USER MOD reduce.3.24.130724 H: found=0, std=0, add=761, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 758 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 MET CE :methyl 167:sc=-0.00646 (180deg=-0.222) USER MOD Single : A 1 MET N :NH3+ 168:sc= 0 (180deg=-0.17) USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 7 SER OG : rot 180:sc= 0.0141 USER MOD Single : A 11 MET CE :methyl 177:sc= -0.206 (180deg=-0.263) USER MOD Single : A 12 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 23 THR OG1 : rot 180:sc= 0 USER MOD Single : A 26 ASN : amide:sc= -0.183 K(o=-0.18,f=-7.5!) USER MOD Single : A 28 TYR OH : rot 180:sc= 0 USER MOD Single : A 30 SER OG : rot 42:sc= 0.468 USER MOD Single : A 32 ASN : amide:sc= 0 K(o=0,f=-1) USER MOD Single : A 35 ASN : amide:sc= -0.183 X(o=-0.18,f=-0.19) USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 CYS SG : rot 180:sc= 0 USER MOD Single : A 48 TYR OH : rot 180:sc= 0 USER MOD Single : A 54 THR OG1 : rot -105:sc= 0.113 USER MOD Single : A 56 ASN : amide:sc= 0.692 K(o=0.69,f=-1.4) USER MOD Single : A 58 MET CE :methyl -163:sc= -1.93 (180deg=-3.16) USER MOD Single : A 60 THR OG1 : rot -42:sc= 0.5 USER MOD Single : A 65 GLN : amide:sc= -0.246 K(o=-0.25,f=-1.3) USER MOD Single : A 70 SER OG : rot 180:sc= -0.0232 USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 HIS : no HE2:sc= -2.27 K(o=-2.3,f=-5.9!) USER MOD Single : A 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 SER OG : rot 180:sc=-0.00985 USER MOD Single : A 84 THR OG1 : rot 180:sc=-0.00827 USER MOD Single : A 88 LYS NZ :NH3+ 150:sc= 0.0498 (180deg=0) USER MOD Single : A 89 THR OG1 : rot 66:sc= 1.24 USER MOD Single : A 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 ASN : amide:sc= -0.223 K(o=-0.22,f=-2!) USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 LYS NZ :NH3+ -126:sc= -0.95! (180deg=-1.57!) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 13.672 11.469 -23.375 1.00 0.00 N ATOM 2 CA MET A 1 12.832 10.343 -22.981 1.00 0.00 C ATOM 3 C MET A 1 13.185 9.867 -21.575 1.00 0.00 C ATOM 4 O MET A 1 13.924 8.898 -21.406 1.00 0.00 O ATOM 5 CB MET A 1 12.988 9.191 -23.976 1.00 0.00 C ATOM 6 CG MET A 1 14.435 8.874 -24.317 1.00 0.00 C ATOM 7 SD MET A 1 14.647 7.201 -24.955 1.00 0.00 S ATOM 8 CE MET A 1 13.448 7.191 -26.285 1.00 0.00 C ATOM 0 H1 MET A 1 13.561 11.645 -24.394 1.00 0.00 H new ATOM 0 H2 MET A 1 13.388 12.317 -22.844 1.00 0.00 H new ATOM 0 H3 MET A 1 14.667 11.249 -23.169 1.00 0.00 H new ATOM 0 HA MET A 1 11.795 10.677 -22.982 1.00 0.00 H new ATOM 0 HB2 MET A 1 12.517 8.299 -23.563 1.00 0.00 H new ATOM 0 HB3 MET A 1 12.453 9.439 -24.893 1.00 0.00 H new ATOM 0 HG2 MET A 1 14.795 9.589 -25.057 1.00 0.00 H new ATOM 0 HG3 MET A 1 15.050 9.000 -23.426 1.00 0.00 H new ATOM 0 HE1 MET A 1 13.615 6.320 -26.919 1.00 0.00 H new ATOM 0 HE2 MET A 1 12.442 7.148 -25.868 1.00 0.00 H new ATOM 0 HE3 MET A 1 13.556 8.099 -26.879 1.00 0.00 H new ATOM 18 N ALA A 2 12.651 10.554 -20.572 1.00 0.00 N ATOM 19 CA ALA A 2 12.908 10.201 -19.181 1.00 0.00 C ATOM 20 C ALA A 2 12.613 8.726 -18.927 1.00 0.00 C ATOM 21 O ALA A 2 11.588 8.203 -19.366 1.00 0.00 O ATOM 22 CB ALA A 2 12.078 11.075 -18.252 1.00 0.00 C ATOM 0 H ALA A 2 12.037 11.359 -20.696 1.00 0.00 H new ATOM 0 HA ALA A 2 13.964 10.375 -18.977 1.00 0.00 H new ATOM 0 HB1 ALA A 2 12.280 10.800 -17.217 1.00 0.00 H new ATOM 0 HB2 ALA A 2 12.339 12.122 -18.407 1.00 0.00 H new ATOM 0 HB3 ALA A 2 11.019 10.930 -18.466 1.00 0.00 H new ATOM 28 N ARG A 3 13.518 8.061 -18.217 1.00 0.00 N ATOM 29 CA ARG A 3 13.355 6.646 -17.905 1.00 0.00 C ATOM 30 C ARG A 3 12.230 6.437 -16.896 1.00 0.00 C ATOM 31 O ARG A 3 11.899 7.336 -16.124 1.00 0.00 O ATOM 32 CB ARG A 3 14.661 6.069 -17.355 1.00 0.00 C ATOM 33 CG ARG A 3 15.644 5.650 -18.436 1.00 0.00 C ATOM 34 CD ARG A 3 16.529 4.503 -17.970 1.00 0.00 C ATOM 35 NE ARG A 3 17.631 4.252 -18.894 1.00 0.00 N ATOM 36 CZ ARG A 3 18.476 3.234 -18.771 1.00 0.00 C ATOM 37 NH1 ARG A 3 18.344 2.377 -17.768 1.00 0.00 N ATOM 38 NH2 ARG A 3 19.453 3.071 -19.653 1.00 0.00 N ATOM 0 H ARG A 3 14.372 8.479 -17.847 1.00 0.00 H new ATOM 0 HA ARG A 3 13.095 6.125 -18.826 1.00 0.00 H new ATOM 0 HB2 ARG A 3 15.135 6.812 -16.713 1.00 0.00 H new ATOM 0 HB3 ARG A 3 14.432 5.206 -16.729 1.00 0.00 H new ATOM 0 HG2 ARG A 3 15.097 5.349 -19.330 1.00 0.00 H new ATOM 0 HG3 ARG A 3 16.266 6.501 -18.714 1.00 0.00 H new ATOM 0 HD2 ARG A 3 16.929 4.732 -16.982 1.00 0.00 H new ATOM 0 HD3 ARG A 3 15.928 3.599 -17.869 1.00 0.00 H new ATOM 0 HE ARG A 3 17.759 4.893 -19.677 1.00 0.00 H new ATOM 0 HH11 ARG A 3 17.593 2.498 -17.089 1.00 0.00 H new ATOM 0 HH12 ARG A 3 18.994 1.596 -17.675 1.00 0.00 H new ATOM 0 HH21 ARG A 3 19.556 3.728 -20.427 1.00 0.00 H new ATOM 0 HH22 ARG A 3 20.101 2.289 -19.558 1.00 0.00 H new ATOM 52 N GLY A 4 11.643 5.243 -16.911 1.00 0.00 N ATOM 53 CA GLY A 4 10.561 4.939 -15.993 1.00 0.00 C ATOM 54 C GLY A 4 9.239 4.730 -16.705 1.00 0.00 C ATOM 55 O GLY A 4 8.175 4.844 -16.097 1.00 0.00 O ATOM 0 H GLY A 4 11.897 4.483 -17.542 1.00 0.00 H new ATOM 0 HA2 GLY A 4 10.811 4.042 -15.426 1.00 0.00 H new ATOM 0 HA3 GLY A 4 10.459 5.752 -15.274 1.00 0.00 H new ATOM 59 N SER A 5 9.306 4.425 -17.997 1.00 0.00 N ATOM 60 CA SER A 5 8.105 4.206 -18.794 1.00 0.00 C ATOM 61 C SER A 5 7.224 3.131 -18.164 1.00 0.00 C ATOM 62 O SER A 5 7.597 2.510 -17.169 1.00 0.00 O ATOM 63 CB SER A 5 8.481 3.801 -20.221 1.00 0.00 C ATOM 64 OG SER A 5 7.500 4.233 -21.148 1.00 0.00 O ATOM 0 H SER A 5 10.179 4.324 -18.514 1.00 0.00 H new ATOM 0 HA SER A 5 7.544 5.140 -18.825 1.00 0.00 H new ATOM 0 HB2 SER A 5 9.448 4.232 -20.482 1.00 0.00 H new ATOM 0 HB3 SER A 5 8.589 2.718 -20.279 1.00 0.00 H new ATOM 0 HG SER A 5 7.764 3.964 -22.053 1.00 0.00 H new ATOM 70 N VAL A 6 6.050 2.918 -18.751 1.00 0.00 N ATOM 71 CA VAL A 6 5.115 1.918 -18.249 1.00 0.00 C ATOM 72 C VAL A 6 4.353 1.256 -19.392 1.00 0.00 C ATOM 73 O VAL A 6 3.723 1.933 -20.205 1.00 0.00 O ATOM 74 CB VAL A 6 4.105 2.538 -17.264 1.00 0.00 C ATOM 75 CG1 VAL A 6 3.270 1.453 -16.602 1.00 0.00 C ATOM 76 CG2 VAL A 6 4.827 3.377 -16.221 1.00 0.00 C ATOM 0 H VAL A 6 5.724 3.424 -19.574 1.00 0.00 H new ATOM 0 HA VAL A 6 5.706 1.166 -17.726 1.00 0.00 H new ATOM 0 HB VAL A 6 3.433 3.190 -17.821 1.00 0.00 H new ATOM 0 HG11 VAL A 6 2.563 1.910 -15.910 1.00 0.00 H new ATOM 0 HG12 VAL A 6 2.724 0.898 -17.365 1.00 0.00 H new ATOM 0 HG13 VAL A 6 3.924 0.773 -16.056 1.00 0.00 H new ATOM 0 HG21 VAL A 6 4.099 3.808 -15.533 1.00 0.00 H new ATOM 0 HG22 VAL A 6 5.523 2.748 -15.666 1.00 0.00 H new ATOM 0 HG23 VAL A 6 5.377 4.178 -16.715 1.00 0.00 H new ATOM 86 N SER A 7 4.414 -0.071 -19.446 1.00 0.00 N ATOM 87 CA SER A 7 3.732 -0.824 -20.492 1.00 0.00 C ATOM 88 C SER A 7 2.223 -0.616 -20.415 1.00 0.00 C ATOM 89 O SER A 7 1.708 -0.082 -19.433 1.00 0.00 O ATOM 90 CB SER A 7 4.059 -2.315 -20.371 1.00 0.00 C ATOM 91 OG SER A 7 5.419 -2.511 -20.028 1.00 0.00 O ATOM 0 H SER A 7 4.928 -0.646 -18.779 1.00 0.00 H new ATOM 0 HA SER A 7 4.083 -0.458 -21.457 1.00 0.00 H new ATOM 0 HB2 SER A 7 3.420 -2.771 -19.614 1.00 0.00 H new ATOM 0 HB3 SER A 7 3.843 -2.816 -21.315 1.00 0.00 H new ATOM 0 HG SER A 7 5.603 -3.471 -19.955 1.00 0.00 H new ATOM 97 N ASP A 8 1.520 -1.040 -21.459 1.00 0.00 N ATOM 98 CA ASP A 8 0.069 -0.902 -21.511 1.00 0.00 C ATOM 99 C ASP A 8 -0.591 -1.653 -20.359 1.00 0.00 C ATOM 100 O ASP A 8 -1.340 -1.070 -19.576 1.00 0.00 O ATOM 101 CB ASP A 8 -0.466 -1.421 -22.847 1.00 0.00 C ATOM 102 CG ASP A 8 -0.539 -0.336 -23.903 1.00 0.00 C ATOM 103 OD1 ASP A 8 -0.195 -0.619 -25.070 1.00 0.00 O ATOM 104 OD2 ASP A 8 -0.940 0.797 -23.563 1.00 0.00 O ATOM 0 H ASP A 8 1.931 -1.482 -22.281 1.00 0.00 H new ATOM 0 HA ASP A 8 -0.174 0.156 -21.417 1.00 0.00 H new ATOM 0 HB2 ASP A 8 0.175 -2.228 -23.203 1.00 0.00 H new ATOM 0 HB3 ASP A 8 -1.459 -1.845 -22.697 1.00 0.00 H new ATOM 109 N GLU A 9 -0.306 -2.947 -20.262 1.00 0.00 N ATOM 110 CA GLU A 9 -0.874 -3.777 -19.206 1.00 0.00 C ATOM 111 C GLU A 9 -0.532 -3.215 -17.829 1.00 0.00 C ATOM 112 O GLU A 9 -1.419 -2.947 -17.019 1.00 0.00 O ATOM 113 CB GLU A 9 -0.361 -5.213 -19.324 1.00 0.00 C ATOM 114 CG GLU A 9 -0.931 -5.967 -20.514 1.00 0.00 C ATOM 115 CD GLU A 9 -2.316 -6.522 -20.244 1.00 0.00 C ATOM 116 OE1 GLU A 9 -2.460 -7.763 -20.204 1.00 0.00 O ATOM 117 OE2 GLU A 9 -3.256 -5.717 -20.073 1.00 0.00 O ATOM 0 H GLU A 9 0.315 -3.444 -20.901 1.00 0.00 H new ATOM 0 HA GLU A 9 -1.958 -3.775 -19.321 1.00 0.00 H new ATOM 0 HB2 GLU A 9 0.726 -5.196 -19.402 1.00 0.00 H new ATOM 0 HB3 GLU A 9 -0.607 -5.754 -18.410 1.00 0.00 H new ATOM 0 HG2 GLU A 9 -0.972 -5.301 -21.376 1.00 0.00 H new ATOM 0 HG3 GLU A 9 -0.260 -6.785 -20.776 1.00 0.00 H new ATOM 124 N GLU A 10 0.761 -3.039 -17.572 1.00 0.00 N ATOM 125 CA GLU A 10 1.221 -2.511 -16.294 1.00 0.00 C ATOM 126 C GLU A 10 0.543 -1.180 -15.980 1.00 0.00 C ATOM 127 O GLU A 10 -0.035 -1.003 -14.908 1.00 0.00 O ATOM 128 CB GLU A 10 2.740 -2.330 -16.307 1.00 0.00 C ATOM 129 CG GLU A 10 3.304 -1.821 -14.992 1.00 0.00 C ATOM 130 CD GLU A 10 4.039 -2.898 -14.217 1.00 0.00 C ATOM 131 OE1 GLU A 10 3.838 -2.985 -12.988 1.00 0.00 O ATOM 132 OE2 GLU A 10 4.816 -3.651 -14.839 1.00 0.00 O ATOM 0 H GLU A 10 1.508 -3.255 -18.233 1.00 0.00 H new ATOM 0 HA GLU A 10 0.955 -3.228 -15.518 1.00 0.00 H new ATOM 0 HB2 GLU A 10 3.209 -3.284 -16.549 1.00 0.00 H new ATOM 0 HB3 GLU A 10 3.007 -1.633 -17.101 1.00 0.00 H new ATOM 0 HG2 GLU A 10 3.984 -0.992 -15.189 1.00 0.00 H new ATOM 0 HG3 GLU A 10 2.492 -1.428 -14.380 1.00 0.00 H new ATOM 139 N MET A 11 0.617 -0.247 -16.924 1.00 0.00 N ATOM 140 CA MET A 11 0.010 1.067 -16.749 1.00 0.00 C ATOM 141 C MET A 11 -1.449 0.940 -16.321 1.00 0.00 C ATOM 142 O MET A 11 -1.908 1.653 -15.430 1.00 0.00 O ATOM 143 CB MET A 11 0.104 1.873 -18.047 1.00 0.00 C ATOM 144 CG MET A 11 -0.416 3.295 -17.917 1.00 0.00 C ATOM 145 SD MET A 11 0.880 4.473 -17.489 1.00 0.00 S ATOM 146 CE MET A 11 0.246 5.128 -15.948 1.00 0.00 C ATOM 0 H MET A 11 1.091 -0.377 -17.818 1.00 0.00 H new ATOM 0 HA MET A 11 0.556 1.590 -15.964 1.00 0.00 H new ATOM 0 HB2 MET A 11 1.144 1.903 -18.372 1.00 0.00 H new ATOM 0 HB3 MET A 11 -0.459 1.359 -18.826 1.00 0.00 H new ATOM 0 HG2 MET A 11 -0.879 3.596 -18.857 1.00 0.00 H new ATOM 0 HG3 MET A 11 -1.195 3.325 -17.155 1.00 0.00 H new ATOM 0 HE1 MET A 11 0.964 5.833 -15.530 1.00 0.00 H new ATOM 0 HE2 MET A 11 -0.699 5.639 -16.131 1.00 0.00 H new ATOM 0 HE3 MET A 11 0.087 4.311 -15.244 1.00 0.00 H new ATOM 156 N MET A 12 -2.171 0.027 -16.962 1.00 0.00 N ATOM 157 CA MET A 12 -3.578 -0.194 -16.646 1.00 0.00 C ATOM 158 C MET A 12 -3.735 -0.776 -15.246 1.00 0.00 C ATOM 159 O MET A 12 -4.372 -0.174 -14.382 1.00 0.00 O ATOM 160 CB MET A 12 -4.213 -1.130 -17.675 1.00 0.00 C ATOM 161 CG MET A 12 -4.854 -0.403 -18.845 1.00 0.00 C ATOM 162 SD MET A 12 -5.715 -1.519 -19.970 1.00 0.00 S ATOM 163 CE MET A 12 -7.297 -1.676 -19.145 1.00 0.00 C ATOM 0 H MET A 12 -1.806 -0.571 -17.703 1.00 0.00 H new ATOM 0 HA MET A 12 -4.088 0.769 -16.679 1.00 0.00 H new ATOM 0 HB2 MET A 12 -3.450 -1.810 -18.054 1.00 0.00 H new ATOM 0 HB3 MET A 12 -4.968 -1.741 -17.180 1.00 0.00 H new ATOM 0 HG2 MET A 12 -5.558 0.338 -18.466 1.00 0.00 H new ATOM 0 HG3 MET A 12 -4.085 0.140 -19.395 1.00 0.00 H new ATOM 0 HE1 MET A 12 -7.944 -2.338 -19.721 1.00 0.00 H new ATOM 0 HE2 MET A 12 -7.148 -2.091 -18.148 1.00 0.00 H new ATOM 0 HE3 MET A 12 -7.764 -0.694 -19.063 1.00 0.00 H new ATOM 173 N GLU A 13 -3.151 -1.950 -15.028 1.00 0.00 N ATOM 174 CA GLU A 13 -3.228 -2.613 -13.732 1.00 0.00 C ATOM 175 C GLU A 13 -2.820 -1.663 -12.609 1.00 0.00 C ATOM 176 O GLU A 13 -3.353 -1.728 -11.501 1.00 0.00 O ATOM 177 CB GLU A 13 -2.334 -3.854 -13.715 1.00 0.00 C ATOM 178 CG GLU A 13 -3.107 -5.162 -13.740 1.00 0.00 C ATOM 179 CD GLU A 13 -4.149 -5.203 -14.841 1.00 0.00 C ATOM 180 OE1 GLU A 13 -5.184 -5.876 -14.653 1.00 0.00 O ATOM 181 OE2 GLU A 13 -3.929 -4.562 -15.890 1.00 0.00 O ATOM 0 H GLU A 13 -2.619 -2.461 -15.732 1.00 0.00 H new ATOM 0 HA GLU A 13 -4.262 -2.917 -13.569 1.00 0.00 H new ATOM 0 HB2 GLU A 13 -1.665 -3.821 -14.575 1.00 0.00 H new ATOM 0 HB3 GLU A 13 -1.708 -3.829 -12.823 1.00 0.00 H new ATOM 0 HG2 GLU A 13 -2.410 -5.989 -13.874 1.00 0.00 H new ATOM 0 HG3 GLU A 13 -3.596 -5.309 -12.777 1.00 0.00 H new ATOM 188 N LEU A 14 -1.871 -0.782 -12.904 1.00 0.00 N ATOM 189 CA LEU A 14 -1.389 0.182 -11.921 1.00 0.00 C ATOM 190 C LEU A 14 -2.392 1.318 -11.735 1.00 0.00 C ATOM 191 O LEU A 14 -2.914 1.524 -10.640 1.00 0.00 O ATOM 192 CB LEU A 14 -0.036 0.749 -12.352 1.00 0.00 C ATOM 193 CG LEU A 14 1.175 -0.156 -12.121 1.00 0.00 C ATOM 194 CD1 LEU A 14 2.431 0.472 -12.705 1.00 0.00 C ATOM 195 CD2 LEU A 14 1.356 -0.433 -10.635 1.00 0.00 C ATOM 0 H LEU A 14 -1.420 -0.715 -13.816 1.00 0.00 H new ATOM 0 HA LEU A 14 -1.272 -0.336 -10.969 1.00 0.00 H new ATOM 0 HB2 LEU A 14 -0.087 0.990 -13.414 1.00 0.00 H new ATOM 0 HB3 LEU A 14 0.129 1.686 -11.820 1.00 0.00 H new ATOM 0 HG LEU A 14 0.999 -1.104 -12.629 1.00 0.00 H new ATOM 0 HD11 LEU A 14 3.282 -0.187 -12.531 1.00 0.00 H new ATOM 0 HD12 LEU A 14 2.300 0.619 -13.777 1.00 0.00 H new ATOM 0 HD13 LEU A 14 2.613 1.434 -12.226 1.00 0.00 H new ATOM 0 HD21 LEU A 14 2.222 -1.078 -10.488 1.00 0.00 H new ATOM 0 HD22 LEU A 14 1.510 0.507 -10.106 1.00 0.00 H new ATOM 0 HD23 LEU A 14 0.465 -0.927 -10.246 1.00 0.00 H new ATOM 207 N ARG A 15 -2.658 2.048 -12.813 1.00 0.00 N ATOM 208 CA ARG A 15 -3.599 3.161 -12.768 1.00 0.00 C ATOM 209 C ARG A 15 -4.923 2.728 -12.146 1.00 0.00 C ATOM 210 O ARG A 15 -5.559 3.495 -11.424 1.00 0.00 O ATOM 211 CB ARG A 15 -3.840 3.709 -14.176 1.00 0.00 C ATOM 212 CG ARG A 15 -4.965 3.007 -14.919 1.00 0.00 C ATOM 213 CD ARG A 15 -6.310 3.657 -14.635 1.00 0.00 C ATOM 214 NE ARG A 15 -7.255 3.462 -15.732 1.00 0.00 N ATOM 215 CZ ARG A 15 -8.400 4.125 -15.842 1.00 0.00 C ATOM 216 NH1 ARG A 15 -8.742 5.021 -14.927 1.00 0.00 N ATOM 217 NH2 ARG A 15 -9.207 3.892 -16.869 1.00 0.00 N ATOM 0 H ARG A 15 -2.236 1.889 -13.728 1.00 0.00 H new ATOM 0 HA ARG A 15 -3.166 3.946 -12.149 1.00 0.00 H new ATOM 0 HB2 ARG A 15 -4.069 4.773 -14.108 1.00 0.00 H new ATOM 0 HB3 ARG A 15 -2.921 3.617 -14.755 1.00 0.00 H new ATOM 0 HG2 ARG A 15 -4.766 3.032 -15.990 1.00 0.00 H new ATOM 0 HG3 ARG A 15 -4.997 1.958 -14.625 1.00 0.00 H new ATOM 0 HD2 ARG A 15 -6.728 3.240 -13.718 1.00 0.00 H new ATOM 0 HD3 ARG A 15 -6.168 4.724 -14.464 1.00 0.00 H new ATOM 0 HE ARG A 15 -7.022 2.779 -16.453 1.00 0.00 H new ATOM 0 HH11 ARG A 15 -8.125 5.203 -14.136 1.00 0.00 H new ATOM 0 HH12 ARG A 15 -9.622 5.529 -15.014 1.00 0.00 H new ATOM 0 HH21 ARG A 15 -8.948 3.203 -17.575 1.00 0.00 H new ATOM 0 HH22 ARG A 15 -10.086 4.402 -16.952 1.00 0.00 H new ATOM 231 N GLU A 16 -5.332 1.496 -12.432 1.00 0.00 N ATOM 232 CA GLU A 16 -6.581 0.963 -11.900 1.00 0.00 C ATOM 233 C GLU A 16 -6.423 0.563 -10.436 1.00 0.00 C ATOM 234 O GLU A 16 -7.351 0.703 -9.640 1.00 0.00 O ATOM 235 CB GLU A 16 -7.037 -0.242 -12.724 1.00 0.00 C ATOM 236 CG GLU A 16 -6.284 -1.522 -12.399 1.00 0.00 C ATOM 237 CD GLU A 16 -6.822 -2.722 -13.153 1.00 0.00 C ATOM 238 OE1 GLU A 16 -6.352 -3.848 -12.887 1.00 0.00 O ATOM 239 OE2 GLU A 16 -7.712 -2.537 -14.009 1.00 0.00 O ATOM 0 H GLU A 16 -4.817 0.849 -13.029 1.00 0.00 H new ATOM 0 HA GLU A 16 -7.337 1.745 -11.964 1.00 0.00 H new ATOM 0 HB2 GLU A 16 -8.102 -0.404 -12.556 1.00 0.00 H new ATOM 0 HB3 GLU A 16 -6.912 -0.016 -13.783 1.00 0.00 H new ATOM 0 HG2 GLU A 16 -5.229 -1.390 -12.639 1.00 0.00 H new ATOM 0 HG3 GLU A 16 -6.345 -1.713 -11.328 1.00 0.00 H new ATOM 246 N ALA A 17 -5.241 0.065 -10.089 1.00 0.00 N ATOM 247 CA ALA A 17 -4.960 -0.355 -8.723 1.00 0.00 C ATOM 248 C ALA A 17 -5.077 0.817 -7.754 1.00 0.00 C ATOM 249 O ALA A 17 -5.545 0.660 -6.626 1.00 0.00 O ATOM 250 CB ALA A 17 -3.574 -0.977 -8.635 1.00 0.00 C ATOM 0 H ALA A 17 -4.462 -0.057 -10.736 1.00 0.00 H new ATOM 0 HA ALA A 17 -5.700 -1.103 -8.440 1.00 0.00 H new ATOM 0 HB1 ALA A 17 -3.378 -1.286 -7.608 1.00 0.00 H new ATOM 0 HB2 ALA A 17 -3.523 -1.846 -9.291 1.00 0.00 H new ATOM 0 HB3 ALA A 17 -2.827 -0.245 -8.942 1.00 0.00 H new ATOM 256 N PHE A 18 -4.650 1.993 -8.201 1.00 0.00 N ATOM 257 CA PHE A 18 -4.705 3.192 -7.373 1.00 0.00 C ATOM 258 C PHE A 18 -6.121 3.760 -7.332 1.00 0.00 C ATOM 259 O PHE A 18 -6.665 4.020 -6.259 1.00 0.00 O ATOM 260 CB PHE A 18 -3.734 4.250 -7.903 1.00 0.00 C ATOM 261 CG PHE A 18 -2.451 3.675 -8.431 1.00 0.00 C ATOM 262 CD1 PHE A 18 -1.730 2.756 -7.687 1.00 0.00 C ATOM 263 CD2 PHE A 18 -1.966 4.054 -9.672 1.00 0.00 C ATOM 264 CE1 PHE A 18 -0.549 2.224 -8.170 1.00 0.00 C ATOM 265 CE2 PHE A 18 -0.786 3.527 -10.160 1.00 0.00 C ATOM 266 CZ PHE A 18 -0.075 2.611 -9.408 1.00 0.00 C ATOM 0 H PHE A 18 -4.262 2.141 -9.132 1.00 0.00 H new ATOM 0 HA PHE A 18 -4.413 2.917 -6.360 1.00 0.00 H new ATOM 0 HB2 PHE A 18 -4.223 4.816 -8.696 1.00 0.00 H new ATOM 0 HB3 PHE A 18 -3.505 4.955 -7.104 1.00 0.00 H new ATOM 0 HD1 PHE A 18 -2.095 2.451 -6.717 1.00 0.00 H new ATOM 0 HD2 PHE A 18 -2.517 4.770 -10.265 1.00 0.00 H new ATOM 0 HE1 PHE A 18 0.002 1.507 -7.580 1.00 0.00 H new ATOM 0 HE2 PHE A 18 -0.419 3.831 -11.129 1.00 0.00 H new ATOM 0 HZ PHE A 18 0.848 2.199 -9.787 1.00 0.00 H new ATOM 276 N ALA A 19 -6.710 3.949 -8.508 1.00 0.00 N ATOM 277 CA ALA A 19 -8.062 4.485 -8.607 1.00 0.00 C ATOM 278 C ALA A 19 -9.058 3.602 -7.862 1.00 0.00 C ATOM 279 O ALA A 19 -10.134 4.054 -7.470 1.00 0.00 O ATOM 280 CB ALA A 19 -8.468 4.626 -10.067 1.00 0.00 C ATOM 0 H ALA A 19 -6.272 3.739 -9.405 1.00 0.00 H new ATOM 0 HA ALA A 19 -8.071 5.471 -8.142 1.00 0.00 H new ATOM 0 HB1 ALA A 19 -9.480 5.027 -10.126 1.00 0.00 H new ATOM 0 HB2 ALA A 19 -7.779 5.303 -10.573 1.00 0.00 H new ATOM 0 HB3 ALA A 19 -8.436 3.649 -10.549 1.00 0.00 H new ATOM 286 N LYS A 20 -8.693 2.338 -7.671 1.00 0.00 N ATOM 287 CA LYS A 20 -9.554 1.391 -6.973 1.00 0.00 C ATOM 288 C LYS A 20 -9.762 1.811 -5.521 1.00 0.00 C ATOM 289 O LYS A 20 -10.888 2.055 -5.090 1.00 0.00 O ATOM 290 CB LYS A 20 -8.949 -0.014 -7.026 1.00 0.00 C ATOM 291 CG LYS A 20 -9.825 -1.026 -7.745 1.00 0.00 C ATOM 292 CD LYS A 20 -9.997 -0.671 -9.212 1.00 0.00 C ATOM 293 CE LYS A 20 -11.199 -1.379 -9.819 1.00 0.00 C ATOM 294 NZ LYS A 20 -11.298 -1.145 -11.287 1.00 0.00 N ATOM 0 H LYS A 20 -7.807 1.946 -7.990 1.00 0.00 H new ATOM 0 HA LYS A 20 -10.523 1.383 -7.473 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -7.981 0.035 -7.524 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -8.767 -0.361 -6.009 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -9.382 -2.018 -7.659 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -10.802 -1.070 -7.263 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -10.118 0.407 -9.315 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -9.096 -0.944 -9.762 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -11.126 -2.449 -9.626 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -12.110 -1.029 -9.333 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -12.130 -1.644 -11.663 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -11.394 -0.126 -11.470 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -10.440 -1.502 -11.754 1.00 0.00 H new ATOM 308 N VAL A 21 -8.667 1.897 -4.772 1.00 0.00 N ATOM 309 CA VAL A 21 -8.729 2.291 -3.370 1.00 0.00 C ATOM 310 C VAL A 21 -9.119 3.757 -3.228 1.00 0.00 C ATOM 311 O VAL A 21 -9.447 4.220 -2.135 1.00 0.00 O ATOM 312 CB VAL A 21 -7.381 2.059 -2.662 1.00 0.00 C ATOM 313 CG1 VAL A 21 -7.149 0.574 -2.425 1.00 0.00 C ATOM 314 CG2 VAL A 21 -6.243 2.661 -3.472 1.00 0.00 C ATOM 0 H VAL A 21 -7.726 1.699 -5.113 1.00 0.00 H new ATOM 0 HA VAL A 21 -9.490 1.668 -2.900 1.00 0.00 H new ATOM 0 HB VAL A 21 -7.410 2.557 -1.693 1.00 0.00 H new ATOM 0 HG11 VAL A 21 -6.192 0.431 -1.924 1.00 0.00 H new ATOM 0 HG12 VAL A 21 -7.949 0.176 -1.800 1.00 0.00 H new ATOM 0 HG13 VAL A 21 -7.140 0.050 -3.381 1.00 0.00 H new ATOM 0 HG21 VAL A 21 -5.298 2.488 -2.957 1.00 0.00 H new ATOM 0 HG22 VAL A 21 -6.210 2.194 -4.456 1.00 0.00 H new ATOM 0 HG23 VAL A 21 -6.404 3.733 -3.584 1.00 0.00 H new ATOM 324 N ASP A 22 -9.083 4.484 -4.339 1.00 0.00 N ATOM 325 CA ASP A 22 -9.434 5.898 -4.340 1.00 0.00 C ATOM 326 C ASP A 22 -10.944 6.084 -4.212 1.00 0.00 C ATOM 327 O ASP A 22 -11.627 6.402 -5.186 1.00 0.00 O ATOM 328 CB ASP A 22 -8.932 6.571 -5.619 1.00 0.00 C ATOM 329 CG ASP A 22 -7.438 6.825 -5.591 1.00 0.00 C ATOM 330 OD1 ASP A 22 -6.778 6.597 -6.627 1.00 0.00 O ATOM 331 OD2 ASP A 22 -6.930 7.253 -4.534 1.00 0.00 O ATOM 0 H ASP A 22 -8.814 4.116 -5.252 1.00 0.00 H new ATOM 0 HA ASP A 22 -8.954 6.366 -3.481 1.00 0.00 H new ATOM 0 HB2 ASP A 22 -9.175 5.943 -6.476 1.00 0.00 H new ATOM 0 HB3 ASP A 22 -9.456 7.517 -5.758 1.00 0.00 H new ATOM 336 N THR A 23 -11.459 5.881 -3.003 1.00 0.00 N ATOM 337 CA THR A 23 -12.888 6.023 -2.748 1.00 0.00 C ATOM 338 C THR A 23 -13.307 7.488 -2.769 1.00 0.00 C ATOM 339 O THR A 23 -14.459 7.809 -3.058 1.00 0.00 O ATOM 340 CB THR A 23 -13.279 5.408 -1.392 1.00 0.00 C ATOM 341 OG1 THR A 23 -13.118 3.985 -1.433 1.00 0.00 O ATOM 342 CG2 THR A 23 -14.719 5.748 -1.038 1.00 0.00 C ATOM 0 H THR A 23 -10.908 5.618 -2.186 1.00 0.00 H new ATOM 0 HA THR A 23 -13.407 5.489 -3.544 1.00 0.00 H new ATOM 0 HB THR A 23 -12.624 5.826 -0.628 1.00 0.00 H new ATOM 0 HG1 THR A 23 -13.367 3.602 -0.566 1.00 0.00 H new ATOM 0 HG21 THR A 23 -14.972 5.303 -0.076 1.00 0.00 H new ATOM 0 HG22 THR A 23 -14.833 6.830 -0.978 1.00 0.00 H new ATOM 0 HG23 THR A 23 -15.385 5.355 -1.806 1.00 0.00 H new ATOM 350 N ASP A 24 -12.364 8.372 -2.463 1.00 0.00 N ATOM 351 CA ASP A 24 -12.636 9.805 -2.449 1.00 0.00 C ATOM 352 C ASP A 24 -12.246 10.445 -3.777 1.00 0.00 C ATOM 353 O ASP A 24 -12.570 11.603 -4.039 1.00 0.00 O ATOM 354 CB ASP A 24 -11.881 10.478 -1.302 1.00 0.00 C ATOM 355 CG ASP A 24 -10.436 10.024 -1.216 1.00 0.00 C ATOM 356 OD1 ASP A 24 -9.842 10.138 -0.123 1.00 0.00 O ATOM 357 OD2 ASP A 24 -9.900 9.556 -2.242 1.00 0.00 O ATOM 0 H ASP A 24 -11.405 8.122 -2.221 1.00 0.00 H new ATOM 0 HA ASP A 24 -13.707 9.945 -2.300 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -11.912 11.559 -1.435 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -12.385 10.258 -0.361 1.00 0.00 H new ATOM 362 N GLY A 25 -11.545 9.685 -4.613 1.00 0.00 N ATOM 363 CA GLY A 25 -11.120 10.194 -5.903 1.00 0.00 C ATOM 364 C GLY A 25 -10.218 11.406 -5.779 1.00 0.00 C ATOM 365 O GLY A 25 -10.566 12.496 -6.230 1.00 0.00 O ATOM 0 H GLY A 25 -11.264 8.724 -4.419 1.00 0.00 H new ATOM 0 HA2 GLY A 25 -10.595 9.408 -6.445 1.00 0.00 H new ATOM 0 HA3 GLY A 25 -11.998 10.457 -6.494 1.00 0.00 H new ATOM 369 N ASN A 26 -9.056 11.215 -5.163 1.00 0.00 N ATOM 370 CA ASN A 26 -8.101 12.303 -4.978 1.00 0.00 C ATOM 371 C ASN A 26 -6.846 12.073 -5.814 1.00 0.00 C ATOM 372 O ASN A 26 -6.055 12.990 -6.030 1.00 0.00 O ATOM 373 CB ASN A 26 -7.727 12.435 -3.500 1.00 0.00 C ATOM 374 CG ASN A 26 -7.005 11.210 -2.975 1.00 0.00 C ATOM 375 OD1 ASN A 26 -7.164 10.108 -3.502 1.00 0.00 O ATOM 376 ND2 ASN A 26 -6.208 11.396 -1.929 1.00 0.00 N ATOM 0 H ASN A 26 -8.753 10.318 -4.784 1.00 0.00 H new ATOM 0 HA ASN A 26 -8.572 13.228 -5.310 1.00 0.00 H new ATOM 0 HB2 ASN A 26 -7.094 13.312 -3.365 1.00 0.00 H new ATOM 0 HB3 ASN A 26 -8.630 12.600 -2.913 1.00 0.00 H new ATOM 0 HD21 ASN A 26 -5.698 10.608 -1.530 1.00 0.00 H new ATOM 0 HD22 ASN A 26 -6.106 12.327 -1.524 1.00 0.00 H new ATOM 383 N GLY A 27 -6.670 10.841 -6.281 1.00 0.00 N ATOM 384 CA GLY A 27 -5.510 10.511 -7.087 1.00 0.00 C ATOM 385 C GLY A 27 -4.277 10.247 -6.248 1.00 0.00 C ATOM 386 O GLY A 27 -3.153 10.289 -6.751 1.00 0.00 O ATOM 0 H GLY A 27 -7.311 10.065 -6.115 1.00 0.00 H new ATOM 0 HA2 GLY A 27 -5.730 9.631 -7.691 1.00 0.00 H new ATOM 0 HA3 GLY A 27 -5.307 11.329 -7.778 1.00 0.00 H new ATOM 390 N TYR A 28 -4.483 9.975 -4.964 1.00 0.00 N ATOM 391 CA TYR A 28 -3.378 9.708 -4.051 1.00 0.00 C ATOM 392 C TYR A 28 -3.691 8.515 -3.153 1.00 0.00 C ATOM 393 O TYR A 28 -4.840 8.086 -3.049 1.00 0.00 O ATOM 394 CB TYR A 28 -3.085 10.941 -3.196 1.00 0.00 C ATOM 395 CG TYR A 28 -2.131 11.917 -3.848 1.00 0.00 C ATOM 396 CD1 TYR A 28 -0.764 11.848 -3.607 1.00 0.00 C ATOM 397 CD2 TYR A 28 -2.597 12.908 -4.703 1.00 0.00 C ATOM 398 CE1 TYR A 28 0.111 12.738 -4.200 1.00 0.00 C ATOM 399 CE2 TYR A 28 -1.729 13.801 -5.301 1.00 0.00 C ATOM 400 CZ TYR A 28 -0.375 13.711 -5.046 1.00 0.00 C ATOM 401 OH TYR A 28 0.492 14.600 -5.639 1.00 0.00 O ATOM 0 H TYR A 28 -5.406 9.934 -4.532 1.00 0.00 H new ATOM 0 HA TYR A 28 -2.497 9.471 -4.647 1.00 0.00 H new ATOM 0 HB2 TYR A 28 -4.022 11.453 -2.978 1.00 0.00 H new ATOM 0 HB3 TYR A 28 -2.667 10.620 -2.242 1.00 0.00 H new ATOM 0 HD1 TYR A 28 -0.379 11.086 -2.945 1.00 0.00 H new ATOM 0 HD2 TYR A 28 -3.656 12.981 -4.904 1.00 0.00 H new ATOM 0 HE1 TYR A 28 1.170 12.671 -4.001 1.00 0.00 H new ATOM 0 HE2 TYR A 28 -2.107 14.565 -5.964 1.00 0.00 H new ATOM 0 HH TYR A 28 -0.012 15.220 -6.206 1.00 0.00 H new ATOM 411 N ILE A 29 -2.659 7.984 -2.505 1.00 0.00 N ATOM 412 CA ILE A 29 -2.822 6.842 -1.614 1.00 0.00 C ATOM 413 C ILE A 29 -2.019 7.027 -0.331 1.00 0.00 C ATOM 414 O ILE A 29 -0.804 7.217 -0.369 1.00 0.00 O ATOM 415 CB ILE A 29 -2.388 5.530 -2.294 1.00 0.00 C ATOM 416 CG1 ILE A 29 -3.324 5.199 -3.458 1.00 0.00 C ATOM 417 CG2 ILE A 29 -2.366 4.393 -1.285 1.00 0.00 C ATOM 418 CD1 ILE A 29 -2.880 4.003 -4.270 1.00 0.00 C ATOM 0 H ILE A 29 -1.701 8.327 -2.581 1.00 0.00 H new ATOM 0 HA ILE A 29 -3.883 6.781 -1.370 1.00 0.00 H new ATOM 0 HB ILE A 29 -1.380 5.659 -2.689 1.00 0.00 H new ATOM 0 HG12 ILE A 29 -4.324 5.011 -3.067 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -3.396 6.067 -4.114 1.00 0.00 H new ATOM 0 HG21 ILE A 29 -2.057 3.473 -1.781 1.00 0.00 H new ATOM 0 HG22 ILE A 29 -1.662 4.629 -0.487 1.00 0.00 H new ATOM 0 HG23 ILE A 29 -3.362 4.261 -0.863 1.00 0.00 H new ATOM 0 HD11 ILE A 29 -3.591 3.827 -5.078 1.00 0.00 H new ATOM 0 HD12 ILE A 29 -1.893 4.195 -4.691 1.00 0.00 H new ATOM 0 HD13 ILE A 29 -2.836 3.123 -3.628 1.00 0.00 H new ATOM 430 N SER A 30 -2.707 6.967 0.805 1.00 0.00 N ATOM 431 CA SER A 30 -2.059 7.129 2.101 1.00 0.00 C ATOM 432 C SER A 30 -1.756 5.773 2.731 1.00 0.00 C ATOM 433 O SER A 30 -1.908 4.731 2.092 1.00 0.00 O ATOM 434 CB SER A 30 -2.943 7.954 3.037 1.00 0.00 C ATOM 435 OG SER A 30 -2.191 8.478 4.119 1.00 0.00 O ATOM 0 H SER A 30 -3.713 6.807 0.854 1.00 0.00 H new ATOM 0 HA SER A 30 -1.117 7.655 1.945 1.00 0.00 H new ATOM 0 HB2 SER A 30 -3.404 8.771 2.481 1.00 0.00 H new ATOM 0 HB3 SER A 30 -3.752 7.332 3.420 1.00 0.00 H new ATOM 0 HG SER A 30 -1.331 8.812 3.788 1.00 0.00 H new ATOM 441 N PHE A 31 -1.328 5.795 3.988 1.00 0.00 N ATOM 442 CA PHE A 31 -1.003 4.567 4.707 1.00 0.00 C ATOM 443 C PHE A 31 -2.265 3.905 5.250 1.00 0.00 C ATOM 444 O PHE A 31 -2.291 2.699 5.492 1.00 0.00 O ATOM 445 CB PHE A 31 -0.034 4.864 5.854 1.00 0.00 C ATOM 446 CG PHE A 31 -0.208 3.952 7.035 1.00 0.00 C ATOM 447 CD1 PHE A 31 0.503 2.767 7.123 1.00 0.00 C ATOM 448 CD2 PHE A 31 -1.082 4.283 8.058 1.00 0.00 C ATOM 449 CE1 PHE A 31 0.347 1.926 8.209 1.00 0.00 C ATOM 450 CE2 PHE A 31 -1.243 3.447 9.147 1.00 0.00 C ATOM 451 CZ PHE A 31 -0.529 2.266 9.222 1.00 0.00 C ATOM 0 H PHE A 31 -1.198 6.649 4.531 1.00 0.00 H new ATOM 0 HA PHE A 31 -0.527 3.880 4.007 1.00 0.00 H new ATOM 0 HB2 PHE A 31 0.989 4.779 5.487 1.00 0.00 H new ATOM 0 HB3 PHE A 31 -0.172 5.896 6.178 1.00 0.00 H new ATOM 0 HD1 PHE A 31 1.188 2.496 6.333 1.00 0.00 H new ATOM 0 HD2 PHE A 31 -1.643 5.204 8.004 1.00 0.00 H new ATOM 0 HE1 PHE A 31 0.909 1.005 8.266 1.00 0.00 H new ATOM 0 HE2 PHE A 31 -1.926 3.717 9.939 1.00 0.00 H new ATOM 0 HZ PHE A 31 -0.656 1.610 10.071 1.00 0.00 H new ATOM 461 N ASN A 32 -3.311 4.704 5.441 1.00 0.00 N ATOM 462 CA ASN A 32 -4.577 4.196 5.957 1.00 0.00 C ATOM 463 C ASN A 32 -5.195 3.192 4.990 1.00 0.00 C ATOM 464 O ASN A 32 -5.401 2.029 5.335 1.00 0.00 O ATOM 465 CB ASN A 32 -5.550 5.350 6.203 1.00 0.00 C ATOM 466 CG ASN A 32 -6.553 5.037 7.297 1.00 0.00 C ATOM 467 OD1 ASN A 32 -6.902 3.878 7.522 1.00 0.00 O ATOM 468 ND2 ASN A 32 -7.023 6.072 7.983 1.00 0.00 N ATOM 0 H ASN A 32 -3.306 5.705 5.246 1.00 0.00 H new ATOM 0 HA ASN A 32 -4.379 3.689 6.901 1.00 0.00 H new ATOM 0 HB2 ASN A 32 -4.988 6.244 6.474 1.00 0.00 H new ATOM 0 HB3 ASN A 32 -6.083 5.576 5.279 1.00 0.00 H new ATOM 0 HD21 ASN A 32 -7.701 5.923 8.730 1.00 0.00 H new ATOM 0 HD22 ASN A 32 -6.706 7.016 7.763 1.00 0.00 H new ATOM 475 N GLU A 33 -5.488 3.649 3.777 1.00 0.00 N ATOM 476 CA GLU A 33 -6.083 2.791 2.760 1.00 0.00 C ATOM 477 C GLU A 33 -5.169 1.612 2.441 1.00 0.00 C ATOM 478 O GLU A 33 -5.637 0.506 2.163 1.00 0.00 O ATOM 479 CB GLU A 33 -6.365 3.591 1.487 1.00 0.00 C ATOM 480 CG GLU A 33 -5.157 4.352 0.966 1.00 0.00 C ATOM 481 CD GLU A 33 -5.536 5.452 -0.007 1.00 0.00 C ATOM 482 OE1 GLU A 33 -5.966 5.125 -1.132 1.00 0.00 O ATOM 483 OE2 GLU A 33 -5.401 6.639 0.357 1.00 0.00 O ATOM 0 H GLU A 33 -5.323 4.609 3.475 1.00 0.00 H new ATOM 0 HA GLU A 33 -7.023 2.404 3.153 1.00 0.00 H new ATOM 0 HB2 GLU A 33 -6.718 2.911 0.711 1.00 0.00 H new ATOM 0 HB3 GLU A 33 -7.172 4.297 1.683 1.00 0.00 H new ATOM 0 HG2 GLU A 33 -4.615 4.786 1.806 1.00 0.00 H new ATOM 0 HG3 GLU A 33 -4.478 3.656 0.475 1.00 0.00 H new ATOM 490 N LEU A 34 -3.863 1.854 2.483 1.00 0.00 N ATOM 491 CA LEU A 34 -2.882 0.813 2.197 1.00 0.00 C ATOM 492 C LEU A 34 -2.939 -0.290 3.248 1.00 0.00 C ATOM 493 O LEU A 34 -3.242 -1.442 2.937 1.00 0.00 O ATOM 494 CB LEU A 34 -1.475 1.412 2.146 1.00 0.00 C ATOM 495 CG LEU A 34 -0.589 0.943 0.991 1.00 0.00 C ATOM 496 CD1 LEU A 34 -0.812 1.809 -0.239 1.00 0.00 C ATOM 497 CD2 LEU A 34 0.876 0.964 1.401 1.00 0.00 C ATOM 0 H LEU A 34 -3.459 2.762 2.712 1.00 0.00 H new ATOM 0 HA LEU A 34 -3.121 0.378 1.226 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -1.565 2.497 2.091 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -0.969 1.181 3.083 1.00 0.00 H new ATOM 0 HG LEU A 34 -0.862 -0.083 0.742 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -0.173 1.460 -1.050 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -1.856 1.744 -0.546 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -0.567 2.845 -0.004 1.00 0.00 H new ATOM 0 HD21 LEU A 34 1.492 0.627 0.567 1.00 0.00 H new ATOM 0 HD22 LEU A 34 1.162 1.979 1.677 1.00 0.00 H new ATOM 0 HD23 LEU A 34 1.025 0.301 2.253 1.00 0.00 H new ATOM 509 N ASN A 35 -2.647 0.069 4.494 1.00 0.00 N ATOM 510 CA ASN A 35 -2.666 -0.891 5.592 1.00 0.00 C ATOM 511 C ASN A 35 -3.992 -1.647 5.630 1.00 0.00 C ATOM 512 O ASN A 35 -4.020 -2.861 5.832 1.00 0.00 O ATOM 513 CB ASN A 35 -2.435 -0.177 6.925 1.00 0.00 C ATOM 514 CG ASN A 35 -2.815 -1.037 8.115 1.00 0.00 C ATOM 515 OD1 ASN A 35 -3.819 -0.785 8.781 1.00 0.00 O ATOM 516 ND2 ASN A 35 -2.013 -2.060 8.386 1.00 0.00 N ATOM 0 H ASN A 35 -2.394 1.018 4.769 1.00 0.00 H new ATOM 0 HA ASN A 35 -1.863 -1.609 5.428 1.00 0.00 H new ATOM 0 HB2 ASN A 35 -1.386 0.106 7.005 1.00 0.00 H new ATOM 0 HB3 ASN A 35 -3.016 0.745 6.946 1.00 0.00 H new ATOM 0 HD21 ASN A 35 -2.219 -2.675 9.174 1.00 0.00 H new ATOM 0 HD22 ASN A 35 -1.191 -2.231 7.807 1.00 0.00 H new ATOM 523 N ASP A 36 -5.086 -0.920 5.434 1.00 0.00 N ATOM 524 CA ASP A 36 -6.415 -1.521 5.445 1.00 0.00 C ATOM 525 C ASP A 36 -6.599 -2.452 4.250 1.00 0.00 C ATOM 526 O ASP A 36 -7.194 -3.523 4.371 1.00 0.00 O ATOM 527 CB ASP A 36 -7.490 -0.433 5.429 1.00 0.00 C ATOM 528 CG ASP A 36 -8.872 -0.981 5.726 1.00 0.00 C ATOM 529 OD1 ASP A 36 -9.066 -1.539 6.827 1.00 0.00 O ATOM 530 OD2 ASP A 36 -9.760 -0.853 4.857 1.00 0.00 O ATOM 0 H ASP A 36 -5.079 0.086 5.266 1.00 0.00 H new ATOM 0 HA ASP A 36 -6.515 -2.107 6.359 1.00 0.00 H new ATOM 0 HB2 ASP A 36 -7.240 0.332 6.164 1.00 0.00 H new ATOM 0 HB3 ASP A 36 -7.497 0.053 4.453 1.00 0.00 H new ATOM 535 N LEU A 37 -6.087 -2.035 3.097 1.00 0.00 N ATOM 536 CA LEU A 37 -6.196 -2.832 1.879 1.00 0.00 C ATOM 537 C LEU A 37 -5.464 -4.161 2.031 1.00 0.00 C ATOM 538 O LEU A 37 -5.920 -5.193 1.538 1.00 0.00 O ATOM 539 CB LEU A 37 -5.630 -2.058 0.688 1.00 0.00 C ATOM 540 CG LEU A 37 -5.733 -2.749 -0.672 1.00 0.00 C ATOM 541 CD1 LEU A 37 -4.554 -3.685 -0.886 1.00 0.00 C ATOM 542 CD2 LEU A 37 -7.047 -3.508 -0.786 1.00 0.00 C ATOM 0 H LEU A 37 -5.593 -1.151 2.980 1.00 0.00 H new ATOM 0 HA LEU A 37 -7.252 -3.038 1.702 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -6.145 -1.099 0.626 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -4.580 -1.844 0.886 1.00 0.00 H new ATOM 0 HG LEU A 37 -5.709 -1.985 -1.449 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -4.645 -4.168 -1.859 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -3.626 -3.115 -0.849 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -4.545 -4.444 -0.104 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -7.103 -3.994 -1.760 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -7.101 -4.262 -0.001 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -7.879 -2.813 -0.679 1.00 0.00 H new ATOM 554 N PHE A 38 -4.327 -4.129 2.718 1.00 0.00 N ATOM 555 CA PHE A 38 -3.532 -5.333 2.936 1.00 0.00 C ATOM 556 C PHE A 38 -4.149 -6.203 4.027 1.00 0.00 C ATOM 557 O PHE A 38 -4.095 -7.431 3.964 1.00 0.00 O ATOM 558 CB PHE A 38 -2.097 -4.959 3.316 1.00 0.00 C ATOM 559 CG PHE A 38 -1.414 -4.090 2.300 1.00 0.00 C ATOM 560 CD1 PHE A 38 -1.804 -4.119 0.970 1.00 0.00 C ATOM 561 CD2 PHE A 38 -0.382 -3.245 2.673 1.00 0.00 C ATOM 562 CE1 PHE A 38 -1.178 -3.321 0.032 1.00 0.00 C ATOM 563 CE2 PHE A 38 0.248 -2.443 1.739 1.00 0.00 C ATOM 564 CZ PHE A 38 -0.150 -2.482 0.417 1.00 0.00 C ATOM 0 H PHE A 38 -3.935 -3.284 3.133 1.00 0.00 H new ATOM 0 HA PHE A 38 -3.518 -5.903 2.007 1.00 0.00 H new ATOM 0 HB2 PHE A 38 -2.107 -4.443 4.276 1.00 0.00 H new ATOM 0 HB3 PHE A 38 -1.516 -5.871 3.451 1.00 0.00 H new ATOM 0 HD1 PHE A 38 -2.607 -4.773 0.664 1.00 0.00 H new ATOM 0 HD2 PHE A 38 -0.066 -3.212 3.705 1.00 0.00 H new ATOM 0 HE1 PHE A 38 -1.492 -3.353 -1.001 1.00 0.00 H new ATOM 0 HE2 PHE A 38 1.050 -1.787 2.043 1.00 0.00 H new ATOM 0 HZ PHE A 38 0.342 -1.858 -0.315 1.00 0.00 H new ATOM 574 N LYS A 39 -4.736 -5.556 5.029 1.00 0.00 N ATOM 575 CA LYS A 39 -5.366 -6.268 6.134 1.00 0.00 C ATOM 576 C LYS A 39 -6.655 -6.946 5.682 1.00 0.00 C ATOM 577 O LYS A 39 -6.878 -8.125 5.958 1.00 0.00 O ATOM 578 CB LYS A 39 -5.661 -5.305 7.287 1.00 0.00 C ATOM 579 CG LYS A 39 -4.988 -5.693 8.591 1.00 0.00 C ATOM 580 CD LYS A 39 -4.369 -4.488 9.280 1.00 0.00 C ATOM 581 CE LYS A 39 -5.417 -3.665 10.014 1.00 0.00 C ATOM 582 NZ LYS A 39 -5.025 -3.401 11.426 1.00 0.00 N ATOM 0 H LYS A 39 -4.788 -4.540 5.098 1.00 0.00 H new ATOM 0 HA LYS A 39 -4.674 -7.037 6.478 1.00 0.00 H new ATOM 0 HB2 LYS A 39 -5.337 -4.303 7.005 1.00 0.00 H new ATOM 0 HB3 LYS A 39 -6.739 -5.259 7.444 1.00 0.00 H new ATOM 0 HG2 LYS A 39 -5.718 -6.157 9.254 1.00 0.00 H new ATOM 0 HG3 LYS A 39 -4.216 -6.438 8.396 1.00 0.00 H new ATOM 0 HD2 LYS A 39 -3.608 -4.822 9.985 1.00 0.00 H new ATOM 0 HD3 LYS A 39 -3.867 -3.864 8.541 1.00 0.00 H new ATOM 0 HE2 LYS A 39 -5.564 -2.718 9.495 1.00 0.00 H new ATOM 0 HE3 LYS A 39 -6.371 -4.191 9.994 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 -5.765 -2.838 11.892 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 -4.909 -4.304 11.929 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 -4.127 -2.877 11.445 1.00 0.00 H new ATOM 596 N ALA A 40 -7.499 -6.195 4.983 1.00 0.00 N ATOM 597 CA ALA A 40 -8.764 -6.725 4.489 1.00 0.00 C ATOM 598 C ALA A 40 -8.552 -8.022 3.717 1.00 0.00 C ATOM 599 O ALA A 40 -9.424 -8.890 3.688 1.00 0.00 O ATOM 600 CB ALA A 40 -9.462 -5.695 3.613 1.00 0.00 C ATOM 0 H ALA A 40 -7.330 -5.217 4.746 1.00 0.00 H new ATOM 0 HA ALA A 40 -9.398 -6.944 5.348 1.00 0.00 H new ATOM 0 HB1 ALA A 40 -10.405 -6.104 3.251 1.00 0.00 H new ATOM 0 HB2 ALA A 40 -9.657 -4.794 4.195 1.00 0.00 H new ATOM 0 HB3 ALA A 40 -8.825 -5.447 2.764 1.00 0.00 H new ATOM 606 N ALA A 41 -7.386 -8.148 3.090 1.00 0.00 N ATOM 607 CA ALA A 41 -7.059 -9.341 2.318 1.00 0.00 C ATOM 608 C ALA A 41 -7.179 -10.598 3.174 1.00 0.00 C ATOM 609 O ALA A 41 -7.394 -11.695 2.655 1.00 0.00 O ATOM 610 CB ALA A 41 -5.657 -9.226 1.739 1.00 0.00 C ATOM 0 H ALA A 41 -6.653 -7.439 3.102 1.00 0.00 H new ATOM 0 HA ALA A 41 -7.773 -9.422 1.499 1.00 0.00 H new ATOM 0 HB1 ALA A 41 -5.426 -10.123 1.165 1.00 0.00 H new ATOM 0 HB2 ALA A 41 -5.603 -8.354 1.087 1.00 0.00 H new ATOM 0 HB3 ALA A 41 -4.936 -9.118 2.550 1.00 0.00 H new ATOM 616 N CYS A 42 -7.037 -10.432 4.484 1.00 0.00 N ATOM 617 CA CYS A 42 -7.127 -11.555 5.411 1.00 0.00 C ATOM 618 C CYS A 42 -6.074 -12.611 5.091 1.00 0.00 C ATOM 619 O CYS A 42 -6.401 -13.725 4.681 1.00 0.00 O ATOM 620 CB CYS A 42 -8.524 -12.177 5.356 1.00 0.00 C ATOM 621 SG CYS A 42 -9.005 -13.043 6.869 1.00 0.00 S ATOM 0 H CYS A 42 -6.859 -9.531 4.928 1.00 0.00 H new ATOM 0 HA CYS A 42 -6.943 -11.179 6.417 1.00 0.00 H new ATOM 0 HB2 CYS A 42 -9.252 -11.392 5.152 1.00 0.00 H new ATOM 0 HB3 CYS A 42 -8.567 -12.876 4.521 1.00 0.00 H new ATOM 0 HG CYS A 42 -10.201 -13.533 6.727 1.00 0.00 H new ATOM 627 N LEU A 43 -4.809 -12.252 5.278 1.00 0.00 N ATOM 628 CA LEU A 43 -3.706 -13.169 5.008 1.00 0.00 C ATOM 629 C LEU A 43 -3.285 -13.903 6.277 1.00 0.00 C ATOM 630 O LEU A 43 -3.547 -13.461 7.395 1.00 0.00 O ATOM 631 CB LEU A 43 -2.515 -12.406 4.427 1.00 0.00 C ATOM 632 CG LEU A 43 -2.559 -12.136 2.923 1.00 0.00 C ATOM 633 CD1 LEU A 43 -1.414 -11.224 2.509 1.00 0.00 C ATOM 634 CD2 LEU A 43 -2.510 -13.443 2.144 1.00 0.00 C ATOM 0 H LEU A 43 -4.521 -11.333 5.615 1.00 0.00 H new ATOM 0 HA LEU A 43 -4.047 -13.906 4.281 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -2.434 -11.450 4.945 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -1.607 -12.967 4.649 1.00 0.00 H new ATOM 0 HG LEU A 43 -3.498 -11.633 2.692 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -1.463 -11.044 1.435 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -1.494 -10.276 3.040 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -0.464 -11.698 2.755 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -2.542 -13.231 1.075 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -1.588 -13.973 2.381 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -3.365 -14.062 2.417 1.00 0.00 H new ATOM 646 N PRO A 44 -2.614 -15.051 6.101 1.00 0.00 N ATOM 647 CA PRO A 44 -2.139 -15.870 7.220 1.00 0.00 C ATOM 648 C PRO A 44 -0.997 -15.205 7.982 1.00 0.00 C ATOM 649 O PRO A 44 -0.567 -15.694 9.027 1.00 0.00 O ATOM 650 CB PRO A 44 -1.654 -17.153 6.540 1.00 0.00 C ATOM 651 CG PRO A 44 -1.305 -16.737 5.153 1.00 0.00 C ATOM 652 CD PRO A 44 -2.266 -15.638 4.795 1.00 0.00 C ATOM 0 HA PRO A 44 -2.918 -16.035 7.964 1.00 0.00 H new ATOM 0 HB2 PRO A 44 -0.791 -17.573 7.056 1.00 0.00 H new ATOM 0 HB3 PRO A 44 -2.430 -17.919 6.540 1.00 0.00 H new ATOM 0 HG2 PRO A 44 -0.274 -16.387 5.099 1.00 0.00 H new ATOM 0 HG3 PRO A 44 -1.394 -17.574 4.461 1.00 0.00 H new ATOM 0 HD2 PRO A 44 -1.808 -14.903 4.133 1.00 0.00 H new ATOM 0 HD3 PRO A 44 -3.146 -16.025 4.281 1.00 0.00 H new ATOM 660 N LEU A 45 -0.511 -14.088 7.452 1.00 0.00 N ATOM 661 CA LEU A 45 0.581 -13.355 8.083 1.00 0.00 C ATOM 662 C LEU A 45 0.103 -12.641 9.343 1.00 0.00 C ATOM 663 O LEU A 45 -1.070 -12.289 9.478 1.00 0.00 O ATOM 664 CB LEU A 45 1.174 -12.342 7.102 1.00 0.00 C ATOM 665 CG LEU A 45 1.696 -12.911 5.782 1.00 0.00 C ATOM 666 CD1 LEU A 45 1.972 -11.792 4.791 1.00 0.00 C ATOM 667 CD2 LEU A 45 2.950 -13.739 6.017 1.00 0.00 C ATOM 0 H LEU A 45 -0.856 -13.670 6.588 1.00 0.00 H new ATOM 0 HA LEU A 45 1.351 -14.072 8.366 1.00 0.00 H new ATOM 0 HB2 LEU A 45 0.412 -11.596 6.877 1.00 0.00 H new ATOM 0 HB3 LEU A 45 1.993 -11.822 7.599 1.00 0.00 H new ATOM 0 HG LEU A 45 0.930 -13.561 5.360 1.00 0.00 H new ATOM 0 HD11 LEU A 45 2.343 -12.216 3.858 1.00 0.00 H new ATOM 0 HD12 LEU A 45 1.051 -11.241 4.599 1.00 0.00 H new ATOM 0 HD13 LEU A 45 2.720 -11.116 5.205 1.00 0.00 H new ATOM 0 HD21 LEU A 45 3.307 -14.136 5.067 1.00 0.00 H new ATOM 0 HD22 LEU A 45 3.722 -13.111 6.462 1.00 0.00 H new ATOM 0 HD23 LEU A 45 2.720 -14.564 6.691 1.00 0.00 H new ATOM 679 N PRO A 46 1.029 -12.420 10.286 1.00 0.00 N ATOM 680 CA PRO A 46 0.725 -11.743 11.551 1.00 0.00 C ATOM 681 C PRO A 46 0.427 -10.261 11.357 1.00 0.00 C ATOM 682 O PRO A 46 0.261 -9.793 10.232 1.00 0.00 O ATOM 683 CB PRO A 46 2.006 -11.928 12.369 1.00 0.00 C ATOM 684 CG PRO A 46 3.083 -12.102 11.353 1.00 0.00 C ATOM 685 CD PRO A 46 2.446 -12.813 10.192 1.00 0.00 C ATOM 0 HA PRO A 46 -0.165 -12.152 12.029 1.00 0.00 H new ATOM 0 HB2 PRO A 46 2.198 -11.064 13.005 1.00 0.00 H new ATOM 0 HB3 PRO A 46 1.936 -12.796 13.024 1.00 0.00 H new ATOM 0 HG2 PRO A 46 3.489 -11.138 11.045 1.00 0.00 H new ATOM 0 HG3 PRO A 46 3.912 -12.682 11.759 1.00 0.00 H new ATOM 0 HD2 PRO A 46 2.886 -12.506 9.243 1.00 0.00 H new ATOM 0 HD3 PRO A 46 2.569 -13.893 10.266 1.00 0.00 H new ATOM 693 N GLY A 47 0.359 -9.526 12.463 1.00 0.00 N ATOM 694 CA GLY A 47 0.081 -8.103 12.394 1.00 0.00 C ATOM 695 C GLY A 47 1.284 -7.298 11.944 1.00 0.00 C ATOM 696 O GLY A 47 1.202 -6.528 10.986 1.00 0.00 O ATOM 0 H GLY A 47 0.492 -9.891 13.406 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -0.746 -7.931 11.705 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -0.242 -7.751 13.374 1.00 0.00 H new ATOM 700 N TYR A 48 2.404 -7.475 12.637 1.00 0.00 N ATOM 701 CA TYR A 48 3.628 -6.755 12.306 1.00 0.00 C ATOM 702 C TYR A 48 3.992 -6.945 10.837 1.00 0.00 C ATOM 703 O TYR A 48 4.638 -6.091 10.230 1.00 0.00 O ATOM 704 CB TYR A 48 4.779 -7.231 13.193 1.00 0.00 C ATOM 705 CG TYR A 48 5.493 -8.451 12.657 1.00 0.00 C ATOM 706 CD1 TYR A 48 5.091 -9.732 13.019 1.00 0.00 C ATOM 707 CD2 TYR A 48 6.571 -8.326 11.788 1.00 0.00 C ATOM 708 CE1 TYR A 48 5.740 -10.849 12.532 1.00 0.00 C ATOM 709 CE2 TYR A 48 7.225 -9.438 11.296 1.00 0.00 C ATOM 710 CZ TYR A 48 6.806 -10.697 11.670 1.00 0.00 C ATOM 711 OH TYR A 48 7.456 -11.808 11.182 1.00 0.00 O ATOM 0 H TYR A 48 2.489 -8.110 13.431 1.00 0.00 H new ATOM 0 HA TYR A 48 3.455 -5.694 12.484 1.00 0.00 H new ATOM 0 HB2 TYR A 48 5.498 -6.420 13.306 1.00 0.00 H new ATOM 0 HB3 TYR A 48 4.392 -7.455 14.187 1.00 0.00 H new ATOM 0 HD1 TYR A 48 4.256 -9.855 13.693 1.00 0.00 H new ATOM 0 HD2 TYR A 48 6.903 -7.342 11.493 1.00 0.00 H new ATOM 0 HE1 TYR A 48 5.415 -11.836 12.824 1.00 0.00 H new ATOM 0 HE2 TYR A 48 8.061 -9.322 10.622 1.00 0.00 H new ATOM 0 HH TYR A 48 8.183 -11.527 10.587 1.00 0.00 H new ATOM 721 N ARG A 49 3.571 -8.072 10.270 1.00 0.00 N ATOM 722 CA ARG A 49 3.852 -8.376 8.873 1.00 0.00 C ATOM 723 C ARG A 49 3.208 -7.343 7.951 1.00 0.00 C ATOM 724 O ARG A 49 3.898 -6.625 7.229 1.00 0.00 O ATOM 725 CB ARG A 49 3.345 -9.776 8.521 1.00 0.00 C ATOM 726 CG ARG A 49 4.444 -10.730 8.086 1.00 0.00 C ATOM 727 CD ARG A 49 5.236 -10.171 6.914 1.00 0.00 C ATOM 728 NE ARG A 49 5.289 -11.107 5.794 1.00 0.00 N ATOM 729 CZ ARG A 49 6.180 -11.027 4.810 1.00 0.00 C ATOM 730 NH1 ARG A 49 7.085 -10.058 4.810 1.00 0.00 N ATOM 731 NH2 ARG A 49 6.165 -11.915 3.826 1.00 0.00 N ATOM 0 H ARG A 49 3.034 -8.789 10.758 1.00 0.00 H new ATOM 0 HA ARG A 49 4.932 -8.342 8.730 1.00 0.00 H new ATOM 0 HB2 ARG A 49 2.833 -10.196 9.387 1.00 0.00 H new ATOM 0 HB3 ARG A 49 2.608 -9.696 7.722 1.00 0.00 H new ATOM 0 HG2 ARG A 49 5.116 -10.919 8.923 1.00 0.00 H new ATOM 0 HG3 ARG A 49 4.006 -11.688 7.806 1.00 0.00 H new ATOM 0 HD2 ARG A 49 4.784 -9.236 6.584 1.00 0.00 H new ATOM 0 HD3 ARG A 49 6.250 -9.937 7.240 1.00 0.00 H new ATOM 0 HE ARG A 49 4.605 -11.863 5.765 1.00 0.00 H new ATOM 0 HH11 ARG A 49 7.098 -9.373 5.565 1.00 0.00 H new ATOM 0 HH12 ARG A 49 7.768 -9.998 4.055 1.00 0.00 H new ATOM 0 HH21 ARG A 49 5.469 -12.661 3.823 1.00 0.00 H new ATOM 0 HH22 ARG A 49 6.849 -11.852 3.072 1.00 0.00 H new ATOM 745 N VAL A 50 1.880 -7.276 7.984 1.00 0.00 N ATOM 746 CA VAL A 50 1.143 -6.332 7.154 1.00 0.00 C ATOM 747 C VAL A 50 1.549 -4.894 7.462 1.00 0.00 C ATOM 748 O VAL A 50 1.620 -4.054 6.565 1.00 0.00 O ATOM 749 CB VAL A 50 -0.378 -6.478 7.352 1.00 0.00 C ATOM 750 CG1 VAL A 50 -0.733 -6.402 8.829 1.00 0.00 C ATOM 751 CG2 VAL A 50 -1.123 -5.413 6.561 1.00 0.00 C ATOM 0 H VAL A 50 1.294 -7.864 8.576 1.00 0.00 H new ATOM 0 HA VAL A 50 1.391 -6.562 6.118 1.00 0.00 H new ATOM 0 HB VAL A 50 -0.684 -7.455 6.979 1.00 0.00 H new ATOM 0 HG11 VAL A 50 -1.811 -6.507 8.950 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -0.228 -7.204 9.366 1.00 0.00 H new ATOM 0 HG13 VAL A 50 -0.415 -5.440 9.231 1.00 0.00 H new ATOM 0 HG21 VAL A 50 -2.196 -5.531 6.713 1.00 0.00 H new ATOM 0 HG22 VAL A 50 -0.815 -4.425 6.902 1.00 0.00 H new ATOM 0 HG23 VAL A 50 -0.892 -5.519 5.501 1.00 0.00 H new ATOM 761 N ARG A 51 1.814 -4.620 8.734 1.00 0.00 N ATOM 762 CA ARG A 51 2.212 -3.285 9.161 1.00 0.00 C ATOM 763 C ARG A 51 3.618 -2.953 8.667 1.00 0.00 C ATOM 764 O ARG A 51 3.950 -1.788 8.450 1.00 0.00 O ATOM 765 CB ARG A 51 2.158 -3.176 10.686 1.00 0.00 C ATOM 766 CG ARG A 51 1.900 -1.764 11.186 1.00 0.00 C ATOM 767 CD ARG A 51 0.414 -1.447 11.217 1.00 0.00 C ATOM 768 NE ARG A 51 -0.207 -1.854 12.476 1.00 0.00 N ATOM 769 CZ ARG A 51 -1.491 -1.662 12.758 1.00 0.00 C ATOM 770 NH1 ARG A 51 -2.286 -1.071 11.876 1.00 0.00 N ATOM 771 NH2 ARG A 51 -1.982 -2.061 13.925 1.00 0.00 N ATOM 0 H ARG A 51 1.760 -5.305 9.488 1.00 0.00 H new ATOM 0 HA ARG A 51 1.514 -2.569 8.727 1.00 0.00 H new ATOM 0 HB2 ARG A 51 1.375 -3.834 11.062 1.00 0.00 H new ATOM 0 HB3 ARG A 51 3.101 -3.533 11.101 1.00 0.00 H new ATOM 0 HG2 ARG A 51 2.319 -1.649 12.186 1.00 0.00 H new ATOM 0 HG3 ARG A 51 2.412 -1.049 10.542 1.00 0.00 H new ATOM 0 HD2 ARG A 51 0.269 -0.377 11.071 1.00 0.00 H new ATOM 0 HD3 ARG A 51 -0.082 -1.952 10.388 1.00 0.00 H new ATOM 0 HE ARG A 51 0.377 -2.310 13.176 1.00 0.00 H new ATOM 0 HH11 ARG A 51 -1.912 -0.763 10.979 1.00 0.00 H new ATOM 0 HH12 ARG A 51 -3.271 -0.925 12.095 1.00 0.00 H new ATOM 0 HH21 ARG A 51 -1.373 -2.515 14.606 1.00 0.00 H new ATOM 0 HH22 ARG A 51 -2.968 -1.913 14.141 1.00 0.00 H new ATOM 785 N GLU A 52 4.438 -3.985 8.492 1.00 0.00 N ATOM 786 CA GLU A 52 5.806 -3.801 8.025 1.00 0.00 C ATOM 787 C GLU A 52 5.836 -3.515 6.526 1.00 0.00 C ATOM 788 O GLU A 52 6.551 -2.623 6.068 1.00 0.00 O ATOM 789 CB GLU A 52 6.645 -5.043 8.335 1.00 0.00 C ATOM 790 CG GLU A 52 8.045 -4.994 7.744 1.00 0.00 C ATOM 791 CD GLU A 52 8.903 -3.909 8.365 1.00 0.00 C ATOM 792 OE1 GLU A 52 10.070 -3.763 7.944 1.00 0.00 O ATOM 793 OE2 GLU A 52 8.407 -3.205 9.270 1.00 0.00 O ATOM 0 H GLU A 52 4.178 -4.956 8.667 1.00 0.00 H new ATOM 0 HA GLU A 52 6.230 -2.944 8.549 1.00 0.00 H new ATOM 0 HB2 GLU A 52 6.720 -5.160 9.416 1.00 0.00 H new ATOM 0 HB3 GLU A 52 6.129 -5.924 7.954 1.00 0.00 H new ATOM 0 HG2 GLU A 52 8.529 -5.960 7.886 1.00 0.00 H new ATOM 0 HG3 GLU A 52 7.976 -4.827 6.669 1.00 0.00 H new ATOM 800 N ILE A 53 5.056 -4.278 5.768 1.00 0.00 N ATOM 801 CA ILE A 53 4.992 -4.106 4.322 1.00 0.00 C ATOM 802 C ILE A 53 4.355 -2.770 3.955 1.00 0.00 C ATOM 803 O ILE A 53 4.774 -2.110 3.004 1.00 0.00 O ATOM 804 CB ILE A 53 4.195 -5.243 3.655 1.00 0.00 C ATOM 805 CG1 ILE A 53 2.788 -5.325 4.249 1.00 0.00 C ATOM 806 CG2 ILE A 53 4.924 -6.568 3.820 1.00 0.00 C ATOM 807 CD1 ILE A 53 1.941 -6.424 3.647 1.00 0.00 C ATOM 0 H ILE A 53 4.459 -5.021 6.131 1.00 0.00 H new ATOM 0 HA ILE A 53 6.018 -4.129 3.955 1.00 0.00 H new ATOM 0 HB ILE A 53 4.107 -5.029 2.590 1.00 0.00 H new ATOM 0 HG12 ILE A 53 2.865 -5.485 5.324 1.00 0.00 H new ATOM 0 HG13 ILE A 53 2.285 -4.369 4.104 1.00 0.00 H new ATOM 0 HG21 ILE A 53 4.349 -7.362 3.344 1.00 0.00 H new ATOM 0 HG22 ILE A 53 5.907 -6.503 3.354 1.00 0.00 H new ATOM 0 HG23 ILE A 53 5.039 -6.790 4.881 1.00 0.00 H new ATOM 0 HD11 ILE A 53 0.957 -6.423 4.116 1.00 0.00 H new ATOM 0 HD12 ILE A 53 1.833 -6.255 2.576 1.00 0.00 H new ATOM 0 HD13 ILE A 53 2.422 -7.388 3.815 1.00 0.00 H new ATOM 819 N THR A 54 3.340 -2.375 4.718 1.00 0.00 N ATOM 820 CA THR A 54 2.644 -1.118 4.473 1.00 0.00 C ATOM 821 C THR A 54 3.499 0.073 4.893 1.00 0.00 C ATOM 822 O THR A 54 3.507 1.108 4.227 1.00 0.00 O ATOM 823 CB THR A 54 1.302 -1.063 5.225 1.00 0.00 C ATOM 824 OG1 THR A 54 0.552 0.083 4.806 1.00 0.00 O ATOM 825 CG2 THR A 54 1.526 -1.005 6.729 1.00 0.00 C ATOM 0 H THR A 54 2.982 -2.908 5.511 1.00 0.00 H new ATOM 0 HA THR A 54 2.453 -1.065 3.401 1.00 0.00 H new ATOM 0 HB THR A 54 0.743 -1.969 4.991 1.00 0.00 H new ATOM 0 HG1 THR A 54 0.590 0.772 5.502 1.00 0.00 H new ATOM 0 HG21 THR A 54 0.563 -0.967 7.239 1.00 0.00 H new ATOM 0 HG22 THR A 54 2.072 -1.892 7.050 1.00 0.00 H new ATOM 0 HG23 THR A 54 2.104 -0.114 6.977 1.00 0.00 H new ATOM 833 N GLU A 55 4.217 -0.081 6.001 1.00 0.00 N ATOM 834 CA GLU A 55 5.075 0.983 6.509 1.00 0.00 C ATOM 835 C GLU A 55 6.252 1.229 5.569 1.00 0.00 C ATOM 836 O GLU A 55 6.568 2.371 5.239 1.00 0.00 O ATOM 837 CB GLU A 55 5.589 0.631 7.907 1.00 0.00 C ATOM 838 CG GLU A 55 4.660 1.070 9.026 1.00 0.00 C ATOM 839 CD GLU A 55 5.329 1.038 10.386 1.00 0.00 C ATOM 840 OE1 GLU A 55 6.464 0.528 10.476 1.00 0.00 O ATOM 841 OE2 GLU A 55 4.717 1.522 11.361 1.00 0.00 O ATOM 0 H GLU A 55 4.222 -0.932 6.564 1.00 0.00 H new ATOM 0 HA GLU A 55 4.482 1.896 6.567 1.00 0.00 H new ATOM 0 HB2 GLU A 55 5.736 -0.447 7.970 1.00 0.00 H new ATOM 0 HB3 GLU A 55 6.565 1.094 8.053 1.00 0.00 H new ATOM 0 HG2 GLU A 55 4.306 2.081 8.823 1.00 0.00 H new ATOM 0 HG3 GLU A 55 3.784 0.422 9.041 1.00 0.00 H new ATOM 848 N ASN A 56 6.896 0.148 5.143 1.00 0.00 N ATOM 849 CA ASN A 56 8.039 0.245 4.241 1.00 0.00 C ATOM 850 C ASN A 56 7.604 0.727 2.860 1.00 0.00 C ATOM 851 O ASN A 56 8.261 1.570 2.250 1.00 0.00 O ATOM 852 CB ASN A 56 8.738 -1.110 4.124 1.00 0.00 C ATOM 853 CG ASN A 56 9.427 -1.519 5.412 1.00 0.00 C ATOM 854 OD1 ASN A 56 9.381 -0.800 6.410 1.00 0.00 O ATOM 855 ND2 ASN A 56 10.070 -2.681 5.395 1.00 0.00 N ATOM 0 H ASN A 56 6.647 -0.805 5.407 1.00 0.00 H new ATOM 0 HA ASN A 56 8.737 0.972 4.656 1.00 0.00 H new ATOM 0 HB2 ASN A 56 8.007 -1.870 3.849 1.00 0.00 H new ATOM 0 HB3 ASN A 56 9.472 -1.069 3.320 1.00 0.00 H new ATOM 0 HD21 ASN A 56 10.552 -3.010 6.232 1.00 0.00 H new ATOM 0 HD22 ASN A 56 10.082 -3.245 4.545 1.00 0.00 H new ATOM 862 N LEU A 57 6.492 0.186 2.374 1.00 0.00 N ATOM 863 CA LEU A 57 5.968 0.561 1.066 1.00 0.00 C ATOM 864 C LEU A 57 5.643 2.050 1.016 1.00 0.00 C ATOM 865 O LEU A 57 5.990 2.738 0.056 1.00 0.00 O ATOM 866 CB LEU A 57 4.715 -0.257 0.745 1.00 0.00 C ATOM 867 CG LEU A 57 4.143 -0.081 -0.663 1.00 0.00 C ATOM 868 CD1 LEU A 57 5.207 -0.368 -1.711 1.00 0.00 C ATOM 869 CD2 LEU A 57 2.936 -0.987 -0.864 1.00 0.00 C ATOM 0 H LEU A 57 5.936 -0.514 2.866 1.00 0.00 H new ATOM 0 HA LEU A 57 6.734 0.350 0.320 1.00 0.00 H new ATOM 0 HB2 LEU A 57 4.946 -1.312 0.893 1.00 0.00 H new ATOM 0 HB3 LEU A 57 3.940 0.004 1.466 1.00 0.00 H new ATOM 0 HG LEU A 57 3.820 0.954 -0.777 1.00 0.00 H new ATOM 0 HD11 LEU A 57 4.782 -0.238 -2.706 1.00 0.00 H new ATOM 0 HD12 LEU A 57 6.042 0.321 -1.580 1.00 0.00 H new ATOM 0 HD13 LEU A 57 5.561 -1.393 -1.599 1.00 0.00 H new ATOM 0 HD21 LEU A 57 2.541 -0.849 -1.871 1.00 0.00 H new ATOM 0 HD22 LEU A 57 3.235 -2.027 -0.731 1.00 0.00 H new ATOM 0 HD23 LEU A 57 2.166 -0.735 -0.135 1.00 0.00 H new ATOM 881 N MET A 58 4.979 2.542 2.056 1.00 0.00 N ATOM 882 CA MET A 58 4.613 3.951 2.132 1.00 0.00 C ATOM 883 C MET A 58 5.849 4.826 2.311 1.00 0.00 C ATOM 884 O MET A 58 5.945 5.908 1.733 1.00 0.00 O ATOM 885 CB MET A 58 3.635 4.185 3.286 1.00 0.00 C ATOM 886 CG MET A 58 2.259 3.585 3.049 1.00 0.00 C ATOM 887 SD MET A 58 1.385 4.373 1.683 1.00 0.00 S ATOM 888 CE MET A 58 1.369 6.078 2.230 1.00 0.00 C ATOM 0 H MET A 58 4.683 1.986 2.858 1.00 0.00 H new ATOM 0 HA MET A 58 4.129 4.226 1.195 1.00 0.00 H new ATOM 0 HB2 MET A 58 4.055 3.761 4.198 1.00 0.00 H new ATOM 0 HB3 MET A 58 3.531 5.257 3.451 1.00 0.00 H new ATOM 0 HG2 MET A 58 2.362 2.520 2.843 1.00 0.00 H new ATOM 0 HG3 MET A 58 1.665 3.678 3.958 1.00 0.00 H new ATOM 0 HE1 MET A 58 0.621 6.634 1.665 1.00 0.00 H new ATOM 0 HE2 MET A 58 1.126 6.117 3.292 1.00 0.00 H new ATOM 0 HE3 MET A 58 2.351 6.522 2.066 1.00 0.00 H new ATOM 898 N ALA A 59 6.793 4.350 3.116 1.00 0.00 N ATOM 899 CA ALA A 59 8.024 5.089 3.371 1.00 0.00 C ATOM 900 C ALA A 59 8.872 5.192 2.108 1.00 0.00 C ATOM 901 O ALA A 59 9.392 6.260 1.781 1.00 0.00 O ATOM 902 CB ALA A 59 8.816 4.426 4.488 1.00 0.00 C ATOM 0 H ALA A 59 6.729 3.456 3.603 1.00 0.00 H new ATOM 0 HA ALA A 59 7.756 6.099 3.681 1.00 0.00 H new ATOM 0 HB1 ALA A 59 9.732 4.988 4.668 1.00 0.00 H new ATOM 0 HB2 ALA A 59 8.217 4.409 5.398 1.00 0.00 H new ATOM 0 HB3 ALA A 59 9.067 3.405 4.200 1.00 0.00 H new ATOM 908 N THR A 60 9.011 4.075 1.399 1.00 0.00 N ATOM 909 CA THR A 60 9.798 4.040 0.174 1.00 0.00 C ATOM 910 C THR A 60 8.937 4.366 -1.042 1.00 0.00 C ATOM 911 O THR A 60 9.399 4.292 -2.179 1.00 0.00 O ATOM 912 CB THR A 60 10.456 2.663 -0.032 1.00 0.00 C ATOM 913 OG1 THR A 60 11.444 2.741 -1.066 1.00 0.00 O ATOM 914 CG2 THR A 60 9.414 1.615 -0.397 1.00 0.00 C ATOM 0 H THR A 60 8.588 3.183 1.654 1.00 0.00 H new ATOM 0 HA THR A 60 10.577 4.795 0.277 1.00 0.00 H new ATOM 0 HB THR A 60 10.933 2.369 0.903 1.00 0.00 H new ATOM 0 HG1 THR A 60 11.103 3.288 -1.804 1.00 0.00 H new ATOM 0 HG21 THR A 60 9.902 0.650 -0.538 1.00 0.00 H new ATOM 0 HG22 THR A 60 8.680 1.537 0.405 1.00 0.00 H new ATOM 0 HG23 THR A 60 8.913 1.906 -1.320 1.00 0.00 H new ATOM 922 N GLY A 61 7.682 4.730 -0.793 1.00 0.00 N ATOM 923 CA GLY A 61 6.777 5.062 -1.877 1.00 0.00 C ATOM 924 C GLY A 61 6.351 6.516 -1.851 1.00 0.00 C ATOM 925 O GLY A 61 5.281 6.865 -2.349 1.00 0.00 O ATOM 0 H GLY A 61 7.277 4.801 0.140 1.00 0.00 H new ATOM 0 HA2 GLY A 61 7.261 4.845 -2.829 1.00 0.00 H new ATOM 0 HA3 GLY A 61 5.894 4.427 -1.816 1.00 0.00 H new ATOM 929 N ASP A 62 7.188 7.367 -1.267 1.00 0.00 N ATOM 930 CA ASP A 62 6.893 8.791 -1.177 1.00 0.00 C ATOM 931 C ASP A 62 8.117 9.625 -1.544 1.00 0.00 C ATOM 932 O ASP A 62 9.239 9.305 -1.151 1.00 0.00 O ATOM 933 CB ASP A 62 6.421 9.148 0.234 1.00 0.00 C ATOM 934 CG ASP A 62 5.307 10.177 0.230 1.00 0.00 C ATOM 935 OD1 ASP A 62 5.311 11.051 -0.661 1.00 0.00 O ATOM 936 OD2 ASP A 62 4.431 10.105 1.116 1.00 0.00 O ATOM 0 H ASP A 62 8.077 7.094 -0.849 1.00 0.00 H new ATOM 0 HA ASP A 62 6.097 9.017 -1.886 1.00 0.00 H new ATOM 0 HB2 ASP A 62 6.076 8.245 0.738 1.00 0.00 H new ATOM 0 HB3 ASP A 62 7.264 9.531 0.809 1.00 0.00 H new ATOM 941 N LEU A 63 7.893 10.695 -2.299 1.00 0.00 N ATOM 942 CA LEU A 63 8.977 11.575 -2.720 1.00 0.00 C ATOM 943 C LEU A 63 9.264 12.632 -1.659 1.00 0.00 C ATOM 944 O LEU A 63 10.420 12.921 -1.352 1.00 0.00 O ATOM 945 CB LEU A 63 8.627 12.250 -4.047 1.00 0.00 C ATOM 946 CG LEU A 63 9.106 11.535 -5.311 1.00 0.00 C ATOM 947 CD1 LEU A 63 10.623 11.589 -5.411 1.00 0.00 C ATOM 948 CD2 LEU A 63 8.620 10.094 -5.326 1.00 0.00 C ATOM 0 H LEU A 63 6.970 10.974 -2.632 1.00 0.00 H new ATOM 0 HA LEU A 63 9.873 10.968 -2.853 1.00 0.00 H new ATOM 0 HB2 LEU A 63 7.544 12.357 -4.103 1.00 0.00 H new ATOM 0 HB3 LEU A 63 9.047 13.256 -4.042 1.00 0.00 H new ATOM 0 HG LEU A 63 8.686 12.047 -6.177 1.00 0.00 H new ATOM 0 HD11 LEU A 63 10.946 11.075 -6.316 1.00 0.00 H new ATOM 0 HD12 LEU A 63 10.948 12.629 -5.448 1.00 0.00 H new ATOM 0 HD13 LEU A 63 11.063 11.102 -4.541 1.00 0.00 H new ATOM 0 HD21 LEU A 63 8.971 9.601 -6.233 1.00 0.00 H new ATOM 0 HD22 LEU A 63 9.010 9.569 -4.454 1.00 0.00 H new ATOM 0 HD23 LEU A 63 7.530 10.077 -5.302 1.00 0.00 H new ATOM 960 N ASP A 64 8.202 13.204 -1.100 1.00 0.00 N ATOM 961 CA ASP A 64 8.340 14.227 -0.070 1.00 0.00 C ATOM 962 C ASP A 64 7.938 13.681 1.297 1.00 0.00 C ATOM 963 O ASP A 64 8.002 14.389 2.301 1.00 0.00 O ATOM 964 CB ASP A 64 7.486 15.449 -0.417 1.00 0.00 C ATOM 965 CG ASP A 64 6.072 15.072 -0.810 1.00 0.00 C ATOM 966 OD1 ASP A 64 5.485 15.776 -1.660 1.00 0.00 O ATOM 967 OD2 ASP A 64 5.551 14.074 -0.270 1.00 0.00 O ATOM 0 H ASP A 64 7.238 12.977 -1.343 1.00 0.00 H new ATOM 0 HA ASP A 64 9.387 14.525 -0.027 1.00 0.00 H new ATOM 0 HB2 ASP A 64 7.455 16.122 0.440 1.00 0.00 H new ATOM 0 HB3 ASP A 64 7.954 15.996 -1.235 1.00 0.00 H new ATOM 972 N GLN A 65 7.522 12.419 1.324 1.00 0.00 N ATOM 973 CA GLN A 65 7.107 11.779 2.567 1.00 0.00 C ATOM 974 C GLN A 65 5.877 12.468 3.149 1.00 0.00 C ATOM 975 O GLN A 65 5.593 12.348 4.342 1.00 0.00 O ATOM 976 CB GLN A 65 8.249 11.803 3.584 1.00 0.00 C ATOM 977 CG GLN A 65 9.621 11.595 2.962 1.00 0.00 C ATOM 978 CD GLN A 65 9.692 10.344 2.109 1.00 0.00 C ATOM 979 OE1 GLN A 65 9.052 9.335 2.410 1.00 0.00 O ATOM 980 NE2 GLN A 65 10.473 10.403 1.037 1.00 0.00 N ATOM 0 H GLN A 65 7.463 11.820 0.500 1.00 0.00 H new ATOM 0 HA GLN A 65 6.850 10.743 2.345 1.00 0.00 H new ATOM 0 HB2 GLN A 65 8.238 12.759 4.108 1.00 0.00 H new ATOM 0 HB3 GLN A 65 8.076 11.028 4.331 1.00 0.00 H new ATOM 0 HG2 GLN A 65 9.874 12.461 2.351 1.00 0.00 H new ATOM 0 HG3 GLN A 65 10.369 11.534 3.753 1.00 0.00 H new ATOM 0 HE21 GLN A 65 10.985 11.259 0.826 1.00 0.00 H new ATOM 0 HE22 GLN A 65 10.561 9.592 0.425 1.00 0.00 H new ATOM 989 N ASP A 66 5.152 13.189 2.302 1.00 0.00 N ATOM 990 CA ASP A 66 3.952 13.896 2.733 1.00 0.00 C ATOM 991 C ASP A 66 2.916 12.923 3.287 1.00 0.00 C ATOM 992 O ASP A 66 2.015 13.314 4.027 1.00 0.00 O ATOM 993 CB ASP A 66 3.355 14.688 1.568 1.00 0.00 C ATOM 994 CG ASP A 66 2.723 13.791 0.522 1.00 0.00 C ATOM 995 OD1 ASP A 66 1.768 14.239 -0.147 1.00 0.00 O ATOM 996 OD2 ASP A 66 3.184 12.640 0.371 1.00 0.00 O ATOM 0 H ASP A 66 5.374 13.299 1.313 1.00 0.00 H new ATOM 0 HA ASP A 66 4.234 14.588 3.527 1.00 0.00 H new ATOM 0 HB2 ASP A 66 2.605 15.380 1.950 1.00 0.00 H new ATOM 0 HB3 ASP A 66 4.136 15.289 1.103 1.00 0.00 H new ATOM 1001 N GLY A 67 3.050 11.652 2.920 1.00 0.00 N ATOM 1002 CA GLY A 67 2.118 10.643 3.388 1.00 0.00 C ATOM 1003 C GLY A 67 1.142 10.212 2.312 1.00 0.00 C ATOM 1004 O GLY A 67 0.299 9.345 2.541 1.00 0.00 O ATOM 0 H GLY A 67 3.787 11.303 2.307 1.00 0.00 H new ATOM 0 HA2 GLY A 67 2.674 9.774 3.739 1.00 0.00 H new ATOM 0 HA3 GLY A 67 1.564 11.033 4.242 1.00 0.00 H new ATOM 1008 N ARG A 68 1.252 10.822 1.137 1.00 0.00 N ATOM 1009 CA ARG A 68 0.370 10.499 0.023 1.00 0.00 C ATOM 1010 C ARG A 68 1.171 10.028 -1.188 1.00 0.00 C ATOM 1011 O ARG A 68 2.194 10.619 -1.534 1.00 0.00 O ATOM 1012 CB ARG A 68 -0.478 11.715 -0.355 1.00 0.00 C ATOM 1013 CG ARG A 68 -1.076 12.436 0.843 1.00 0.00 C ATOM 1014 CD ARG A 68 -1.878 13.655 0.416 1.00 0.00 C ATOM 1015 NE ARG A 68 -2.047 14.609 1.509 1.00 0.00 N ATOM 1016 CZ ARG A 68 -2.948 14.468 2.475 1.00 0.00 C ATOM 1017 NH1 ARG A 68 -3.755 13.416 2.484 1.00 0.00 N ATOM 1018 NH2 ARG A 68 -3.041 15.378 3.435 1.00 0.00 N ATOM 0 H ARG A 68 1.944 11.543 0.932 1.00 0.00 H new ATOM 0 HA ARG A 68 -0.288 9.690 0.338 1.00 0.00 H new ATOM 0 HB2 ARG A 68 0.137 12.415 -0.920 1.00 0.00 H new ATOM 0 HB3 ARG A 68 -1.284 11.394 -1.015 1.00 0.00 H new ATOM 0 HG2 ARG A 68 -1.719 11.752 1.397 1.00 0.00 H new ATOM 0 HG3 ARG A 68 -0.278 12.743 1.520 1.00 0.00 H new ATOM 0 HD2 ARG A 68 -1.376 14.145 -0.419 1.00 0.00 H new ATOM 0 HD3 ARG A 68 -2.857 13.337 0.057 1.00 0.00 H new ATOM 0 HE ARG A 68 -1.440 15.428 1.532 1.00 0.00 H new ATOM 0 HH11 ARG A 68 -3.685 12.713 1.748 1.00 0.00 H new ATOM 0 HH12 ARG A 68 -4.446 13.310 3.227 1.00 0.00 H new ATOM 0 HH21 ARG A 68 -2.420 16.187 3.432 1.00 0.00 H new ATOM 0 HH22 ARG A 68 -3.733 15.269 4.176 1.00 0.00 H new ATOM 1032 N ILE A 69 0.699 8.963 -1.825 1.00 0.00 N ATOM 1033 CA ILE A 69 1.371 8.414 -2.997 1.00 0.00 C ATOM 1034 C ILE A 69 0.540 8.630 -4.258 1.00 0.00 C ATOM 1035 O ILE A 69 -0.627 8.245 -4.318 1.00 0.00 O ATOM 1036 CB ILE A 69 1.651 6.909 -2.832 1.00 0.00 C ATOM 1037 CG1 ILE A 69 2.342 6.641 -1.492 1.00 0.00 C ATOM 1038 CG2 ILE A 69 2.504 6.400 -3.983 1.00 0.00 C ATOM 1039 CD1 ILE A 69 2.763 5.200 -1.307 1.00 0.00 C ATOM 0 H ILE A 69 -0.146 8.462 -1.550 1.00 0.00 H new ATOM 0 HA ILE A 69 2.319 8.943 -3.094 1.00 0.00 H new ATOM 0 HB ILE A 69 0.701 6.374 -2.844 1.00 0.00 H new ATOM 0 HG12 ILE A 69 3.221 7.281 -1.411 1.00 0.00 H new ATOM 0 HG13 ILE A 69 1.668 6.921 -0.682 1.00 0.00 H new ATOM 0 HG21 ILE A 69 2.693 5.335 -3.852 1.00 0.00 H new ATOM 0 HG22 ILE A 69 1.979 6.562 -4.924 1.00 0.00 H new ATOM 0 HG23 ILE A 69 3.452 6.938 -3.999 1.00 0.00 H new ATOM 0 HD11 ILE A 69 3.245 5.084 -0.337 1.00 0.00 H new ATOM 0 HD12 ILE A 69 1.885 4.555 -1.356 1.00 0.00 H new ATOM 0 HD13 ILE A 69 3.462 4.921 -2.095 1.00 0.00 H new ATOM 1051 N SER A 70 1.152 9.244 -5.265 1.00 0.00 N ATOM 1052 CA SER A 70 0.469 9.513 -6.524 1.00 0.00 C ATOM 1053 C SER A 70 0.692 8.375 -7.516 1.00 0.00 C ATOM 1054 O SER A 70 1.527 7.497 -7.294 1.00 0.00 O ATOM 1055 CB SER A 70 0.961 10.831 -7.125 1.00 0.00 C ATOM 1056 OG SER A 70 0.117 11.258 -8.180 1.00 0.00 O ATOM 0 H SER A 70 2.120 9.565 -5.233 1.00 0.00 H new ATOM 0 HA SER A 70 -0.599 9.591 -6.320 1.00 0.00 H new ATOM 0 HB2 SER A 70 0.995 11.597 -6.350 1.00 0.00 H new ATOM 0 HB3 SER A 70 1.978 10.707 -7.496 1.00 0.00 H new ATOM 0 HG SER A 70 0.452 12.103 -8.546 1.00 0.00 H new ATOM 1062 N PHE A 71 -0.060 8.397 -8.612 1.00 0.00 N ATOM 1063 CA PHE A 71 0.053 7.368 -9.639 1.00 0.00 C ATOM 1064 C PHE A 71 1.510 7.165 -10.046 1.00 0.00 C ATOM 1065 O PHE A 71 2.038 6.055 -9.970 1.00 0.00 O ATOM 1066 CB PHE A 71 -0.783 7.745 -10.863 1.00 0.00 C ATOM 1067 CG PHE A 71 -2.232 7.369 -10.737 1.00 0.00 C ATOM 1068 CD1 PHE A 71 -2.925 7.611 -9.563 1.00 0.00 C ATOM 1069 CD2 PHE A 71 -2.900 6.773 -11.795 1.00 0.00 C ATOM 1070 CE1 PHE A 71 -4.258 7.267 -9.443 1.00 0.00 C ATOM 1071 CE2 PHE A 71 -4.234 6.427 -11.682 1.00 0.00 C ATOM 1072 CZ PHE A 71 -4.914 6.673 -10.505 1.00 0.00 C ATOM 0 H PHE A 71 -0.755 9.117 -8.812 1.00 0.00 H new ATOM 0 HA PHE A 71 -0.324 6.433 -9.225 1.00 0.00 H new ATOM 0 HB2 PHE A 71 -0.708 8.820 -11.028 1.00 0.00 H new ATOM 0 HB3 PHE A 71 -0.364 7.257 -11.743 1.00 0.00 H new ATOM 0 HD1 PHE A 71 -2.417 8.075 -8.730 1.00 0.00 H new ATOM 0 HD2 PHE A 71 -2.373 6.577 -12.717 1.00 0.00 H new ATOM 0 HE1 PHE A 71 -4.786 7.462 -8.521 1.00 0.00 H new ATOM 0 HE2 PHE A 71 -4.744 5.964 -12.514 1.00 0.00 H new ATOM 0 HZ PHE A 71 -5.956 6.402 -10.415 1.00 0.00 H new ATOM 1082 N ASP A 72 2.153 8.243 -10.480 1.00 0.00 N ATOM 1083 CA ASP A 72 3.548 8.185 -10.898 1.00 0.00 C ATOM 1084 C ASP A 72 4.433 7.657 -9.774 1.00 0.00 C ATOM 1085 O ASP A 72 5.347 6.868 -10.010 1.00 0.00 O ATOM 1086 CB ASP A 72 4.030 9.569 -11.336 1.00 0.00 C ATOM 1087 CG ASP A 72 3.534 9.945 -12.719 1.00 0.00 C ATOM 1088 OD1 ASP A 72 2.339 9.717 -13.003 1.00 0.00 O ATOM 1089 OD2 ASP A 72 4.340 10.469 -13.515 1.00 0.00 O ATOM 0 H ASP A 72 1.730 9.168 -10.551 1.00 0.00 H new ATOM 0 HA ASP A 72 3.619 7.500 -11.743 1.00 0.00 H new ATOM 0 HB2 ASP A 72 3.689 10.314 -10.616 1.00 0.00 H new ATOM 0 HB3 ASP A 72 5.120 9.591 -11.326 1.00 0.00 H new ATOM 1094 N GLU A 73 4.152 8.098 -8.551 1.00 0.00 N ATOM 1095 CA GLU A 73 4.925 7.671 -7.390 1.00 0.00 C ATOM 1096 C GLU A 73 4.931 6.149 -7.272 1.00 0.00 C ATOM 1097 O GLU A 73 5.982 5.513 -7.357 1.00 0.00 O ATOM 1098 CB GLU A 73 4.353 8.291 -6.113 1.00 0.00 C ATOM 1099 CG GLU A 73 5.040 9.583 -5.703 1.00 0.00 C ATOM 1100 CD GLU A 73 4.330 10.285 -4.564 1.00 0.00 C ATOM 1101 OE1 GLU A 73 4.796 10.166 -3.411 1.00 0.00 O ATOM 1102 OE2 GLU A 73 3.308 10.953 -4.823 1.00 0.00 O ATOM 0 H GLU A 73 3.396 8.749 -8.339 1.00 0.00 H new ATOM 0 HA GLU A 73 5.952 8.012 -7.522 1.00 0.00 H new ATOM 0 HB2 GLU A 73 3.290 8.485 -6.258 1.00 0.00 H new ATOM 0 HB3 GLU A 73 4.438 7.570 -5.300 1.00 0.00 H new ATOM 0 HG2 GLU A 73 6.067 9.366 -5.408 1.00 0.00 H new ATOM 0 HG3 GLU A 73 5.090 10.252 -6.562 1.00 0.00 H new ATOM 1109 N PHE A 74 3.750 5.572 -7.073 1.00 0.00 N ATOM 1110 CA PHE A 74 3.619 4.127 -6.941 1.00 0.00 C ATOM 1111 C PHE A 74 4.207 3.413 -8.155 1.00 0.00 C ATOM 1112 O PHE A 74 5.096 2.571 -8.022 1.00 0.00 O ATOM 1113 CB PHE A 74 2.148 3.740 -6.771 1.00 0.00 C ATOM 1114 CG PHE A 74 1.868 2.993 -5.498 1.00 0.00 C ATOM 1115 CD1 PHE A 74 0.817 3.367 -4.677 1.00 0.00 C ATOM 1116 CD2 PHE A 74 2.656 1.917 -5.123 1.00 0.00 C ATOM 1117 CE1 PHE A 74 0.556 2.681 -3.506 1.00 0.00 C ATOM 1118 CE2 PHE A 74 2.399 1.228 -3.953 1.00 0.00 C ATOM 1119 CZ PHE A 74 1.348 1.611 -3.142 1.00 0.00 C ATOM 0 H PHE A 74 2.871 6.084 -7.000 1.00 0.00 H new ATOM 0 HA PHE A 74 4.174 3.817 -6.056 1.00 0.00 H new ATOM 0 HB2 PHE A 74 1.538 4.643 -6.795 1.00 0.00 H new ATOM 0 HB3 PHE A 74 1.842 3.126 -7.618 1.00 0.00 H new ATOM 0 HD1 PHE A 74 0.194 4.204 -4.955 1.00 0.00 H new ATOM 0 HD2 PHE A 74 3.480 1.613 -5.752 1.00 0.00 H new ATOM 0 HE1 PHE A 74 -0.268 2.982 -2.876 1.00 0.00 H new ATOM 0 HE2 PHE A 74 3.020 0.390 -3.672 1.00 0.00 H new ATOM 0 HZ PHE A 74 1.147 1.075 -2.226 1.00 0.00 H new ATOM 1129 N ILE A 75 3.704 3.755 -9.336 1.00 0.00 N ATOM 1130 CA ILE A 75 4.179 3.149 -10.573 1.00 0.00 C ATOM 1131 C ILE A 75 5.700 3.211 -10.667 1.00 0.00 C ATOM 1132 O ILE A 75 6.345 2.259 -11.107 1.00 0.00 O ATOM 1133 CB ILE A 75 3.571 3.839 -11.808 1.00 0.00 C ATOM 1134 CG1 ILE A 75 2.044 3.799 -11.741 1.00 0.00 C ATOM 1135 CG2 ILE A 75 4.069 3.177 -13.083 1.00 0.00 C ATOM 1136 CD1 ILE A 75 1.373 4.850 -12.598 1.00 0.00 C ATOM 0 H ILE A 75 2.967 4.449 -9.462 1.00 0.00 H new ATOM 0 HA ILE A 75 3.861 2.107 -10.556 1.00 0.00 H new ATOM 0 HB ILE A 75 3.888 4.882 -11.816 1.00 0.00 H new ATOM 0 HG12 ILE A 75 1.701 2.813 -12.054 1.00 0.00 H new ATOM 0 HG13 ILE A 75 1.730 3.932 -10.706 1.00 0.00 H new ATOM 0 HG21 ILE A 75 3.630 3.676 -13.947 1.00 0.00 H new ATOM 0 HG22 ILE A 75 5.155 3.254 -13.132 1.00 0.00 H new ATOM 0 HG23 ILE A 75 3.779 2.126 -13.085 1.00 0.00 H new ATOM 0 HD11 ILE A 75 0.291 4.762 -12.501 1.00 0.00 H new ATOM 0 HD12 ILE A 75 1.687 5.841 -12.271 1.00 0.00 H new ATOM 0 HD13 ILE A 75 1.657 4.705 -13.640 1.00 0.00 H new ATOM 1148 N LYS A 76 6.267 4.337 -10.249 1.00 0.00 N ATOM 1149 CA LYS A 76 7.713 4.523 -10.282 1.00 0.00 C ATOM 1150 C LYS A 76 8.416 3.482 -9.417 1.00 0.00 C ATOM 1151 O LYS A 76 9.357 2.825 -9.862 1.00 0.00 O ATOM 1152 CB LYS A 76 8.078 5.930 -9.800 1.00 0.00 C ATOM 1153 CG LYS A 76 8.108 6.964 -10.914 1.00 0.00 C ATOM 1154 CD LYS A 76 9.355 6.826 -11.770 1.00 0.00 C ATOM 1155 CE LYS A 76 9.506 7.999 -12.726 1.00 0.00 C ATOM 1156 NZ LYS A 76 10.195 9.152 -12.084 1.00 0.00 N ATOM 0 H LYS A 76 5.747 5.135 -9.883 1.00 0.00 H new ATOM 0 HA LYS A 76 8.046 4.399 -11.312 1.00 0.00 H new ATOM 0 HB2 LYS A 76 7.359 6.244 -9.043 1.00 0.00 H new ATOM 0 HB3 LYS A 76 9.055 5.898 -9.318 1.00 0.00 H new ATOM 0 HG2 LYS A 76 7.222 6.852 -11.539 1.00 0.00 H new ATOM 0 HG3 LYS A 76 8.070 7.965 -10.484 1.00 0.00 H new ATOM 0 HD2 LYS A 76 10.233 6.763 -11.128 1.00 0.00 H new ATOM 0 HD3 LYS A 76 9.307 5.896 -12.337 1.00 0.00 H new ATOM 0 HE2 LYS A 76 10.069 7.682 -13.604 1.00 0.00 H new ATOM 0 HE3 LYS A 76 8.522 8.312 -13.075 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 10.279 9.931 -12.768 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 9.645 9.471 -11.261 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 11.144 8.860 -11.774 1.00 0.00 H new ATOM 1170 N ILE A 77 7.953 3.336 -8.180 1.00 0.00 N ATOM 1171 CA ILE A 77 8.536 2.372 -7.255 1.00 0.00 C ATOM 1172 C ILE A 77 8.439 0.954 -7.805 1.00 0.00 C ATOM 1173 O ILE A 77 9.307 0.117 -7.555 1.00 0.00 O ATOM 1174 CB ILE A 77 7.848 2.425 -5.879 1.00 0.00 C ATOM 1175 CG1 ILE A 77 8.462 3.531 -5.018 1.00 0.00 C ATOM 1176 CG2 ILE A 77 7.959 1.079 -5.178 1.00 0.00 C ATOM 1177 CD1 ILE A 77 8.090 4.926 -5.472 1.00 0.00 C ATOM 0 H ILE A 77 7.176 3.873 -7.795 1.00 0.00 H new ATOM 0 HA ILE A 77 9.585 2.642 -7.138 1.00 0.00 H new ATOM 0 HB ILE A 77 6.792 2.650 -6.027 1.00 0.00 H new ATOM 0 HG12 ILE A 77 8.142 3.396 -3.985 1.00 0.00 H new ATOM 0 HG13 ILE A 77 9.547 3.430 -5.031 1.00 0.00 H new ATOM 0 HG21 ILE A 77 7.468 1.133 -4.207 1.00 0.00 H new ATOM 0 HG22 ILE A 77 7.479 0.312 -5.785 1.00 0.00 H new ATOM 0 HG23 ILE A 77 9.010 0.827 -5.039 1.00 0.00 H new ATOM 0 HD11 ILE A 77 8.560 5.659 -4.817 1.00 0.00 H new ATOM 0 HD12 ILE A 77 8.434 5.080 -6.495 1.00 0.00 H new ATOM 0 HD13 ILE A 77 7.007 5.045 -5.432 1.00 0.00 H new ATOM 1189 N PHE A 78 7.376 0.689 -8.559 1.00 0.00 N ATOM 1190 CA PHE A 78 7.165 -0.629 -9.146 1.00 0.00 C ATOM 1191 C PHE A 78 8.151 -0.882 -10.283 1.00 0.00 C ATOM 1192 O PHE A 78 8.684 -1.984 -10.424 1.00 0.00 O ATOM 1193 CB PHE A 78 5.730 -0.757 -9.661 1.00 0.00 C ATOM 1194 CG PHE A 78 4.793 -1.395 -8.676 1.00 0.00 C ATOM 1195 CD1 PHE A 78 3.829 -2.295 -9.100 1.00 0.00 C ATOM 1196 CD2 PHE A 78 4.878 -1.096 -7.326 1.00 0.00 C ATOM 1197 CE1 PHE A 78 2.965 -2.885 -8.197 1.00 0.00 C ATOM 1198 CE2 PHE A 78 4.018 -1.683 -6.418 1.00 0.00 C ATOM 1199 CZ PHE A 78 3.059 -2.577 -6.853 1.00 0.00 C ATOM 0 H PHE A 78 6.648 1.369 -8.777 1.00 0.00 H new ATOM 0 HA PHE A 78 7.333 -1.376 -8.371 1.00 0.00 H new ATOM 0 HB2 PHE A 78 5.355 0.234 -9.917 1.00 0.00 H new ATOM 0 HB3 PHE A 78 5.733 -1.344 -10.579 1.00 0.00 H new ATOM 0 HD1 PHE A 78 3.752 -2.539 -10.149 1.00 0.00 H new ATOM 0 HD2 PHE A 78 5.625 -0.397 -6.980 1.00 0.00 H new ATOM 0 HE1 PHE A 78 2.218 -3.585 -8.541 1.00 0.00 H new ATOM 0 HE2 PHE A 78 4.096 -1.443 -5.368 1.00 0.00 H new ATOM 0 HZ PHE A 78 2.384 -3.034 -6.144 1.00 0.00 H new ATOM 1209 N HIS A 79 8.387 0.145 -11.093 1.00 0.00 N ATOM 1210 CA HIS A 79 9.308 0.035 -12.218 1.00 0.00 C ATOM 1211 C HIS A 79 10.753 0.181 -11.753 1.00 0.00 C ATOM 1212 O HIS A 79 11.686 -0.184 -12.468 1.00 0.00 O ATOM 1213 CB HIS A 79 8.990 1.097 -13.271 1.00 0.00 C ATOM 1214 CG HIS A 79 8.018 0.634 -14.314 1.00 0.00 C ATOM 1215 ND1 HIS A 79 8.410 0.097 -15.522 1.00 0.00 N ATOM 1216 CD2 HIS A 79 6.665 0.629 -14.323 1.00 0.00 C ATOM 1217 CE1 HIS A 79 7.341 -0.217 -16.230 1.00 0.00 C ATOM 1218 NE2 HIS A 79 6.268 0.095 -15.524 1.00 0.00 N ATOM 0 H HIS A 79 7.953 1.063 -10.991 1.00 0.00 H new ATOM 0 HA HIS A 79 9.185 -0.953 -12.661 1.00 0.00 H new ATOM 0 HB2 HIS A 79 8.585 1.979 -12.775 1.00 0.00 H new ATOM 0 HB3 HIS A 79 9.916 1.402 -13.759 1.00 0.00 H new ATOM 0 HD1 HIS A 79 9.376 -0.037 -15.822 1.00 0.00 H new ATOM 0 HD2 HIS A 79 6.018 0.980 -13.533 1.00 0.00 H new ATOM 0 HE1 HIS A 79 7.343 -0.654 -17.218 1.00 0.00 H new ATOM 1226 N GLY A 80 10.932 0.719 -10.550 1.00 0.00 N ATOM 1227 CA GLY A 80 12.267 0.904 -10.011 1.00 0.00 C ATOM 1228 C GLY A 80 12.714 -0.264 -9.155 1.00 0.00 C ATOM 1229 O GLY A 80 13.455 -1.134 -9.615 1.00 0.00 O ATOM 0 H GLY A 80 10.176 1.030 -9.939 1.00 0.00 H new ATOM 0 HA2 GLY A 80 12.971 1.039 -10.832 1.00 0.00 H new ATOM 0 HA3 GLY A 80 12.292 1.817 -9.416 1.00 0.00 H new ATOM 1233 N LEU A 81 12.265 -0.284 -7.905 1.00 0.00 N ATOM 1234 CA LEU A 81 12.624 -1.353 -6.980 1.00 0.00 C ATOM 1235 C LEU A 81 12.354 -2.721 -7.598 1.00 0.00 C ATOM 1236 O LEU A 81 11.321 -2.935 -8.234 1.00 0.00 O ATOM 1237 CB LEU A 81 11.843 -1.208 -5.673 1.00 0.00 C ATOM 1238 CG LEU A 81 11.914 0.162 -4.997 1.00 0.00 C ATOM 1239 CD1 LEU A 81 11.011 0.201 -3.774 1.00 0.00 C ATOM 1240 CD2 LEU A 81 13.349 0.492 -4.612 1.00 0.00 C ATOM 0 H LEU A 81 11.652 0.428 -7.509 1.00 0.00 H new ATOM 0 HA LEU A 81 13.690 -1.274 -6.769 1.00 0.00 H new ATOM 0 HB2 LEU A 81 10.796 -1.439 -5.871 1.00 0.00 H new ATOM 0 HB3 LEU A 81 12.208 -1.957 -4.970 1.00 0.00 H new ATOM 0 HG LEU A 81 11.566 0.914 -5.705 1.00 0.00 H new ATOM 0 HD11 LEU A 81 11.075 1.183 -3.306 1.00 0.00 H new ATOM 0 HD12 LEU A 81 9.981 0.009 -4.076 1.00 0.00 H new ATOM 0 HD13 LEU A 81 11.329 -0.561 -3.062 1.00 0.00 H new ATOM 0 HD21 LEU A 81 13.381 1.470 -4.132 1.00 0.00 H new ATOM 0 HD22 LEU A 81 13.723 -0.263 -3.921 1.00 0.00 H new ATOM 0 HD23 LEU A 81 13.972 0.506 -5.507 1.00 0.00 H new ATOM 1252 N LYS A 82 13.287 -3.647 -7.405 1.00 0.00 N ATOM 1253 CA LYS A 82 13.150 -4.996 -7.939 1.00 0.00 C ATOM 1254 C LYS A 82 11.909 -5.681 -7.376 1.00 0.00 C ATOM 1255 O LYS A 82 11.089 -5.050 -6.709 1.00 0.00 O ATOM 1256 CB LYS A 82 14.395 -5.825 -7.614 1.00 0.00 C ATOM 1257 CG LYS A 82 14.605 -6.049 -6.127 1.00 0.00 C ATOM 1258 CD LYS A 82 15.432 -7.295 -5.862 1.00 0.00 C ATOM 1259 CE LYS A 82 14.557 -8.535 -5.763 1.00 0.00 C ATOM 1260 NZ LYS A 82 15.307 -9.702 -5.222 1.00 0.00 N ATOM 0 H LYS A 82 14.148 -3.487 -6.882 1.00 0.00 H new ATOM 0 HA LYS A 82 13.043 -4.922 -9.021 1.00 0.00 H new ATOM 0 HB2 LYS A 82 14.317 -6.792 -8.111 1.00 0.00 H new ATOM 0 HB3 LYS A 82 15.272 -5.325 -8.025 1.00 0.00 H new ATOM 0 HG2 LYS A 82 15.104 -5.182 -5.694 1.00 0.00 H new ATOM 0 HG3 LYS A 82 13.638 -6.141 -5.632 1.00 0.00 H new ATOM 0 HD2 LYS A 82 16.161 -7.426 -6.662 1.00 0.00 H new ATOM 0 HD3 LYS A 82 15.994 -7.170 -4.936 1.00 0.00 H new ATOM 0 HE2 LYS A 82 13.701 -8.325 -5.122 1.00 0.00 H new ATOM 0 HE3 LYS A 82 14.164 -8.782 -6.749 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 14.676 -10.527 -5.170 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 16.109 -9.919 -5.847 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 15.661 -9.476 -4.270 1.00 0.00 H new ATOM 1274 N SER A 83 11.778 -6.976 -7.647 1.00 0.00 N ATOM 1275 CA SER A 83 10.636 -7.745 -7.170 1.00 0.00 C ATOM 1276 C SER A 83 10.591 -7.762 -5.644 1.00 0.00 C ATOM 1277 O SER A 83 11.243 -8.584 -5.001 1.00 0.00 O ATOM 1278 CB SER A 83 10.699 -9.177 -7.704 1.00 0.00 C ATOM 1279 OG SER A 83 12.033 -9.654 -7.731 1.00 0.00 O ATOM 0 H SER A 83 12.449 -7.514 -8.195 1.00 0.00 H new ATOM 0 HA SER A 83 9.729 -7.266 -7.538 1.00 0.00 H new ATOM 0 HB2 SER A 83 10.089 -9.829 -7.078 1.00 0.00 H new ATOM 0 HB3 SER A 83 10.277 -9.213 -8.708 1.00 0.00 H new ATOM 0 HG SER A 83 12.045 -10.572 -8.075 1.00 0.00 H new ATOM 1285 N THR A 84 9.817 -6.845 -5.071 1.00 0.00 N ATOM 1286 CA THR A 84 9.688 -6.752 -3.623 1.00 0.00 C ATOM 1287 C THR A 84 8.391 -7.394 -3.144 1.00 0.00 C ATOM 1288 O THR A 84 7.481 -7.642 -3.936 1.00 0.00 O ATOM 1289 CB THR A 84 9.727 -5.286 -3.149 1.00 0.00 C ATOM 1290 OG1 THR A 84 10.508 -4.499 -4.055 1.00 0.00 O ATOM 1291 CG2 THR A 84 10.313 -5.187 -1.748 1.00 0.00 C ATOM 0 H THR A 84 9.270 -6.157 -5.588 1.00 0.00 H new ATOM 0 HA THR A 84 10.535 -7.288 -3.195 1.00 0.00 H new ATOM 0 HB THR A 84 8.706 -4.906 -3.127 1.00 0.00 H new ATOM 0 HG1 THR A 84 10.526 -3.569 -3.748 1.00 0.00 H new ATOM 0 HG21 THR A 84 10.331 -4.143 -1.434 1.00 0.00 H new ATOM 0 HG22 THR A 84 9.700 -5.764 -1.056 1.00 0.00 H new ATOM 0 HG23 THR A 84 11.329 -5.583 -1.750 1.00 0.00 H new ATOM 1299 N ASP A 85 8.311 -7.658 -1.846 1.00 0.00 N ATOM 1300 CA ASP A 85 7.123 -8.270 -1.261 1.00 0.00 C ATOM 1301 C ASP A 85 5.978 -7.266 -1.180 1.00 0.00 C ATOM 1302 O ASP A 85 4.812 -7.624 -1.344 1.00 0.00 O ATOM 1303 CB ASP A 85 7.437 -8.816 0.133 1.00 0.00 C ATOM 1304 CG ASP A 85 8.791 -9.496 0.196 1.00 0.00 C ATOM 1305 OD1 ASP A 85 9.724 -8.909 0.782 1.00 0.00 O ATOM 1306 OD2 ASP A 85 8.916 -10.617 -0.340 1.00 0.00 O ATOM 0 H ASP A 85 9.055 -7.458 -1.177 1.00 0.00 H new ATOM 0 HA ASP A 85 6.816 -9.094 -1.905 1.00 0.00 H new ATOM 0 HB2 ASP A 85 7.410 -8.000 0.855 1.00 0.00 H new ATOM 0 HB3 ASP A 85 6.663 -9.526 0.425 1.00 0.00 H new ATOM 1311 N VAL A 86 6.319 -6.006 -0.927 1.00 0.00 N ATOM 1312 CA VAL A 86 5.319 -4.949 -0.825 1.00 0.00 C ATOM 1313 C VAL A 86 4.652 -4.692 -2.172 1.00 0.00 C ATOM 1314 O VAL A 86 3.450 -4.437 -2.241 1.00 0.00 O ATOM 1315 CB VAL A 86 5.941 -3.636 -0.314 1.00 0.00 C ATOM 1316 CG1 VAL A 86 6.456 -3.806 1.107 1.00 0.00 C ATOM 1317 CG2 VAL A 86 7.057 -3.179 -1.242 1.00 0.00 C ATOM 0 H VAL A 86 7.280 -5.692 -0.789 1.00 0.00 H new ATOM 0 HA VAL A 86 4.570 -5.290 -0.111 1.00 0.00 H new ATOM 0 HB VAL A 86 5.168 -2.868 -0.305 1.00 0.00 H new ATOM 0 HG11 VAL A 86 6.892 -2.868 1.451 1.00 0.00 H new ATOM 0 HG12 VAL A 86 5.631 -4.084 1.762 1.00 0.00 H new ATOM 0 HG13 VAL A 86 7.215 -4.588 1.128 1.00 0.00 H new ATOM 0 HG21 VAL A 86 7.485 -2.250 -0.866 1.00 0.00 H new ATOM 0 HG22 VAL A 86 7.832 -3.945 -1.284 1.00 0.00 H new ATOM 0 HG23 VAL A 86 6.655 -3.015 -2.242 1.00 0.00 H new ATOM 1327 N ALA A 87 5.440 -4.764 -3.239 1.00 0.00 N ATOM 1328 CA ALA A 87 4.925 -4.541 -4.585 1.00 0.00 C ATOM 1329 C ALA A 87 3.999 -5.675 -5.013 1.00 0.00 C ATOM 1330 O ALA A 87 2.897 -5.436 -5.507 1.00 0.00 O ATOM 1331 CB ALA A 87 6.074 -4.395 -5.572 1.00 0.00 C ATOM 0 H ALA A 87 6.437 -4.975 -3.198 1.00 0.00 H new ATOM 0 HA ALA A 87 4.347 -3.617 -4.578 1.00 0.00 H new ATOM 0 HB1 ALA A 87 5.675 -4.229 -6.573 1.00 0.00 H new ATOM 0 HB2 ALA A 87 6.696 -3.547 -5.284 1.00 0.00 H new ATOM 0 HB3 ALA A 87 6.675 -5.304 -5.567 1.00 0.00 H new ATOM 1337 N LYS A 88 4.453 -6.908 -4.819 1.00 0.00 N ATOM 1338 CA LYS A 88 3.665 -8.079 -5.184 1.00 0.00 C ATOM 1339 C LYS A 88 2.400 -8.169 -4.337 1.00 0.00 C ATOM 1340 O LYS A 88 1.339 -8.560 -4.827 1.00 0.00 O ATOM 1341 CB LYS A 88 4.497 -9.353 -5.012 1.00 0.00 C ATOM 1342 CG LYS A 88 4.649 -9.790 -3.566 1.00 0.00 C ATOM 1343 CD LYS A 88 5.388 -11.114 -3.458 1.00 0.00 C ATOM 1344 CE LYS A 88 6.845 -10.975 -3.873 1.00 0.00 C ATOM 1345 NZ LYS A 88 7.723 -11.930 -3.141 1.00 0.00 N ATOM 0 H LYS A 88 5.363 -7.123 -4.411 1.00 0.00 H new ATOM 0 HA LYS A 88 3.375 -7.979 -6.230 1.00 0.00 H new ATOM 0 HB2 LYS A 88 4.033 -10.159 -5.579 1.00 0.00 H new ATOM 0 HB3 LYS A 88 5.486 -9.191 -5.440 1.00 0.00 H new ATOM 0 HG2 LYS A 88 5.189 -9.025 -3.008 1.00 0.00 H new ATOM 0 HG3 LYS A 88 3.664 -9.883 -3.108 1.00 0.00 H new ATOM 0 HD2 LYS A 88 5.334 -11.479 -2.432 1.00 0.00 H new ATOM 0 HD3 LYS A 88 4.899 -11.857 -4.087 1.00 0.00 H new ATOM 0 HE2 LYS A 88 6.935 -11.147 -4.945 1.00 0.00 H new ATOM 0 HE3 LYS A 88 7.181 -9.955 -3.685 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 8.534 -12.184 -3.740 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 8.065 -11.486 -2.265 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 7.184 -12.788 -2.906 1.00 0.00 H new ATOM 1359 N THR A 89 2.517 -7.804 -3.065 1.00 0.00 N ATOM 1360 CA THR A 89 1.383 -7.843 -2.150 1.00 0.00 C ATOM 1361 C THR A 89 0.326 -6.815 -2.540 1.00 0.00 C ATOM 1362 O THR A 89 -0.871 -7.104 -2.522 1.00 0.00 O ATOM 1363 CB THR A 89 1.822 -7.584 -0.697 1.00 0.00 C ATOM 1364 OG1 THR A 89 2.696 -8.629 -0.256 1.00 0.00 O ATOM 1365 CG2 THR A 89 0.617 -7.499 0.227 1.00 0.00 C ATOM 0 H THR A 89 3.387 -7.477 -2.644 1.00 0.00 H new ATOM 0 HA THR A 89 0.957 -8.844 -2.219 1.00 0.00 H new ATOM 0 HB THR A 89 2.350 -6.631 -0.665 1.00 0.00 H new ATOM 0 HG1 THR A 89 3.530 -8.596 -0.769 1.00 0.00 H new ATOM 0 HG21 THR A 89 0.953 -7.316 1.247 1.00 0.00 H new ATOM 0 HG22 THR A 89 -0.031 -6.683 -0.094 1.00 0.00 H new ATOM 0 HG23 THR A 89 0.064 -8.437 0.190 1.00 0.00 H new ATOM 1373 N PHE A 90 0.776 -5.616 -2.894 1.00 0.00 N ATOM 1374 CA PHE A 90 -0.132 -4.545 -3.289 1.00 0.00 C ATOM 1375 C PHE A 90 -0.866 -4.902 -4.578 1.00 0.00 C ATOM 1376 O PHE A 90 -2.095 -4.940 -4.614 1.00 0.00 O ATOM 1377 CB PHE A 90 0.640 -3.237 -3.474 1.00 0.00 C ATOM 1378 CG PHE A 90 -0.143 -2.176 -4.191 1.00 0.00 C ATOM 1379 CD1 PHE A 90 -0.880 -1.240 -3.483 1.00 0.00 C ATOM 1380 CD2 PHE A 90 -0.142 -2.113 -5.576 1.00 0.00 C ATOM 1381 CE1 PHE A 90 -1.602 -0.262 -4.140 1.00 0.00 C ATOM 1382 CE2 PHE A 90 -0.862 -1.136 -6.239 1.00 0.00 C ATOM 1383 CZ PHE A 90 -1.593 -0.211 -5.521 1.00 0.00 C ATOM 0 H PHE A 90 1.763 -5.361 -2.916 1.00 0.00 H new ATOM 0 HA PHE A 90 -0.869 -4.416 -2.496 1.00 0.00 H new ATOM 0 HB2 PHE A 90 0.938 -2.859 -2.496 1.00 0.00 H new ATOM 0 HB3 PHE A 90 1.555 -3.440 -4.030 1.00 0.00 H new ATOM 0 HD1 PHE A 90 -0.890 -1.275 -2.404 1.00 0.00 H new ATOM 0 HD2 PHE A 90 0.427 -2.835 -6.143 1.00 0.00 H new ATOM 0 HE1 PHE A 90 -2.172 0.461 -3.575 1.00 0.00 H new ATOM 0 HE2 PHE A 90 -0.852 -1.097 -7.318 1.00 0.00 H new ATOM 0 HZ PHE A 90 -2.157 0.551 -6.038 1.00 0.00 H new ATOM 1393 N ARG A 91 -0.101 -5.161 -5.635 1.00 0.00 N ATOM 1394 CA ARG A 91 -0.679 -5.512 -6.926 1.00 0.00 C ATOM 1395 C ARG A 91 -1.669 -6.666 -6.784 1.00 0.00 C ATOM 1396 O ARG A 91 -2.775 -6.618 -7.322 1.00 0.00 O ATOM 1397 CB ARG A 91 0.425 -5.893 -7.915 1.00 0.00 C ATOM 1398 CG ARG A 91 0.224 -5.312 -9.305 1.00 0.00 C ATOM 1399 CD ARG A 91 1.411 -5.608 -10.209 1.00 0.00 C ATOM 1400 NE ARG A 91 1.195 -5.123 -11.570 1.00 0.00 N ATOM 1401 CZ ARG A 91 1.883 -5.555 -12.622 1.00 0.00 C ATOM 1402 NH1 ARG A 91 2.824 -6.477 -12.469 1.00 0.00 N ATOM 1403 NH2 ARG A 91 1.629 -5.066 -13.828 1.00 0.00 N ATOM 0 H ARG A 91 0.919 -5.134 -5.622 1.00 0.00 H new ATOM 0 HA ARG A 91 -1.214 -4.641 -7.305 1.00 0.00 H new ATOM 0 HB2 ARG A 91 1.384 -5.554 -7.524 1.00 0.00 H new ATOM 0 HB3 ARG A 91 0.476 -6.979 -7.988 1.00 0.00 H new ATOM 0 HG2 ARG A 91 -0.683 -5.726 -9.746 1.00 0.00 H new ATOM 0 HG3 ARG A 91 0.080 -4.234 -9.233 1.00 0.00 H new ATOM 0 HD2 ARG A 91 2.306 -5.143 -9.796 1.00 0.00 H new ATOM 0 HD3 ARG A 91 1.591 -6.683 -10.231 1.00 0.00 H new ATOM 0 HE ARG A 91 0.477 -4.414 -11.721 1.00 0.00 H new ATOM 0 HH11 ARG A 91 3.021 -6.856 -11.543 1.00 0.00 H new ATOM 0 HH12 ARG A 91 3.351 -6.807 -13.278 1.00 0.00 H new ATOM 0 HH21 ARG A 91 0.905 -4.358 -13.949 1.00 0.00 H new ATOM 0 HH22 ARG A 91 2.158 -5.398 -14.635 1.00 0.00 H new ATOM 1417 N LYS A 92 -1.263 -7.700 -6.056 1.00 0.00 N ATOM 1418 CA LYS A 92 -2.113 -8.865 -5.841 1.00 0.00 C ATOM 1419 C LYS A 92 -3.336 -8.500 -5.005 1.00 0.00 C ATOM 1420 O LYS A 92 -4.472 -8.625 -5.462 1.00 0.00 O ATOM 1421 CB LYS A 92 -1.323 -9.979 -5.150 1.00 0.00 C ATOM 1422 CG LYS A 92 -0.426 -10.764 -6.092 1.00 0.00 C ATOM 1423 CD LYS A 92 -0.298 -12.214 -5.660 1.00 0.00 C ATOM 1424 CE LYS A 92 -0.114 -13.137 -6.855 1.00 0.00 C ATOM 1425 NZ LYS A 92 0.910 -14.186 -6.593 1.00 0.00 N ATOM 0 H LYS A 92 -0.350 -7.755 -5.605 1.00 0.00 H new ATOM 0 HA LYS A 92 -2.453 -9.220 -6.814 1.00 0.00 H new ATOM 0 HB2 LYS A 92 -0.712 -9.543 -4.359 1.00 0.00 H new ATOM 0 HB3 LYS A 92 -2.022 -10.665 -4.671 1.00 0.00 H new ATOM 0 HG2 LYS A 92 -0.831 -10.719 -7.103 1.00 0.00 H new ATOM 0 HG3 LYS A 92 0.562 -10.304 -6.123 1.00 0.00 H new ATOM 0 HD2 LYS A 92 0.550 -12.320 -4.983 1.00 0.00 H new ATOM 0 HD3 LYS A 92 -1.188 -12.509 -5.104 1.00 0.00 H new ATOM 0 HE2 LYS A 92 -1.065 -13.611 -7.098 1.00 0.00 H new ATOM 0 HE3 LYS A 92 0.181 -12.550 -7.725 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 1.006 -14.794 -7.431 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 1.824 -13.735 -6.386 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 0.616 -14.762 -5.779 1.00 0.00 H new ATOM 1439 N ALA A 93 -3.094 -8.047 -3.779 1.00 0.00 N ATOM 1440 CA ALA A 93 -4.176 -7.661 -2.881 1.00 0.00 C ATOM 1441 C ALA A 93 -5.164 -6.734 -3.579 1.00 0.00 C ATOM 1442 O ALA A 93 -6.360 -7.019 -3.639 1.00 0.00 O ATOM 1443 CB ALA A 93 -3.614 -6.995 -1.634 1.00 0.00 C ATOM 0 H ALA A 93 -2.159 -7.938 -3.385 1.00 0.00 H new ATOM 0 HA ALA A 93 -4.711 -8.564 -2.587 1.00 0.00 H new ATOM 0 HB1 ALA A 93 -4.433 -6.712 -0.972 1.00 0.00 H new ATOM 0 HB2 ALA A 93 -2.953 -7.690 -1.117 1.00 0.00 H new ATOM 0 HB3 ALA A 93 -3.053 -6.105 -1.918 1.00 0.00 H new ATOM 1449 N ILE A 94 -4.657 -5.624 -4.104 1.00 0.00 N ATOM 1450 CA ILE A 94 -5.496 -4.654 -4.798 1.00 0.00 C ATOM 1451 C ILE A 94 -6.265 -5.311 -5.939 1.00 0.00 C ATOM 1452 O ILE A 94 -7.318 -4.827 -6.351 1.00 0.00 O ATOM 1453 CB ILE A 94 -4.663 -3.487 -5.359 1.00 0.00 C ATOM 1454 CG1 ILE A 94 -5.408 -2.164 -5.173 1.00 0.00 C ATOM 1455 CG2 ILE A 94 -4.347 -3.722 -6.829 1.00 0.00 C ATOM 1456 CD1 ILE A 94 -4.660 -1.165 -4.317 1.00 0.00 C ATOM 0 H ILE A 94 -3.669 -5.374 -4.062 1.00 0.00 H new ATOM 0 HA ILE A 94 -6.201 -4.264 -4.064 1.00 0.00 H new ATOM 0 HB ILE A 94 -3.723 -3.433 -4.809 1.00 0.00 H new ATOM 0 HG12 ILE A 94 -5.597 -1.722 -6.151 1.00 0.00 H new ATOM 0 HG13 ILE A 94 -6.379 -2.364 -4.720 1.00 0.00 H new ATOM 0 HG21 ILE A 94 -3.758 -2.889 -7.212 1.00 0.00 H new ATOM 0 HG22 ILE A 94 -3.780 -4.647 -6.936 1.00 0.00 H new ATOM 0 HG23 ILE A 94 -5.276 -3.799 -7.393 1.00 0.00 H new ATOM 0 HD11 ILE A 94 -5.247 -0.251 -4.228 1.00 0.00 H new ATOM 0 HD12 ILE A 94 -4.494 -1.587 -3.326 1.00 0.00 H new ATOM 0 HD13 ILE A 94 -3.700 -0.936 -4.780 1.00 0.00 H new ATOM 1468 N ASN A 95 -5.730 -6.418 -6.446 1.00 0.00 N ATOM 1469 CA ASN A 95 -6.367 -7.143 -7.539 1.00 0.00 C ATOM 1470 C ASN A 95 -7.234 -8.280 -7.007 1.00 0.00 C ATOM 1471 O ASN A 95 -7.516 -9.245 -7.717 1.00 0.00 O ATOM 1472 CB ASN A 95 -5.309 -7.698 -8.495 1.00 0.00 C ATOM 1473 CG ASN A 95 -4.850 -6.668 -9.510 1.00 0.00 C ATOM 1474 OD1 ASN A 95 -5.549 -5.692 -9.780 1.00 0.00 O ATOM 1475 ND2 ASN A 95 -3.669 -6.884 -10.078 1.00 0.00 N ATOM 0 H ASN A 95 -4.858 -6.832 -6.117 1.00 0.00 H new ATOM 0 HA ASN A 95 -7.007 -6.445 -8.080 1.00 0.00 H new ATOM 0 HB2 ASN A 95 -4.450 -8.046 -7.920 1.00 0.00 H new ATOM 0 HB3 ASN A 95 -5.714 -8.564 -9.018 1.00 0.00 H new ATOM 0 HD21 ASN A 95 -3.308 -6.227 -10.769 1.00 0.00 H new ATOM 0 HD22 ASN A 95 -3.123 -7.707 -9.823 1.00 0.00 H new ATOM 1482 N LYS A 96 -7.655 -8.158 -5.753 1.00 0.00 N ATOM 1483 CA LYS A 96 -8.491 -9.174 -5.123 1.00 0.00 C ATOM 1484 C LYS A 96 -7.790 -10.529 -5.117 1.00 0.00 C ATOM 1485 O LYS A 96 -8.429 -11.570 -4.966 1.00 0.00 O ATOM 1486 CB LYS A 96 -9.831 -9.284 -5.855 1.00 0.00 C ATOM 1487 CG LYS A 96 -10.786 -8.143 -5.551 1.00 0.00 C ATOM 1488 CD LYS A 96 -11.927 -8.594 -4.656 1.00 0.00 C ATOM 1489 CE LYS A 96 -12.558 -7.420 -3.923 1.00 0.00 C ATOM 1490 NZ LYS A 96 -13.715 -7.844 -3.086 1.00 0.00 N ATOM 0 H LYS A 96 -7.431 -7.365 -5.152 1.00 0.00 H new ATOM 0 HA LYS A 96 -8.670 -8.874 -4.091 1.00 0.00 H new ATOM 0 HB2 LYS A 96 -9.647 -9.316 -6.929 1.00 0.00 H new ATOM 0 HB3 LYS A 96 -10.307 -10.227 -5.585 1.00 0.00 H new ATOM 0 HG2 LYS A 96 -10.242 -7.331 -5.068 1.00 0.00 H new ATOM 0 HG3 LYS A 96 -11.189 -7.746 -6.483 1.00 0.00 H new ATOM 0 HD2 LYS A 96 -12.684 -9.099 -5.256 1.00 0.00 H new ATOM 0 HD3 LYS A 96 -11.558 -9.320 -3.932 1.00 0.00 H new ATOM 0 HE2 LYS A 96 -11.809 -6.942 -3.292 1.00 0.00 H new ATOM 0 HE3 LYS A 96 -12.888 -6.675 -4.647 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 -14.117 -7.015 -2.603 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 -14.441 -8.278 -3.691 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 -13.396 -8.536 -2.378 1.00 0.00 H new ATOM 1504 N LYS A 97 -6.471 -10.508 -5.281 1.00 0.00 N ATOM 1505 CA LYS A 97 -5.682 -11.734 -5.291 1.00 0.00 C ATOM 1506 C LYS A 97 -6.076 -12.625 -6.464 1.00 0.00 C ATOM 1507 O LYS A 97 -6.157 -13.841 -6.295 1.00 0.00 O ATOM 1508 CB LYS A 97 -5.865 -12.493 -3.975 1.00 0.00 C ATOM 1509 CG LYS A 97 -5.668 -11.630 -2.741 1.00 0.00 C ATOM 1510 CD LYS A 97 -5.260 -12.463 -1.537 1.00 0.00 C ATOM 1511 CE LYS A 97 -5.601 -11.760 -0.232 1.00 0.00 C ATOM 1512 NZ LYS A 97 -5.398 -12.648 0.946 1.00 0.00 N ATOM 0 H LYS A 97 -5.926 -9.655 -5.409 1.00 0.00 H new ATOM 0 HA LYS A 97 -4.633 -11.461 -5.402 1.00 0.00 H new ATOM 0 HB2 LYS A 97 -6.866 -12.924 -3.950 1.00 0.00 H new ATOM 0 HB3 LYS A 97 -5.160 -13.323 -3.943 1.00 0.00 H new ATOM 0 HG2 LYS A 97 -4.904 -10.878 -2.940 1.00 0.00 H new ATOM 0 HG3 LYS A 97 -6.591 -11.095 -2.519 1.00 0.00 H new ATOM 0 HD2 LYS A 97 -5.764 -13.429 -1.574 1.00 0.00 H new ATOM 0 HD3 LYS A 97 -4.189 -12.661 -1.576 1.00 0.00 H new ATOM 0 HE2 LYS A 97 -4.981 -10.870 -0.127 1.00 0.00 H new ATOM 0 HE3 LYS A 97 -6.638 -11.425 -0.260 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 -6.271 -12.682 1.510 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 -5.158 -13.606 0.621 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 -4.622 -12.277 1.531 1.00 0.00 H new TER 1526 LYS A 97 HETATM 1527 CA CA A 101 -7.516 7.754 -1.565 1.00 0.00 CA HETATM 1528 CA CA A 102 3.871 12.970 -2.601 1.00 0.00 CA