USER MOD reduce.3.24.130724 H: found=0, std=0, add=1025, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 1024 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 94 HIS : no HD1:sc=-0.00422 X(o=0.049,f=0.053) USER MOD Set 1.2: A 95 ASN : amide:sc= 0.0534 K(o=0.049,f=-1.1) USER MOD Set 2.1: A 19 MET CE :methyl -118:sc= -1.29 (180deg=-0.791) USER MOD Set 2.2: A 115 MET CE :methyl 143:sc= -1.44 (180deg=-1.72) USER MOD Single : A 9 GLN : amide:sc=-0.00569 X(o=-0.0057,f=-0.42) USER MOD Single : A 10 GLN :FLIP amide:sc= -0.15 F(o=-1.3,f=-0.15) USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 GLN : amide:sc= -0.848 K(o=-0.85,f=-1.5) USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 41 SER OG : rot -149:sc= -1.61 USER MOD Single : A 42 SER OG : rot 180:sc= 0 USER MOD Single : A 44 ASN : amide:sc= -0.133 K(o=-0.13,f=-1.7) USER MOD Single : A 55 LYS NZ :NH3+ -162:sc= 1.4 (180deg=0.715) USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 SER OG : rot 180:sc= 0 USER MOD Single : A 67 GLN : amide:sc= -0.47 X(o=-0.47,f=-0.021) USER MOD Single : A 71 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 80 SER OG : rot 180:sc= 0 USER MOD Single : A 83 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 86 SER OG : rot 180:sc= 0 USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 SER OG : rot 180:sc= -0.146 USER MOD Single : A 89 TYR OH : rot 117:sc= 0.0621 USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 92 THR OG1 : rot 170:sc= 0 USER MOD Single : A 93 THR OG1 : rot -76:sc= 0.0165 USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 102 TYR OH : rot 180:sc= 0 USER MOD Single : A 103 THR OG1 : rot -134:sc= 0.0114 USER MOD Single : A 108 GLN :FLIP amide:sc= -1.06 F(o=-1.8!,f=-1.1) USER MOD Single : A 110 HIS : no HD1:sc= 0 X(o=0,f=-0.021) USER MOD Single : A 112 TYR OH : rot 180:sc= 0 USER MOD Single : A 113 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 116 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 117 SER OG : rot 180:sc= 0.00394 USER MOD Single : A 119 SER OG : rot 180:sc=-0.00766 USER MOD Single : A 120 TYR OH : rot 180:sc= 0.225 USER MOD Single : A 126 SER OG : rot 177:sc= 0.214 USER MOD Single : A 127 SER OG : rot 180:sc= 0 USER MOD Single : A 129 TYR OH : rot 175:sc= -1.79 USER MOD Single : A 130 GLN : amide:sc= -0.0589 K(o=-0.059,f=-1.7!) USER MOD ----------------------------------------------------------------- ATOM 77 N GLN A 9 -18.579 8.080 2.260 1.00 0.00 N ATOM 78 CA GLN A 9 -18.903 7.547 0.942 1.00 0.00 C ATOM 79 C GLN A 9 -18.228 8.362 -0.156 1.00 0.00 C ATOM 80 O GLN A 9 -17.708 7.806 -1.123 1.00 0.00 O ATOM 81 CB GLN A 9 -20.418 7.541 0.730 1.00 0.00 C ATOM 82 CG GLN A 9 -20.842 6.980 -0.618 1.00 0.00 C ATOM 83 CD GLN A 9 -22.285 6.518 -0.630 1.00 0.00 C ATOM 84 OE1 GLN A 9 -22.702 5.723 0.214 1.00 0.00 O ATOM 85 NE2 GLN A 9 -23.058 7.013 -1.590 1.00 0.00 N ATOM 0 HA GLN A 9 -18.531 6.524 0.890 1.00 0.00 H new ATOM 0 HB2 GLN A 9 -20.885 6.954 1.521 1.00 0.00 H new ATOM 0 HB3 GLN A 9 -20.794 8.560 0.825 1.00 0.00 H new ATOM 0 HG2 GLN A 9 -20.702 7.742 -1.385 1.00 0.00 H new ATOM 0 HG3 GLN A 9 -20.194 6.143 -0.879 1.00 0.00 H new ATOM 0 HE21 GLN A 9 -22.671 7.669 -2.269 1.00 0.00 H new ATOM 0 HE22 GLN A 9 -24.038 6.737 -1.649 1.00 0.00 H new ATOM 94 N GLN A 10 -18.240 9.682 0.001 1.00 0.00 N ATOM 95 CA GLN A 10 -17.629 10.572 -0.979 1.00 0.00 C ATOM 96 C GLN A 10 -16.111 10.422 -0.979 1.00 0.00 C ATOM 97 O GLN A 10 -15.490 10.304 -2.035 1.00 0.00 O ATOM 98 CB GLN A 10 -18.010 12.025 -0.686 1.00 0.00 C ATOM 99 CG GLN A 10 -19.511 12.264 -0.643 1.00 0.00 C ATOM 100 CD GLN A 10 -20.242 11.585 -1.784 1.00 0.00 C ATOM 101 OE1 GLN A 10 -20.630 10.332 -1.576 1.00 0.00 O flip ATOM 102 NE2 GLN A 10 -20.457 12.179 -2.841 1.00 0.00 N flip ATOM 0 H GLN A 10 -18.666 10.158 0.796 1.00 0.00 H new ATOM 0 HA GLN A 10 -18.003 10.297 -1.965 1.00 0.00 H new ATOM 0 HB2 GLN A 10 -17.576 12.320 0.269 1.00 0.00 H new ATOM 0 HB3 GLN A 10 -17.570 12.668 -1.448 1.00 0.00 H new ATOM 0 HG2 GLN A 10 -19.906 11.899 0.305 1.00 0.00 H new ATOM 0 HG3 GLN A 10 -19.706 13.336 -0.678 1.00 0.00 H new ATOM 0 HE21 GLN A 10 -20.141 13.142 -2.958 1.00 0.00 H new ATOM 0 HE22 GLN A 10 -20.951 11.708 -3.599 1.00 0.00 H new ATOM 111 N ARG A 11 -15.521 10.429 0.211 1.00 0.00 N ATOM 112 CA ARG A 11 -14.076 10.295 0.348 1.00 0.00 C ATOM 113 C ARG A 11 -13.585 9.007 -0.306 1.00 0.00 C ATOM 114 O ARG A 11 -12.697 9.030 -1.159 1.00 0.00 O ATOM 115 CB ARG A 11 -13.678 10.314 1.825 1.00 0.00 C ATOM 116 CG ARG A 11 -12.287 10.875 2.074 1.00 0.00 C ATOM 117 CD ARG A 11 -12.178 11.499 3.457 1.00 0.00 C ATOM 118 NE ARG A 11 -11.983 10.494 4.497 1.00 0.00 N ATOM 119 CZ ARG A 11 -12.442 10.621 5.737 1.00 0.00 C ATOM 120 NH1 ARG A 11 -13.120 11.704 6.089 1.00 0.00 N ATOM 121 NH2 ARG A 11 -12.224 9.662 6.628 1.00 0.00 N ATOM 0 H ARG A 11 -16.021 10.526 1.095 1.00 0.00 H new ATOM 0 HA ARG A 11 -13.609 11.140 -0.158 1.00 0.00 H new ATOM 0 HB2 ARG A 11 -14.404 10.907 2.381 1.00 0.00 H new ATOM 0 HB3 ARG A 11 -13.727 9.299 2.219 1.00 0.00 H new ATOM 0 HG2 ARG A 11 -11.549 10.079 1.973 1.00 0.00 H new ATOM 0 HG3 ARG A 11 -12.054 11.623 1.316 1.00 0.00 H new ATOM 0 HD2 ARG A 11 -11.346 12.203 3.472 1.00 0.00 H new ATOM 0 HD3 ARG A 11 -13.082 12.070 3.669 1.00 0.00 H new ATOM 0 HE ARG A 11 -11.466 9.648 4.259 1.00 0.00 H new ATOM 0 HH11 ARG A 11 -13.291 12.443 5.407 1.00 0.00 H new ATOM 0 HH12 ARG A 11 -13.471 11.799 7.042 1.00 0.00 H new ATOM 0 HH21 ARG A 11 -11.704 8.826 6.361 1.00 0.00 H new ATOM 0 HH22 ARG A 11 -12.577 9.760 7.580 1.00 0.00 H new ATOM 135 N VAL A 12 -14.168 7.884 0.100 1.00 0.00 N ATOM 136 CA VAL A 12 -13.791 6.586 -0.447 1.00 0.00 C ATOM 137 C VAL A 12 -13.601 6.660 -1.958 1.00 0.00 C ATOM 138 O VAL A 12 -12.517 6.386 -2.473 1.00 0.00 O ATOM 139 CB VAL A 12 -14.848 5.513 -0.125 1.00 0.00 C ATOM 140 CG1 VAL A 12 -14.442 4.170 -0.712 1.00 0.00 C ATOM 141 CG2 VAL A 12 -15.058 5.406 1.377 1.00 0.00 C ATOM 0 H VAL A 12 -14.903 7.847 0.806 1.00 0.00 H new ATOM 0 HA VAL A 12 -12.847 6.307 0.021 1.00 0.00 H new ATOM 0 HB VAL A 12 -15.793 5.811 -0.580 1.00 0.00 H new ATOM 0 HG11 VAL A 12 -15.201 3.425 -0.474 1.00 0.00 H new ATOM 0 HG12 VAL A 12 -14.348 4.259 -1.794 1.00 0.00 H new ATOM 0 HG13 VAL A 12 -13.486 3.862 -0.289 1.00 0.00 H new ATOM 0 HG21 VAL A 12 -15.808 4.643 1.586 1.00 0.00 H new ATOM 0 HG22 VAL A 12 -14.118 5.132 1.857 1.00 0.00 H new ATOM 0 HG23 VAL A 12 -15.398 6.366 1.766 1.00 0.00 H new ATOM 151 N LYS A 13 -14.663 7.033 -2.664 1.00 0.00 N ATOM 152 CA LYS A 13 -14.614 7.145 -4.117 1.00 0.00 C ATOM 153 C LYS A 13 -13.398 7.953 -4.560 1.00 0.00 C ATOM 154 O LYS A 13 -12.714 7.588 -5.517 1.00 0.00 O ATOM 155 CB LYS A 13 -15.893 7.801 -4.641 1.00 0.00 C ATOM 156 CG LYS A 13 -16.247 7.395 -6.062 1.00 0.00 C ATOM 157 CD LYS A 13 -17.727 7.590 -6.345 1.00 0.00 C ATOM 158 CE LYS A 13 -18.063 7.278 -7.795 1.00 0.00 C ATOM 159 NZ LYS A 13 -19.528 7.347 -8.053 1.00 0.00 N ATOM 0 H LYS A 13 -15.568 7.263 -2.254 1.00 0.00 H new ATOM 0 HA LYS A 13 -14.531 6.140 -4.531 1.00 0.00 H new ATOM 0 HB2 LYS A 13 -16.721 7.542 -3.981 1.00 0.00 H new ATOM 0 HB3 LYS A 13 -15.779 8.884 -4.599 1.00 0.00 H new ATOM 0 HG2 LYS A 13 -15.660 7.984 -6.767 1.00 0.00 H new ATOM 0 HG3 LYS A 13 -15.980 6.350 -6.220 1.00 0.00 H new ATOM 0 HD2 LYS A 13 -18.312 6.946 -5.688 1.00 0.00 H new ATOM 0 HD3 LYS A 13 -18.010 8.618 -6.118 1.00 0.00 H new ATOM 0 HE2 LYS A 13 -17.546 7.982 -8.447 1.00 0.00 H new ATOM 0 HE3 LYS A 13 -17.697 6.283 -8.046 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 -19.715 7.128 -9.052 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 -20.020 6.657 -7.449 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 -19.874 8.304 -7.838 1.00 0.00 H new ATOM 173 N ARG A 14 -13.134 9.049 -3.857 1.00 0.00 N ATOM 174 CA ARG A 14 -12.000 9.908 -4.179 1.00 0.00 C ATOM 175 C ARG A 14 -10.704 9.103 -4.224 1.00 0.00 C ATOM 176 O ARG A 14 -9.907 9.243 -5.152 1.00 0.00 O ATOM 177 CB ARG A 14 -11.877 11.033 -3.150 1.00 0.00 C ATOM 178 CG ARG A 14 -11.012 12.192 -3.615 1.00 0.00 C ATOM 179 CD ARG A 14 -11.774 13.115 -4.553 1.00 0.00 C ATOM 180 NE ARG A 14 -10.923 14.173 -5.091 1.00 0.00 N ATOM 181 CZ ARG A 14 -11.381 15.358 -5.480 1.00 0.00 C ATOM 182 NH1 ARG A 14 -12.675 15.634 -5.392 1.00 0.00 N ATOM 183 NH2 ARG A 14 -10.545 16.270 -5.958 1.00 0.00 N ATOM 0 H ARG A 14 -13.689 9.363 -3.061 1.00 0.00 H new ATOM 0 HA ARG A 14 -12.173 10.342 -5.164 1.00 0.00 H new ATOM 0 HB2 ARG A 14 -12.873 11.407 -2.912 1.00 0.00 H new ATOM 0 HB3 ARG A 14 -11.460 10.627 -2.228 1.00 0.00 H new ATOM 0 HG2 ARG A 14 -10.664 12.757 -2.750 1.00 0.00 H new ATOM 0 HG3 ARG A 14 -10.127 11.807 -4.122 1.00 0.00 H new ATOM 0 HD2 ARG A 14 -12.191 12.533 -5.374 1.00 0.00 H new ATOM 0 HD3 ARG A 14 -12.613 13.561 -4.020 1.00 0.00 H new ATOM 0 HE ARG A 14 -9.922 13.992 -5.173 1.00 0.00 H new ATOM 0 HH11 ARG A 14 -13.322 14.936 -5.025 1.00 0.00 H new ATOM 0 HH12 ARG A 14 -13.024 16.545 -5.691 1.00 0.00 H new ATOM 0 HH21 ARG A 14 -9.549 16.062 -6.027 1.00 0.00 H new ATOM 0 HH22 ARG A 14 -10.898 17.179 -6.256 1.00 0.00 H new ATOM 197 N TRP A 15 -10.502 8.260 -3.218 1.00 0.00 N ATOM 198 CA TRP A 15 -9.303 7.433 -3.144 1.00 0.00 C ATOM 199 C TRP A 15 -8.898 6.935 -4.527 1.00 0.00 C ATOM 200 O TRP A 15 -7.712 6.810 -4.829 1.00 0.00 O ATOM 201 CB TRP A 15 -9.535 6.246 -2.208 1.00 0.00 C ATOM 202 CG TRP A 15 -9.815 6.651 -0.792 1.00 0.00 C ATOM 203 CD1 TRP A 15 -9.489 7.837 -0.199 1.00 0.00 C ATOM 204 CD2 TRP A 15 -10.477 5.869 0.208 1.00 0.00 C ATOM 205 NE1 TRP A 15 -9.908 7.839 1.109 1.00 0.00 N ATOM 206 CE2 TRP A 15 -10.518 6.644 1.383 1.00 0.00 C ATOM 207 CE3 TRP A 15 -11.042 4.590 0.224 1.00 0.00 C ATOM 208 CZ2 TRP A 15 -11.099 6.180 2.560 1.00 0.00 C ATOM 209 CZ3 TRP A 15 -11.618 4.132 1.393 1.00 0.00 C ATOM 210 CH2 TRP A 15 -11.644 4.925 2.548 1.00 0.00 C ATOM 0 H TRP A 15 -11.152 8.131 -2.443 1.00 0.00 H new ATOM 0 HA TRP A 15 -8.493 8.046 -2.748 1.00 0.00 H new ATOM 0 HB2 TRP A 15 -10.372 5.656 -2.582 1.00 0.00 H new ATOM 0 HB3 TRP A 15 -8.657 5.601 -2.227 1.00 0.00 H new ATOM 0 HD1 TRP A 15 -8.977 8.653 -0.687 1.00 0.00 H new ATOM 0 HE1 TRP A 15 -9.785 8.606 1.769 1.00 0.00 H new ATOM 0 HE3 TRP A 15 -11.028 3.972 -0.661 1.00 0.00 H new ATOM 0 HZ2 TRP A 15 -11.119 6.789 3.451 1.00 0.00 H new ATOM 0 HZ3 TRP A 15 -12.056 3.145 1.417 1.00 0.00 H new ATOM 0 HH2 TRP A 15 -12.103 4.538 3.446 1.00 0.00 H new ATOM 221 N GLY A 16 -9.892 6.652 -5.363 1.00 0.00 N ATOM 222 CA GLY A 16 -9.618 6.170 -6.705 1.00 0.00 C ATOM 223 C GLY A 16 -8.960 7.222 -7.575 1.00 0.00 C ATOM 224 O GLY A 16 -8.172 8.035 -7.090 1.00 0.00 O ATOM 0 H GLY A 16 -10.882 6.748 -5.136 1.00 0.00 H new ATOM 0 HA2 GLY A 16 -8.972 5.294 -6.648 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -10.550 5.849 -7.170 1.00 0.00 H new ATOM 228 N PHE A 17 -9.281 7.208 -8.864 1.00 0.00 N ATOM 229 CA PHE A 17 -8.713 8.166 -9.805 1.00 0.00 C ATOM 230 C PHE A 17 -7.193 8.211 -9.684 1.00 0.00 C ATOM 231 O PHE A 17 -6.577 9.264 -9.846 1.00 0.00 O ATOM 232 CB PHE A 17 -9.297 9.559 -9.561 1.00 0.00 C ATOM 233 CG PHE A 17 -10.753 9.543 -9.195 1.00 0.00 C ATOM 234 CD1 PHE A 17 -11.657 8.791 -9.928 1.00 0.00 C ATOM 235 CD2 PHE A 17 -11.219 10.280 -8.118 1.00 0.00 C ATOM 236 CE1 PHE A 17 -12.999 8.774 -9.594 1.00 0.00 C ATOM 237 CE2 PHE A 17 -12.558 10.267 -7.779 1.00 0.00 C ATOM 238 CZ PHE A 17 -13.450 9.513 -8.518 1.00 0.00 C ATOM 0 H PHE A 17 -9.932 6.543 -9.281 1.00 0.00 H new ATOM 0 HA PHE A 17 -8.970 7.843 -10.814 1.00 0.00 H new ATOM 0 HB2 PHE A 17 -8.735 10.045 -8.763 1.00 0.00 H new ATOM 0 HB3 PHE A 17 -9.163 10.163 -10.459 1.00 0.00 H new ATOM 0 HD1 PHE A 17 -11.309 8.211 -10.770 1.00 0.00 H new ATOM 0 HD2 PHE A 17 -10.527 10.872 -7.537 1.00 0.00 H new ATOM 0 HE1 PHE A 17 -13.693 8.184 -10.174 1.00 0.00 H new ATOM 0 HE2 PHE A 17 -12.908 10.846 -6.937 1.00 0.00 H new ATOM 0 HZ PHE A 17 -14.497 9.502 -8.255 1.00 0.00 H new ATOM 248 N GLY A 18 -6.593 7.060 -9.397 1.00 0.00 N ATOM 249 CA GLY A 18 -5.150 6.989 -9.258 1.00 0.00 C ATOM 250 C GLY A 18 -4.706 6.998 -7.808 1.00 0.00 C ATOM 251 O GLY A 18 -5.242 7.748 -6.993 1.00 0.00 O ATOM 0 H GLY A 18 -7.081 6.175 -9.258 1.00 0.00 H new ATOM 0 HA2 GLY A 18 -4.786 6.082 -9.741 1.00 0.00 H new ATOM 0 HA3 GLY A 18 -4.696 7.832 -9.779 1.00 0.00 H new ATOM 255 N MET A 19 -3.726 6.161 -7.486 1.00 0.00 N ATOM 256 CA MET A 19 -3.210 6.075 -6.125 1.00 0.00 C ATOM 257 C MET A 19 -3.110 7.460 -5.494 1.00 0.00 C ATOM 258 O MET A 19 -3.387 7.633 -4.306 1.00 0.00 O ATOM 259 CB MET A 19 -1.839 5.398 -6.117 1.00 0.00 C ATOM 260 CG MET A 19 -1.311 5.110 -4.721 1.00 0.00 C ATOM 261 SD MET A 19 0.107 3.996 -4.730 1.00 0.00 S ATOM 262 CE MET A 19 1.286 4.957 -5.677 1.00 0.00 C ATOM 0 H MET A 19 -3.273 5.532 -8.149 1.00 0.00 H new ATOM 0 HA MET A 19 -3.905 5.476 -5.537 1.00 0.00 H new ATOM 0 HB2 MET A 19 -1.902 4.462 -6.673 1.00 0.00 H new ATOM 0 HB3 MET A 19 -1.126 6.034 -6.642 1.00 0.00 H new ATOM 0 HG2 MET A 19 -1.028 6.048 -4.243 1.00 0.00 H new ATOM 0 HG3 MET A 19 -2.107 4.673 -4.119 1.00 0.00 H new ATOM 0 HE1 MET A 19 1.546 4.418 -6.588 1.00 0.00 H new ATOM 0 HE2 MET A 19 0.845 5.919 -5.938 1.00 0.00 H new ATOM 0 HE3 MET A 19 2.185 5.119 -5.082 1.00 0.00 H new ATOM 272 N ASP A 20 -2.713 8.443 -6.294 1.00 0.00 N ATOM 273 CA ASP A 20 -2.577 9.813 -5.814 1.00 0.00 C ATOM 274 C ASP A 20 -3.611 10.115 -4.734 1.00 0.00 C ATOM 275 O ASP A 20 -3.260 10.449 -3.602 1.00 0.00 O ATOM 276 CB ASP A 20 -2.728 10.800 -6.973 1.00 0.00 C ATOM 277 CG ASP A 20 -1.454 10.942 -7.782 1.00 0.00 C ATOM 278 OD1 ASP A 20 -0.365 10.980 -7.173 1.00 0.00 O ATOM 279 OD2 ASP A 20 -1.547 11.015 -9.025 1.00 0.00 O ATOM 0 H ASP A 20 -2.479 8.317 -7.279 1.00 0.00 H new ATOM 0 HA ASP A 20 -1.583 9.923 -5.381 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -3.535 10.468 -7.626 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -3.016 11.775 -6.581 1.00 0.00 H new ATOM 284 N GLU A 21 -4.885 9.997 -5.092 1.00 0.00 N ATOM 285 CA GLU A 21 -5.970 10.259 -4.153 1.00 0.00 C ATOM 286 C GLU A 21 -5.842 9.378 -2.914 1.00 0.00 C ATOM 287 O GLU A 21 -5.673 9.875 -1.800 1.00 0.00 O ATOM 288 CB GLU A 21 -7.324 10.021 -4.824 1.00 0.00 C ATOM 289 CG GLU A 21 -7.540 10.859 -6.073 1.00 0.00 C ATOM 290 CD GLU A 21 -7.972 12.277 -5.757 1.00 0.00 C ATOM 291 OE1 GLU A 21 -7.690 12.748 -4.636 1.00 0.00 O ATOM 292 OE2 GLU A 21 -8.593 12.916 -6.632 1.00 0.00 O ATOM 0 H GLU A 21 -5.192 9.722 -6.025 1.00 0.00 H new ATOM 0 HA GLU A 21 -5.904 11.302 -3.844 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -7.410 8.966 -5.085 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -8.118 10.238 -4.109 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -6.617 10.885 -6.652 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -8.296 10.384 -6.698 1.00 0.00 H new ATOM 299 N ALA A 22 -5.924 8.067 -3.116 1.00 0.00 N ATOM 300 CA ALA A 22 -5.816 7.116 -2.017 1.00 0.00 C ATOM 301 C ALA A 22 -4.795 7.583 -0.985 1.00 0.00 C ATOM 302 O ALA A 22 -5.025 7.483 0.221 1.00 0.00 O ATOM 303 CB ALA A 22 -5.443 5.739 -2.545 1.00 0.00 C ATOM 0 H ALA A 22 -6.065 7.639 -4.031 1.00 0.00 H new ATOM 0 HA ALA A 22 -6.787 7.054 -1.526 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -5.366 5.039 -1.713 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -6.210 5.395 -3.239 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -4.485 5.795 -3.062 1.00 0.00 H new ATOM 309 N LEU A 23 -3.667 8.093 -1.465 1.00 0.00 N ATOM 310 CA LEU A 23 -2.609 8.576 -0.584 1.00 0.00 C ATOM 311 C LEU A 23 -3.074 9.792 0.210 1.00 0.00 C ATOM 312 O LEU A 23 -3.014 9.806 1.439 1.00 0.00 O ATOM 313 CB LEU A 23 -1.362 8.929 -1.397 1.00 0.00 C ATOM 314 CG LEU A 23 -0.841 7.839 -2.334 1.00 0.00 C ATOM 315 CD1 LEU A 23 0.262 8.385 -3.227 1.00 0.00 C ATOM 316 CD2 LEU A 23 -0.339 6.644 -1.535 1.00 0.00 C ATOM 0 H LEU A 23 -3.461 8.183 -2.460 1.00 0.00 H new ATOM 0 HA LEU A 23 -2.363 7.779 0.118 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -1.579 9.817 -1.991 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -0.564 9.196 -0.704 1.00 0.00 H new ATOM 0 HG LEU A 23 -1.664 7.508 -2.968 1.00 0.00 H new ATOM 0 HD11 LEU A 23 0.620 7.595 -3.887 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -0.128 9.208 -3.825 1.00 0.00 H new ATOM 0 HD13 LEU A 23 1.086 8.744 -2.610 1.00 0.00 H new ATOM 0 HD21 LEU A 23 0.028 5.878 -2.218 1.00 0.00 H new ATOM 0 HD22 LEU A 23 0.470 6.961 -0.876 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -1.155 6.237 -0.938 1.00 0.00 H new ATOM 328 N LYS A 24 -3.540 10.813 -0.502 1.00 0.00 N ATOM 329 CA LYS A 24 -4.020 12.034 0.135 1.00 0.00 C ATOM 330 C LYS A 24 -4.752 11.719 1.435 1.00 0.00 C ATOM 331 O LYS A 24 -4.365 12.187 2.506 1.00 0.00 O ATOM 332 CB LYS A 24 -4.948 12.797 -0.813 1.00 0.00 C ATOM 333 CG LYS A 24 -4.228 13.816 -1.680 1.00 0.00 C ATOM 334 CD LYS A 24 -3.681 13.182 -2.948 1.00 0.00 C ATOM 335 CE LYS A 24 -3.166 14.233 -3.919 1.00 0.00 C ATOM 336 NZ LYS A 24 -4.250 14.759 -4.794 1.00 0.00 N ATOM 0 H LYS A 24 -3.595 10.819 -1.520 1.00 0.00 H new ATOM 0 HA LYS A 24 -3.156 12.656 0.367 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -5.462 12.083 -1.457 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -5.713 13.307 -0.227 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -4.914 14.622 -1.942 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -3.411 14.264 -1.114 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -2.875 12.494 -2.694 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -4.463 12.593 -3.428 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -2.719 15.055 -3.360 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -2.378 13.802 -4.536 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -3.858 15.473 -5.441 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -4.660 13.979 -5.346 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -4.990 15.193 -4.207 1.00 0.00 H new ATOM 350 N ASP A 25 -5.810 10.921 1.334 1.00 0.00 N ATOM 351 CA ASP A 25 -6.594 10.541 2.503 1.00 0.00 C ATOM 352 C ASP A 25 -5.840 9.526 3.357 1.00 0.00 C ATOM 353 O ASP A 25 -5.167 8.629 2.849 1.00 0.00 O ATOM 354 CB ASP A 25 -7.943 9.962 2.073 1.00 0.00 C ATOM 355 CG ASP A 25 -9.028 10.190 3.107 1.00 0.00 C ATOM 356 OD1 ASP A 25 -9.298 11.365 3.434 1.00 0.00 O ATOM 357 OD2 ASP A 25 -9.606 9.194 3.588 1.00 0.00 O ATOM 0 H ASP A 25 -6.144 10.525 0.455 1.00 0.00 H new ATOM 0 HA ASP A 25 -6.765 11.436 3.101 1.00 0.00 H new ATOM 0 HB2 ASP A 25 -8.245 10.415 1.128 1.00 0.00 H new ATOM 0 HB3 ASP A 25 -7.835 8.892 1.894 1.00 0.00 H new ATOM 362 N PRO A 26 -5.954 9.670 4.686 1.00 0.00 N ATOM 363 CA PRO A 26 -5.289 8.775 5.638 1.00 0.00 C ATOM 364 C PRO A 26 -5.895 7.376 5.640 1.00 0.00 C ATOM 365 O PRO A 26 -5.177 6.377 5.601 1.00 0.00 O ATOM 366 CB PRO A 26 -5.520 9.460 6.988 1.00 0.00 C ATOM 367 CG PRO A 26 -6.757 10.268 6.796 1.00 0.00 C ATOM 368 CD PRO A 26 -6.739 10.716 5.361 1.00 0.00 C ATOM 0 HA PRO A 26 -4.237 8.628 5.393 1.00 0.00 H new ATOM 0 HB2 PRO A 26 -5.645 8.729 7.787 1.00 0.00 H new ATOM 0 HB3 PRO A 26 -4.674 10.090 7.262 1.00 0.00 H new ATOM 0 HG2 PRO A 26 -7.647 9.676 7.009 1.00 0.00 H new ATOM 0 HG3 PRO A 26 -6.774 11.123 7.472 1.00 0.00 H new ATOM 0 HD2 PRO A 26 -7.746 10.790 4.951 1.00 0.00 H new ATOM 0 HD3 PRO A 26 -6.278 11.698 5.252 1.00 0.00 H new ATOM 376 N VAL A 27 -7.222 7.311 5.684 1.00 0.00 N ATOM 377 CA VAL A 27 -7.926 6.034 5.688 1.00 0.00 C ATOM 378 C VAL A 27 -7.674 5.264 4.397 1.00 0.00 C ATOM 379 O VAL A 27 -7.347 4.078 4.423 1.00 0.00 O ATOM 380 CB VAL A 27 -9.443 6.229 5.869 1.00 0.00 C ATOM 381 CG1 VAL A 27 -10.166 4.894 5.788 1.00 0.00 C ATOM 382 CG2 VAL A 27 -9.736 6.924 7.190 1.00 0.00 C ATOM 0 H VAL A 27 -7.831 8.128 5.717 1.00 0.00 H new ATOM 0 HA VAL A 27 -7.538 5.462 6.531 1.00 0.00 H new ATOM 0 HB VAL A 27 -9.810 6.863 5.062 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -11.237 5.052 5.918 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -9.982 4.439 4.815 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -9.799 4.233 6.573 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -10.812 7.054 7.302 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -9.356 6.318 8.012 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -9.249 7.899 7.204 1.00 0.00 H new ATOM 392 N GLY A 28 -7.828 5.947 3.267 1.00 0.00 N ATOM 393 CA GLY A 28 -7.613 5.311 1.980 1.00 0.00 C ATOM 394 C GLY A 28 -6.251 4.655 1.878 1.00 0.00 C ATOM 395 O GLY A 28 -6.075 3.684 1.142 1.00 0.00 O ATOM 0 H GLY A 28 -8.098 6.930 3.220 1.00 0.00 H new ATOM 0 HA2 GLY A 28 -8.387 4.562 1.815 1.00 0.00 H new ATOM 0 HA3 GLY A 28 -7.715 6.054 1.189 1.00 0.00 H new ATOM 399 N ARG A 29 -5.283 5.187 2.617 1.00 0.00 N ATOM 400 CA ARG A 29 -3.928 4.648 2.605 1.00 0.00 C ATOM 401 C ARG A 29 -3.885 3.270 3.257 1.00 0.00 C ATOM 402 O ARG A 29 -3.297 2.335 2.714 1.00 0.00 O ATOM 403 CB ARG A 29 -2.972 5.598 3.330 1.00 0.00 C ATOM 404 CG ARG A 29 -2.333 6.632 2.418 1.00 0.00 C ATOM 405 CD ARG A 29 -1.330 7.493 3.170 1.00 0.00 C ATOM 406 NE ARG A 29 -1.977 8.593 3.880 1.00 0.00 N ATOM 407 CZ ARG A 29 -1.313 9.509 4.576 1.00 0.00 C ATOM 408 NH1 ARG A 29 0.009 9.457 4.656 1.00 0.00 N ATOM 409 NH2 ARG A 29 -1.973 10.480 5.195 1.00 0.00 N ATOM 0 H ARG A 29 -5.412 5.991 3.232 1.00 0.00 H new ATOM 0 HA ARG A 29 -3.612 4.549 1.566 1.00 0.00 H new ATOM 0 HB2 ARG A 29 -3.516 6.112 4.123 1.00 0.00 H new ATOM 0 HB3 ARG A 29 -2.186 5.014 3.809 1.00 0.00 H new ATOM 0 HG2 ARG A 29 -1.834 6.129 1.590 1.00 0.00 H new ATOM 0 HG3 ARG A 29 -3.107 7.266 1.986 1.00 0.00 H new ATOM 0 HD2 ARG A 29 -0.783 6.874 3.881 1.00 0.00 H new ATOM 0 HD3 ARG A 29 -0.599 7.895 2.468 1.00 0.00 H new ATOM 0 HE ARG A 29 -2.994 8.662 3.839 1.00 0.00 H new ATOM 0 HH11 ARG A 29 0.520 8.712 4.182 1.00 0.00 H new ATOM 0 HH12 ARG A 29 0.516 10.162 5.191 1.00 0.00 H new ATOM 0 HH21 ARG A 29 -2.990 10.523 5.136 1.00 0.00 H new ATOM 0 HH22 ARG A 29 -1.463 11.183 5.729 1.00 0.00 H new ATOM 423 N GLU A 30 -4.511 3.152 4.423 1.00 0.00 N ATOM 424 CA GLU A 30 -4.542 1.888 5.149 1.00 0.00 C ATOM 425 C GLU A 30 -5.485 0.896 4.474 1.00 0.00 C ATOM 426 O GLU A 30 -5.160 -0.282 4.327 1.00 0.00 O ATOM 427 CB GLU A 30 -4.977 2.117 6.598 1.00 0.00 C ATOM 428 CG GLU A 30 -6.483 2.061 6.797 1.00 0.00 C ATOM 429 CD GLU A 30 -6.893 2.345 8.229 1.00 0.00 C ATOM 430 OE1 GLU A 30 -6.081 2.087 9.142 1.00 0.00 O ATOM 431 OE2 GLU A 30 -8.027 2.826 8.437 1.00 0.00 O ATOM 0 H GLU A 30 -5.004 3.916 4.885 1.00 0.00 H new ATOM 0 HA GLU A 30 -3.536 1.469 5.141 1.00 0.00 H new ATOM 0 HB2 GLU A 30 -4.507 1.366 7.233 1.00 0.00 H new ATOM 0 HB3 GLU A 30 -4.611 3.089 6.929 1.00 0.00 H new ATOM 0 HG2 GLU A 30 -6.960 2.785 6.136 1.00 0.00 H new ATOM 0 HG3 GLU A 30 -6.848 1.076 6.507 1.00 0.00 H new ATOM 438 N GLN A 31 -6.653 1.382 4.067 1.00 0.00 N ATOM 439 CA GLN A 31 -7.643 0.538 3.408 1.00 0.00 C ATOM 440 C GLN A 31 -7.052 -0.132 2.173 1.00 0.00 C ATOM 441 O GLN A 31 -7.055 -1.358 2.057 1.00 0.00 O ATOM 442 CB GLN A 31 -8.869 1.364 3.017 1.00 0.00 C ATOM 443 CG GLN A 31 -9.845 1.583 4.162 1.00 0.00 C ATOM 444 CD GLN A 31 -10.198 0.297 4.882 1.00 0.00 C ATOM 445 OE1 GLN A 31 -10.828 -0.595 4.312 1.00 0.00 O ATOM 446 NE2 GLN A 31 -9.793 0.193 6.143 1.00 0.00 N ATOM 0 H GLN A 31 -6.937 2.355 4.182 1.00 0.00 H new ATOM 0 HA GLN A 31 -7.946 -0.239 4.110 1.00 0.00 H new ATOM 0 HB2 GLN A 31 -8.539 2.333 2.641 1.00 0.00 H new ATOM 0 HB3 GLN A 31 -9.388 0.864 2.199 1.00 0.00 H new ATOM 0 HG2 GLN A 31 -9.412 2.286 4.874 1.00 0.00 H new ATOM 0 HG3 GLN A 31 -10.756 2.040 3.776 1.00 0.00 H new ATOM 0 HE21 GLN A 31 -9.273 0.956 6.576 1.00 0.00 H new ATOM 0 HE22 GLN A 31 -10.002 -0.650 6.678 1.00 0.00 H new ATOM 455 N PHE A 32 -6.545 0.679 1.251 1.00 0.00 N ATOM 456 CA PHE A 32 -5.951 0.165 0.022 1.00 0.00 C ATOM 457 C PHE A 32 -4.858 -0.854 0.332 1.00 0.00 C ATOM 458 O PHE A 32 -4.677 -1.829 -0.399 1.00 0.00 O ATOM 459 CB PHE A 32 -5.374 1.312 -0.810 1.00 0.00 C ATOM 460 CG PHE A 32 -4.357 0.866 -1.821 1.00 0.00 C ATOM 461 CD1 PHE A 32 -4.696 -0.042 -2.811 1.00 0.00 C ATOM 462 CD2 PHE A 32 -3.061 1.356 -1.782 1.00 0.00 C ATOM 463 CE1 PHE A 32 -3.762 -0.454 -3.742 1.00 0.00 C ATOM 464 CE2 PHE A 32 -2.122 0.948 -2.711 1.00 0.00 C ATOM 465 CZ PHE A 32 -2.474 0.042 -3.693 1.00 0.00 C ATOM 0 H PHE A 32 -6.533 1.696 1.331 1.00 0.00 H new ATOM 0 HA PHE A 32 -6.734 -0.331 -0.551 1.00 0.00 H new ATOM 0 HB2 PHE A 32 -6.188 1.822 -1.326 1.00 0.00 H new ATOM 0 HB3 PHE A 32 -4.915 2.040 -0.141 1.00 0.00 H new ATOM 0 HD1 PHE A 32 -5.702 -0.432 -2.855 1.00 0.00 H new ATOM 0 HD2 PHE A 32 -2.781 2.065 -1.017 1.00 0.00 H new ATOM 0 HE1 PHE A 32 -4.039 -1.164 -4.508 1.00 0.00 H new ATOM 0 HE2 PHE A 32 -1.115 1.337 -2.669 1.00 0.00 H new ATOM 0 HZ PHE A 32 -1.743 -0.278 -4.421 1.00 0.00 H new ATOM 475 N LEU A 33 -4.131 -0.621 1.419 1.00 0.00 N ATOM 476 CA LEU A 33 -3.054 -1.517 1.826 1.00 0.00 C ATOM 477 C LEU A 33 -3.604 -2.884 2.222 1.00 0.00 C ATOM 478 O LEU A 33 -3.182 -3.912 1.693 1.00 0.00 O ATOM 479 CB LEU A 33 -2.274 -0.911 2.994 1.00 0.00 C ATOM 480 CG LEU A 33 -1.458 -1.892 3.837 1.00 0.00 C ATOM 481 CD1 LEU A 33 -0.053 -2.039 3.275 1.00 0.00 C ATOM 482 CD2 LEU A 33 -1.409 -1.435 5.288 1.00 0.00 C ATOM 0 H LEU A 33 -4.268 0.181 2.035 1.00 0.00 H new ATOM 0 HA LEU A 33 -2.383 -1.647 0.977 1.00 0.00 H new ATOM 0 HB2 LEU A 33 -1.598 -0.153 2.599 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -2.979 -0.399 3.649 1.00 0.00 H new ATOM 0 HG LEU A 33 -1.945 -2.866 3.800 1.00 0.00 H new ATOM 0 HD11 LEU A 33 0.512 -2.741 3.888 1.00 0.00 H new ATOM 0 HD12 LEU A 33 -0.107 -2.412 2.252 1.00 0.00 H new ATOM 0 HD13 LEU A 33 0.445 -1.069 3.281 1.00 0.00 H new ATOM 0 HD21 LEU A 33 -0.824 -2.145 5.873 1.00 0.00 H new ATOM 0 HD22 LEU A 33 -0.946 -0.450 5.344 1.00 0.00 H new ATOM 0 HD23 LEU A 33 -2.422 -1.383 5.687 1.00 0.00 H new ATOM 494 N LYS A 34 -4.550 -2.887 3.155 1.00 0.00 N ATOM 495 CA LYS A 34 -5.161 -4.127 3.621 1.00 0.00 C ATOM 496 C LYS A 34 -5.288 -5.132 2.481 1.00 0.00 C ATOM 497 O LYS A 34 -4.749 -6.237 2.551 1.00 0.00 O ATOM 498 CB LYS A 34 -6.540 -3.845 4.222 1.00 0.00 C ATOM 499 CG LYS A 34 -6.510 -2.855 5.374 1.00 0.00 C ATOM 500 CD LYS A 34 -7.663 -3.085 6.337 1.00 0.00 C ATOM 501 CE LYS A 34 -7.742 -1.986 7.385 1.00 0.00 C ATOM 502 NZ LYS A 34 -6.628 -2.077 8.369 1.00 0.00 N ATOM 0 H LYS A 34 -4.910 -2.045 3.604 1.00 0.00 H new ATOM 0 HA LYS A 34 -4.517 -4.555 4.389 1.00 0.00 H new ATOM 0 HB2 LYS A 34 -7.196 -3.461 3.441 1.00 0.00 H new ATOM 0 HB3 LYS A 34 -6.974 -4.782 4.570 1.00 0.00 H new ATOM 0 HG2 LYS A 34 -5.565 -2.946 5.909 1.00 0.00 H new ATOM 0 HG3 LYS A 34 -6.559 -1.839 4.983 1.00 0.00 H new ATOM 0 HD2 LYS A 34 -8.600 -3.127 5.781 1.00 0.00 H new ATOM 0 HD3 LYS A 34 -7.541 -4.050 6.829 1.00 0.00 H new ATOM 0 HE2 LYS A 34 -7.714 -1.013 6.894 1.00 0.00 H new ATOM 0 HE3 LYS A 34 -8.696 -2.052 7.909 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 -6.717 -1.311 9.066 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 -6.669 -2.995 8.856 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 -5.718 -1.989 7.873 1.00 0.00 H new ATOM 516 N PHE A 35 -6.003 -4.743 1.431 1.00 0.00 N ATOM 517 CA PHE A 35 -6.200 -5.610 0.276 1.00 0.00 C ATOM 518 C PHE A 35 -4.869 -6.164 -0.222 1.00 0.00 C ATOM 519 O PHE A 35 -4.730 -7.366 -0.453 1.00 0.00 O ATOM 520 CB PHE A 35 -6.900 -4.845 -0.850 1.00 0.00 C ATOM 521 CG PHE A 35 -6.979 -5.613 -2.138 1.00 0.00 C ATOM 522 CD1 PHE A 35 -8.062 -6.434 -2.406 1.00 0.00 C ATOM 523 CD2 PHE A 35 -5.968 -5.515 -3.081 1.00 0.00 C ATOM 524 CE1 PHE A 35 -8.138 -7.142 -3.591 1.00 0.00 C ATOM 525 CE2 PHE A 35 -6.038 -6.220 -4.268 1.00 0.00 C ATOM 526 CZ PHE A 35 -7.124 -7.035 -4.522 1.00 0.00 C ATOM 0 H PHE A 35 -6.456 -3.832 1.356 1.00 0.00 H new ATOM 0 HA PHE A 35 -6.829 -6.445 0.584 1.00 0.00 H new ATOM 0 HB2 PHE A 35 -7.909 -4.585 -0.529 1.00 0.00 H new ATOM 0 HB3 PHE A 35 -6.370 -3.909 -1.026 1.00 0.00 H new ATOM 0 HD1 PHE A 35 -8.857 -6.522 -1.680 1.00 0.00 H new ATOM 0 HD2 PHE A 35 -5.116 -4.881 -2.886 1.00 0.00 H new ATOM 0 HE1 PHE A 35 -8.989 -7.777 -3.788 1.00 0.00 H new ATOM 0 HE2 PHE A 35 -5.245 -6.134 -4.996 1.00 0.00 H new ATOM 0 HZ PHE A 35 -7.180 -7.588 -5.448 1.00 0.00 H new ATOM 536 N LEU A 36 -3.891 -5.279 -0.387 1.00 0.00 N ATOM 537 CA LEU A 36 -2.570 -5.677 -0.858 1.00 0.00 C ATOM 538 C LEU A 36 -1.991 -6.786 0.016 1.00 0.00 C ATOM 539 O LEU A 36 -1.584 -7.834 -0.484 1.00 0.00 O ATOM 540 CB LEU A 36 -1.625 -4.474 -0.866 1.00 0.00 C ATOM 541 CG LEU A 36 -1.477 -3.746 -2.202 1.00 0.00 C ATOM 542 CD1 LEU A 36 -2.758 -3.003 -2.551 1.00 0.00 C ATOM 543 CD2 LEU A 36 -0.297 -2.786 -2.159 1.00 0.00 C ATOM 0 H LEU A 36 -3.989 -4.281 -0.201 1.00 0.00 H new ATOM 0 HA LEU A 36 -2.674 -6.057 -1.874 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -1.974 -3.758 -0.122 1.00 0.00 H new ATOM 0 HB3 LEU A 36 -0.638 -4.810 -0.547 1.00 0.00 H new ATOM 0 HG LEU A 36 -1.289 -4.488 -2.978 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -2.633 -2.491 -3.505 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -3.582 -3.713 -2.625 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -2.978 -2.272 -1.773 1.00 0.00 H new ATOM 0 HD21 LEU A 36 -0.207 -2.277 -3.119 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -0.455 -2.050 -1.371 1.00 0.00 H new ATOM 0 HD23 LEU A 36 0.618 -3.343 -1.957 1.00 0.00 H new ATOM 555 N GLU A 37 -1.961 -6.547 1.323 1.00 0.00 N ATOM 556 CA GLU A 37 -1.434 -7.526 2.266 1.00 0.00 C ATOM 557 C GLU A 37 -1.878 -8.937 1.891 1.00 0.00 C ATOM 558 O GLU A 37 -1.089 -9.881 1.937 1.00 0.00 O ATOM 559 CB GLU A 37 -1.893 -7.197 3.688 1.00 0.00 C ATOM 560 CG GLU A 37 -1.156 -6.022 4.309 1.00 0.00 C ATOM 561 CD GLU A 37 -1.700 -5.648 5.674 1.00 0.00 C ATOM 562 OE1 GLU A 37 -2.203 -6.547 6.380 1.00 0.00 O ATOM 563 OE2 GLU A 37 -1.622 -4.455 6.036 1.00 0.00 O ATOM 0 H GLU A 37 -2.295 -5.684 1.753 1.00 0.00 H new ATOM 0 HA GLU A 37 -0.346 -7.482 2.224 1.00 0.00 H new ATOM 0 HB2 GLU A 37 -2.961 -6.979 3.675 1.00 0.00 H new ATOM 0 HB3 GLU A 37 -1.755 -8.076 4.318 1.00 0.00 H new ATOM 0 HG2 GLU A 37 -0.098 -6.268 4.399 1.00 0.00 H new ATOM 0 HG3 GLU A 37 -1.228 -5.161 3.645 1.00 0.00 H new ATOM 570 N SER A 38 -3.147 -9.072 1.519 1.00 0.00 N ATOM 571 CA SER A 38 -3.699 -10.367 1.139 1.00 0.00 C ATOM 572 C SER A 38 -2.968 -10.935 -0.073 1.00 0.00 C ATOM 573 O SER A 38 -2.528 -12.084 -0.064 1.00 0.00 O ATOM 574 CB SER A 38 -5.193 -10.240 0.835 1.00 0.00 C ATOM 575 OG SER A 38 -5.967 -10.363 2.015 1.00 0.00 O ATOM 0 H SER A 38 -3.812 -8.300 1.473 1.00 0.00 H new ATOM 0 HA SER A 38 -3.563 -11.051 1.977 1.00 0.00 H new ATOM 0 HB2 SER A 38 -5.391 -9.276 0.366 1.00 0.00 H new ATOM 0 HB3 SER A 38 -5.488 -11.009 0.121 1.00 0.00 H new ATOM 0 HG SER A 38 -6.918 -10.276 1.793 1.00 0.00 H new ATOM 581 N GLU A 39 -2.842 -10.120 -1.116 1.00 0.00 N ATOM 582 CA GLU A 39 -2.165 -10.541 -2.337 1.00 0.00 C ATOM 583 C GLU A 39 -0.651 -10.433 -2.184 1.00 0.00 C ATOM 584 O GLU A 39 0.088 -10.472 -3.168 1.00 0.00 O ATOM 585 CB GLU A 39 -2.631 -9.694 -3.523 1.00 0.00 C ATOM 586 CG GLU A 39 -2.346 -8.210 -3.360 1.00 0.00 C ATOM 587 CD GLU A 39 -2.275 -7.481 -4.688 1.00 0.00 C ATOM 588 OE1 GLU A 39 -1.691 -8.039 -5.640 1.00 0.00 O ATOM 589 OE2 GLU A 39 -2.803 -6.353 -4.775 1.00 0.00 O ATOM 0 H GLU A 39 -3.200 -9.165 -1.140 1.00 0.00 H new ATOM 0 HA GLU A 39 -2.420 -11.584 -2.523 1.00 0.00 H new ATOM 0 HB2 GLU A 39 -2.142 -10.052 -4.429 1.00 0.00 H new ATOM 0 HB3 GLU A 39 -3.703 -9.837 -3.662 1.00 0.00 H new ATOM 0 HG2 GLU A 39 -3.124 -7.760 -2.744 1.00 0.00 H new ATOM 0 HG3 GLU A 39 -1.403 -8.081 -2.828 1.00 0.00 H new ATOM 596 N PHE A 40 -0.195 -10.295 -0.943 1.00 0.00 N ATOM 597 CA PHE A 40 1.231 -10.179 -0.660 1.00 0.00 C ATOM 598 C PHE A 40 1.863 -9.070 -1.496 1.00 0.00 C ATOM 599 O PHE A 40 2.985 -9.207 -1.982 1.00 0.00 O ATOM 600 CB PHE A 40 1.937 -11.508 -0.938 1.00 0.00 C ATOM 601 CG PHE A 40 1.204 -12.701 -0.393 1.00 0.00 C ATOM 602 CD1 PHE A 40 0.118 -13.231 -1.070 1.00 0.00 C ATOM 603 CD2 PHE A 40 1.603 -13.293 0.794 1.00 0.00 C ATOM 604 CE1 PHE A 40 -0.558 -14.329 -0.570 1.00 0.00 C ATOM 605 CE2 PHE A 40 0.931 -14.391 1.298 1.00 0.00 C ATOM 606 CZ PHE A 40 -0.150 -14.910 0.614 1.00 0.00 C ATOM 0 H PHE A 40 -0.793 -10.261 -0.117 1.00 0.00 H new ATOM 0 HA PHE A 40 1.348 -9.927 0.394 1.00 0.00 H new ATOM 0 HB2 PHE A 40 2.059 -11.627 -2.015 1.00 0.00 H new ATOM 0 HB3 PHE A 40 2.937 -11.477 -0.505 1.00 0.00 H new ATOM 0 HD1 PHE A 40 -0.204 -12.782 -1.998 1.00 0.00 H new ATOM 0 HD2 PHE A 40 2.449 -12.892 1.332 1.00 0.00 H new ATOM 0 HE1 PHE A 40 -1.405 -14.732 -1.106 1.00 0.00 H new ATOM 0 HE2 PHE A 40 1.251 -14.842 2.226 1.00 0.00 H new ATOM 0 HZ PHE A 40 -0.676 -15.769 1.004 1.00 0.00 H new ATOM 616 N SER A 41 1.132 -7.972 -1.660 1.00 0.00 N ATOM 617 CA SER A 41 1.619 -6.840 -2.441 1.00 0.00 C ATOM 618 C SER A 41 1.965 -5.663 -1.534 1.00 0.00 C ATOM 619 O SER A 41 2.715 -4.767 -1.921 1.00 0.00 O ATOM 620 CB SER A 41 0.569 -6.414 -3.469 1.00 0.00 C ATOM 621 OG SER A 41 0.482 -7.353 -4.528 1.00 0.00 O ATOM 0 H SER A 41 0.201 -7.842 -1.263 1.00 0.00 H new ATOM 0 HA SER A 41 2.523 -7.152 -2.963 1.00 0.00 H new ATOM 0 HB2 SER A 41 -0.402 -6.318 -2.983 1.00 0.00 H new ATOM 0 HB3 SER A 41 0.824 -5.433 -3.869 1.00 0.00 H new ATOM 0 HG SER A 41 0.229 -6.891 -5.355 1.00 0.00 H new ATOM 627 N SER A 42 1.413 -5.674 -0.325 1.00 0.00 N ATOM 628 CA SER A 42 1.660 -4.606 0.637 1.00 0.00 C ATOM 629 C SER A 42 3.102 -4.116 0.546 1.00 0.00 C ATOM 630 O SER A 42 3.358 -2.913 0.506 1.00 0.00 O ATOM 631 CB SER A 42 1.363 -5.091 2.057 1.00 0.00 C ATOM 632 OG SER A 42 2.051 -6.298 2.338 1.00 0.00 O ATOM 0 H SER A 42 0.792 -6.410 0.012 1.00 0.00 H new ATOM 0 HA SER A 42 0.996 -3.775 0.398 1.00 0.00 H new ATOM 0 HB2 SER A 42 1.657 -4.325 2.775 1.00 0.00 H new ATOM 0 HB3 SER A 42 0.290 -5.244 2.176 1.00 0.00 H new ATOM 0 HG SER A 42 1.846 -6.586 3.252 1.00 0.00 H new ATOM 638 N GLU A 43 4.040 -5.057 0.515 1.00 0.00 N ATOM 639 CA GLU A 43 5.456 -4.721 0.430 1.00 0.00 C ATOM 640 C GLU A 43 5.668 -3.462 -0.406 1.00 0.00 C ATOM 641 O GLU A 43 6.171 -2.454 0.088 1.00 0.00 O ATOM 642 CB GLU A 43 6.244 -5.886 -0.174 1.00 0.00 C ATOM 643 CG GLU A 43 6.005 -7.212 0.528 1.00 0.00 C ATOM 644 CD GLU A 43 6.815 -8.344 -0.073 1.00 0.00 C ATOM 645 OE1 GLU A 43 7.981 -8.104 -0.449 1.00 0.00 O ATOM 646 OE2 GLU A 43 6.282 -9.470 -0.167 1.00 0.00 O ATOM 0 H GLU A 43 3.845 -6.058 0.547 1.00 0.00 H new ATOM 0 HA GLU A 43 5.819 -4.531 1.440 1.00 0.00 H new ATOM 0 HB2 GLU A 43 5.976 -5.988 -1.226 1.00 0.00 H new ATOM 0 HB3 GLU A 43 7.308 -5.652 -0.137 1.00 0.00 H new ATOM 0 HG2 GLU A 43 6.257 -7.111 1.584 1.00 0.00 H new ATOM 0 HG3 GLU A 43 4.945 -7.461 0.476 1.00 0.00 H new ATOM 653 N ASN A 44 5.279 -3.529 -1.675 1.00 0.00 N ATOM 654 CA ASN A 44 5.426 -2.395 -2.580 1.00 0.00 C ATOM 655 C ASN A 44 5.091 -1.086 -1.872 1.00 0.00 C ATOM 656 O ASN A 44 5.919 -0.178 -1.798 1.00 0.00 O ATOM 657 CB ASN A 44 4.525 -2.572 -3.804 1.00 0.00 C ATOM 658 CG ASN A 44 4.846 -3.834 -4.581 1.00 0.00 C ATOM 659 OD1 ASN A 44 5.805 -4.541 -4.270 1.00 0.00 O ATOM 660 ND2 ASN A 44 4.044 -4.122 -5.599 1.00 0.00 N ATOM 0 H ASN A 44 4.860 -4.356 -2.100 1.00 0.00 H new ATOM 0 HA ASN A 44 6.465 -2.355 -2.906 1.00 0.00 H new ATOM 0 HB2 ASN A 44 3.483 -2.601 -3.484 1.00 0.00 H new ATOM 0 HB3 ASN A 44 4.633 -1.708 -4.459 1.00 0.00 H new ATOM 0 HD21 ASN A 44 4.211 -4.958 -6.159 1.00 0.00 H new ATOM 0 HD22 ASN A 44 3.261 -3.507 -5.821 1.00 0.00 H new ATOM 667 N LEU A 45 3.871 -0.997 -1.353 1.00 0.00 N ATOM 668 CA LEU A 45 3.425 0.201 -0.650 1.00 0.00 C ATOM 669 C LEU A 45 4.220 0.405 0.636 1.00 0.00 C ATOM 670 O LEU A 45 4.900 1.417 0.803 1.00 0.00 O ATOM 671 CB LEU A 45 1.932 0.102 -0.330 1.00 0.00 C ATOM 672 CG LEU A 45 1.309 1.321 0.350 1.00 0.00 C ATOM 673 CD1 LEU A 45 1.286 2.508 -0.600 1.00 0.00 C ATOM 674 CD2 LEU A 45 -0.095 1.000 0.839 1.00 0.00 C ATOM 0 H LEU A 45 3.174 -1.739 -1.406 1.00 0.00 H new ATOM 0 HA LEU A 45 3.595 1.059 -1.300 1.00 0.00 H new ATOM 0 HB2 LEU A 45 1.393 -0.086 -1.259 1.00 0.00 H new ATOM 0 HB3 LEU A 45 1.775 -0.766 0.310 1.00 0.00 H new ATOM 0 HG LEU A 45 1.921 1.584 1.213 1.00 0.00 H new ATOM 0 HD11 LEU A 45 0.839 3.367 -0.099 1.00 0.00 H new ATOM 0 HD12 LEU A 45 2.305 2.753 -0.901 1.00 0.00 H new ATOM 0 HD13 LEU A 45 0.698 2.256 -1.482 1.00 0.00 H new ATOM 0 HD21 LEU A 45 -0.523 1.880 1.320 1.00 0.00 H new ATOM 0 HD22 LEU A 45 -0.718 0.711 -0.007 1.00 0.00 H new ATOM 0 HD23 LEU A 45 -0.052 0.179 1.555 1.00 0.00 H new ATOM 686 N ARG A 46 4.130 -0.564 1.541 1.00 0.00 N ATOM 687 CA ARG A 46 4.842 -0.492 2.812 1.00 0.00 C ATOM 688 C ARG A 46 6.198 0.184 2.637 1.00 0.00 C ATOM 689 O ARG A 46 6.576 1.054 3.423 1.00 0.00 O ATOM 690 CB ARG A 46 5.029 -1.892 3.397 1.00 0.00 C ATOM 691 CG ARG A 46 3.747 -2.503 3.938 1.00 0.00 C ATOM 692 CD ARG A 46 4.037 -3.614 4.936 1.00 0.00 C ATOM 693 NE ARG A 46 2.816 -4.270 5.395 1.00 0.00 N ATOM 694 CZ ARG A 46 2.781 -5.514 5.861 1.00 0.00 C ATOM 695 NH1 ARG A 46 3.894 -6.231 5.930 1.00 0.00 N ATOM 696 NH2 ARG A 46 1.631 -6.042 6.259 1.00 0.00 N ATOM 0 H ARG A 46 3.571 -1.408 1.418 1.00 0.00 H new ATOM 0 HA ARG A 46 4.244 0.104 3.501 1.00 0.00 H new ATOM 0 HB2 ARG A 46 5.437 -2.547 2.627 1.00 0.00 H new ATOM 0 HB3 ARG A 46 5.766 -1.846 4.199 1.00 0.00 H new ATOM 0 HG2 ARG A 46 3.148 -1.729 4.418 1.00 0.00 H new ATOM 0 HG3 ARG A 46 3.155 -2.899 3.113 1.00 0.00 H new ATOM 0 HD2 ARG A 46 4.694 -4.352 4.476 1.00 0.00 H new ATOM 0 HD3 ARG A 46 4.571 -3.202 5.792 1.00 0.00 H new ATOM 0 HE ARG A 46 1.942 -3.745 5.356 1.00 0.00 H new ATOM 0 HH11 ARG A 46 4.780 -5.828 5.625 1.00 0.00 H new ATOM 0 HH12 ARG A 46 3.864 -7.186 6.288 1.00 0.00 H new ATOM 0 HH21 ARG A 46 0.773 -5.493 6.207 1.00 0.00 H new ATOM 0 HH22 ARG A 46 1.605 -6.997 6.617 1.00 0.00 H new ATOM 710 N PHE A 47 6.927 -0.221 1.603 1.00 0.00 N ATOM 711 CA PHE A 47 8.242 0.344 1.325 1.00 0.00 C ATOM 712 C PHE A 47 8.135 1.825 0.974 1.00 0.00 C ATOM 713 O PHE A 47 8.833 2.661 1.547 1.00 0.00 O ATOM 714 CB PHE A 47 8.916 -0.416 0.181 1.00 0.00 C ATOM 715 CG PHE A 47 10.037 0.346 -0.467 1.00 0.00 C ATOM 716 CD1 PHE A 47 11.124 0.773 0.280 1.00 0.00 C ATOM 717 CD2 PHE A 47 10.004 0.635 -1.821 1.00 0.00 C ATOM 718 CE1 PHE A 47 12.156 1.475 -0.313 1.00 0.00 C ATOM 719 CE2 PHE A 47 11.034 1.337 -2.420 1.00 0.00 C ATOM 720 CZ PHE A 47 12.111 1.756 -1.665 1.00 0.00 C ATOM 0 H PHE A 47 6.629 -0.939 0.943 1.00 0.00 H new ATOM 0 HA PHE A 47 8.849 0.245 2.225 1.00 0.00 H new ATOM 0 HB2 PHE A 47 9.302 -1.361 0.562 1.00 0.00 H new ATOM 0 HB3 PHE A 47 8.168 -0.658 -0.574 1.00 0.00 H new ATOM 0 HD1 PHE A 47 11.165 0.555 1.337 1.00 0.00 H new ATOM 0 HD2 PHE A 47 9.164 0.308 -2.416 1.00 0.00 H new ATOM 0 HE1 PHE A 47 12.997 1.804 0.280 1.00 0.00 H new ATOM 0 HE2 PHE A 47 10.996 1.557 -3.477 1.00 0.00 H new ATOM 0 HZ PHE A 47 12.918 2.303 -2.131 1.00 0.00 H new ATOM 730 N TRP A 48 7.257 2.140 0.029 1.00 0.00 N ATOM 731 CA TRP A 48 7.059 3.520 -0.400 1.00 0.00 C ATOM 732 C TRP A 48 6.828 4.434 0.798 1.00 0.00 C ATOM 733 O TRP A 48 7.565 5.398 1.007 1.00 0.00 O ATOM 734 CB TRP A 48 5.874 3.611 -1.363 1.00 0.00 C ATOM 735 CG TRP A 48 5.839 4.890 -2.144 1.00 0.00 C ATOM 736 CD1 TRP A 48 6.707 5.274 -3.125 1.00 0.00 C ATOM 737 CD2 TRP A 48 4.890 5.952 -2.006 1.00 0.00 C ATOM 738 NE1 TRP A 48 6.355 6.512 -3.606 1.00 0.00 N ATOM 739 CE2 TRP A 48 5.243 6.949 -2.937 1.00 0.00 C ATOM 740 CE3 TRP A 48 3.775 6.158 -1.189 1.00 0.00 C ATOM 741 CZ2 TRP A 48 4.520 8.132 -3.070 1.00 0.00 C ATOM 742 CZ3 TRP A 48 3.059 7.333 -1.322 1.00 0.00 C ATOM 743 CH2 TRP A 48 3.433 8.307 -2.257 1.00 0.00 C ATOM 0 H TRP A 48 6.671 1.459 -0.455 1.00 0.00 H new ATOM 0 HA TRP A 48 7.962 3.848 -0.915 1.00 0.00 H new ATOM 0 HB2 TRP A 48 5.914 2.771 -2.057 1.00 0.00 H new ATOM 0 HB3 TRP A 48 4.947 3.514 -0.797 1.00 0.00 H new ATOM 0 HD1 TRP A 48 7.547 4.691 -3.472 1.00 0.00 H new ATOM 0 HE1 TRP A 48 6.843 7.023 -4.342 1.00 0.00 H new ATOM 0 HE3 TRP A 48 3.478 5.412 -0.466 1.00 0.00 H new ATOM 0 HZ2 TRP A 48 4.807 8.885 -3.789 1.00 0.00 H new ATOM 0 HZ3 TRP A 48 2.197 7.503 -0.694 1.00 0.00 H new ATOM 0 HH2 TRP A 48 2.852 9.214 -2.338 1.00 0.00 H new ATOM 754 N LEU A 49 5.801 4.126 1.582 1.00 0.00 N ATOM 755 CA LEU A 49 5.473 4.921 2.761 1.00 0.00 C ATOM 756 C LEU A 49 6.697 5.102 3.653 1.00 0.00 C ATOM 757 O LEU A 49 7.033 6.219 4.043 1.00 0.00 O ATOM 758 CB LEU A 49 4.345 4.256 3.551 1.00 0.00 C ATOM 759 CG LEU A 49 2.981 4.207 2.863 1.00 0.00 C ATOM 760 CD1 LEU A 49 2.031 3.295 3.623 1.00 0.00 C ATOM 761 CD2 LEU A 49 2.395 5.607 2.740 1.00 0.00 C ATOM 0 H LEU A 49 5.181 3.332 1.423 1.00 0.00 H new ATOM 0 HA LEU A 49 5.142 5.904 2.426 1.00 0.00 H new ATOM 0 HB2 LEU A 49 4.647 3.236 3.787 1.00 0.00 H new ATOM 0 HB3 LEU A 49 4.233 4.783 4.499 1.00 0.00 H new ATOM 0 HG LEU A 49 3.116 3.801 1.860 1.00 0.00 H new ATOM 0 HD11 LEU A 49 1.065 3.273 3.118 1.00 0.00 H new ATOM 0 HD12 LEU A 49 2.445 2.287 3.659 1.00 0.00 H new ATOM 0 HD13 LEU A 49 1.901 3.670 4.638 1.00 0.00 H new ATOM 0 HD21 LEU A 49 1.424 5.553 2.248 1.00 0.00 H new ATOM 0 HD22 LEU A 49 2.275 6.040 3.733 1.00 0.00 H new ATOM 0 HD23 LEU A 49 3.066 6.232 2.151 1.00 0.00 H new ATOM 773 N ALA A 50 7.360 3.995 3.971 1.00 0.00 N ATOM 774 CA ALA A 50 8.549 4.031 4.814 1.00 0.00 C ATOM 775 C ALA A 50 9.519 5.111 4.347 1.00 0.00 C ATOM 776 O ALA A 50 10.075 5.852 5.158 1.00 0.00 O ATOM 777 CB ALA A 50 9.232 2.672 4.821 1.00 0.00 C ATOM 0 H ALA A 50 7.094 3.062 3.657 1.00 0.00 H new ATOM 0 HA ALA A 50 8.238 4.273 5.830 1.00 0.00 H new ATOM 0 HB1 ALA A 50 10.118 2.713 5.454 1.00 0.00 H new ATOM 0 HB2 ALA A 50 8.544 1.921 5.209 1.00 0.00 H new ATOM 0 HB3 ALA A 50 9.524 2.406 3.805 1.00 0.00 H new ATOM 783 N VAL A 51 9.719 5.195 3.036 1.00 0.00 N ATOM 784 CA VAL A 51 10.622 6.185 2.461 1.00 0.00 C ATOM 785 C VAL A 51 10.071 7.596 2.632 1.00 0.00 C ATOM 786 O VAL A 51 10.798 8.515 3.006 1.00 0.00 O ATOM 787 CB VAL A 51 10.867 5.918 0.964 1.00 0.00 C ATOM 788 CG1 VAL A 51 11.813 6.960 0.384 1.00 0.00 C ATOM 789 CG2 VAL A 51 11.415 4.514 0.756 1.00 0.00 C ATOM 0 H VAL A 51 9.267 4.589 2.351 1.00 0.00 H new ATOM 0 HA VAL A 51 11.568 6.101 2.997 1.00 0.00 H new ATOM 0 HB VAL A 51 9.915 5.993 0.438 1.00 0.00 H new ATOM 0 HG11 VAL A 51 11.975 6.756 -0.674 1.00 0.00 H new ATOM 0 HG12 VAL A 51 11.376 7.952 0.499 1.00 0.00 H new ATOM 0 HG13 VAL A 51 12.766 6.919 0.911 1.00 0.00 H new ATOM 0 HG21 VAL A 51 11.582 4.343 -0.307 1.00 0.00 H new ATOM 0 HG22 VAL A 51 12.357 4.408 1.293 1.00 0.00 H new ATOM 0 HG23 VAL A 51 10.698 3.784 1.133 1.00 0.00 H new ATOM 799 N GLU A 52 8.781 7.759 2.354 1.00 0.00 N ATOM 800 CA GLU A 52 8.133 9.059 2.477 1.00 0.00 C ATOM 801 C GLU A 52 8.314 9.628 3.881 1.00 0.00 C ATOM 802 O GLU A 52 8.722 10.777 4.050 1.00 0.00 O ATOM 803 CB GLU A 52 6.642 8.944 2.150 1.00 0.00 C ATOM 804 CG GLU A 52 6.324 9.149 0.679 1.00 0.00 C ATOM 805 CD GLU A 52 6.483 10.592 0.243 1.00 0.00 C ATOM 806 OE1 GLU A 52 6.368 11.489 1.104 1.00 0.00 O ATOM 807 OE2 GLU A 52 6.722 10.825 -0.961 1.00 0.00 O ATOM 0 H GLU A 52 8.165 7.008 2.043 1.00 0.00 H new ATOM 0 HA GLU A 52 8.603 9.738 1.766 1.00 0.00 H new ATOM 0 HB2 GLU A 52 6.286 7.960 2.456 1.00 0.00 H new ATOM 0 HB3 GLU A 52 6.092 9.679 2.738 1.00 0.00 H new ATOM 0 HG2 GLU A 52 6.979 8.518 0.078 1.00 0.00 H new ATOM 0 HG3 GLU A 52 5.302 8.825 0.484 1.00 0.00 H new ATOM 814 N ASP A 53 8.009 8.814 4.886 1.00 0.00 N ATOM 815 CA ASP A 53 8.138 9.234 6.276 1.00 0.00 C ATOM 816 C ASP A 53 9.606 9.391 6.662 1.00 0.00 C ATOM 817 O ASP A 53 9.976 10.330 7.369 1.00 0.00 O ATOM 818 CB ASP A 53 7.460 8.223 7.202 1.00 0.00 C ATOM 819 CG ASP A 53 7.500 8.652 8.656 1.00 0.00 C ATOM 820 OD1 ASP A 53 8.456 9.357 9.041 1.00 0.00 O ATOM 821 OD2 ASP A 53 6.574 8.283 9.408 1.00 0.00 O ATOM 0 H ASP A 53 7.671 7.860 4.764 1.00 0.00 H new ATOM 0 HA ASP A 53 7.646 10.201 6.385 1.00 0.00 H new ATOM 0 HB2 ASP A 53 6.423 8.091 6.894 1.00 0.00 H new ATOM 0 HB3 ASP A 53 7.949 7.255 7.098 1.00 0.00 H new ATOM 826 N LEU A 54 10.437 8.467 6.194 1.00 0.00 N ATOM 827 CA LEU A 54 11.865 8.502 6.491 1.00 0.00 C ATOM 828 C LEU A 54 12.366 9.939 6.588 1.00 0.00 C ATOM 829 O LEU A 54 12.935 10.343 7.603 1.00 0.00 O ATOM 830 CB LEU A 54 12.649 7.749 5.414 1.00 0.00 C ATOM 831 CG LEU A 54 14.170 7.743 5.571 1.00 0.00 C ATOM 832 CD1 LEU A 54 14.571 7.024 6.850 1.00 0.00 C ATOM 833 CD2 LEU A 54 14.828 7.093 4.363 1.00 0.00 C ATOM 0 H LEU A 54 10.147 7.684 5.607 1.00 0.00 H new ATOM 0 HA LEU A 54 12.022 8.016 7.454 1.00 0.00 H new ATOM 0 HB2 LEU A 54 12.302 6.716 5.396 1.00 0.00 H new ATOM 0 HB3 LEU A 54 12.406 8.184 4.445 1.00 0.00 H new ATOM 0 HG LEU A 54 14.514 8.775 5.635 1.00 0.00 H new ATOM 0 HD11 LEU A 54 15.657 7.029 6.945 1.00 0.00 H new ATOM 0 HD12 LEU A 54 14.129 7.532 7.707 1.00 0.00 H new ATOM 0 HD13 LEU A 54 14.215 5.994 6.816 1.00 0.00 H new ATOM 0 HD21 LEU A 54 15.910 7.097 4.492 1.00 0.00 H new ATOM 0 HD22 LEU A 54 14.478 6.065 4.267 1.00 0.00 H new ATOM 0 HD23 LEU A 54 14.568 7.650 3.463 1.00 0.00 H new ATOM 845 N LYS A 55 12.149 10.710 5.528 1.00 0.00 N ATOM 846 CA LYS A 55 12.575 12.104 5.494 1.00 0.00 C ATOM 847 C LYS A 55 12.078 12.854 6.725 1.00 0.00 C ATOM 848 O LYS A 55 12.844 13.553 7.390 1.00 0.00 O ATOM 849 CB LYS A 55 12.057 12.785 4.225 1.00 0.00 C ATOM 850 CG LYS A 55 12.480 12.088 2.944 1.00 0.00 C ATOM 851 CD LYS A 55 11.495 12.347 1.816 1.00 0.00 C ATOM 852 CE LYS A 55 11.433 11.174 0.850 1.00 0.00 C ATOM 853 NZ LYS A 55 12.611 11.142 -0.060 1.00 0.00 N ATOM 0 H LYS A 55 11.680 10.392 4.680 1.00 0.00 H new ATOM 0 HA LYS A 55 13.665 12.126 5.492 1.00 0.00 H new ATOM 0 HB2 LYS A 55 10.968 12.826 4.264 1.00 0.00 H new ATOM 0 HB3 LYS A 55 12.415 13.814 4.204 1.00 0.00 H new ATOM 0 HG2 LYS A 55 13.471 12.435 2.650 1.00 0.00 H new ATOM 0 HG3 LYS A 55 12.558 11.015 3.121 1.00 0.00 H new ATOM 0 HD2 LYS A 55 10.504 12.530 2.232 1.00 0.00 H new ATOM 0 HD3 LYS A 55 11.786 13.249 1.277 1.00 0.00 H new ATOM 0 HE2 LYS A 55 11.384 10.242 1.413 1.00 0.00 H new ATOM 0 HE3 LYS A 55 10.519 11.238 0.259 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 12.399 10.540 -0.881 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 12.826 12.107 -0.384 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 13.432 10.757 0.449 1.00 0.00 H new ATOM 867 N LYS A 56 10.792 12.705 7.025 1.00 0.00 N ATOM 868 CA LYS A 56 10.194 13.366 8.179 1.00 0.00 C ATOM 869 C LYS A 56 10.957 13.029 9.456 1.00 0.00 C ATOM 870 O LYS A 56 11.193 13.897 10.296 1.00 0.00 O ATOM 871 CB LYS A 56 8.727 12.953 8.324 1.00 0.00 C ATOM 872 CG LYS A 56 7.888 13.245 7.093 1.00 0.00 C ATOM 873 CD LYS A 56 7.556 14.724 6.982 1.00 0.00 C ATOM 874 CE LYS A 56 6.833 15.037 5.681 1.00 0.00 C ATOM 875 NZ LYS A 56 5.386 14.693 5.753 1.00 0.00 N ATOM 0 H LYS A 56 10.144 12.132 6.485 1.00 0.00 H new ATOM 0 HA LYS A 56 10.249 14.443 8.019 1.00 0.00 H new ATOM 0 HB2 LYS A 56 8.679 11.886 8.541 1.00 0.00 H new ATOM 0 HB3 LYS A 56 8.295 13.473 9.179 1.00 0.00 H new ATOM 0 HG2 LYS A 56 8.426 12.924 6.201 1.00 0.00 H new ATOM 0 HG3 LYS A 56 6.965 12.666 7.135 1.00 0.00 H new ATOM 0 HD2 LYS A 56 6.934 15.023 7.826 1.00 0.00 H new ATOM 0 HD3 LYS A 56 8.474 15.309 7.039 1.00 0.00 H new ATOM 0 HE2 LYS A 56 6.943 16.097 5.450 1.00 0.00 H new ATOM 0 HE3 LYS A 56 7.298 14.483 4.865 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 4.929 14.921 4.847 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 5.280 13.677 5.948 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 4.937 15.240 6.515 1.00 0.00 H new ATOM 889 N ARG A 57 11.341 11.764 9.594 1.00 0.00 N ATOM 890 CA ARG A 57 12.077 11.313 10.769 1.00 0.00 C ATOM 891 C ARG A 57 13.300 12.193 11.014 1.00 0.00 C ATOM 892 O ARG A 57 13.920 12.709 10.085 1.00 0.00 O ATOM 893 CB ARG A 57 12.510 9.856 10.598 1.00 0.00 C ATOM 894 CG ARG A 57 11.347 8.889 10.445 1.00 0.00 C ATOM 895 CD ARG A 57 10.874 8.369 11.793 1.00 0.00 C ATOM 896 NE ARG A 57 9.649 7.583 11.677 1.00 0.00 N ATOM 897 CZ ARG A 57 9.290 6.649 12.551 1.00 0.00 C ATOM 898 NH1 ARG A 57 10.058 6.387 13.600 1.00 0.00 N ATOM 899 NH2 ARG A 57 8.160 5.975 12.378 1.00 0.00 N ATOM 0 H ARG A 57 11.155 11.034 8.907 1.00 0.00 H new ATOM 0 HA ARG A 57 11.416 11.389 11.633 1.00 0.00 H new ATOM 0 HB2 ARG A 57 13.154 9.778 9.722 1.00 0.00 H new ATOM 0 HB3 ARG A 57 13.107 9.560 11.460 1.00 0.00 H new ATOM 0 HG2 ARG A 57 10.522 9.388 9.936 1.00 0.00 H new ATOM 0 HG3 ARG A 57 11.649 8.051 9.816 1.00 0.00 H new ATOM 0 HD2 ARG A 57 11.657 7.756 12.240 1.00 0.00 H new ATOM 0 HD3 ARG A 57 10.703 9.209 12.466 1.00 0.00 H new ATOM 0 HE ARG A 57 9.035 7.761 10.882 1.00 0.00 H new ATOM 0 HH11 ARG A 57 10.927 6.903 13.738 1.00 0.00 H new ATOM 0 HH12 ARG A 57 9.780 5.669 14.269 1.00 0.00 H new ATOM 0 HH21 ARG A 57 7.566 6.174 11.573 1.00 0.00 H new ATOM 0 HH22 ARG A 57 7.886 5.258 13.050 1.00 0.00 H new ATOM 913 N PRO A 58 13.655 12.368 12.296 1.00 0.00 N ATOM 914 CA PRO A 58 14.806 13.185 12.693 1.00 0.00 C ATOM 915 C PRO A 58 16.134 12.540 12.311 1.00 0.00 C ATOM 916 O PRO A 58 16.201 11.336 12.065 1.00 0.00 O ATOM 917 CB PRO A 58 14.671 13.270 14.216 1.00 0.00 C ATOM 918 CG PRO A 58 13.902 12.052 14.597 1.00 0.00 C ATOM 919 CD PRO A 58 12.961 11.783 13.455 1.00 0.00 C ATOM 0 HA PRO A 58 14.808 14.155 12.196 1.00 0.00 H new ATOM 0 HB2 PRO A 58 15.648 13.289 14.700 1.00 0.00 H new ATOM 0 HB3 PRO A 58 14.149 14.178 14.517 1.00 0.00 H new ATOM 0 HG2 PRO A 58 14.568 11.205 14.761 1.00 0.00 H new ATOM 0 HG3 PRO A 58 13.354 12.211 15.525 1.00 0.00 H new ATOM 0 HD2 PRO A 58 12.786 10.715 13.322 1.00 0.00 H new ATOM 0 HD3 PRO A 58 11.989 12.248 13.618 1.00 0.00 H new ATOM 927 N ILE A 59 17.187 13.349 12.264 1.00 0.00 N ATOM 928 CA ILE A 59 18.513 12.856 11.914 1.00 0.00 C ATOM 929 C ILE A 59 18.911 11.676 12.794 1.00 0.00 C ATOM 930 O ILE A 59 19.587 10.751 12.343 1.00 0.00 O ATOM 931 CB ILE A 59 19.577 13.962 12.044 1.00 0.00 C ATOM 932 CG1 ILE A 59 20.929 13.462 11.530 1.00 0.00 C ATOM 933 CG2 ILE A 59 19.691 14.419 13.491 1.00 0.00 C ATOM 934 CD1 ILE A 59 21.004 13.369 10.022 1.00 0.00 C ATOM 0 H ILE A 59 17.147 14.348 12.464 1.00 0.00 H new ATOM 0 HA ILE A 59 18.465 12.530 10.875 1.00 0.00 H new ATOM 0 HB ILE A 59 19.271 14.814 11.437 1.00 0.00 H new ATOM 0 HG12 ILE A 59 21.713 14.131 11.884 1.00 0.00 H new ATOM 0 HG13 ILE A 59 21.131 12.480 11.957 1.00 0.00 H new ATOM 0 HG21 ILE A 59 20.447 15.201 13.567 1.00 0.00 H new ATOM 0 HG22 ILE A 59 18.730 14.809 13.826 1.00 0.00 H new ATOM 0 HG23 ILE A 59 19.978 13.575 14.118 1.00 0.00 H new ATOM 0 HD11 ILE A 59 21.990 13.008 9.728 1.00 0.00 H new ATOM 0 HD12 ILE A 59 20.242 12.678 9.662 1.00 0.00 H new ATOM 0 HD13 ILE A 59 20.834 14.354 9.588 1.00 0.00 H new ATOM 946 N LYS A 60 18.487 11.714 14.052 1.00 0.00 N ATOM 947 CA LYS A 60 18.796 10.648 14.997 1.00 0.00 C ATOM 948 C LYS A 60 18.216 9.318 14.525 1.00 0.00 C ATOM 949 O LYS A 60 18.765 8.255 14.813 1.00 0.00 O ATOM 950 CB LYS A 60 18.247 10.991 16.384 1.00 0.00 C ATOM 951 CG LYS A 60 16.730 11.027 16.445 1.00 0.00 C ATOM 952 CD LYS A 60 16.231 11.072 17.880 1.00 0.00 C ATOM 953 CE LYS A 60 16.518 12.417 18.528 1.00 0.00 C ATOM 954 NZ LYS A 60 16.206 12.410 19.984 1.00 0.00 N ATOM 0 H LYS A 60 17.927 12.473 14.441 1.00 0.00 H new ATOM 0 HA LYS A 60 19.880 10.553 15.056 1.00 0.00 H new ATOM 0 HB2 LYS A 60 18.614 10.258 17.102 1.00 0.00 H new ATOM 0 HB3 LYS A 60 18.638 11.961 16.691 1.00 0.00 H new ATOM 0 HG2 LYS A 60 16.364 11.899 15.904 1.00 0.00 H new ATOM 0 HG3 LYS A 60 16.324 10.148 15.945 1.00 0.00 H new ATOM 0 HD2 LYS A 60 15.158 10.879 17.899 1.00 0.00 H new ATOM 0 HD3 LYS A 60 16.708 10.280 18.457 1.00 0.00 H new ATOM 0 HE2 LYS A 60 17.567 12.673 18.383 1.00 0.00 H new ATOM 0 HE3 LYS A 60 15.930 13.191 18.034 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 16.415 13.345 20.388 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 15.199 12.191 20.122 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 16.786 11.689 20.460 1.00 0.00 H new ATOM 968 N GLU A 61 17.106 9.386 13.797 1.00 0.00 N ATOM 969 CA GLU A 61 16.454 8.187 13.284 1.00 0.00 C ATOM 970 C GLU A 61 16.528 8.136 11.761 1.00 0.00 C ATOM 971 O GLU A 61 15.822 7.359 11.119 1.00 0.00 O ATOM 972 CB GLU A 61 14.993 8.141 13.736 1.00 0.00 C ATOM 973 CG GLU A 61 14.818 7.718 15.185 1.00 0.00 C ATOM 974 CD GLU A 61 15.311 6.308 15.445 1.00 0.00 C ATOM 975 OE1 GLU A 61 15.111 5.439 14.570 1.00 0.00 O ATOM 976 OE2 GLU A 61 15.895 6.072 16.523 1.00 0.00 O ATOM 0 H GLU A 61 16.640 10.259 13.549 1.00 0.00 H new ATOM 0 HA GLU A 61 16.979 7.320 13.685 1.00 0.00 H new ATOM 0 HB2 GLU A 61 14.547 9.126 13.597 1.00 0.00 H new ATOM 0 HB3 GLU A 61 14.445 7.450 13.096 1.00 0.00 H new ATOM 0 HG2 GLU A 61 15.357 8.412 15.830 1.00 0.00 H new ATOM 0 HG3 GLU A 61 13.764 7.786 15.455 1.00 0.00 H new ATOM 983 N VAL A 62 17.389 8.971 11.188 1.00 0.00 N ATOM 984 CA VAL A 62 17.557 9.022 9.740 1.00 0.00 C ATOM 985 C VAL A 62 18.296 7.790 9.229 1.00 0.00 C ATOM 986 O VAL A 62 17.794 7.037 8.395 1.00 0.00 O ATOM 987 CB VAL A 62 18.326 10.285 9.309 1.00 0.00 C ATOM 988 CG1 VAL A 62 19.157 10.005 8.065 1.00 0.00 C ATOM 989 CG2 VAL A 62 17.364 11.438 9.069 1.00 0.00 C ATOM 0 H VAL A 62 17.981 9.622 11.704 1.00 0.00 H new ATOM 0 HA VAL A 62 16.558 9.048 9.305 1.00 0.00 H new ATOM 0 HB VAL A 62 19.004 10.569 10.114 1.00 0.00 H new ATOM 0 HG11 VAL A 62 19.693 10.908 7.775 1.00 0.00 H new ATOM 0 HG12 VAL A 62 19.872 9.210 8.277 1.00 0.00 H new ATOM 0 HG13 VAL A 62 18.501 9.695 7.251 1.00 0.00 H new ATOM 0 HG21 VAL A 62 17.924 12.322 8.765 1.00 0.00 H new ATOM 0 HG22 VAL A 62 16.660 11.167 8.282 1.00 0.00 H new ATOM 0 HG23 VAL A 62 16.817 11.653 9.987 1.00 0.00 H new ATOM 999 N PRO A 63 19.518 7.579 9.741 1.00 0.00 N ATOM 1000 CA PRO A 63 20.353 6.439 9.351 1.00 0.00 C ATOM 1001 C PRO A 63 19.801 5.114 9.866 1.00 0.00 C ATOM 1002 O PRO A 63 19.640 4.160 9.105 1.00 0.00 O ATOM 1003 CB PRO A 63 21.702 6.747 10.006 1.00 0.00 C ATOM 1004 CG PRO A 63 21.370 7.623 11.163 1.00 0.00 C ATOM 1005 CD PRO A 63 20.179 8.437 10.739 1.00 0.00 C ATOM 0 HA PRO A 63 20.406 6.324 8.268 1.00 0.00 H new ATOM 0 HB2 PRO A 63 22.202 5.834 10.331 1.00 0.00 H new ATOM 0 HB3 PRO A 63 22.375 7.248 9.310 1.00 0.00 H new ATOM 0 HG2 PRO A 63 21.142 7.030 12.049 1.00 0.00 H new ATOM 0 HG3 PRO A 63 22.211 8.267 11.419 1.00 0.00 H new ATOM 0 HD2 PRO A 63 19.521 8.655 11.580 1.00 0.00 H new ATOM 0 HD3 PRO A 63 20.478 9.394 10.311 1.00 0.00 H new ATOM 1013 N SER A 64 19.513 5.062 11.163 1.00 0.00 N ATOM 1014 CA SER A 64 18.982 3.852 11.780 1.00 0.00 C ATOM 1015 C SER A 64 17.893 3.232 10.911 1.00 0.00 C ATOM 1016 O SER A 64 17.791 2.010 10.802 1.00 0.00 O ATOM 1017 CB SER A 64 18.424 4.166 13.170 1.00 0.00 C ATOM 1018 OG SER A 64 19.460 4.222 14.135 1.00 0.00 O ATOM 0 H SER A 64 19.638 5.843 11.806 1.00 0.00 H new ATOM 0 HA SER A 64 19.797 3.135 11.877 1.00 0.00 H new ATOM 0 HB2 SER A 64 17.894 5.118 13.146 1.00 0.00 H new ATOM 0 HB3 SER A 64 17.698 3.404 13.455 1.00 0.00 H new ATOM 0 HG SER A 64 19.078 4.426 15.014 1.00 0.00 H new ATOM 1024 N ARG A 65 17.080 4.083 10.293 1.00 0.00 N ATOM 1025 CA ARG A 65 15.998 3.620 9.434 1.00 0.00 C ATOM 1026 C ARG A 65 16.530 3.203 8.066 1.00 0.00 C ATOM 1027 O ARG A 65 16.153 2.158 7.534 1.00 0.00 O ATOM 1028 CB ARG A 65 14.943 4.716 9.270 1.00 0.00 C ATOM 1029 CG ARG A 65 13.548 4.182 8.990 1.00 0.00 C ATOM 1030 CD ARG A 65 12.840 3.774 10.272 1.00 0.00 C ATOM 1031 NE ARG A 65 11.390 3.919 10.167 1.00 0.00 N ATOM 1032 CZ ARG A 65 10.526 3.197 10.871 1.00 0.00 C ATOM 1033 NH1 ARG A 65 10.963 2.284 11.728 1.00 0.00 N ATOM 1034 NH2 ARG A 65 9.222 3.387 10.720 1.00 0.00 N ATOM 0 H ARG A 65 17.151 5.097 10.372 1.00 0.00 H new ATOM 0 HA ARG A 65 15.539 2.752 9.907 1.00 0.00 H new ATOM 0 HB2 ARG A 65 14.916 5.321 10.176 1.00 0.00 H new ATOM 0 HB3 ARG A 65 15.241 5.376 8.455 1.00 0.00 H new ATOM 0 HG2 ARG A 65 12.962 4.944 8.476 1.00 0.00 H new ATOM 0 HG3 ARG A 65 13.613 3.324 8.320 1.00 0.00 H new ATOM 0 HD2 ARG A 65 13.085 2.738 10.507 1.00 0.00 H new ATOM 0 HD3 ARG A 65 13.206 4.383 11.098 1.00 0.00 H new ATOM 0 HE ARG A 65 11.021 4.613 9.517 1.00 0.00 H new ATOM 0 HH11 ARG A 65 11.965 2.135 11.848 1.00 0.00 H new ATOM 0 HH12 ARG A 65 10.297 1.731 12.267 1.00 0.00 H new ATOM 0 HH21 ARG A 65 8.882 4.088 10.062 1.00 0.00 H new ATOM 0 HH22 ARG A 65 8.560 2.832 11.261 1.00 0.00 H new ATOM 1048 N VAL A 66 17.407 4.027 7.501 1.00 0.00 N ATOM 1049 CA VAL A 66 17.991 3.744 6.196 1.00 0.00 C ATOM 1050 C VAL A 66 18.257 2.253 6.024 1.00 0.00 C ATOM 1051 O VAL A 66 17.640 1.595 5.186 1.00 0.00 O ATOM 1052 CB VAL A 66 19.308 4.516 5.991 1.00 0.00 C ATOM 1053 CG1 VAL A 66 20.070 3.965 4.795 1.00 0.00 C ATOM 1054 CG2 VAL A 66 19.033 6.002 5.819 1.00 0.00 C ATOM 0 H VAL A 66 17.728 4.896 7.927 1.00 0.00 H new ATOM 0 HA VAL A 66 17.267 4.069 5.449 1.00 0.00 H new ATOM 0 HB VAL A 66 19.927 4.384 6.878 1.00 0.00 H new ATOM 0 HG11 VAL A 66 20.997 4.523 4.666 1.00 0.00 H new ATOM 0 HG12 VAL A 66 20.300 2.913 4.963 1.00 0.00 H new ATOM 0 HG13 VAL A 66 19.459 4.064 3.898 1.00 0.00 H new ATOM 0 HG21 VAL A 66 19.975 6.532 5.675 1.00 0.00 H new ATOM 0 HG22 VAL A 66 18.394 6.155 4.950 1.00 0.00 H new ATOM 0 HG23 VAL A 66 18.533 6.385 6.709 1.00 0.00 H new ATOM 1064 N GLN A 67 19.178 1.726 6.825 1.00 0.00 N ATOM 1065 CA GLN A 67 19.525 0.311 6.761 1.00 0.00 C ATOM 1066 C GLN A 67 18.303 -0.562 7.023 1.00 0.00 C ATOM 1067 O GLN A 67 18.054 -1.529 6.304 1.00 0.00 O ATOM 1068 CB GLN A 67 20.625 -0.012 7.774 1.00 0.00 C ATOM 1069 CG GLN A 67 20.139 -0.027 9.215 1.00 0.00 C ATOM 1070 CD GLN A 67 21.278 -0.031 10.215 1.00 0.00 C ATOM 1071 OE1 GLN A 67 22.261 -0.754 10.050 1.00 0.00 O ATOM 1072 NE2 GLN A 67 21.152 0.778 11.260 1.00 0.00 N ATOM 0 H GLN A 67 19.697 2.257 7.525 1.00 0.00 H new ATOM 0 HA GLN A 67 19.892 0.098 5.757 1.00 0.00 H new ATOM 0 HB2 GLN A 67 21.055 -0.985 7.534 1.00 0.00 H new ATOM 0 HB3 GLN A 67 21.425 0.722 7.676 1.00 0.00 H new ATOM 0 HG2 GLN A 67 19.509 0.845 9.391 1.00 0.00 H new ATOM 0 HG3 GLN A 67 19.517 -0.907 9.375 1.00 0.00 H new ATOM 0 HE21 GLN A 67 20.320 1.360 11.357 1.00 0.00 H new ATOM 0 HE22 GLN A 67 21.887 0.818 11.966 1.00 0.00 H new ATOM 1081 N GLU A 68 17.544 -0.214 8.058 1.00 0.00 N ATOM 1082 CA GLU A 68 16.348 -0.968 8.415 1.00 0.00 C ATOM 1083 C GLU A 68 15.491 -1.244 7.183 1.00 0.00 C ATOM 1084 O GLU A 68 15.307 -2.395 6.786 1.00 0.00 O ATOM 1085 CB GLU A 68 15.530 -0.205 9.459 1.00 0.00 C ATOM 1086 CG GLU A 68 16.015 -0.414 10.883 1.00 0.00 C ATOM 1087 CD GLU A 68 15.834 -1.843 11.358 1.00 0.00 C ATOM 1088 OE1 GLU A 68 16.723 -2.676 11.085 1.00 0.00 O ATOM 1089 OE2 GLU A 68 14.803 -2.127 12.002 1.00 0.00 O ATOM 0 H GLU A 68 17.736 0.584 8.663 1.00 0.00 H new ATOM 0 HA GLU A 68 16.663 -1.922 8.838 1.00 0.00 H new ATOM 0 HB2 GLU A 68 15.561 0.859 9.226 1.00 0.00 H new ATOM 0 HB3 GLU A 68 14.488 -0.516 9.390 1.00 0.00 H new ATOM 0 HG2 GLU A 68 17.069 -0.145 10.947 1.00 0.00 H new ATOM 0 HG3 GLU A 68 15.474 0.258 11.549 1.00 0.00 H new ATOM 1096 N ILE A 69 14.968 -0.180 6.583 1.00 0.00 N ATOM 1097 CA ILE A 69 14.131 -0.307 5.396 1.00 0.00 C ATOM 1098 C ILE A 69 14.754 -1.262 4.384 1.00 0.00 C ATOM 1099 O ILE A 69 14.065 -2.096 3.797 1.00 0.00 O ATOM 1100 CB ILE A 69 13.899 1.059 4.723 1.00 0.00 C ATOM 1101 CG1 ILE A 69 13.162 2.003 5.674 1.00 0.00 C ATOM 1102 CG2 ILE A 69 13.118 0.885 3.429 1.00 0.00 C ATOM 1103 CD1 ILE A 69 13.397 3.467 5.376 1.00 0.00 C ATOM 0 H ILE A 69 15.109 0.779 6.899 1.00 0.00 H new ATOM 0 HA ILE A 69 13.172 -0.707 5.726 1.00 0.00 H new ATOM 0 HB ILE A 69 14.867 1.499 4.484 1.00 0.00 H new ATOM 0 HG12 ILE A 69 12.093 1.797 5.621 1.00 0.00 H new ATOM 0 HG13 ILE A 69 13.477 1.794 6.696 1.00 0.00 H new ATOM 0 HG21 ILE A 69 12.962 1.859 2.965 1.00 0.00 H new ATOM 0 HG22 ILE A 69 13.679 0.244 2.749 1.00 0.00 H new ATOM 0 HG23 ILE A 69 12.153 0.427 3.645 1.00 0.00 H new ATOM 0 HD11 ILE A 69 12.844 4.077 6.090 1.00 0.00 H new ATOM 0 HD12 ILE A 69 14.461 3.689 5.458 1.00 0.00 H new ATOM 0 HD13 ILE A 69 13.056 3.692 4.365 1.00 0.00 H new ATOM 1115 N TRP A 70 16.061 -1.134 4.185 1.00 0.00 N ATOM 1116 CA TRP A 70 16.778 -1.988 3.244 1.00 0.00 C ATOM 1117 C TRP A 70 16.920 -3.403 3.793 1.00 0.00 C ATOM 1118 O TRP A 70 17.066 -4.360 3.033 1.00 0.00 O ATOM 1119 CB TRP A 70 18.159 -1.403 2.944 1.00 0.00 C ATOM 1120 CG TRP A 70 19.222 -2.446 2.780 1.00 0.00 C ATOM 1121 CD1 TRP A 70 19.811 -3.179 3.770 1.00 0.00 C ATOM 1122 CD2 TRP A 70 19.824 -2.870 1.552 1.00 0.00 C ATOM 1123 NE1 TRP A 70 20.743 -4.033 3.232 1.00 0.00 N ATOM 1124 CE2 TRP A 70 20.770 -3.864 1.873 1.00 0.00 C ATOM 1125 CE3 TRP A 70 19.656 -2.509 0.213 1.00 0.00 C ATOM 1126 CZ2 TRP A 70 21.542 -4.497 0.903 1.00 0.00 C ATOM 1127 CZ3 TRP A 70 20.423 -3.139 -0.749 1.00 0.00 C ATOM 1128 CH2 TRP A 70 21.356 -4.124 -0.400 1.00 0.00 C ATOM 0 H TRP A 70 16.646 -0.448 4.662 1.00 0.00 H new ATOM 0 HA TRP A 70 16.202 -2.033 2.320 1.00 0.00 H new ATOM 0 HB2 TRP A 70 18.103 -0.805 2.034 1.00 0.00 H new ATOM 0 HB3 TRP A 70 18.443 -0.728 3.752 1.00 0.00 H new ATOM 0 HD1 TRP A 70 19.578 -3.099 4.822 1.00 0.00 H new ATOM 0 HE1 TRP A 70 21.321 -4.687 3.759 1.00 0.00 H new ATOM 0 HE3 TRP A 70 18.939 -1.751 -0.066 1.00 0.00 H new ATOM 0 HZ2 TRP A 70 22.263 -5.256 1.170 1.00 0.00 H new ATOM 0 HZ3 TRP A 70 20.301 -2.867 -1.787 1.00 0.00 H new ATOM 0 HH2 TRP A 70 21.940 -4.598 -1.175 1.00 0.00 H new ATOM 1139 N GLN A 71 16.875 -3.528 5.115 1.00 0.00 N ATOM 1140 CA GLN A 71 17.000 -4.828 5.764 1.00 0.00 C ATOM 1141 C GLN A 71 15.659 -5.554 5.789 1.00 0.00 C ATOM 1142 O GLN A 71 15.579 -6.714 6.193 1.00 0.00 O ATOM 1143 CB GLN A 71 17.531 -4.662 7.188 1.00 0.00 C ATOM 1144 CG GLN A 71 19.012 -4.327 7.250 1.00 0.00 C ATOM 1145 CD GLN A 71 19.650 -4.737 8.563 1.00 0.00 C ATOM 1146 OE1 GLN A 71 19.553 -4.025 9.563 1.00 0.00 O ATOM 1147 NE2 GLN A 71 20.306 -5.892 8.568 1.00 0.00 N ATOM 0 H GLN A 71 16.753 -2.745 5.758 1.00 0.00 H new ATOM 0 HA GLN A 71 17.706 -5.427 5.189 1.00 0.00 H new ATOM 0 HB2 GLN A 71 16.968 -3.874 7.687 1.00 0.00 H new ATOM 0 HB3 GLN A 71 17.352 -5.583 7.743 1.00 0.00 H new ATOM 0 HG2 GLN A 71 19.528 -4.825 6.429 1.00 0.00 H new ATOM 0 HG3 GLN A 71 19.144 -3.255 7.106 1.00 0.00 H new ATOM 0 HE21 GLN A 71 20.362 -6.451 7.716 1.00 0.00 H new ATOM 0 HE22 GLN A 71 20.754 -6.220 9.423 1.00 0.00 H new ATOM 1156 N GLU A 72 14.609 -4.864 5.356 1.00 0.00 N ATOM 1157 CA GLU A 72 13.271 -5.443 5.332 1.00 0.00 C ATOM 1158 C GLU A 72 12.831 -5.736 3.900 1.00 0.00 C ATOM 1159 O GLU A 72 12.392 -6.842 3.587 1.00 0.00 O ATOM 1160 CB GLU A 72 12.270 -4.500 6.002 1.00 0.00 C ATOM 1161 CG GLU A 72 10.993 -5.190 6.454 1.00 0.00 C ATOM 1162 CD GLU A 72 11.143 -5.872 7.799 1.00 0.00 C ATOM 1163 OE1 GLU A 72 11.932 -6.835 7.892 1.00 0.00 O ATOM 1164 OE2 GLU A 72 10.471 -5.441 8.760 1.00 0.00 O ATOM 0 H GLU A 72 14.659 -3.903 5.017 1.00 0.00 H new ATOM 0 HA GLU A 72 13.300 -6.382 5.885 1.00 0.00 H new ATOM 0 HB2 GLU A 72 12.745 -4.032 6.864 1.00 0.00 H new ATOM 0 HB3 GLU A 72 12.015 -3.701 5.306 1.00 0.00 H new ATOM 0 HG2 GLU A 72 10.189 -4.457 6.511 1.00 0.00 H new ATOM 0 HG3 GLU A 72 10.699 -5.928 5.707 1.00 0.00 H new ATOM 1171 N PHE A 73 12.952 -4.735 3.034 1.00 0.00 N ATOM 1172 CA PHE A 73 12.566 -4.883 1.636 1.00 0.00 C ATOM 1173 C PHE A 73 13.783 -5.181 0.764 1.00 0.00 C ATOM 1174 O PHE A 73 13.876 -6.246 0.152 1.00 0.00 O ATOM 1175 CB PHE A 73 11.868 -3.614 1.140 1.00 0.00 C ATOM 1176 CG PHE A 73 10.720 -3.184 2.008 1.00 0.00 C ATOM 1177 CD1 PHE A 73 10.933 -2.376 3.112 1.00 0.00 C ATOM 1178 CD2 PHE A 73 9.427 -3.588 1.718 1.00 0.00 C ATOM 1179 CE1 PHE A 73 9.878 -1.980 3.912 1.00 0.00 C ATOM 1180 CE2 PHE A 73 8.367 -3.195 2.514 1.00 0.00 C ATOM 1181 CZ PHE A 73 8.594 -2.389 3.612 1.00 0.00 C ATOM 0 H PHE A 73 13.314 -3.813 3.276 1.00 0.00 H new ATOM 0 HA PHE A 73 11.874 -5.722 1.563 1.00 0.00 H new ATOM 0 HB2 PHE A 73 12.597 -2.805 1.087 1.00 0.00 H new ATOM 0 HB3 PHE A 73 11.504 -3.781 0.126 1.00 0.00 H new ATOM 0 HD1 PHE A 73 11.935 -2.052 3.351 1.00 0.00 H new ATOM 0 HD2 PHE A 73 9.245 -4.218 0.860 1.00 0.00 H new ATOM 0 HE1 PHE A 73 10.058 -1.351 4.771 1.00 0.00 H new ATOM 0 HE2 PHE A 73 7.364 -3.518 2.278 1.00 0.00 H new ATOM 0 HZ PHE A 73 7.768 -2.079 4.235 1.00 0.00 H new ATOM 1191 N LEU A 74 14.712 -4.234 0.713 1.00 0.00 N ATOM 1192 CA LEU A 74 15.924 -4.393 -0.084 1.00 0.00 C ATOM 1193 C LEU A 74 16.855 -5.426 0.542 1.00 0.00 C ATOM 1194 O LEU A 74 18.044 -5.477 0.227 1.00 0.00 O ATOM 1195 CB LEU A 74 16.648 -3.053 -0.220 1.00 0.00 C ATOM 1196 CG LEU A 74 15.787 -1.865 -0.649 1.00 0.00 C ATOM 1197 CD1 LEU A 74 16.644 -0.621 -0.827 1.00 0.00 C ATOM 1198 CD2 LEU A 74 15.037 -2.186 -1.934 1.00 0.00 C ATOM 0 H LEU A 74 14.650 -3.348 1.214 1.00 0.00 H new ATOM 0 HA LEU A 74 15.635 -4.744 -1.074 1.00 0.00 H new ATOM 0 HB2 LEU A 74 17.110 -2.814 0.738 1.00 0.00 H new ATOM 0 HB3 LEU A 74 17.455 -3.171 -0.943 1.00 0.00 H new ATOM 0 HG LEU A 74 15.056 -1.669 0.136 1.00 0.00 H new ATOM 0 HD11 LEU A 74 16.014 0.214 -1.132 1.00 0.00 H new ATOM 0 HD12 LEU A 74 17.135 -0.379 0.116 1.00 0.00 H new ATOM 0 HD13 LEU A 74 17.398 -0.805 -1.592 1.00 0.00 H new ATOM 0 HD21 LEU A 74 14.429 -1.329 -2.224 1.00 0.00 H new ATOM 0 HD22 LEU A 74 15.752 -2.409 -2.726 1.00 0.00 H new ATOM 0 HD23 LEU A 74 14.392 -3.050 -1.773 1.00 0.00 H new ATOM 1210 N ALA A 75 16.306 -6.250 1.428 1.00 0.00 N ATOM 1211 CA ALA A 75 17.086 -7.285 2.095 1.00 0.00 C ATOM 1212 C ALA A 75 16.600 -8.677 1.704 1.00 0.00 C ATOM 1213 O ALA A 75 15.406 -8.914 1.520 1.00 0.00 O ATOM 1214 CB ALA A 75 17.021 -7.105 3.604 1.00 0.00 C ATOM 0 H ALA A 75 15.324 -6.221 1.701 1.00 0.00 H new ATOM 0 HA ALA A 75 18.123 -7.188 1.773 1.00 0.00 H new ATOM 0 HB1 ALA A 75 17.608 -7.885 4.089 1.00 0.00 H new ATOM 0 HB2 ALA A 75 17.424 -6.128 3.872 1.00 0.00 H new ATOM 0 HB3 ALA A 75 15.984 -7.173 3.934 1.00 0.00 H new ATOM 1220 N PRO A 76 17.544 -9.620 1.574 1.00 0.00 N ATOM 1221 CA PRO A 76 17.235 -11.004 1.204 1.00 0.00 C ATOM 1222 C PRO A 76 16.504 -11.752 2.313 1.00 0.00 C ATOM 1223 O PRO A 76 16.507 -11.326 3.468 1.00 0.00 O ATOM 1224 CB PRO A 76 18.614 -11.623 0.961 1.00 0.00 C ATOM 1225 CG PRO A 76 19.547 -10.803 1.783 1.00 0.00 C ATOM 1226 CD PRO A 76 18.987 -9.408 1.778 1.00 0.00 C ATOM 0 HA PRO A 76 16.571 -11.056 0.341 1.00 0.00 H new ATOM 0 HB2 PRO A 76 18.637 -12.670 1.263 1.00 0.00 H new ATOM 0 HB3 PRO A 76 18.883 -11.589 -0.095 1.00 0.00 H new ATOM 0 HG2 PRO A 76 19.617 -11.192 2.799 1.00 0.00 H new ATOM 0 HG3 PRO A 76 20.554 -10.821 1.365 1.00 0.00 H new ATOM 0 HD2 PRO A 76 19.188 -8.891 2.716 1.00 0.00 H new ATOM 0 HD3 PRO A 76 19.421 -8.804 0.981 1.00 0.00 H new ATOM 1234 N GLY A 77 15.878 -12.869 1.956 1.00 0.00 N ATOM 1235 CA GLY A 77 15.152 -13.658 2.934 1.00 0.00 C ATOM 1236 C GLY A 77 14.329 -12.801 3.875 1.00 0.00 C ATOM 1237 O GLY A 77 13.978 -13.233 4.972 1.00 0.00 O ATOM 0 H GLY A 77 15.861 -13.242 1.007 1.00 0.00 H new ATOM 0 HA2 GLY A 77 14.495 -14.358 2.417 1.00 0.00 H new ATOM 0 HA3 GLY A 77 15.858 -14.253 3.513 1.00 0.00 H new ATOM 1241 N ALA A 78 14.022 -11.581 3.445 1.00 0.00 N ATOM 1242 CA ALA A 78 13.235 -10.661 4.257 1.00 0.00 C ATOM 1243 C ALA A 78 11.741 -10.912 4.079 1.00 0.00 C ATOM 1244 O ALA A 78 11.293 -11.438 3.060 1.00 0.00 O ATOM 1245 CB ALA A 78 13.576 -9.221 3.904 1.00 0.00 C ATOM 0 H ALA A 78 14.306 -11.207 2.539 1.00 0.00 H new ATOM 0 HA ALA A 78 13.484 -10.835 5.304 1.00 0.00 H new ATOM 0 HB1 ALA A 78 12.981 -8.545 4.518 1.00 0.00 H new ATOM 0 HB2 ALA A 78 14.635 -9.042 4.089 1.00 0.00 H new ATOM 0 HB3 ALA A 78 13.357 -9.043 2.851 1.00 0.00 H new ATOM 1251 N PRO A 79 10.951 -10.527 5.092 1.00 0.00 N ATOM 1252 CA PRO A 79 9.495 -10.701 5.071 1.00 0.00 C ATOM 1253 C PRO A 79 8.817 -9.779 4.063 1.00 0.00 C ATOM 1254 O PRO A 79 7.831 -10.156 3.430 1.00 0.00 O ATOM 1255 CB PRO A 79 9.074 -10.337 6.496 1.00 0.00 C ATOM 1256 CG PRO A 79 10.145 -9.426 6.987 1.00 0.00 C ATOM 1257 CD PRO A 79 11.417 -9.894 6.337 1.00 0.00 C ATOM 0 HA PRO A 79 9.209 -11.709 4.772 1.00 0.00 H new ATOM 0 HB2 PRO A 79 8.101 -9.846 6.508 1.00 0.00 H new ATOM 0 HB3 PRO A 79 8.991 -11.225 7.123 1.00 0.00 H new ATOM 0 HG2 PRO A 79 9.929 -8.391 6.722 1.00 0.00 H new ATOM 0 HG3 PRO A 79 10.224 -9.467 8.073 1.00 0.00 H new ATOM 0 HD2 PRO A 79 12.095 -9.064 6.137 1.00 0.00 H new ATOM 0 HD3 PRO A 79 11.955 -10.600 6.970 1.00 0.00 H new ATOM 1265 N SER A 80 9.351 -8.571 3.919 1.00 0.00 N ATOM 1266 CA SER A 80 8.795 -7.595 2.990 1.00 0.00 C ATOM 1267 C SER A 80 9.723 -7.389 1.797 1.00 0.00 C ATOM 1268 O SER A 80 9.617 -6.396 1.078 1.00 0.00 O ATOM 1269 CB SER A 80 8.556 -6.261 3.701 1.00 0.00 C ATOM 1270 OG SER A 80 7.611 -6.403 4.748 1.00 0.00 O ATOM 0 H SER A 80 10.169 -8.245 4.434 1.00 0.00 H new ATOM 0 HA SER A 80 7.843 -7.980 2.625 1.00 0.00 H new ATOM 0 HB2 SER A 80 9.497 -5.887 4.104 1.00 0.00 H new ATOM 0 HB3 SER A 80 8.200 -5.522 2.984 1.00 0.00 H new ATOM 0 HG SER A 80 7.477 -5.537 5.188 1.00 0.00 H new ATOM 1276 N ALA A 81 10.634 -8.335 1.594 1.00 0.00 N ATOM 1277 CA ALA A 81 11.581 -8.260 0.488 1.00 0.00 C ATOM 1278 C ALA A 81 10.861 -8.025 -0.835 1.00 0.00 C ATOM 1279 O ALA A 81 10.076 -8.862 -1.283 1.00 0.00 O ATOM 1280 CB ALA A 81 12.414 -9.531 0.420 1.00 0.00 C ATOM 0 H ALA A 81 10.736 -9.163 2.181 1.00 0.00 H new ATOM 0 HA ALA A 81 12.244 -7.414 0.666 1.00 0.00 H new ATOM 0 HB1 ALA A 81 13.117 -9.461 -0.410 1.00 0.00 H new ATOM 0 HB2 ALA A 81 12.965 -9.655 1.352 1.00 0.00 H new ATOM 0 HB3 ALA A 81 11.758 -10.388 0.269 1.00 0.00 H new ATOM 1286 N ILE A 82 11.132 -6.883 -1.457 1.00 0.00 N ATOM 1287 CA ILE A 82 10.510 -6.539 -2.729 1.00 0.00 C ATOM 1288 C ILE A 82 11.404 -6.929 -3.901 1.00 0.00 C ATOM 1289 O ILE A 82 12.470 -7.514 -3.714 1.00 0.00 O ATOM 1290 CB ILE A 82 10.199 -5.033 -2.815 1.00 0.00 C ATOM 1291 CG1 ILE A 82 11.496 -4.222 -2.831 1.00 0.00 C ATOM 1292 CG2 ILE A 82 9.315 -4.608 -1.652 1.00 0.00 C ATOM 1293 CD1 ILE A 82 11.346 -2.856 -3.463 1.00 0.00 C ATOM 0 H ILE A 82 11.779 -6.180 -1.100 1.00 0.00 H new ATOM 0 HA ILE A 82 9.576 -7.098 -2.785 1.00 0.00 H new ATOM 0 HB ILE A 82 9.662 -4.840 -3.743 1.00 0.00 H new ATOM 0 HG12 ILE A 82 11.853 -4.103 -1.808 1.00 0.00 H new ATOM 0 HG13 ILE A 82 12.259 -4.782 -3.372 1.00 0.00 H new ATOM 0 HG21 ILE A 82 9.104 -3.541 -1.726 1.00 0.00 H new ATOM 0 HG22 ILE A 82 8.379 -5.166 -1.683 1.00 0.00 H new ATOM 0 HG23 ILE A 82 9.828 -4.812 -0.712 1.00 0.00 H new ATOM 0 HD11 ILE A 82 12.304 -2.337 -3.440 1.00 0.00 H new ATOM 0 HD12 ILE A 82 11.018 -2.967 -4.497 1.00 0.00 H new ATOM 0 HD13 ILE A 82 10.607 -2.278 -2.909 1.00 0.00 H new ATOM 1305 N ASN A 83 10.962 -6.600 -5.111 1.00 0.00 N ATOM 1306 CA ASN A 83 11.723 -6.915 -6.315 1.00 0.00 C ATOM 1307 C ASN A 83 11.868 -5.684 -7.204 1.00 0.00 C ATOM 1308 O ASN A 83 10.881 -5.032 -7.547 1.00 0.00 O ATOM 1309 CB ASN A 83 11.043 -8.043 -7.093 1.00 0.00 C ATOM 1310 CG ASN A 83 11.876 -8.520 -8.267 1.00 0.00 C ATOM 1311 OD1 ASN A 83 11.563 -8.231 -9.422 1.00 0.00 O ATOM 1312 ND2 ASN A 83 12.943 -9.255 -7.975 1.00 0.00 N ATOM 0 H ASN A 83 10.081 -6.116 -5.284 1.00 0.00 H new ATOM 0 HA ASN A 83 12.718 -7.241 -6.011 1.00 0.00 H new ATOM 0 HB2 ASN A 83 10.853 -8.881 -6.422 1.00 0.00 H new ATOM 0 HB3 ASN A 83 10.074 -7.698 -7.455 1.00 0.00 H new ATOM 0 HD21 ASN A 83 13.542 -9.605 -8.723 1.00 0.00 H new ATOM 0 HD22 ASN A 83 13.164 -9.470 -7.003 1.00 0.00 H new ATOM 1319 N LEU A 84 13.105 -5.372 -7.576 1.00 0.00 N ATOM 1320 CA LEU A 84 13.380 -4.219 -8.426 1.00 0.00 C ATOM 1321 C LEU A 84 14.201 -4.626 -9.646 1.00 0.00 C ATOM 1322 O LEU A 84 14.636 -5.772 -9.759 1.00 0.00 O ATOM 1323 CB LEU A 84 14.122 -3.141 -7.635 1.00 0.00 C ATOM 1324 CG LEU A 84 13.353 -2.512 -6.473 1.00 0.00 C ATOM 1325 CD1 LEU A 84 14.312 -1.871 -5.482 1.00 0.00 C ATOM 1326 CD2 LEU A 84 12.352 -1.488 -6.989 1.00 0.00 C ATOM 0 H LEU A 84 13.933 -5.901 -7.302 1.00 0.00 H new ATOM 0 HA LEU A 84 12.427 -3.817 -8.769 1.00 0.00 H new ATOM 0 HB2 LEU A 84 15.042 -3.575 -7.243 1.00 0.00 H new ATOM 0 HB3 LEU A 84 14.412 -2.348 -8.324 1.00 0.00 H new ATOM 0 HG LEU A 84 12.804 -3.300 -5.957 1.00 0.00 H new ATOM 0 HD11 LEU A 84 13.746 -1.429 -4.662 1.00 0.00 H new ATOM 0 HD12 LEU A 84 14.989 -2.629 -5.088 1.00 0.00 H new ATOM 0 HD13 LEU A 84 14.889 -1.095 -5.984 1.00 0.00 H new ATOM 0 HD21 LEU A 84 11.813 -1.050 -6.149 1.00 0.00 H new ATOM 0 HD22 LEU A 84 12.881 -0.703 -7.530 1.00 0.00 H new ATOM 0 HD23 LEU A 84 11.644 -1.977 -7.659 1.00 0.00 H new ATOM 1338 N ASP A 85 14.409 -3.680 -10.555 1.00 0.00 N ATOM 1339 CA ASP A 85 15.181 -3.939 -11.765 1.00 0.00 C ATOM 1340 C ASP A 85 16.628 -4.280 -11.424 1.00 0.00 C ATOM 1341 O ASP A 85 17.060 -4.124 -10.283 1.00 0.00 O ATOM 1342 CB ASP A 85 15.135 -2.725 -12.694 1.00 0.00 C ATOM 1343 CG ASP A 85 15.706 -3.024 -14.066 1.00 0.00 C ATOM 1344 OD1 ASP A 85 15.572 -4.178 -14.526 1.00 0.00 O ATOM 1345 OD2 ASP A 85 16.285 -2.104 -14.681 1.00 0.00 O ATOM 0 H ASP A 85 14.054 -2.727 -10.477 1.00 0.00 H new ATOM 0 HA ASP A 85 14.736 -4.794 -12.274 1.00 0.00 H new ATOM 0 HB2 ASP A 85 14.103 -2.390 -12.798 1.00 0.00 H new ATOM 0 HB3 ASP A 85 15.693 -1.904 -12.243 1.00 0.00 H new ATOM 1350 N SER A 86 17.371 -4.748 -12.422 1.00 0.00 N ATOM 1351 CA SER A 86 18.768 -5.116 -12.227 1.00 0.00 C ATOM 1352 C SER A 86 19.606 -3.895 -11.861 1.00 0.00 C ATOM 1353 O SER A 86 20.227 -3.848 -10.800 1.00 0.00 O ATOM 1354 CB SER A 86 19.326 -5.772 -13.492 1.00 0.00 C ATOM 1355 OG SER A 86 19.132 -7.175 -13.467 1.00 0.00 O ATOM 0 H SER A 86 17.029 -4.881 -13.374 1.00 0.00 H new ATOM 0 HA SER A 86 18.819 -5.829 -11.404 1.00 0.00 H new ATOM 0 HB2 SER A 86 18.837 -5.350 -14.370 1.00 0.00 H new ATOM 0 HB3 SER A 86 20.389 -5.550 -13.582 1.00 0.00 H new ATOM 0 HG SER A 86 19.496 -7.570 -14.287 1.00 0.00 H new ATOM 1361 N LYS A 87 19.618 -2.906 -12.750 1.00 0.00 N ATOM 1362 CA LYS A 87 20.378 -1.683 -12.523 1.00 0.00 C ATOM 1363 C LYS A 87 19.829 -0.916 -11.324 1.00 0.00 C ATOM 1364 O LYS A 87 20.587 -0.438 -10.480 1.00 0.00 O ATOM 1365 CB LYS A 87 20.340 -0.796 -13.769 1.00 0.00 C ATOM 1366 CG LYS A 87 18.959 -0.248 -14.084 1.00 0.00 C ATOM 1367 CD LYS A 87 18.853 0.197 -15.533 1.00 0.00 C ATOM 1368 CE LYS A 87 17.750 1.229 -15.720 1.00 0.00 C ATOM 1369 NZ LYS A 87 17.765 1.815 -17.089 1.00 0.00 N ATOM 0 H LYS A 87 19.110 -2.928 -13.634 1.00 0.00 H new ATOM 0 HA LYS A 87 21.411 -1.961 -12.313 1.00 0.00 H new ATOM 0 HB2 LYS A 87 21.030 0.037 -13.633 1.00 0.00 H new ATOM 0 HB3 LYS A 87 20.698 -1.370 -14.624 1.00 0.00 H new ATOM 0 HG2 LYS A 87 18.208 -1.012 -13.881 1.00 0.00 H new ATOM 0 HG3 LYS A 87 18.742 0.594 -13.427 1.00 0.00 H new ATOM 0 HD2 LYS A 87 19.805 0.618 -15.856 1.00 0.00 H new ATOM 0 HD3 LYS A 87 18.655 -0.667 -16.167 1.00 0.00 H new ATOM 0 HE2 LYS A 87 16.782 0.763 -15.535 1.00 0.00 H new ATOM 0 HE3 LYS A 87 17.868 2.024 -14.983 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 16.999 2.513 -17.176 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 18.679 2.281 -17.257 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 17.627 1.060 -17.791 1.00 0.00 H new ATOM 1383 N SER A 88 18.506 -0.804 -11.254 1.00 0.00 N ATOM 1384 CA SER A 88 17.856 -0.093 -10.159 1.00 0.00 C ATOM 1385 C SER A 88 18.273 -0.673 -8.811 1.00 0.00 C ATOM 1386 O SER A 88 18.865 0.019 -7.982 1.00 0.00 O ATOM 1387 CB SER A 88 16.335 -0.165 -10.309 1.00 0.00 C ATOM 1388 OG SER A 88 15.914 0.421 -11.529 1.00 0.00 O ATOM 0 H SER A 88 17.864 -1.196 -11.942 1.00 0.00 H new ATOM 0 HA SER A 88 18.170 0.950 -10.199 1.00 0.00 H new ATOM 0 HB2 SER A 88 16.012 -1.205 -10.271 1.00 0.00 H new ATOM 0 HB3 SER A 88 15.859 0.347 -9.473 1.00 0.00 H new ATOM 0 HG SER A 88 14.939 0.361 -11.601 1.00 0.00 H new ATOM 1394 N TYR A 89 17.961 -1.947 -8.600 1.00 0.00 N ATOM 1395 CA TYR A 89 18.301 -2.620 -7.352 1.00 0.00 C ATOM 1396 C TYR A 89 19.769 -2.402 -6.998 1.00 0.00 C ATOM 1397 O TYR A 89 20.094 -1.955 -5.898 1.00 0.00 O ATOM 1398 CB TYR A 89 18.008 -4.118 -7.460 1.00 0.00 C ATOM 1399 CG TYR A 89 18.187 -4.865 -6.158 1.00 0.00 C ATOM 1400 CD1 TYR A 89 19.437 -5.326 -5.765 1.00 0.00 C ATOM 1401 CD2 TYR A 89 17.105 -5.109 -5.321 1.00 0.00 C ATOM 1402 CE1 TYR A 89 19.604 -6.010 -4.576 1.00 0.00 C ATOM 1403 CE2 TYR A 89 17.263 -5.791 -4.130 1.00 0.00 C ATOM 1404 CZ TYR A 89 18.514 -6.240 -3.762 1.00 0.00 C ATOM 1405 OH TYR A 89 18.677 -6.920 -2.577 1.00 0.00 O ATOM 0 H TYR A 89 17.473 -2.534 -9.277 1.00 0.00 H new ATOM 0 HA TYR A 89 17.687 -2.192 -6.559 1.00 0.00 H new ATOM 0 HB2 TYR A 89 16.985 -4.255 -7.810 1.00 0.00 H new ATOM 0 HB3 TYR A 89 18.664 -4.555 -8.213 1.00 0.00 H new ATOM 0 HD1 TYR A 89 20.293 -5.147 -6.399 1.00 0.00 H new ATOM 0 HD2 TYR A 89 16.124 -4.760 -5.606 1.00 0.00 H new ATOM 0 HE1 TYR A 89 20.583 -6.363 -4.285 1.00 0.00 H new ATOM 0 HE2 TYR A 89 16.412 -5.972 -3.491 1.00 0.00 H new ATOM 0 HH TYR A 89 18.442 -6.333 -1.828 1.00 0.00 H new ATOM 1415 N ASP A 90 20.651 -2.722 -7.938 1.00 0.00 N ATOM 1416 CA ASP A 90 22.085 -2.560 -7.728 1.00 0.00 C ATOM 1417 C ASP A 90 22.415 -1.131 -7.310 1.00 0.00 C ATOM 1418 O ASP A 90 23.124 -0.907 -6.328 1.00 0.00 O ATOM 1419 CB ASP A 90 22.853 -2.923 -9.000 1.00 0.00 C ATOM 1420 CG ASP A 90 24.287 -3.325 -8.716 1.00 0.00 C ATOM 1421 OD1 ASP A 90 24.869 -2.802 -7.743 1.00 0.00 O ATOM 1422 OD2 ASP A 90 24.827 -4.164 -9.467 1.00 0.00 O ATOM 0 H ASP A 90 20.398 -3.095 -8.853 1.00 0.00 H new ATOM 0 HA ASP A 90 22.388 -3.233 -6.926 1.00 0.00 H new ATOM 0 HB2 ASP A 90 22.343 -3.742 -9.508 1.00 0.00 H new ATOM 0 HB3 ASP A 90 22.845 -2.072 -9.681 1.00 0.00 H new ATOM 1427 N LYS A 91 21.898 -0.165 -8.062 1.00 0.00 N ATOM 1428 CA LYS A 91 22.136 1.243 -7.771 1.00 0.00 C ATOM 1429 C LYS A 91 21.928 1.535 -6.288 1.00 0.00 C ATOM 1430 O LYS A 91 22.834 2.015 -5.605 1.00 0.00 O ATOM 1431 CB LYS A 91 21.208 2.124 -8.610 1.00 0.00 C ATOM 1432 CG LYS A 91 21.362 3.609 -8.332 1.00 0.00 C ATOM 1433 CD LYS A 91 22.454 4.226 -9.190 1.00 0.00 C ATOM 1434 CE LYS A 91 22.401 5.746 -9.151 1.00 0.00 C ATOM 1435 NZ LYS A 91 23.199 6.357 -10.250 1.00 0.00 N ATOM 0 H LYS A 91 21.311 -0.333 -8.879 1.00 0.00 H new ATOM 0 HA LYS A 91 23.171 1.470 -8.027 1.00 0.00 H new ATOM 0 HB2 LYS A 91 21.402 1.939 -9.666 1.00 0.00 H new ATOM 0 HB3 LYS A 91 20.175 1.833 -8.420 1.00 0.00 H new ATOM 0 HG2 LYS A 91 20.417 4.116 -8.524 1.00 0.00 H new ATOM 0 HG3 LYS A 91 21.596 3.761 -7.278 1.00 0.00 H new ATOM 0 HD2 LYS A 91 23.429 3.886 -8.841 1.00 0.00 H new ATOM 0 HD3 LYS A 91 22.347 3.883 -10.219 1.00 0.00 H new ATOM 0 HE2 LYS A 91 21.365 6.075 -9.228 1.00 0.00 H new ATOM 0 HE3 LYS A 91 22.777 6.098 -8.190 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 23.138 7.393 -10.189 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 24.193 6.063 -10.162 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 22.825 6.042 -11.168 1.00 0.00 H new ATOM 1449 N THR A 92 20.729 1.241 -5.794 1.00 0.00 N ATOM 1450 CA THR A 92 20.402 1.472 -4.393 1.00 0.00 C ATOM 1451 C THR A 92 21.433 0.826 -3.474 1.00 0.00 C ATOM 1452 O THR A 92 22.021 1.489 -2.620 1.00 0.00 O ATOM 1453 CB THR A 92 19.005 0.923 -4.045 1.00 0.00 C ATOM 1454 OG1 THR A 92 18.011 1.573 -4.843 1.00 0.00 O ATOM 1455 CG2 THR A 92 18.695 1.132 -2.570 1.00 0.00 C ATOM 0 H THR A 92 19.968 0.842 -6.344 1.00 0.00 H new ATOM 0 HA THR A 92 20.409 2.551 -4.240 1.00 0.00 H new ATOM 0 HB THR A 92 18.996 -0.147 -4.255 1.00 0.00 H new ATOM 0 HG1 THR A 92 17.153 1.112 -4.736 1.00 0.00 H new ATOM 0 HG21 THR A 92 17.704 0.737 -2.347 1.00 0.00 H new ATOM 0 HG22 THR A 92 19.438 0.612 -1.965 1.00 0.00 H new ATOM 0 HG23 THR A 92 18.721 2.197 -2.340 1.00 0.00 H new ATOM 1463 N THR A 93 21.649 -0.474 -3.656 1.00 0.00 N ATOM 1464 CA THR A 93 22.608 -1.210 -2.843 1.00 0.00 C ATOM 1465 C THR A 93 23.853 -0.373 -2.570 1.00 0.00 C ATOM 1466 O THR A 93 24.399 -0.396 -1.466 1.00 0.00 O ATOM 1467 CB THR A 93 23.028 -2.527 -3.523 1.00 0.00 C ATOM 1468 OG1 THR A 93 21.867 -3.258 -3.933 1.00 0.00 O ATOM 1469 CG2 THR A 93 23.865 -3.380 -2.582 1.00 0.00 C ATOM 0 H THR A 93 21.172 -1.038 -4.360 1.00 0.00 H new ATOM 0 HA THR A 93 22.113 -1.439 -1.900 1.00 0.00 H new ATOM 0 HB THR A 93 23.631 -2.282 -4.398 1.00 0.00 H new ATOM 0 HG1 THR A 93 21.451 -3.677 -3.151 1.00 0.00 H new ATOM 0 HG21 THR A 93 24.149 -4.304 -3.085 1.00 0.00 H new ATOM 0 HG22 THR A 93 24.763 -2.832 -2.295 1.00 0.00 H new ATOM 0 HG23 THR A 93 23.284 -3.616 -1.691 1.00 0.00 H new ATOM 1477 N HIS A 94 24.298 0.365 -3.581 1.00 0.00 N ATOM 1478 CA HIS A 94 25.479 1.211 -3.449 1.00 0.00 C ATOM 1479 C HIS A 94 25.168 2.452 -2.617 1.00 0.00 C ATOM 1480 O HIS A 94 25.927 2.815 -1.719 1.00 0.00 O ATOM 1481 CB HIS A 94 25.995 1.623 -4.828 1.00 0.00 C ATOM 1482 CG HIS A 94 26.982 2.748 -4.787 1.00 0.00 C ATOM 1483 ND1 HIS A 94 28.320 2.565 -4.508 1.00 0.00 N ATOM 1484 CD2 HIS A 94 26.821 4.076 -4.993 1.00 0.00 C ATOM 1485 CE1 HIS A 94 28.939 3.732 -4.543 1.00 0.00 C ATOM 1486 NE2 HIS A 94 28.051 4.665 -4.835 1.00 0.00 N ATOM 0 H HIS A 94 23.859 0.395 -4.501 1.00 0.00 H new ATOM 0 HA HIS A 94 26.251 0.636 -2.938 1.00 0.00 H new ATOM 0 HB2 HIS A 94 26.460 0.760 -5.305 1.00 0.00 H new ATOM 0 HB3 HIS A 94 25.149 1.915 -5.451 1.00 0.00 H new ATOM 0 HD2 HIS A 94 25.897 4.579 -5.236 1.00 0.00 H new ATOM 0 HE1 HIS A 94 29.991 3.895 -4.363 1.00 0.00 H new ATOM 0 HE2 HIS A 94 28.247 5.662 -4.928 1.00 0.00 H new ATOM 1494 N ASN A 95 24.048 3.098 -2.924 1.00 0.00 N ATOM 1495 CA ASN A 95 23.638 4.300 -2.206 1.00 0.00 C ATOM 1496 C ASN A 95 23.515 4.024 -0.710 1.00 0.00 C ATOM 1497 O ASN A 95 23.964 4.817 0.117 1.00 0.00 O ATOM 1498 CB ASN A 95 22.305 4.816 -2.752 1.00 0.00 C ATOM 1499 CG ASN A 95 22.481 5.666 -3.995 1.00 0.00 C ATOM 1500 OD1 ASN A 95 23.570 5.737 -4.564 1.00 0.00 O ATOM 1501 ND2 ASN A 95 21.405 6.317 -4.423 1.00 0.00 N ATOM 0 H ASN A 95 23.408 2.810 -3.664 1.00 0.00 H new ATOM 0 HA ASN A 95 24.403 5.062 -2.356 1.00 0.00 H new ATOM 0 HB2 ASN A 95 21.658 3.970 -2.982 1.00 0.00 H new ATOM 0 HB3 ASN A 95 21.802 5.402 -1.982 1.00 0.00 H new ATOM 0 HD21 ASN A 95 21.462 6.905 -5.255 1.00 0.00 H new ATOM 0 HD22 ASN A 95 20.522 6.229 -3.920 1.00 0.00 H new ATOM 1508 N VAL A 96 22.904 2.893 -0.371 1.00 0.00 N ATOM 1509 CA VAL A 96 22.723 2.511 1.024 1.00 0.00 C ATOM 1510 C VAL A 96 23.958 2.848 1.851 1.00 0.00 C ATOM 1511 O VAL A 96 23.854 3.406 2.944 1.00 0.00 O ATOM 1512 CB VAL A 96 22.423 1.006 1.160 1.00 0.00 C ATOM 1513 CG1 VAL A 96 22.290 0.618 2.624 1.00 0.00 C ATOM 1514 CG2 VAL A 96 21.163 0.643 0.387 1.00 0.00 C ATOM 0 H VAL A 96 22.526 2.226 -1.044 1.00 0.00 H new ATOM 0 HA VAL A 96 21.872 3.079 1.399 1.00 0.00 H new ATOM 0 HB VAL A 96 23.257 0.447 0.736 1.00 0.00 H new ATOM 0 HG11 VAL A 96 22.078 -0.449 2.700 1.00 0.00 H new ATOM 0 HG12 VAL A 96 23.221 0.841 3.146 1.00 0.00 H new ATOM 0 HG13 VAL A 96 21.476 1.183 3.078 1.00 0.00 H new ATOM 0 HG21 VAL A 96 20.965 -0.424 0.494 1.00 0.00 H new ATOM 0 HG22 VAL A 96 20.319 1.209 0.780 1.00 0.00 H new ATOM 0 HG23 VAL A 96 21.301 0.883 -0.667 1.00 0.00 H new ATOM 1524 N LYS A 97 25.128 2.507 1.323 1.00 0.00 N ATOM 1525 CA LYS A 97 26.386 2.774 2.010 1.00 0.00 C ATOM 1526 C LYS A 97 26.311 4.082 2.792 1.00 0.00 C ATOM 1527 O LYS A 97 26.724 4.147 3.949 1.00 0.00 O ATOM 1528 CB LYS A 97 27.538 2.834 1.004 1.00 0.00 C ATOM 1529 CG LYS A 97 27.718 1.553 0.208 1.00 0.00 C ATOM 1530 CD LYS A 97 28.649 0.583 0.916 1.00 0.00 C ATOM 1531 CE LYS A 97 28.336 -0.859 0.547 1.00 0.00 C ATOM 1532 NZ LYS A 97 29.339 -1.805 1.109 1.00 0.00 N ATOM 0 H LYS A 97 25.232 2.044 0.420 1.00 0.00 H new ATOM 0 HA LYS A 97 26.568 1.961 2.712 1.00 0.00 H new ATOM 0 HB2 LYS A 97 27.364 3.659 0.314 1.00 0.00 H new ATOM 0 HB3 LYS A 97 28.463 3.054 1.537 1.00 0.00 H new ATOM 0 HG2 LYS A 97 26.748 1.080 0.053 1.00 0.00 H new ATOM 0 HG3 LYS A 97 28.118 1.789 -0.778 1.00 0.00 H new ATOM 0 HD2 LYS A 97 29.682 0.811 0.653 1.00 0.00 H new ATOM 0 HD3 LYS A 97 28.559 0.712 1.995 1.00 0.00 H new ATOM 0 HE2 LYS A 97 27.344 -1.121 0.915 1.00 0.00 H new ATOM 0 HE3 LYS A 97 28.311 -0.959 -0.538 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 29.091 -2.777 0.835 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 30.282 -1.571 0.739 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 29.346 -1.728 2.146 1.00 0.00 H new ATOM 1546 N GLU A 98 25.782 5.120 2.152 1.00 0.00 N ATOM 1547 CA GLU A 98 25.654 6.425 2.789 1.00 0.00 C ATOM 1548 C GLU A 98 24.228 6.650 3.286 1.00 0.00 C ATOM 1549 O GLU A 98 23.274 6.699 2.510 1.00 0.00 O ATOM 1550 CB GLU A 98 26.045 7.535 1.812 1.00 0.00 C ATOM 1551 CG GLU A 98 25.294 7.478 0.492 1.00 0.00 C ATOM 1552 CD GLU A 98 25.646 8.629 -0.430 1.00 0.00 C ATOM 1553 OE1 GLU A 98 26.712 8.564 -1.079 1.00 0.00 O ATOM 1554 OE2 GLU A 98 24.857 9.594 -0.504 1.00 0.00 O ATOM 0 H GLU A 98 25.435 5.082 1.193 1.00 0.00 H new ATOM 0 HA GLU A 98 26.328 6.450 3.645 1.00 0.00 H new ATOM 0 HB2 GLU A 98 25.863 8.502 2.282 1.00 0.00 H new ATOM 0 HB3 GLU A 98 27.115 7.473 1.614 1.00 0.00 H new ATOM 0 HG2 GLU A 98 25.517 6.536 -0.008 1.00 0.00 H new ATOM 0 HG3 GLU A 98 24.222 7.489 0.688 1.00 0.00 H new ATOM 1561 N PRO A 99 24.080 6.788 4.612 1.00 0.00 N ATOM 1562 CA PRO A 99 22.776 7.010 5.244 1.00 0.00 C ATOM 1563 C PRO A 99 22.210 8.392 4.937 1.00 0.00 C ATOM 1564 O PRO A 99 22.821 9.410 5.262 1.00 0.00 O ATOM 1565 CB PRO A 99 23.078 6.875 6.738 1.00 0.00 C ATOM 1566 CG PRO A 99 24.522 7.218 6.865 1.00 0.00 C ATOM 1567 CD PRO A 99 25.174 6.740 5.597 1.00 0.00 C ATOM 0 HA PRO A 99 22.024 6.309 4.882 1.00 0.00 H new ATOM 0 HB2 PRO A 99 22.458 7.548 7.330 1.00 0.00 H new ATOM 0 HB3 PRO A 99 22.879 5.864 7.092 1.00 0.00 H new ATOM 0 HG2 PRO A 99 24.658 8.292 6.993 1.00 0.00 H new ATOM 0 HG3 PRO A 99 24.963 6.735 7.737 1.00 0.00 H new ATOM 0 HD2 PRO A 99 26.005 7.382 5.306 1.00 0.00 H new ATOM 0 HD3 PRO A 99 25.573 5.731 5.706 1.00 0.00 H new ATOM 1575 N GLY A 100 21.039 8.422 4.309 1.00 0.00 N ATOM 1576 CA GLY A 100 20.411 9.685 3.969 1.00 0.00 C ATOM 1577 C GLY A 100 18.898 9.593 3.947 1.00 0.00 C ATOM 1578 O GLY A 100 18.322 8.607 4.408 1.00 0.00 O ATOM 0 H GLY A 100 20.514 7.594 4.029 1.00 0.00 H new ATOM 0 HA2 GLY A 100 20.715 10.444 4.690 1.00 0.00 H new ATOM 0 HA3 GLY A 100 20.766 10.012 2.992 1.00 0.00 H new ATOM 1582 N ARG A 101 18.252 10.623 3.410 1.00 0.00 N ATOM 1583 CA ARG A 101 16.796 10.655 3.333 1.00 0.00 C ATOM 1584 C ARG A 101 16.316 10.217 1.952 1.00 0.00 C ATOM 1585 O ARG A 101 15.424 9.376 1.832 1.00 0.00 O ATOM 1586 CB ARG A 101 16.279 12.061 3.642 1.00 0.00 C ATOM 1587 CG ARG A 101 16.667 12.564 5.023 1.00 0.00 C ATOM 1588 CD ARG A 101 16.301 14.028 5.206 1.00 0.00 C ATOM 1589 NE ARG A 101 17.007 14.891 4.263 1.00 0.00 N ATOM 1590 CZ ARG A 101 16.676 16.157 4.035 1.00 0.00 C ATOM 1591 NH1 ARG A 101 15.655 16.705 4.679 1.00 0.00 N ATOM 1592 NH2 ARG A 101 17.366 16.878 3.161 1.00 0.00 N ATOM 0 H ARG A 101 18.713 11.446 3.022 1.00 0.00 H new ATOM 0 HA ARG A 101 16.402 9.959 4.074 1.00 0.00 H new ATOM 0 HB2 ARG A 101 16.662 12.753 2.892 1.00 0.00 H new ATOM 0 HB3 ARG A 101 15.193 12.067 3.555 1.00 0.00 H new ATOM 0 HG2 ARG A 101 16.166 11.965 5.784 1.00 0.00 H new ATOM 0 HG3 ARG A 101 17.739 12.435 5.170 1.00 0.00 H new ATOM 0 HD2 ARG A 101 15.226 14.152 5.076 1.00 0.00 H new ATOM 0 HD3 ARG A 101 16.536 14.336 6.225 1.00 0.00 H new ATOM 0 HE ARG A 101 17.798 14.500 3.751 1.00 0.00 H new ATOM 0 HH11 ARG A 101 15.121 16.154 5.352 1.00 0.00 H new ATOM 0 HH12 ARG A 101 15.403 17.677 4.502 1.00 0.00 H new ATOM 0 HH21 ARG A 101 18.152 16.460 2.663 1.00 0.00 H new ATOM 0 HH22 ARG A 101 17.110 17.850 2.987 1.00 0.00 H new ATOM 1606 N TYR A 102 16.912 10.792 0.914 1.00 0.00 N ATOM 1607 CA TYR A 102 16.543 10.464 -0.458 1.00 0.00 C ATOM 1608 C TYR A 102 17.451 9.375 -1.020 1.00 0.00 C ATOM 1609 O TYR A 102 17.532 9.181 -2.234 1.00 0.00 O ATOM 1610 CB TYR A 102 16.616 11.710 -1.341 1.00 0.00 C ATOM 1611 CG TYR A 102 15.709 12.831 -0.882 1.00 0.00 C ATOM 1612 CD1 TYR A 102 16.084 13.672 0.157 1.00 0.00 C ATOM 1613 CD2 TYR A 102 14.478 13.047 -1.488 1.00 0.00 C ATOM 1614 CE1 TYR A 102 15.259 14.697 0.580 1.00 0.00 C ATOM 1615 CE2 TYR A 102 13.647 14.069 -1.073 1.00 0.00 C ATOM 1616 CZ TYR A 102 14.042 14.892 -0.039 1.00 0.00 C ATOM 1617 OH TYR A 102 13.217 15.911 0.378 1.00 0.00 O ATOM 0 H TYR A 102 17.653 11.488 0.996 1.00 0.00 H new ATOM 0 HA TYR A 102 15.519 10.091 -0.452 1.00 0.00 H new ATOM 0 HB2 TYR A 102 17.644 12.071 -1.361 1.00 0.00 H new ATOM 0 HB3 TYR A 102 16.354 11.437 -2.363 1.00 0.00 H new ATOM 0 HD1 TYR A 102 17.037 13.523 0.643 1.00 0.00 H new ATOM 0 HD2 TYR A 102 14.165 12.405 -2.298 1.00 0.00 H new ATOM 0 HE1 TYR A 102 15.566 15.342 1.391 1.00 0.00 H new ATOM 0 HE2 TYR A 102 12.693 14.223 -1.555 1.00 0.00 H new ATOM 0 HH TYR A 102 12.399 15.912 -0.162 1.00 0.00 H new ATOM 1627 N THR A 103 18.135 8.664 -0.128 1.00 0.00 N ATOM 1628 CA THR A 103 19.038 7.595 -0.533 1.00 0.00 C ATOM 1629 C THR A 103 18.323 6.572 -1.408 1.00 0.00 C ATOM 1630 O THR A 103 18.857 6.128 -2.425 1.00 0.00 O ATOM 1631 CB THR A 103 19.641 6.876 0.688 1.00 0.00 C ATOM 1632 OG1 THR A 103 20.323 7.818 1.524 1.00 0.00 O ATOM 1633 CG2 THR A 103 20.608 5.785 0.252 1.00 0.00 C ATOM 0 H THR A 103 18.080 8.810 0.880 1.00 0.00 H new ATOM 0 HA THR A 103 19.841 8.060 -1.105 1.00 0.00 H new ATOM 0 HB THR A 103 18.827 6.415 1.248 1.00 0.00 H new ATOM 0 HG1 THR A 103 21.196 7.455 1.781 1.00 0.00 H new ATOM 0 HG21 THR A 103 21.021 5.292 1.132 1.00 0.00 H new ATOM 0 HG22 THR A 103 20.080 5.054 -0.360 1.00 0.00 H new ATOM 0 HG23 THR A 103 21.417 6.227 -0.329 1.00 0.00 H new ATOM 1641 N PHE A 104 17.111 6.203 -1.008 1.00 0.00 N ATOM 1642 CA PHE A 104 16.321 5.232 -1.756 1.00 0.00 C ATOM 1643 C PHE A 104 15.387 5.931 -2.739 1.00 0.00 C ATOM 1644 O PHE A 104 14.424 5.338 -3.225 1.00 0.00 O ATOM 1645 CB PHE A 104 15.510 4.356 -0.799 1.00 0.00 C ATOM 1646 CG PHE A 104 16.323 3.792 0.332 1.00 0.00 C ATOM 1647 CD1 PHE A 104 16.538 4.533 1.483 1.00 0.00 C ATOM 1648 CD2 PHE A 104 16.870 2.523 0.244 1.00 0.00 C ATOM 1649 CE1 PHE A 104 17.286 4.017 2.525 1.00 0.00 C ATOM 1650 CE2 PHE A 104 17.618 2.001 1.283 1.00 0.00 C ATOM 1651 CZ PHE A 104 17.826 2.749 2.425 1.00 0.00 C ATOM 0 H PHE A 104 16.654 6.562 -0.170 1.00 0.00 H new ATOM 0 HA PHE A 104 17.008 4.601 -2.321 1.00 0.00 H new ATOM 0 HB2 PHE A 104 14.689 4.944 -0.388 1.00 0.00 H new ATOM 0 HB3 PHE A 104 15.064 3.535 -1.360 1.00 0.00 H new ATOM 0 HD1 PHE A 104 16.117 5.524 1.567 1.00 0.00 H new ATOM 0 HD2 PHE A 104 16.710 1.934 -0.647 1.00 0.00 H new ATOM 0 HE1 PHE A 104 17.448 4.605 3.417 1.00 0.00 H new ATOM 0 HE2 PHE A 104 18.039 1.010 1.202 1.00 0.00 H new ATOM 0 HZ PHE A 104 18.410 2.344 3.238 1.00 0.00 H new ATOM 1661 N GLU A 105 15.678 7.196 -3.025 1.00 0.00 N ATOM 1662 CA GLU A 105 14.863 7.977 -3.948 1.00 0.00 C ATOM 1663 C GLU A 105 14.574 7.187 -5.221 1.00 0.00 C ATOM 1664 O GLU A 105 13.430 7.109 -5.669 1.00 0.00 O ATOM 1665 CB GLU A 105 15.566 9.290 -4.299 1.00 0.00 C ATOM 1666 CG GLU A 105 14.755 10.189 -5.216 1.00 0.00 C ATOM 1667 CD GLU A 105 14.998 9.897 -6.684 1.00 0.00 C ATOM 1668 OE1 GLU A 105 14.471 8.881 -7.182 1.00 0.00 O ATOM 1669 OE2 GLU A 105 15.717 10.685 -7.335 1.00 0.00 O ATOM 0 H GLU A 105 16.472 7.702 -2.631 1.00 0.00 H new ATOM 0 HA GLU A 105 13.916 8.200 -3.456 1.00 0.00 H new ATOM 0 HB2 GLU A 105 15.789 9.830 -3.379 1.00 0.00 H new ATOM 0 HB3 GLU A 105 16.520 9.065 -4.776 1.00 0.00 H new ATOM 0 HG2 GLU A 105 13.695 10.065 -4.995 1.00 0.00 H new ATOM 0 HG3 GLU A 105 15.004 11.230 -5.011 1.00 0.00 H new ATOM 1676 N ASP A 106 15.618 6.604 -5.798 1.00 0.00 N ATOM 1677 CA ASP A 106 15.477 5.819 -7.019 1.00 0.00 C ATOM 1678 C ASP A 106 14.390 4.761 -6.862 1.00 0.00 C ATOM 1679 O ASP A 106 13.373 4.794 -7.555 1.00 0.00 O ATOM 1680 CB ASP A 106 16.807 5.153 -7.379 1.00 0.00 C ATOM 1681 CG ASP A 106 17.907 6.161 -7.642 1.00 0.00 C ATOM 1682 OD1 ASP A 106 18.058 6.584 -8.807 1.00 0.00 O ATOM 1683 OD2 ASP A 106 18.619 6.528 -6.682 1.00 0.00 O ATOM 0 H ASP A 106 16.572 6.660 -5.440 1.00 0.00 H new ATOM 0 HA ASP A 106 15.188 6.494 -7.825 1.00 0.00 H new ATOM 0 HB2 ASP A 106 17.110 4.492 -6.567 1.00 0.00 H new ATOM 0 HB3 ASP A 106 16.670 4.530 -8.263 1.00 0.00 H new ATOM 1688 N ALA A 107 14.612 3.822 -5.948 1.00 0.00 N ATOM 1689 CA ALA A 107 13.651 2.754 -5.700 1.00 0.00 C ATOM 1690 C ALA A 107 12.236 3.308 -5.577 1.00 0.00 C ATOM 1691 O ALA A 107 11.326 2.874 -6.284 1.00 0.00 O ATOM 1692 CB ALA A 107 14.030 1.984 -4.444 1.00 0.00 C ATOM 0 H ALA A 107 15.449 3.779 -5.367 1.00 0.00 H new ATOM 0 HA ALA A 107 13.674 2.073 -6.551 1.00 0.00 H new ATOM 0 HB1 ALA A 107 13.304 1.190 -4.271 1.00 0.00 H new ATOM 0 HB2 ALA A 107 15.021 1.548 -4.570 1.00 0.00 H new ATOM 0 HB3 ALA A 107 14.037 2.661 -3.590 1.00 0.00 H new ATOM 1698 N GLN A 108 12.057 4.267 -4.674 1.00 0.00 N ATOM 1699 CA GLN A 108 10.751 4.878 -4.458 1.00 0.00 C ATOM 1700 C GLN A 108 10.094 5.243 -5.785 1.00 0.00 C ATOM 1701 O GLN A 108 8.891 5.060 -5.964 1.00 0.00 O ATOM 1702 CB GLN A 108 10.886 6.125 -3.583 1.00 0.00 C ATOM 1703 CG GLN A 108 9.553 6.716 -3.154 1.00 0.00 C ATOM 1704 CD GLN A 108 9.708 7.833 -2.141 1.00 0.00 C ATOM 1705 OE1 GLN A 108 8.750 7.940 -1.227 1.00 0.00 O flip ATOM 1706 NE2 GLN A 108 10.677 8.591 -2.179 1.00 0.00 N flip ATOM 0 H GLN A 108 12.800 4.637 -4.081 1.00 0.00 H new ATOM 0 HA GLN A 108 10.119 4.151 -3.948 1.00 0.00 H new ATOM 0 HB2 GLN A 108 11.465 5.874 -2.694 1.00 0.00 H new ATOM 0 HB3 GLN A 108 11.451 6.881 -4.128 1.00 0.00 H new ATOM 0 HG2 GLN A 108 9.030 7.096 -4.031 1.00 0.00 H new ATOM 0 HG3 GLN A 108 8.931 5.929 -2.728 1.00 0.00 H new ATOM 0 HE21 GLN A 108 11.390 8.472 -2.899 1.00 0.00 H new ATOM 0 HE22 GLN A 108 10.767 9.338 -1.490 1.00 0.00 H new ATOM 1715 N GLU A 109 10.893 5.761 -6.713 1.00 0.00 N ATOM 1716 CA GLU A 109 10.388 6.153 -8.024 1.00 0.00 C ATOM 1717 C GLU A 109 9.928 4.933 -8.816 1.00 0.00 C ATOM 1718 O GLU A 109 8.795 4.882 -9.296 1.00 0.00 O ATOM 1719 CB GLU A 109 11.466 6.906 -8.806 1.00 0.00 C ATOM 1720 CG GLU A 109 11.361 6.728 -10.312 1.00 0.00 C ATOM 1721 CD GLU A 109 12.346 7.595 -11.071 1.00 0.00 C ATOM 1722 OE1 GLU A 109 12.914 8.524 -10.458 1.00 0.00 O ATOM 1723 OE2 GLU A 109 12.550 7.346 -12.278 1.00 0.00 O ATOM 0 H GLU A 109 11.892 5.919 -6.581 1.00 0.00 H new ATOM 0 HA GLU A 109 9.532 6.811 -7.874 1.00 0.00 H new ATOM 0 HB2 GLU A 109 11.400 7.968 -8.569 1.00 0.00 H new ATOM 0 HB3 GLU A 109 12.447 6.565 -8.476 1.00 0.00 H new ATOM 0 HG2 GLU A 109 11.534 5.682 -10.564 1.00 0.00 H new ATOM 0 HG3 GLU A 109 10.348 6.969 -10.633 1.00 0.00 H new ATOM 1730 N HIS A 110 10.815 3.952 -8.950 1.00 0.00 N ATOM 1731 CA HIS A 110 10.500 2.731 -9.684 1.00 0.00 C ATOM 1732 C HIS A 110 9.167 2.150 -9.225 1.00 0.00 C ATOM 1733 O HIS A 110 8.251 1.963 -10.027 1.00 0.00 O ATOM 1734 CB HIS A 110 11.612 1.698 -9.498 1.00 0.00 C ATOM 1735 CG HIS A 110 11.695 0.701 -10.612 1.00 0.00 C ATOM 1736 ND1 HIS A 110 12.359 0.948 -11.795 1.00 0.00 N ATOM 1737 CD2 HIS A 110 11.195 -0.552 -10.718 1.00 0.00 C ATOM 1738 CE1 HIS A 110 12.262 -0.109 -12.581 1.00 0.00 C ATOM 1739 NE2 HIS A 110 11.561 -1.034 -11.951 1.00 0.00 N ATOM 0 H HIS A 110 11.757 3.979 -8.560 1.00 0.00 H new ATOM 0 HA HIS A 110 10.421 2.982 -10.742 1.00 0.00 H new ATOM 0 HB2 HIS A 110 12.567 2.216 -9.413 1.00 0.00 H new ATOM 0 HB3 HIS A 110 11.452 1.169 -8.559 1.00 0.00 H new ATOM 0 HD2 HIS A 110 10.616 -1.076 -9.972 1.00 0.00 H new ATOM 0 HE1 HIS A 110 12.684 -0.201 -13.571 1.00 0.00 H new ATOM 0 HE2 HIS A 110 11.329 -1.956 -12.320 1.00 0.00 H new ATOM 1747 N ILE A 111 9.065 1.865 -7.931 1.00 0.00 N ATOM 1748 CA ILE A 111 7.844 1.305 -7.366 1.00 0.00 C ATOM 1749 C ILE A 111 6.665 2.253 -7.555 1.00 0.00 C ATOM 1750 O ILE A 111 5.575 1.835 -7.946 1.00 0.00 O ATOM 1751 CB ILE A 111 8.006 0.999 -5.865 1.00 0.00 C ATOM 1752 CG1 ILE A 111 9.130 -0.017 -5.648 1.00 0.00 C ATOM 1753 CG2 ILE A 111 6.698 0.482 -5.285 1.00 0.00 C ATOM 1754 CD1 ILE A 111 8.867 -1.357 -6.298 1.00 0.00 C ATOM 0 H ILE A 111 9.814 2.013 -7.254 1.00 0.00 H new ATOM 0 HA ILE A 111 7.648 0.375 -7.899 1.00 0.00 H new ATOM 0 HB ILE A 111 8.270 1.921 -5.348 1.00 0.00 H new ATOM 0 HG12 ILE A 111 10.060 0.393 -6.042 1.00 0.00 H new ATOM 0 HG13 ILE A 111 9.275 -0.164 -4.578 1.00 0.00 H new ATOM 0 HG21 ILE A 111 6.829 0.270 -4.224 1.00 0.00 H new ATOM 0 HG22 ILE A 111 5.921 1.236 -5.412 1.00 0.00 H new ATOM 0 HG23 ILE A 111 6.406 -0.431 -5.804 1.00 0.00 H new ATOM 0 HD11 ILE A 111 9.705 -2.027 -6.103 1.00 0.00 H new ATOM 0 HD12 ILE A 111 7.954 -1.788 -5.886 1.00 0.00 H new ATOM 0 HD13 ILE A 111 8.752 -1.223 -7.374 1.00 0.00 H new ATOM 1766 N TYR A 112 6.892 3.532 -7.278 1.00 0.00 N ATOM 1767 CA TYR A 112 5.848 4.541 -7.417 1.00 0.00 C ATOM 1768 C TYR A 112 5.134 4.404 -8.758 1.00 0.00 C ATOM 1769 O TYR A 112 3.917 4.227 -8.812 1.00 0.00 O ATOM 1770 CB TYR A 112 6.445 5.943 -7.286 1.00 0.00 C ATOM 1771 CG TYR A 112 5.497 7.046 -7.700 1.00 0.00 C ATOM 1772 CD1 TYR A 112 4.514 7.506 -6.832 1.00 0.00 C ATOM 1773 CD2 TYR A 112 5.583 7.627 -8.959 1.00 0.00 C ATOM 1774 CE1 TYR A 112 3.645 8.513 -7.207 1.00 0.00 C ATOM 1775 CE2 TYR A 112 4.719 8.635 -9.342 1.00 0.00 C ATOM 1776 CZ TYR A 112 3.752 9.074 -8.462 1.00 0.00 C ATOM 1777 OH TYR A 112 2.889 10.077 -8.840 1.00 0.00 O ATOM 0 H TYR A 112 7.789 3.895 -6.956 1.00 0.00 H new ATOM 0 HA TYR A 112 5.120 4.387 -6.620 1.00 0.00 H new ATOM 0 HB2 TYR A 112 6.748 6.105 -6.251 1.00 0.00 H new ATOM 0 HB3 TYR A 112 7.347 6.003 -7.895 1.00 0.00 H new ATOM 0 HD1 TYR A 112 4.428 7.069 -5.848 1.00 0.00 H new ATOM 0 HD2 TYR A 112 6.339 7.285 -9.651 1.00 0.00 H new ATOM 0 HE1 TYR A 112 2.886 8.859 -6.521 1.00 0.00 H new ATOM 0 HE2 TYR A 112 4.800 9.076 -10.324 1.00 0.00 H new ATOM 0 HH TYR A 112 3.100 10.363 -9.753 1.00 0.00 H new ATOM 1787 N LYS A 113 5.900 4.487 -9.841 1.00 0.00 N ATOM 1788 CA LYS A 113 5.344 4.371 -11.183 1.00 0.00 C ATOM 1789 C LYS A 113 4.592 3.054 -11.349 1.00 0.00 C ATOM 1790 O LYS A 113 3.605 2.978 -12.081 1.00 0.00 O ATOM 1791 CB LYS A 113 6.456 4.470 -12.229 1.00 0.00 C ATOM 1792 CG LYS A 113 7.360 5.677 -12.044 1.00 0.00 C ATOM 1793 CD LYS A 113 8.548 5.636 -12.990 1.00 0.00 C ATOM 1794 CE LYS A 113 9.553 4.572 -12.575 1.00 0.00 C ATOM 1795 NZ LYS A 113 10.335 4.065 -13.737 1.00 0.00 N ATOM 0 H LYS A 113 6.909 4.634 -9.815 1.00 0.00 H new ATOM 0 HA LYS A 113 4.642 5.191 -11.330 1.00 0.00 H new ATOM 0 HB2 LYS A 113 7.061 3.564 -12.191 1.00 0.00 H new ATOM 0 HB3 LYS A 113 6.007 4.512 -13.221 1.00 0.00 H new ATOM 0 HG2 LYS A 113 6.789 6.590 -12.215 1.00 0.00 H new ATOM 0 HG3 LYS A 113 7.715 5.712 -11.014 1.00 0.00 H new ATOM 0 HD2 LYS A 113 8.201 5.435 -14.004 1.00 0.00 H new ATOM 0 HD3 LYS A 113 9.035 6.611 -13.007 1.00 0.00 H new ATOM 0 HE2 LYS A 113 10.234 4.986 -11.832 1.00 0.00 H new ATOM 0 HE3 LYS A 113 9.029 3.743 -12.100 1.00 0.00 H new ATOM 0 HZ1 LYS A 113 11.009 3.342 -13.413 1.00 0.00 H new ATOM 0 HZ2 LYS A 113 9.688 3.647 -14.435 1.00 0.00 H new ATOM 0 HZ3 LYS A 113 10.856 4.852 -14.175 1.00 0.00 H new ATOM 1809 N LEU A 114 5.064 2.019 -10.663 1.00 0.00 N ATOM 1810 CA LEU A 114 4.436 0.704 -10.733 1.00 0.00 C ATOM 1811 C LEU A 114 3.066 0.719 -10.063 1.00 0.00 C ATOM 1812 O LEU A 114 2.038 0.574 -10.725 1.00 0.00 O ATOM 1813 CB LEU A 114 5.329 -0.346 -10.070 1.00 0.00 C ATOM 1814 CG LEU A 114 4.637 -1.640 -9.639 1.00 0.00 C ATOM 1815 CD1 LEU A 114 4.629 -2.646 -10.779 1.00 0.00 C ATOM 1816 CD2 LEU A 114 5.321 -2.226 -8.412 1.00 0.00 C ATOM 0 H LEU A 114 5.879 2.065 -10.052 1.00 0.00 H new ATOM 0 HA LEU A 114 4.304 0.447 -11.784 1.00 0.00 H new ATOM 0 HB2 LEU A 114 6.132 -0.600 -10.762 1.00 0.00 H new ATOM 0 HB3 LEU A 114 5.794 0.103 -9.193 1.00 0.00 H new ATOM 0 HG LEU A 114 3.604 -1.409 -9.379 1.00 0.00 H new ATOM 0 HD11 LEU A 114 4.133 -3.560 -10.454 1.00 0.00 H new ATOM 0 HD12 LEU A 114 4.094 -2.226 -11.631 1.00 0.00 H new ATOM 0 HD13 LEU A 114 5.654 -2.874 -11.071 1.00 0.00 H new ATOM 0 HD21 LEU A 114 4.816 -3.146 -8.119 1.00 0.00 H new ATOM 0 HD22 LEU A 114 6.363 -2.443 -8.645 1.00 0.00 H new ATOM 0 HD23 LEU A 114 5.274 -1.509 -7.592 1.00 0.00 H new ATOM 1828 N MET A 115 3.059 0.898 -8.746 1.00 0.00 N ATOM 1829 CA MET A 115 1.815 0.936 -7.987 1.00 0.00 C ATOM 1830 C MET A 115 0.748 1.735 -8.730 1.00 0.00 C ATOM 1831 O MET A 115 -0.416 1.337 -8.782 1.00 0.00 O ATOM 1832 CB MET A 115 2.054 1.546 -6.604 1.00 0.00 C ATOM 1833 CG MET A 115 3.045 0.764 -5.758 1.00 0.00 C ATOM 1834 SD MET A 115 3.167 1.392 -4.072 1.00 0.00 S ATOM 1835 CE MET A 115 3.846 3.023 -4.367 1.00 0.00 C ATOM 0 H MET A 115 3.901 1.019 -8.183 1.00 0.00 H new ATOM 0 HA MET A 115 1.460 -0.088 -7.868 1.00 0.00 H new ATOM 0 HB2 MET A 115 2.417 2.567 -6.724 1.00 0.00 H new ATOM 0 HB3 MET A 115 1.104 1.606 -6.073 1.00 0.00 H new ATOM 0 HG2 MET A 115 2.746 -0.284 -5.730 1.00 0.00 H new ATOM 0 HG3 MET A 115 4.028 0.803 -6.228 1.00 0.00 H new ATOM 0 HE1 MET A 115 3.408 3.732 -3.664 1.00 0.00 H new ATOM 0 HE2 MET A 115 4.927 2.997 -4.231 1.00 0.00 H new ATOM 0 HE3 MET A 115 3.616 3.334 -5.386 1.00 0.00 H new ATOM 1845 N LYS A 116 1.153 2.863 -9.304 1.00 0.00 N ATOM 1846 CA LYS A 116 0.233 3.717 -10.045 1.00 0.00 C ATOM 1847 C LYS A 116 -0.831 2.885 -10.753 1.00 0.00 C ATOM 1848 O LYS A 116 -2.007 2.927 -10.393 1.00 0.00 O ATOM 1849 CB LYS A 116 0.999 4.561 -11.066 1.00 0.00 C ATOM 1850 CG LYS A 116 1.707 5.758 -10.457 1.00 0.00 C ATOM 1851 CD LYS A 116 2.628 6.432 -11.461 1.00 0.00 C ATOM 1852 CE LYS A 116 1.939 7.596 -12.156 1.00 0.00 C ATOM 1853 NZ LYS A 116 2.696 8.053 -13.354 1.00 0.00 N ATOM 0 H LYS A 116 2.113 3.207 -9.270 1.00 0.00 H new ATOM 0 HA LYS A 116 -0.262 4.379 -9.334 1.00 0.00 H new ATOM 0 HB2 LYS A 116 1.734 3.931 -11.567 1.00 0.00 H new ATOM 0 HB3 LYS A 116 0.305 4.910 -11.830 1.00 0.00 H new ATOM 0 HG2 LYS A 116 0.968 6.476 -10.100 1.00 0.00 H new ATOM 0 HG3 LYS A 116 2.285 5.438 -9.590 1.00 0.00 H new ATOM 0 HD2 LYS A 116 3.523 6.789 -10.952 1.00 0.00 H new ATOM 0 HD3 LYS A 116 2.953 5.704 -12.204 1.00 0.00 H new ATOM 0 HE2 LYS A 116 0.934 7.298 -12.454 1.00 0.00 H new ATOM 0 HE3 LYS A 116 1.832 8.425 -11.456 1.00 0.00 H new ATOM 0 HZ1 LYS A 116 2.194 8.847 -13.800 1.00 0.00 H new ATOM 0 HZ2 LYS A 116 3.647 8.362 -13.067 1.00 0.00 H new ATOM 0 HZ3 LYS A 116 2.777 7.270 -14.033 1.00 0.00 H new ATOM 1867 N SER A 117 -0.410 2.129 -11.762 1.00 0.00 N ATOM 1868 CA SER A 117 -1.328 1.289 -12.522 1.00 0.00 C ATOM 1869 C SER A 117 -1.023 -0.189 -12.300 1.00 0.00 C ATOM 1870 O SER A 117 -1.444 -1.046 -13.078 1.00 0.00 O ATOM 1871 CB SER A 117 -1.241 1.621 -14.013 1.00 0.00 C ATOM 1872 OG SER A 117 0.034 2.143 -14.346 1.00 0.00 O ATOM 0 H SER A 117 0.561 2.081 -12.072 1.00 0.00 H new ATOM 0 HA SER A 117 -2.340 1.490 -12.171 1.00 0.00 H new ATOM 0 HB2 SER A 117 -1.435 0.724 -14.600 1.00 0.00 H new ATOM 0 HB3 SER A 117 -2.013 2.345 -14.273 1.00 0.00 H new ATOM 0 HG SER A 117 0.064 2.345 -15.304 1.00 0.00 H new ATOM 1878 N ASP A 118 -0.287 -0.481 -11.233 1.00 0.00 N ATOM 1879 CA ASP A 118 0.075 -1.855 -10.906 1.00 0.00 C ATOM 1880 C ASP A 118 -0.861 -2.426 -9.845 1.00 0.00 C ATOM 1881 O ASP A 118 -1.673 -3.307 -10.129 1.00 0.00 O ATOM 1882 CB ASP A 118 1.523 -1.920 -10.415 1.00 0.00 C ATOM 1883 CG ASP A 118 1.934 -3.322 -10.011 1.00 0.00 C ATOM 1884 OD1 ASP A 118 2.124 -4.167 -10.912 1.00 0.00 O ATOM 1885 OD2 ASP A 118 2.065 -3.576 -8.796 1.00 0.00 O ATOM 0 H ASP A 118 0.071 0.216 -10.580 1.00 0.00 H new ATOM 0 HA ASP A 118 -0.021 -2.455 -11.811 1.00 0.00 H new ATOM 0 HB2 ASP A 118 2.187 -1.562 -11.202 1.00 0.00 H new ATOM 0 HB3 ASP A 118 1.646 -1.249 -9.565 1.00 0.00 H new ATOM 1890 N SER A 119 -0.741 -1.919 -8.623 1.00 0.00 N ATOM 1891 CA SER A 119 -1.573 -2.382 -7.518 1.00 0.00 C ATOM 1892 C SER A 119 -2.862 -1.570 -7.432 1.00 0.00 C ATOM 1893 O SER A 119 -3.958 -2.129 -7.377 1.00 0.00 O ATOM 1894 CB SER A 119 -0.806 -2.284 -6.198 1.00 0.00 C ATOM 1895 OG SER A 119 -0.036 -1.096 -6.142 1.00 0.00 O ATOM 0 H SER A 119 -0.076 -1.187 -8.372 1.00 0.00 H new ATOM 0 HA SER A 119 -1.832 -3.425 -7.702 1.00 0.00 H new ATOM 0 HB2 SER A 119 -1.507 -2.306 -5.364 1.00 0.00 H new ATOM 0 HB3 SER A 119 -0.153 -3.150 -6.088 1.00 0.00 H new ATOM 0 HG SER A 119 0.443 -1.057 -5.288 1.00 0.00 H new ATOM 1901 N TYR A 120 -2.722 -0.250 -7.420 1.00 0.00 N ATOM 1902 CA TYR A 120 -3.874 0.640 -7.338 1.00 0.00 C ATOM 1903 C TYR A 120 -5.075 0.046 -8.069 1.00 0.00 C ATOM 1904 O TYR A 120 -6.182 -0.031 -7.537 1.00 0.00 O ATOM 1905 CB TYR A 120 -3.531 2.009 -7.927 1.00 0.00 C ATOM 1906 CG TYR A 120 -4.714 2.713 -8.553 1.00 0.00 C ATOM 1907 CD1 TYR A 120 -5.689 3.310 -7.765 1.00 0.00 C ATOM 1908 CD2 TYR A 120 -4.855 2.782 -9.934 1.00 0.00 C ATOM 1909 CE1 TYR A 120 -6.772 3.954 -8.332 1.00 0.00 C ATOM 1910 CE2 TYR A 120 -5.933 3.425 -10.511 1.00 0.00 C ATOM 1911 CZ TYR A 120 -6.889 4.008 -9.706 1.00 0.00 C ATOM 1912 OH TYR A 120 -7.965 4.650 -10.275 1.00 0.00 O ATOM 0 H TYR A 120 -1.822 0.228 -7.466 1.00 0.00 H new ATOM 0 HA TYR A 120 -4.134 0.759 -6.286 1.00 0.00 H new ATOM 0 HB2 TYR A 120 -3.118 2.640 -7.140 1.00 0.00 H new ATOM 0 HB3 TYR A 120 -2.752 1.887 -8.680 1.00 0.00 H new ATOM 0 HD1 TYR A 120 -5.599 3.270 -6.689 1.00 0.00 H new ATOM 0 HD2 TYR A 120 -4.109 2.325 -10.567 1.00 0.00 H new ATOM 0 HE1 TYR A 120 -7.522 4.412 -7.704 1.00 0.00 H new ATOM 0 HE2 TYR A 120 -6.027 3.471 -11.586 1.00 0.00 H new ATOM 0 HH TYR A 120 -7.898 4.599 -11.251 1.00 0.00 H new ATOM 1922 N PRO A 121 -4.851 -0.385 -9.319 1.00 0.00 N ATOM 1923 CA PRO A 121 -5.901 -0.981 -10.151 1.00 0.00 C ATOM 1924 C PRO A 121 -6.692 -2.051 -9.407 1.00 0.00 C ATOM 1925 O PRO A 121 -7.883 -1.886 -9.145 1.00 0.00 O ATOM 1926 CB PRO A 121 -5.122 -1.603 -11.313 1.00 0.00 C ATOM 1927 CG PRO A 121 -3.870 -0.801 -11.402 1.00 0.00 C ATOM 1928 CD PRO A 121 -3.556 -0.324 -10.017 1.00 0.00 C ATOM 0 HA PRO A 121 -6.642 -0.245 -10.462 1.00 0.00 H new ATOM 0 HB2 PRO A 121 -4.906 -2.655 -11.127 1.00 0.00 H new ATOM 0 HB3 PRO A 121 -5.690 -1.554 -12.242 1.00 0.00 H new ATOM 0 HG2 PRO A 121 -3.053 -1.405 -11.797 1.00 0.00 H new ATOM 0 HG3 PRO A 121 -4.000 0.042 -12.080 1.00 0.00 H new ATOM 0 HD2 PRO A 121 -2.812 -0.958 -9.535 1.00 0.00 H new ATOM 0 HD3 PRO A 121 -3.154 0.689 -10.025 1.00 0.00 H new ATOM 1936 N ARG A 122 -6.022 -3.148 -9.068 1.00 0.00 N ATOM 1937 CA ARG A 122 -6.663 -4.246 -8.355 1.00 0.00 C ATOM 1938 C ARG A 122 -7.628 -3.717 -7.297 1.00 0.00 C ATOM 1939 O ARG A 122 -8.788 -4.125 -7.240 1.00 0.00 O ATOM 1940 CB ARG A 122 -5.610 -5.140 -7.698 1.00 0.00 C ATOM 1941 CG ARG A 122 -4.928 -6.091 -8.668 1.00 0.00 C ATOM 1942 CD ARG A 122 -4.107 -7.140 -7.935 1.00 0.00 C ATOM 1943 NE ARG A 122 -4.944 -8.028 -7.133 1.00 0.00 N ATOM 1944 CZ ARG A 122 -5.217 -9.284 -7.470 1.00 0.00 C ATOM 1945 NH1 ARG A 122 -4.721 -9.797 -8.587 1.00 0.00 N ATOM 1946 NH2 ARG A 122 -5.987 -10.029 -6.688 1.00 0.00 N ATOM 0 H ARG A 122 -5.035 -3.300 -9.276 1.00 0.00 H new ATOM 0 HA ARG A 122 -7.229 -4.834 -9.078 1.00 0.00 H new ATOM 0 HB2 ARG A 122 -4.854 -4.511 -7.227 1.00 0.00 H new ATOM 0 HB3 ARG A 122 -6.082 -5.720 -6.905 1.00 0.00 H new ATOM 0 HG2 ARG A 122 -5.679 -6.582 -9.286 1.00 0.00 H new ATOM 0 HG3 ARG A 122 -4.282 -5.526 -9.340 1.00 0.00 H new ATOM 0 HD2 ARG A 122 -3.543 -7.729 -8.658 1.00 0.00 H new ATOM 0 HD3 ARG A 122 -3.381 -6.646 -7.290 1.00 0.00 H new ATOM 0 HE ARG A 122 -5.341 -7.664 -6.267 1.00 0.00 H new ATOM 0 HH11 ARG A 122 -4.128 -9.227 -9.190 1.00 0.00 H new ATOM 0 HH12 ARG A 122 -4.932 -10.761 -8.843 1.00 0.00 H new ATOM 0 HH21 ARG A 122 -6.370 -9.638 -5.827 1.00 0.00 H new ATOM 0 HH22 ARG A 122 -6.196 -10.993 -6.947 1.00 0.00 H new ATOM 1960 N PHE A 123 -7.140 -2.806 -6.461 1.00 0.00 N ATOM 1961 CA PHE A 123 -7.958 -2.222 -5.405 1.00 0.00 C ATOM 1962 C PHE A 123 -9.379 -1.965 -5.896 1.00 0.00 C ATOM 1963 O PHE A 123 -10.347 -2.455 -5.314 1.00 0.00 O ATOM 1964 CB PHE A 123 -7.333 -0.916 -4.910 1.00 0.00 C ATOM 1965 CG PHE A 123 -7.983 -0.373 -3.669 1.00 0.00 C ATOM 1966 CD1 PHE A 123 -8.258 -1.203 -2.595 1.00 0.00 C ATOM 1967 CD2 PHE A 123 -8.318 0.968 -3.578 1.00 0.00 C ATOM 1968 CE1 PHE A 123 -8.855 -0.707 -1.452 1.00 0.00 C ATOM 1969 CE2 PHE A 123 -8.915 1.471 -2.437 1.00 0.00 C ATOM 1970 CZ PHE A 123 -9.185 0.632 -1.373 1.00 0.00 C ATOM 0 H PHE A 123 -6.182 -2.457 -6.495 1.00 0.00 H new ATOM 0 HA PHE A 123 -8.001 -2.932 -4.579 1.00 0.00 H new ATOM 0 HB2 PHE A 123 -6.274 -1.081 -4.713 1.00 0.00 H new ATOM 0 HB3 PHE A 123 -7.398 -0.169 -5.701 1.00 0.00 H new ATOM 0 HD1 PHE A 123 -8.003 -2.251 -2.652 1.00 0.00 H new ATOM 0 HD2 PHE A 123 -8.111 1.628 -4.407 1.00 0.00 H new ATOM 0 HE1 PHE A 123 -9.063 -1.365 -0.622 1.00 0.00 H new ATOM 0 HE2 PHE A 123 -9.170 2.519 -2.377 1.00 0.00 H new ATOM 0 HZ PHE A 123 -9.653 1.022 -0.481 1.00 0.00 H new ATOM 1980 N ILE A 124 -9.496 -1.193 -6.971 1.00 0.00 N ATOM 1981 CA ILE A 124 -10.798 -0.871 -7.542 1.00 0.00 C ATOM 1982 C ILE A 124 -11.522 -2.130 -8.006 1.00 0.00 C ATOM 1983 O ILE A 124 -12.738 -2.250 -7.860 1.00 0.00 O ATOM 1984 CB ILE A 124 -10.668 0.101 -8.730 1.00 0.00 C ATOM 1985 CG1 ILE A 124 -9.907 1.359 -8.306 1.00 0.00 C ATOM 1986 CG2 ILE A 124 -12.043 0.464 -9.270 1.00 0.00 C ATOM 1987 CD1 ILE A 124 -8.403 1.205 -8.368 1.00 0.00 C ATOM 0 H ILE A 124 -8.705 -0.779 -7.464 1.00 0.00 H new ATOM 0 HA ILE A 124 -11.378 -0.392 -6.753 1.00 0.00 H new ATOM 0 HB ILE A 124 -10.106 -0.391 -9.524 1.00 0.00 H new ATOM 0 HG12 ILE A 124 -10.206 2.188 -8.947 1.00 0.00 H new ATOM 0 HG13 ILE A 124 -10.196 1.623 -7.289 1.00 0.00 H new ATOM 0 HG21 ILE A 124 -11.935 1.151 -10.109 1.00 0.00 H new ATOM 0 HG22 ILE A 124 -12.553 -0.440 -9.605 1.00 0.00 H new ATOM 0 HG23 ILE A 124 -12.628 0.941 -8.484 1.00 0.00 H new ATOM 0 HD11 ILE A 124 -7.929 2.135 -8.054 1.00 0.00 H new ATOM 0 HD12 ILE A 124 -8.092 0.397 -7.705 1.00 0.00 H new ATOM 0 HD13 ILE A 124 -8.103 0.972 -9.390 1.00 0.00 H new ATOM 1999 N ARG A 125 -10.764 -3.068 -8.566 1.00 0.00 N ATOM 2000 CA ARG A 125 -11.333 -4.320 -9.052 1.00 0.00 C ATOM 2001 C ARG A 125 -12.044 -5.067 -7.928 1.00 0.00 C ATOM 2002 O ARG A 125 -13.223 -5.402 -8.040 1.00 0.00 O ATOM 2003 CB ARG A 125 -10.238 -5.203 -9.653 1.00 0.00 C ATOM 2004 CG ARG A 125 -9.381 -4.492 -10.687 1.00 0.00 C ATOM 2005 CD ARG A 125 -10.160 -4.222 -11.965 1.00 0.00 C ATOM 2006 NE ARG A 125 -10.527 -5.456 -12.654 1.00 0.00 N ATOM 2007 CZ ARG A 125 -11.679 -5.626 -13.294 1.00 0.00 C ATOM 2008 NH1 ARG A 125 -12.569 -4.644 -13.335 1.00 0.00 N ATOM 2009 NH2 ARG A 125 -11.940 -6.779 -13.897 1.00 0.00 N ATOM 0 H ARG A 125 -9.756 -2.985 -8.694 1.00 0.00 H new ATOM 0 HA ARG A 125 -12.064 -4.082 -9.825 1.00 0.00 H new ATOM 0 HB2 ARG A 125 -9.597 -5.568 -8.851 1.00 0.00 H new ATOM 0 HB3 ARG A 125 -10.700 -6.076 -10.114 1.00 0.00 H new ATOM 0 HG2 ARG A 125 -9.018 -3.550 -10.275 1.00 0.00 H new ATOM 0 HG3 ARG A 125 -8.505 -5.099 -10.915 1.00 0.00 H new ATOM 0 HD2 ARG A 125 -11.062 -3.658 -11.727 1.00 0.00 H new ATOM 0 HD3 ARG A 125 -9.561 -3.600 -12.630 1.00 0.00 H new ATOM 0 HE ARG A 125 -9.863 -6.230 -12.643 1.00 0.00 H new ATOM 0 HH11 ARG A 125 -12.370 -3.756 -12.875 1.00 0.00 H new ATOM 0 HH12 ARG A 125 -13.453 -4.777 -13.827 1.00 0.00 H new ATOM 0 HH21 ARG A 125 -11.256 -7.535 -13.869 1.00 0.00 H new ATOM 0 HH22 ARG A 125 -12.824 -6.909 -14.388 1.00 0.00 H new ATOM 2023 N SER A 126 -11.318 -5.324 -6.844 1.00 0.00 N ATOM 2024 CA SER A 126 -11.878 -6.036 -5.701 1.00 0.00 C ATOM 2025 C SER A 126 -13.131 -5.334 -5.185 1.00 0.00 C ATOM 2026 O SER A 126 -13.359 -4.158 -5.469 1.00 0.00 O ATOM 2027 CB SER A 126 -10.841 -6.141 -4.581 1.00 0.00 C ATOM 2028 OG SER A 126 -11.223 -7.110 -3.621 1.00 0.00 O ATOM 0 H SER A 126 -10.342 -5.050 -6.734 1.00 0.00 H new ATOM 0 HA SER A 126 -12.153 -7.039 -6.028 1.00 0.00 H new ATOM 0 HB2 SER A 126 -9.871 -6.405 -5.003 1.00 0.00 H new ATOM 0 HB3 SER A 126 -10.725 -5.171 -4.097 1.00 0.00 H new ATOM 0 HG SER A 126 -10.518 -7.197 -2.946 1.00 0.00 H new ATOM 2034 N SER A 127 -13.940 -6.065 -4.424 1.00 0.00 N ATOM 2035 CA SER A 127 -15.172 -5.515 -3.871 1.00 0.00 C ATOM 2036 C SER A 127 -14.888 -4.712 -2.604 1.00 0.00 C ATOM 2037 O SER A 127 -15.563 -3.724 -2.319 1.00 0.00 O ATOM 2038 CB SER A 127 -16.164 -6.639 -3.564 1.00 0.00 C ATOM 2039 OG SER A 127 -16.851 -7.046 -4.735 1.00 0.00 O ATOM 0 H SER A 127 -13.764 -7.039 -4.177 1.00 0.00 H new ATOM 0 HA SER A 127 -15.608 -4.847 -4.614 1.00 0.00 H new ATOM 0 HB2 SER A 127 -15.634 -7.489 -3.135 1.00 0.00 H new ATOM 0 HB3 SER A 127 -16.882 -6.301 -2.816 1.00 0.00 H new ATOM 0 HG SER A 127 -17.478 -7.766 -4.513 1.00 0.00 H new ATOM 2045 N ALA A 128 -13.884 -5.146 -1.849 1.00 0.00 N ATOM 2046 CA ALA A 128 -13.509 -4.468 -0.614 1.00 0.00 C ATOM 2047 C ALA A 128 -13.655 -2.957 -0.752 1.00 0.00 C ATOM 2048 O ALA A 128 -14.140 -2.284 0.158 1.00 0.00 O ATOM 2049 CB ALA A 128 -12.083 -4.830 -0.226 1.00 0.00 C ATOM 0 H ALA A 128 -13.316 -5.964 -2.071 1.00 0.00 H new ATOM 0 HA ALA A 128 -14.184 -4.801 0.175 1.00 0.00 H new ATOM 0 HB1 ALA A 128 -11.816 -4.317 0.698 1.00 0.00 H new ATOM 0 HB2 ALA A 128 -12.009 -5.907 -0.077 1.00 0.00 H new ATOM 0 HB3 ALA A 128 -11.401 -4.526 -1.020 1.00 0.00 H new ATOM 2055 N TYR A 129 -13.231 -2.428 -1.895 1.00 0.00 N ATOM 2056 CA TYR A 129 -13.311 -0.995 -2.150 1.00 0.00 C ATOM 2057 C TYR A 129 -14.763 -0.545 -2.281 1.00 0.00 C ATOM 2058 O TYR A 129 -15.183 0.424 -1.649 1.00 0.00 O ATOM 2059 CB TYR A 129 -12.539 -0.638 -3.421 1.00 0.00 C ATOM 2060 CG TYR A 129 -12.956 0.681 -4.033 1.00 0.00 C ATOM 2061 CD1 TYR A 129 -12.423 1.880 -3.577 1.00 0.00 C ATOM 2062 CD2 TYR A 129 -13.882 0.726 -5.068 1.00 0.00 C ATOM 2063 CE1 TYR A 129 -12.802 3.087 -4.133 1.00 0.00 C ATOM 2064 CE2 TYR A 129 -14.265 1.928 -5.631 1.00 0.00 C ATOM 2065 CZ TYR A 129 -13.723 3.106 -5.159 1.00 0.00 C ATOM 2066 OH TYR A 129 -14.102 4.306 -5.716 1.00 0.00 O ATOM 0 H TYR A 129 -12.829 -2.971 -2.659 1.00 0.00 H new ATOM 0 HA TYR A 129 -12.863 -0.476 -1.303 1.00 0.00 H new ATOM 0 HB2 TYR A 129 -11.474 -0.602 -3.191 1.00 0.00 H new ATOM 0 HB3 TYR A 129 -12.680 -1.431 -4.156 1.00 0.00 H new ATOM 0 HD1 TYR A 129 -11.700 1.869 -2.775 1.00 0.00 H new ATOM 0 HD2 TYR A 129 -14.309 -0.194 -5.438 1.00 0.00 H new ATOM 0 HE1 TYR A 129 -12.379 4.010 -3.766 1.00 0.00 H new ATOM 0 HE2 TYR A 129 -14.985 1.946 -6.436 1.00 0.00 H new ATOM 0 HH TYR A 129 -14.695 4.140 -6.479 1.00 0.00 H new ATOM 2076 N GLN A 130 -15.524 -1.258 -3.105 1.00 0.00 N ATOM 2077 CA GLN A 130 -16.930 -0.933 -3.320 1.00 0.00 C ATOM 2078 C GLN A 130 -17.709 -0.998 -2.011 1.00 0.00 C ATOM 2079 O GLN A 130 -18.512 -0.115 -1.712 1.00 0.00 O ATOM 2080 CB GLN A 130 -17.546 -1.889 -4.342 1.00 0.00 C ATOM 2081 CG GLN A 130 -16.773 -1.963 -5.650 1.00 0.00 C ATOM 2082 CD GLN A 130 -17.197 -0.895 -6.638 1.00 0.00 C ATOM 2083 OE1 GLN A 130 -18.081 -0.085 -6.355 1.00 0.00 O ATOM 2084 NE2 GLN A 130 -16.568 -0.887 -7.808 1.00 0.00 N ATOM 0 H GLN A 130 -15.191 -2.064 -3.634 1.00 0.00 H new ATOM 0 HA GLN A 130 -16.987 0.085 -3.706 1.00 0.00 H new ATOM 0 HB2 GLN A 130 -17.602 -2.886 -3.906 1.00 0.00 H new ATOM 0 HB3 GLN A 130 -18.568 -1.574 -4.551 1.00 0.00 H new ATOM 0 HG2 GLN A 130 -15.707 -1.860 -5.444 1.00 0.00 H new ATOM 0 HG3 GLN A 130 -16.918 -2.946 -6.098 1.00 0.00 H new ATOM 0 HE21 GLN A 130 -15.842 -1.576 -8.001 1.00 0.00 H new ATOM 0 HE22 GLN A 130 -16.811 -0.191 -8.513 1.00 0.00 H new ATOM 2093 N GLU A 131 -17.466 -2.049 -1.235 1.00 0.00 N ATOM 2094 CA GLU A 131 -18.147 -2.229 0.042 1.00 0.00 C ATOM 2095 C GLU A 131 -18.265 -0.903 0.787 1.00 0.00 C ATOM 2096 O GLU A 131 -19.366 -0.456 1.112 1.00 0.00 O ATOM 2097 CB GLU A 131 -17.399 -3.247 0.906 1.00 0.00 C ATOM 2098 CG GLU A 131 -17.182 -4.585 0.219 1.00 0.00 C ATOM 2099 CD GLU A 131 -17.138 -5.743 1.197 1.00 0.00 C ATOM 2100 OE1 GLU A 131 -16.280 -5.721 2.105 1.00 0.00 O ATOM 2101 OE2 GLU A 131 -17.961 -6.671 1.055 1.00 0.00 O ATOM 0 H GLU A 131 -16.803 -2.788 -1.468 1.00 0.00 H new ATOM 0 HA GLU A 131 -19.151 -2.603 -0.161 1.00 0.00 H new ATOM 0 HB2 GLU A 131 -16.431 -2.831 1.187 1.00 0.00 H new ATOM 0 HB3 GLU A 131 -17.957 -3.408 1.828 1.00 0.00 H new ATOM 0 HG2 GLU A 131 -17.982 -4.753 -0.502 1.00 0.00 H new ATOM 0 HG3 GLU A 131 -16.249 -4.553 -0.343 1.00 0.00 H new ATOM 2108 N LEU A 132 -17.124 -0.278 1.056 1.00 0.00 N ATOM 2109 CA LEU A 132 -17.098 0.997 1.763 1.00 0.00 C ATOM 2110 C LEU A 132 -17.983 2.025 1.066 1.00 0.00 C ATOM 2111 O LEU A 132 -18.777 2.714 1.708 1.00 0.00 O ATOM 2112 CB LEU A 132 -15.664 1.522 1.856 1.00 0.00 C ATOM 2113 CG LEU A 132 -14.590 0.486 2.190 1.00 0.00 C ATOM 2114 CD1 LEU A 132 -13.225 1.146 2.295 1.00 0.00 C ATOM 2115 CD2 LEU A 132 -14.934 -0.240 3.483 1.00 0.00 C ATOM 0 H LEU A 132 -16.204 -0.634 0.795 1.00 0.00 H new ATOM 0 HA LEU A 132 -17.485 0.834 2.769 1.00 0.00 H new ATOM 0 HB2 LEU A 132 -15.407 1.989 0.905 1.00 0.00 H new ATOM 0 HB3 LEU A 132 -15.633 2.305 2.614 1.00 0.00 H new ATOM 0 HG LEU A 132 -14.555 -0.246 1.383 1.00 0.00 H new ATOM 0 HD11 LEU A 132 -12.474 0.393 2.533 1.00 0.00 H new ATOM 0 HD12 LEU A 132 -12.976 1.619 1.345 1.00 0.00 H new ATOM 0 HD13 LEU A 132 -13.245 1.900 3.082 1.00 0.00 H new ATOM 0 HD21 LEU A 132 -14.159 -0.974 3.706 1.00 0.00 H new ATOM 0 HD22 LEU A 132 -14.997 0.480 4.299 1.00 0.00 H new ATOM 0 HD23 LEU A 132 -15.892 -0.747 3.372 1.00 0.00 H new ATOM 2127 N LEU A 133 -17.844 2.121 -0.252 1.00 0.00 N ATOM 2128 CA LEU A 133 -18.633 3.064 -1.038 1.00 0.00 C ATOM 2129 C LEU A 133 -20.119 2.927 -0.720 1.00 0.00 C ATOM 2130 O LEU A 133 -20.713 3.805 -0.094 1.00 0.00 O ATOM 2131 CB LEU A 133 -18.396 2.836 -2.532 1.00 0.00 C ATOM 2132 CG LEU A 133 -17.363 3.749 -3.194 1.00 0.00 C ATOM 2133 CD1 LEU A 133 -16.857 3.131 -4.488 1.00 0.00 C ATOM 2134 CD2 LEU A 133 -17.957 5.125 -3.454 1.00 0.00 C ATOM 0 H LEU A 133 -17.193 1.558 -0.799 1.00 0.00 H new ATOM 0 HA LEU A 133 -18.316 4.073 -0.776 1.00 0.00 H new ATOM 0 HB2 LEU A 133 -18.083 1.802 -2.676 1.00 0.00 H new ATOM 0 HB3 LEU A 133 -19.346 2.957 -3.053 1.00 0.00 H new ATOM 0 HG LEU A 133 -16.518 3.863 -2.515 1.00 0.00 H new ATOM 0 HD11 LEU A 133 -16.123 3.794 -4.945 1.00 0.00 H new ATOM 0 HD12 LEU A 133 -16.393 2.168 -4.274 1.00 0.00 H new ATOM 0 HD13 LEU A 133 -17.692 2.987 -5.173 1.00 0.00 H new ATOM 0 HD21 LEU A 133 -17.208 5.761 -3.925 1.00 0.00 H new ATOM 0 HD22 LEU A 133 -18.820 5.030 -4.114 1.00 0.00 H new ATOM 0 HD23 LEU A 133 -18.270 5.571 -2.510 1.00 0.00 H new