 HA ASP A 73 -3.634 12.466 -8.048 1.00 0.00 H new ATOM 0 HB2 ASP A 73 -3.394 13.051 -5.076 1.00 0.00 H new ATOM 0 HB3 ASP A 73 -2.118 13.178 -6.271 1.00 0.00 H new ATOM 1124 N ILE A 74 -4.409 9.817 -6.782 1.00 0.00 N ATOM 1125 CA ILE A 74 -4.070 8.418 -6.509 1.00 0.00 C ATOM 1126 C ILE A 74 -2.828 7.992 -7.309 1.00 0.00 C ATOM 1127 O ILE A 74 -2.560 8.512 -8.402 1.00 0.00 O ATOM 1128 CB ILE A 74 -5.295 7.501 -6.774 1.00 0.00 C ATOM 1129 CG1 ILE A 74 -5.330 6.377 -5.737 1.00 0.00 C ATOM 1130 CG2 ILE A 74 -5.434 7.067 -8.244 1.00 0.00 C ATOM 1131 CD1 ILE A 74 -6.560 5.466 -5.825 1.00 0.00 C ATOM 0 H ILE A 74 -5.378 9.957 -7.069 1.00 0.00 H new ATOM 0 HA ILE A 74 -3.815 8.313 -5.455 1.00 0.00 H new ATOM 0 HB ILE A 74 -6.209 8.078 -6.630 1.00 0.00 H new ATOM 0 HG12 ILE A 74 -4.434 5.767 -5.851 1.00 0.00 H new ATOM 0 HG13 ILE A 74 -5.291 6.818 -4.741 1.00 0.00 H new ATOM 0 HG21 ILE A 74 -6.311 6.429 -8.354 1.00 0.00 H new ATOM 0 HG22 ILE A 74 -5.546 7.949 -8.875 1.00 0.00 H new ATOM 0 HG23 ILE A 74 -4.544 6.515 -8.546 1.00 0.00 H new ATOM 0 HD11 ILE A 74 -6.501 4.699 -5.053 1.00 0.00 H new ATOM 0 HD12 ILE A 74 -7.463 6.059 -5.679 1.00 0.00 H new ATOM 0 HD13 ILE A 74 -6.592 4.992 -6.806 1.00 0.00 H new ATOM 1143 N GLY A 75 -2.082 7.025 -6.774 1.00 0.00 N ATOM 1144 CA GLY A 75 -0.892 6.482 -7.413 1.00 0.00 C ATOM 1145 C GLY A 75 0.302 7.436 -7.381 1.00 0.00 C ATOM 1146 O GLY A 75 1.398 7.035 -7.771 1.00 0.00 O ATOM 0 H GLY A 75 -2.293 6.594 -5.874 1.00 0.00 H new ATOM 0 HA2 GLY A 75 -0.617 5.550 -6.919 1.00 0.00 H new ATOM 0 HA3 GLY A 75 -1.125 6.237 -8.449 1.00 0.00 H new ATOM 1150 N LYS A 76 0.148 8.680 -6.911 1.00 0.00 N ATOM 1151 CA LYS A 76 1.261 9.551 -6.586 1.00 0.00 C ATOM 1152 C LYS A 76 1.848 9.080 -5.257 1.00 0.00 C ATOM 1153 O LYS A 76 1.113 8.569 -4.419 1.00 0.00 O ATOM 1154 CB LYS A 76 0.796 11.005 -6.444 1.00 0.00 C ATOM 1155 CG LYS A 76 0.255 11.575 -7.764 1.00 0.00 C ATOM 1156 CD LYS A 76 1.378 12.190 -8.599 1.00 0.00 C ATOM 1157 CE LYS A 76 0.913 12.349 -10.047 1.00 0.00 C ATOM 1158 NZ LYS A 76 1.856 13.167 -10.839 1.00 0.00 N ATOM 0 H LYS A 76 -0.765 9.105 -6.748 1.00 0.00 H new ATOM 0 HA LYS A 76 2.002 9.508 -7.384 1.00 0.00 H new ATOM 0 HB2 LYS A 76 0.020 11.063 -5.681 1.00 0.00 H new ATOM 0 HB3 LYS A 76 1.629 11.619 -6.100 1.00 0.00 H new ATOM 0 HG2 LYS A 76 -0.233 10.784 -8.332 1.00 0.00 H new ATOM 0 HG3 LYS A 76 -0.502 12.331 -7.554 1.00 0.00 H new ATOM 0 HD2 LYS A 76 1.661 13.159 -8.189 1.00 0.00 H new ATOM 0 HD3 LYS A 76 2.264 11.556 -8.558 1.00 0.00 H new ATOM 0 HE2 LYS A 76 0.810 11.366 -10.506 1.00 0.00 H new ATOM 0 HE3 LYS A 76 -0.073 12.813 -10.063 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 1.507 13.252 -11.815 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 1.935 14.114 -10.416 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 2.791 12.711 -10.845 1.00 0.00 H new ATOM 1172 N PRO A 77 3.144 9.283 -5.026 1.00 0.00 N ATOM 1173 CA PRO A 77 3.803 8.893 -3.794 1.00 0.00 C ATOM 1174 C PRO A 77 3.356 9.763 -2.614 1.00 0.00 C ATOM 1175 O PRO A 77 2.918 10.907 -2.793 1.00 0.00 O ATOM 1176 CB PRO A 77 5.302 8.936 -4.095 1.00 0.00 C ATOM 1177 CG PRO A 77 5.428 9.813 -5.342 1.00 0.00 C ATOM 1178 CD PRO A 77 4.050 9.836 -5.994 1.00 0.00 C ATOM 0 HA PRO A 77 3.531 7.888 -3.473 1.00 0.00 H new ATOM 0 HB2 PRO A 77 5.861 9.356 -3.259 1.00 0.00 H new ATOM 0 HB3 PRO A 77 5.698 7.936 -4.273 1.00 0.00 H new ATOM 0 HG2 PRO A 77 5.749 10.820 -5.077 1.00 0.00 H new ATOM 0 HG3 PRO A 77 6.175 9.410 -6.026 1.00 0.00 H new ATOM 0 HD2 PRO A 77 3.762 10.853 -6.262 1.00 0.00 H new ATOM 0 HD3 PRO A 77 4.044 9.250 -6.913 1.00 0.00 H new ATOM 1186 N ILE A 78 3.506 9.232 -1.399 1.00 0.00 N ATOM 1187 CA ILE A 78 3.194 9.935 -0.157 1.00 0.00 C ATOM 1188 C ILE A 78 4.495 10.436 0.464 1.00 0.00 C ATOM 1189 O ILE A 78 5.530 9.785 0.340 1.00 0.00 O ATOM 1190 CB ILE A 78 2.417 9.037 0.838 1.00 0.00 C ATOM 1191 CG1 ILE A 78 3.043 7.650 1.068 1.00 0.00 C ATOM 1192 CG2 ILE A 78 0.986 8.832 0.343 1.00 0.00 C ATOM 1193 CD1 ILE A 78 2.518 6.935 2.321 1.00 0.00 C ATOM 0 H ILE A 78 3.854 8.285 -1.250 1.00 0.00 H new ATOM 0 HA ILE A 78 2.544 10.779 -0.386 1.00 0.00 H new ATOM 0 HB ILE A 78 2.450 9.568 1.789 1.00 0.00 H new ATOM 0 HG12 ILE A 78 2.850 7.025 0.196 1.00 0.00 H new ATOM 0 HG13 ILE A 78 4.125 7.758 1.149 1.00 0.00 H new ATOM 0 HG21 ILE A 78 0.445 8.200 1.047 1.00 0.00 H new ATOM 0 HG22 ILE A 78 0.486 9.798 0.264 1.00 0.00 H new ATOM 0 HG23 ILE A 78 1.005 8.352 -0.636 1.00 0.00 H new ATOM 0 HD11 ILE A 78 3.005 5.964 2.417 1.00 0.00 H new ATOM 0 HD12 ILE A 78 2.735 7.539 3.202 1.00 0.00 H new ATOM 0 HD13 ILE A 78 1.441 6.794 2.235 1.00 0.00 H new ATOM 1205 N GLU A 79 4.401 11.573 1.158 1.00 0.00 N ATOM 1206 CA GLU A 79 5.450 12.230 1.933 1.00 0.00 C ATOM 1207 C GLU A 79 6.828 12.067 1.276 1.00 0.00 C ATOM 1208 O GLU A 79 7.715 11.371 1.786 1.00 0.00 O ATOM 1209 CB GLU A 79 5.426 11.745 3.389 1.00 0.00 C ATOM 1210 CG GLU A 79 4.091 12.001 4.105 1.00 0.00 C ATOM 1211 CD GLU A 79 4.110 11.534 5.567 1.00 0.00 C ATOM 1212 OE1 GLU A 79 4.840 10.575 5.901 1.00 0.00 O ATOM 1213 OE2 GLU A 79 3.357 12.101 6.396 1.00 0.00 O ATOM 0 H GLU A 79 3.525 12.094 1.194 1.00 0.00 H new ATOM 0 HA GLU A 79 5.249 13.301 1.945 1.00 0.00 H new ATOM 0 HB2 GLU A 79 5.640 10.676 3.410 1.00 0.00 H new ATOM 0 HB3 GLU A 79 6.225 12.241 3.941 1.00 0.00 H new ATOM 0 HG2 GLU A 79 3.862 13.066 4.070 1.00 0.00 H new ATOM 0 HG3 GLU A 79 3.292 11.485 3.572 1.00 0.00 H new ATOM 1220 N LYS A 80 6.995 12.726 0.128 1.00 0.00 N ATOM 1221 CA LYS A 80 8.267 12.886 -0.570 1.00 0.00 C ATOM 1222 C LYS A 80 8.580 14.370 -0.705 1.00 0.00 C ATOM 1223 O LYS A 80 7.745 15.207 -0.350 1.00 0.00 O ATOM 1224 CB LYS A 80 8.235 12.173 -1.933 1.00 0.00 C ATOM 1225 CG LYS A 80 7.121 12.661 -2.889 1.00 0.00 C ATOM 1226 CD LYS A 80 7.595 12.928 -4.329 1.00 0.00 C ATOM 1227 CE LYS A 80 8.371 11.744 -4.920 1.00 0.00 C ATOM 1228 NZ LYS A 80 8.762 11.960 -6.327 1.00 0.00 N ATOM 0 H LYS A 80 6.219 13.178 -0.356 1.00 0.00 H new ATOM 0 HA LYS A 80 9.065 12.419 0.007 1.00 0.00 H new ATOM 0 HB2 LYS A 80 9.200 12.308 -2.422 1.00 0.00 H new ATOM 0 HB3 LYS A 80 8.109 11.103 -1.766 1.00 0.00 H new ATOM 0 HG2 LYS A 80 6.326 11.915 -2.913 1.00 0.00 H new ATOM 0 HG3 LYS A 80 6.687 13.576 -2.486 1.00 0.00 H new ATOM 0 HD2 LYS A 80 6.732 13.143 -4.958 1.00 0.00 H new ATOM 0 HD3 LYS A 80 8.228 13.816 -4.341 1.00 0.00 H new ATOM 0 HE2 LYS A 80 9.265 11.567 -4.322 1.00 0.00 H new ATOM 0 HE3 LYS A 80 7.759 10.844 -4.852 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 9.283 11.129 -6.674 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 7.910 12.101 -6.906 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 9.369 12.802 -6.393 1.00 0.00 H new ATOM 1242 N GLY A 81 9.764 14.692 -1.216 1.00 0.00 N ATOM 1243 CA GLY A 81 10.188 16.061 -1.455 1.00 0.00 C ATOM 1244 C GLY A 81 9.227 16.807 -2.385 1.00 0.00 C ATOM 1245 O GLY A 81 8.346 16.202 -3.013 1.00 0.00 O ATOM 0 H GLY A 81 10.463 13.997 -1.478 1.00 0.00 H new ATOM 0 HA2 GLY A 81 10.256 16.590 -0.505 1.00 0.00 H new ATOM 0 HA3 GLY A 81 11.187 16.060 -1.892 1.00 0.00 H new ATOM 1249 N PRO A 82 9.377 18.131 -2.495 1.00 0.00 N ATOM 1250 CA PRO A 82 8.499 18.953 -3.312 1.00 0.00 C ATOM 1251 C PRO A 82 8.765 18.722 -4.801 1.00 0.00 C ATOM 1252 O PRO A 82 9.865 18.330 -5.199 1.00 0.00 O ATOM 1253 CB PRO A 82 8.827 20.387 -2.902 1.00 0.00 C ATOM 1254 CG PRO A 82 10.293 20.315 -2.458 1.00 0.00 C ATOM 1255 CD PRO A 82 10.403 18.929 -1.839 1.00 0.00 C ATOM 0 HA PRO A 82 7.446 18.717 -3.161 1.00 0.00 H new ATOM 0 HB2 PRO A 82 8.694 21.081 -3.732 1.00 0.00 H new ATOM 0 HB3 PRO A 82 8.181 20.730 -2.094 1.00 0.00 H new ATOM 0 HG2 PRO A 82 10.975 20.435 -3.300 1.00 0.00 H new ATOM 0 HG3 PRO A 82 10.534 21.097 -1.738 1.00 0.00 H new ATOM 0 HD2 PRO A 82 11.394 18.504 -2.000 1.00 0.00 H new ATOM 0 HD3 PRO A 82 10.243 18.966 -0.761 1.00 0.00 H new ATOM 1263 N ARG A 83 7.773 19.016 -5.646 1.00 0.00 N ATOM 1264 CA ARG A 83 7.957 19.153 -7.100 1.00 0.00 C ATOM 1265 C ARG A 83 6.914 20.092 -7.727 1.00 0.00 C ATOM 1266 O ARG A 83 6.815 20.178 -8.952 1.00 0.00 O ATOM 1267 CB ARG A 83 7.971 17.756 -7.768 1.00 0.00 C ATOM 1268 CG ARG A 83 9.186 17.540 -8.692 1.00 0.00 C ATOM 1269 CD ARG A 83 9.177 18.358 -9.991 1.00 0.00 C ATOM 1270 NE ARG A 83 8.053 17.983 -10.861 1.00 0.00 N ATOM 1271 CZ ARG A 83 8.097 17.283 -11.999 1.00 0.00 C ATOM 1272 NH1 ARG A 83 9.248 16.990 -12.590 1.00 0.00 N ATOM 1273 NH2 ARG A 83 6.961 16.858 -12.537 1.00 0.00 N ATOM 0 H ARG A 83 6.811 19.167 -5.342 1.00 0.00 H new ATOM 0 HA ARG A 83 8.925 19.621 -7.281 1.00 0.00 H new ATOM 0 HB2 ARG A 83 7.970 16.989 -6.993 1.00 0.00 H new ATOM 0 HB3 ARG A 83 7.055 17.627 -8.345 1.00 0.00 H new ATOM 0 HG2 ARG A 83 10.092 17.782 -8.136 1.00 0.00 H new ATOM 0 HG3 ARG A 83 9.243 16.482 -8.949 1.00 0.00 H new ATOM 0 HD2 ARG A 83 9.114 19.420 -9.752 1.00 0.00 H new ATOM 0 HD3 ARG A 83 10.116 18.206 -10.523 1.00 0.00 H new ATOM 0 HE ARG A 83 7.129 18.294 -10.560 1.00 0.00 H new ATOM 0 HH11 ARG A 83 10.127 17.300 -12.176 1.00 0.00 H new ATOM 0 HH12 ARG A 83 9.254 16.454 -13.458 1.00 0.00 H new ATOM 0 HH21 ARG A 83 6.072 17.067 -12.083 1.00 0.00 H new ATOM 0 HH22 ARG A 83 6.977 16.323 -13.405 1.00 0.00 H new ATOM 1287 N ALA A 84 6.085 20.743 -6.913 1.00 0.00 N ATOM 1288 CA ALA A 84 5.060 21.715 -7.266 1.00 0.00 C ATOM 1289 C ALA A 84 4.550 22.304 -5.945 1.00 0.00 C ATOM 1290 O ALA A 84 5.016 21.902 -4.870 1.00 0.00 O ATOM 1291 CB ALA A 84 3.908 21.023 -8.011 1.00 0.00 C ATOM 0 H ALA A 84 6.119 20.589 -5.905 1.00 0.00 H new ATOM 0 HA ALA A 84 5.460 22.490 -7.920 1.00 0.00 H new ATOM 0 HB1 ALA A 84 3.148 21.760 -8.270 1.00 0.00 H new ATOM 0 HB2 ALA A 84 4.289 20.560 -8.921 1.00 0.00 H new ATOM 0 HB3 ALA A 84 3.469 20.258 -7.371 1.00 0.00 H new ATOM 1297 N LYS A 85 3.562 23.195 -6.018 1.00 0.00 N ATOM 1298 CA LYS A 85 2.678 23.542 -4.909 1.00 0.00 C ATOM 1299 C LYS A 85 1.266 23.792 -5.454 1.00 0.00 C ATOM 1300 O LYS A 85 0.969 23.361 -6.574 1.00 0.00 O ATOM 1301 CB LYS A 85 3.266 24.709 -4.097 1.00 0.00 C ATOM 1302 CG LYS A 85 3.432 26.012 -4.891 1.00 0.00 C ATOM 1303 CD LYS A 85 3.913 27.112 -3.942 1.00 0.00 C ATOM 1304 CE LYS A 85 4.053 28.468 -4.637 1.00 0.00 C ATOM 1305 NZ LYS A 85 5.309 28.563 -5.405 1.00 0.00 N ATOM 0 H LYS A 85 3.350 23.708 -6.873 1.00 0.00 H new ATOM 0 HA LYS A 85 2.597 22.717 -4.201 1.00 0.00 H new ATOM 0 HB2 LYS A 85 2.622 24.900 -3.239 1.00 0.00 H new ATOM 0 HB3 LYS A 85 4.238 24.410 -3.705 1.00 0.00 H new ATOM 0 HG2 LYS A 85 4.149 25.872 -5.700 1.00 0.00 H new ATOM 0 HG3 LYS A 85 2.485 26.297 -5.350 1.00 0.00 H new ATOM 0 HD2 LYS A 85 3.212 27.204 -3.113 1.00 0.00 H new ATOM 0 HD3 LYS A 85 4.875 26.825 -3.516 1.00 0.00 H new ATOM 0 HE2 LYS A 85 3.206 28.623 -5.305 1.00 0.00 H new ATOM 0 HE3 LYS A 85 4.021 29.263 -3.892 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 5.367 29.496 -5.861 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 6.118 28.440 -4.763 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 5.328 27.820 -6.133 1.00 0.00 H new ATOM 1319 N SER A 86 0.410 24.461 -4.678 1.00 0.00 N ATOM 1320 CA SER A 86 -0.933 24.903 -5.044 1.00 0.00 C ATOM 1321 C SER A 86 -1.891 23.756 -5.403 1.00 0.00 C ATOM 1322 O SER A 86 -1.544 22.568 -5.398 1.00 0.00 O ATOM 1323 CB SER A 86 -0.838 25.949 -6.173 1.00 0.00 C ATOM 1324 OG SER A 86 -0.310 27.174 -5.706 1.00 0.00 O ATOM 0 H SER A 86 0.652 24.723 -3.722 1.00 0.00 H new ATOM 0 HA SER A 86 -1.376 25.361 -4.160 1.00 0.00 H new ATOM 0 HB2 SER A 86 -0.208 25.563 -6.975 1.00 0.00 H new ATOM 0 HB3 SER A 86 -1.828 26.117 -6.598 1.00 0.00 H new ATOM 0 HG SER A 86 -0.262 27.813 -6.447 1.00 0.00 H new ATOM 1330 N GLY A 87 -3.130 24.133 -5.714 1.00 0.00 N ATOM 1331 CA GLY A 87 -4.079 23.328 -6.457 1.00 0.00 C ATOM 1332 C GLY A 87 -4.666 24.159 -7.596 1.00 0.00 C ATOM 1333 O GLY A 87 -4.299 25.329 -7.755 1.00 0.00 O ATOM 0 H GLY A 87 -3.507 25.041 -5.443 1.00 0.00 H new ATOM 0 HA2 GLY A 87 -3.587 22.441 -6.855 1.00 0.00 H new ATOM 0 HA3 GLY A 87 -4.874 22.982 -5.797 1.00 0.00 H new ATOM 1337 N PRO A 88 -5.545 23.581 -8.421 1.00 0.00 N ATOM 1338 CA PRO A 88 -6.269 24.330 -9.437 1.00 0.00 C ATOM 1339 C PRO A 88 -7.397 25.178 -8.815 1.00 0.00 C ATOM 1340 O PRO A 88 -7.612 26.305 -9.262 1.00 0.00 O ATOM 1341 CB PRO A 88 -6.763 23.257 -10.404 1.00 0.00 C ATOM 1342 CG PRO A 88 -6.965 22.026 -9.523 1.00 0.00 C ATOM 1343 CD PRO A 88 -5.858 22.162 -8.481 1.00 0.00 C ATOM 0 HA PRO A 88 -5.654 25.067 -9.954 1.00 0.00 H new ATOM 0 HB2 PRO A 88 -7.692 23.556 -10.890 1.00 0.00 H new ATOM 0 HB3 PRO A 88 -6.036 23.067 -11.194 1.00 0.00 H new ATOM 0 HG2 PRO A 88 -7.953 22.017 -9.063 1.00 0.00 H new ATOM 0 HG3 PRO A 88 -6.871 21.102 -10.093 1.00 0.00 H new ATOM 0 HD2 PRO A 88 -6.187 21.792 -7.510 1.00 0.00 H new ATOM 0 HD3 PRO A 88 -4.981 21.579 -8.763 1.00 0.00 H new ATOM 1351 N SER A 89 -8.049 24.666 -7.758 1.00 0.00 N ATOM 1352 CA SER A 89 -9.044 25.320 -6.900 1.00 0.00 C ATOM 1353 C SER A 89 -10.284 25.855 -7.653 1.00 0.00 C ATOM 1354 O SER A 89 -10.323 25.872 -8.885 1.00 0.00 O ATOM 1355 CB SER A 89 -8.349 26.391 -6.037 1.00 0.00 C ATOM 1356 OG SER A 89 -7.111 25.919 -5.506 1.00 0.00 O ATOM 0 H SER A 89 -7.878 23.706 -7.460 1.00 0.00 H new ATOM 0 HA SER A 89 -9.463 24.557 -6.244 1.00 0.00 H new ATOM 0 HB2 SER A 89 -8.171 27.283 -6.638 1.00 0.00 H new ATOM 0 HB3 SER A 89 -9.008 26.683 -5.219 1.00 0.00 H new ATOM 0 HG SER A 89 -6.697 26.624 -4.966 1.00 0.00 H new ATOM 1362 N SER A 90 -11.355 26.223 -6.946 1.00 0.00 N ATOM 1363 CA SER A 90 -12.554 26.904 -7.464 1.00 0.00 C ATOM 1364 C SER A 90 -13.379 27.559 -6.344 1.00 0.00 C ATOM 1365 O SER A 90 -14.106 28.524 -6.600 1.00 0.00 O ATOM 1366 CB SER A 90 -13.480 25.921 -8.203 1.00 0.00 C ATOM 1367 OG SER A 90 -12.846 25.324 -9.325 1.00 0.00 O ATOM 0 H SER A 90 -11.417 26.047 -5.943 1.00 0.00 H new ATOM 0 HA SER A 90 -12.186 27.671 -8.146 1.00 0.00 H new ATOM 0 HB2 SER A 90 -13.803 25.141 -7.513 1.00 0.00 H new ATOM 0 HB3 SER A 90 -14.376 26.447 -8.532 1.00 0.00 H new ATOM 0 HG SER A 90 -11.979 25.755 -9.478 1.00 0.00 H new ATOM 1373 N GLY A 91 -13.293 27.059 -5.108 1.00 0.00 N ATOM 1374 CA GLY A 91 -14.059 27.527 -3.966 1.00 0.00 C ATOM 1375 C GLY A 91 -14.127 26.427 -2.933 1.00 0.00 C ATOM 1376 O GLY A 91 -13.155 25.638 -2.843 1.00 0.00 O ATOM 0 H GLY A 91 -12.664 26.291 -4.875 1.00 0.00 H new ATOM 0 HA2 GLY A 91 -13.593 28.415 -3.539 1.00 0.00 H new ATOM 0 HA3 GLY A 91 -15.064 27.812 -4.278 1.00 0.00 H new TER 1380 GLY A 91