USER MOD reduce.3.24.130724 H: found=0, std=0, add=676, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 674 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 41 MET CE :methyl -136:sc= -0.146 (180deg=-0.927) USER MOD Set 1.2: A 116 CYS SG : rot 77:sc= 0.914 USER MOD Set 2.1: A 79 SER OG : rot 180:sc= 0 USER MOD Set 2.2: A 83 ASN : amide:sc= -0.524 X(o=-0.52,f=-0.076) USER MOD Single : A 33 SER OG : rot 34:sc= 0.365 USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 47 HIS :FLIP no HE2:sc= -0.11 F(o=-1.4,f=-0.11) USER MOD Single : A 48 LYS NZ :NH3+ -155:sc= 0.469! (180deg=-0.876!) USER MOD Single : A 49 HIS : no HD1:sc= -2.32 K(o=-2.3,f=-2.8!) USER MOD Single : A 57 SER OG : rot 180:sc= 0 USER MOD Single : A 60 TYR OH : rot 180:sc= 0 USER MOD Single : A 62 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 TYR OH : rot 180:sc= 0 USER MOD Single : A 81 CYS SG : rot -47:sc= -6.55! USER MOD Single : A 84 GLN : amide:sc= -3.91! C(o=-3.9!,f=-4.1!) USER MOD Single : A 87 SER OG : rot 180:sc= 0 USER MOD Single : A 89 MET CE :methyl -152:sc= -0.179 (180deg=-1.26) USER MOD Single : A 92 TYR OH : rot 180:sc= 0 USER MOD Single : A 94 GLN :FLIP amide:sc= -2.06 F(o=-9.7!,f=-2.1) USER MOD Single : A 98 HIS : no HE2:sc= 0.469! C(o=0.47!,f=-9.4!) USER MOD Single : A 105 THR OG1 : rot 180:sc= 0 USER MOD Single : A 106 THR OG1 : rot 180:sc= -5.65! USER MOD Single : A 114 GLN : amide:sc= -0.253 X(o=-0.25,f=-0.35) USER MOD Single : A 120 LYS NZ :NH3+ -172:sc= 0.646 (180deg=0.448) USER MOD Single : A 124 SER OG : rot 180:sc= 0 USER MOD Single : A 127 GLN : amide:sc= 0 K(o=0,f=-1.2!) USER MOD Single : A 128 GLN : amide:sc= -0.0446 K(o=-0.045,f=-2.6!) USER MOD Single : A 129 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 133 N SER A 33 0.154 -13.078 8.698 1.00 0.00 N ATOM 134 CA SER A 33 -0.492 -12.531 9.880 1.00 0.00 C ATOM 135 C SER A 33 -1.770 -13.299 10.181 1.00 0.00 C ATOM 136 O SER A 33 -1.848 -14.033 11.164 1.00 0.00 O ATOM 137 CB SER A 33 -0.809 -11.048 9.659 1.00 0.00 C ATOM 138 OG SER A 33 0.332 -10.413 9.107 1.00 0.00 O ATOM 0 HA SER A 33 0.183 -12.628 10.730 1.00 0.00 H new ATOM 0 HB2 SER A 33 -1.662 -10.940 8.989 1.00 0.00 H new ATOM 0 HB3 SER A 33 -1.084 -10.576 10.602 1.00 0.00 H new ATOM 0 HG SER A 33 0.804 -11.040 8.520 1.00 0.00 H new ATOM 144 N LEU A 34 -2.794 -13.086 9.350 1.00 0.00 N ATOM 145 CA LEU A 34 -4.086 -13.728 9.567 1.00 0.00 C ATOM 146 C LEU A 34 -3.891 -15.154 10.055 1.00 0.00 C ATOM 147 O LEU A 34 -4.603 -15.620 10.945 1.00 0.00 O ATOM 148 CB LEU A 34 -4.885 -13.732 8.265 1.00 0.00 C ATOM 149 CG LEU A 34 -6.227 -14.431 8.488 1.00 0.00 C ATOM 150 CD1 LEU A 34 -7.004 -13.712 9.594 1.00 0.00 C ATOM 151 CD2 LEU A 34 -7.039 -14.399 7.192 1.00 0.00 C ATOM 0 H LEU A 34 -2.752 -12.480 8.530 1.00 0.00 H new ATOM 0 HA LEU A 34 -4.634 -13.169 10.326 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -5.048 -12.710 7.924 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -4.323 -14.243 7.483 1.00 0.00 H new ATOM 0 HG LEU A 34 -6.051 -15.465 8.783 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -7.960 -14.212 9.751 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -6.426 -13.735 10.518 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -7.180 -12.677 9.301 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -7.996 -14.897 7.350 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -7.213 -13.364 6.897 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -6.488 -14.913 6.405 1.00 0.00 H new ATOM 163 N GLU A 35 -2.917 -15.840 9.473 1.00 0.00 N ATOM 164 CA GLU A 35 -2.629 -17.215 9.862 1.00 0.00 C ATOM 165 C GLU A 35 -2.118 -17.277 11.296 1.00 0.00 C ATOM 166 O GLU A 35 -2.540 -18.130 12.078 1.00 0.00 O ATOM 167 CB GLU A 35 -1.586 -17.815 8.916 1.00 0.00 C ATOM 168 CG GLU A 35 -1.083 -19.142 9.485 1.00 0.00 C ATOM 169 CD GLU A 35 -0.247 -19.876 8.444 1.00 0.00 C ATOM 170 OE1 GLU A 35 0.455 -20.801 8.818 1.00 0.00 O ATOM 171 OE2 GLU A 35 -0.324 -19.504 7.284 1.00 0.00 O ATOM 0 H GLU A 35 -2.317 -15.471 8.735 1.00 0.00 H new ATOM 0 HA GLU A 35 -3.552 -17.791 9.799 1.00 0.00 H new ATOM 0 HB2 GLU A 35 -2.022 -17.972 7.930 1.00 0.00 H new ATOM 0 HB3 GLU A 35 -0.754 -17.123 8.790 1.00 0.00 H new ATOM 0 HG2 GLU A 35 -0.487 -18.960 10.379 1.00 0.00 H new ATOM 0 HG3 GLU A 35 -1.928 -19.761 9.786 1.00 0.00 H new ATOM 178 N GLU A 36 -1.209 -16.371 11.634 1.00 0.00 N ATOM 179 CA GLU A 36 -0.648 -16.335 12.978 1.00 0.00 C ATOM 180 C GLU A 36 -1.726 -15.993 14.000 1.00 0.00 C ATOM 181 O GLU A 36 -1.780 -16.581 15.080 1.00 0.00 O ATOM 182 CB GLU A 36 0.474 -15.297 13.047 1.00 0.00 C ATOM 183 CG GLU A 36 1.675 -15.781 12.235 1.00 0.00 C ATOM 184 CD GLU A 36 2.754 -14.704 12.197 1.00 0.00 C ATOM 185 OE1 GLU A 36 2.512 -13.635 12.734 1.00 0.00 O ATOM 186 OE2 GLU A 36 3.805 -14.962 11.635 1.00 0.00 O ATOM 0 H GLU A 36 -0.847 -15.657 11.002 1.00 0.00 H new ATOM 0 HA GLU A 36 -0.245 -17.321 13.210 1.00 0.00 H new ATOM 0 HB2 GLU A 36 0.122 -14.341 12.659 1.00 0.00 H new ATOM 0 HB3 GLU A 36 0.767 -15.132 14.084 1.00 0.00 H new ATOM 0 HG2 GLU A 36 2.077 -16.693 12.675 1.00 0.00 H new ATOM 0 HG3 GLU A 36 1.362 -16.028 11.221 1.00 0.00 H new ATOM 193 N LYS A 37 -2.582 -15.036 13.654 1.00 0.00 N ATOM 194 CA LYS A 37 -3.646 -14.617 14.563 1.00 0.00 C ATOM 195 C LYS A 37 -4.513 -15.813 14.944 1.00 0.00 C ATOM 196 O LYS A 37 -4.809 -16.023 16.120 1.00 0.00 O ATOM 197 CB LYS A 37 -4.522 -13.566 13.877 1.00 0.00 C ATOM 198 CG LYS A 37 -3.641 -12.433 13.357 1.00 0.00 C ATOM 199 CD LYS A 37 -4.483 -11.471 12.509 1.00 0.00 C ATOM 200 CE LYS A 37 -3.627 -10.903 11.377 1.00 0.00 C ATOM 201 NZ LYS A 37 -4.510 -10.254 10.363 1.00 0.00 N ATOM 0 H LYS A 37 -2.562 -14.541 12.762 1.00 0.00 H new ATOM 0 HA LYS A 37 -3.195 -14.196 15.462 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -5.075 -14.019 13.054 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -5.259 -13.176 14.579 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -3.190 -11.897 14.192 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -2.824 -12.839 12.761 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -5.347 -11.993 12.098 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -4.866 -10.662 13.131 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -2.916 -10.178 11.773 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -3.045 -11.699 10.912 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 -3.928 -9.867 9.593 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -5.172 -10.958 9.978 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -5.046 -9.484 10.812 1.00 0.00 H new ATOM 215 N ILE A 38 -4.912 -16.599 13.948 1.00 0.00 N ATOM 216 CA ILE A 38 -5.740 -17.774 14.200 1.00 0.00 C ATOM 217 C ILE A 38 -4.983 -18.788 15.052 1.00 0.00 C ATOM 218 O ILE A 38 -5.535 -19.360 15.991 1.00 0.00 O ATOM 219 CB ILE A 38 -6.147 -18.418 12.874 1.00 0.00 C ATOM 220 CG1 ILE A 38 -7.073 -17.469 12.111 1.00 0.00 C ATOM 221 CG2 ILE A 38 -6.885 -19.731 13.150 1.00 0.00 C ATOM 222 CD1 ILE A 38 -7.268 -17.984 10.683 1.00 0.00 C ATOM 0 H ILE A 38 -4.678 -16.446 12.967 1.00 0.00 H new ATOM 0 HA ILE A 38 -6.634 -17.460 14.739 1.00 0.00 H new ATOM 0 HB ILE A 38 -5.256 -18.618 12.279 1.00 0.00 H new ATOM 0 HG12 ILE A 38 -8.035 -17.398 12.618 1.00 0.00 H new ATOM 0 HG13 ILE A 38 -6.647 -16.466 12.092 1.00 0.00 H new ATOM 0 HG21 ILE A 38 -7.175 -20.191 12.205 1.00 0.00 H new ATOM 0 HG22 ILE A 38 -6.230 -20.409 13.697 1.00 0.00 H new ATOM 0 HG23 ILE A 38 -7.776 -19.530 13.745 1.00 0.00 H new ATOM 0 HD11 ILE A 38 -7.928 -17.308 10.139 1.00 0.00 H new ATOM 0 HD12 ILE A 38 -6.303 -18.033 10.179 1.00 0.00 H new ATOM 0 HD13 ILE A 38 -7.712 -18.979 10.713 1.00 0.00 H new ATOM 234 N LYS A 39 -3.717 -19.009 14.716 1.00 0.00 N ATOM 235 CA LYS A 39 -2.895 -19.961 15.456 1.00 0.00 C ATOM 236 C LYS A 39 -2.767 -19.532 16.912 1.00 0.00 C ATOM 237 O LYS A 39 -2.799 -20.366 17.818 1.00 0.00 O ATOM 238 CB LYS A 39 -1.505 -20.048 14.822 1.00 0.00 C ATOM 239 CG LYS A 39 -1.607 -20.745 13.464 1.00 0.00 C ATOM 240 CD LYS A 39 -0.287 -20.589 12.703 1.00 0.00 C ATOM 241 CE LYS A 39 0.714 -21.642 13.168 1.00 0.00 C ATOM 242 NZ LYS A 39 1.804 -21.773 12.165 1.00 0.00 N ATOM 0 H LYS A 39 -3.240 -18.546 13.942 1.00 0.00 H new ATOM 0 HA LYS A 39 -3.374 -20.940 15.418 1.00 0.00 H new ATOM 0 HB2 LYS A 39 -1.086 -19.049 14.700 1.00 0.00 H new ATOM 0 HB3 LYS A 39 -0.829 -20.599 15.476 1.00 0.00 H new ATOM 0 HG2 LYS A 39 -1.835 -21.802 13.603 1.00 0.00 H new ATOM 0 HG3 LYS A 39 -2.425 -20.316 12.885 1.00 0.00 H new ATOM 0 HD2 LYS A 39 -0.462 -20.690 11.632 1.00 0.00 H new ATOM 0 HD3 LYS A 39 0.120 -19.591 12.867 1.00 0.00 H new ATOM 0 HE2 LYS A 39 1.129 -21.361 14.136 1.00 0.00 H new ATOM 0 HE3 LYS A 39 0.213 -22.601 13.302 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 2.485 -22.491 12.484 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 1.401 -22.060 11.250 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 2.289 -20.859 12.058 1.00 0.00 H new ATOM 256 N LEU A 40 -2.618 -18.229 17.131 1.00 0.00 N ATOM 257 CA LEU A 40 -2.489 -17.706 18.486 1.00 0.00 C ATOM 258 C LEU A 40 -3.792 -17.882 19.262 1.00 0.00 C ATOM 259 O LEU A 40 -3.792 -18.366 20.393 1.00 0.00 O ATOM 260 CB LEU A 40 -2.120 -16.221 18.437 1.00 0.00 C ATOM 261 CG LEU A 40 -2.024 -15.669 19.861 1.00 0.00 C ATOM 262 CD1 LEU A 40 -0.995 -16.476 20.655 1.00 0.00 C ATOM 263 CD2 LEU A 40 -1.591 -14.203 19.810 1.00 0.00 C ATOM 0 H LEU A 40 -2.584 -17.523 16.396 1.00 0.00 H new ATOM 0 HA LEU A 40 -1.702 -18.263 18.995 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -1.170 -16.089 17.920 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -2.870 -15.668 17.871 1.00 0.00 H new ATOM 0 HG LEU A 40 -2.997 -15.746 20.346 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -0.927 -16.082 21.669 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -1.302 -17.521 20.692 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -0.021 -16.401 20.171 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -1.522 -13.808 20.824 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -0.618 -14.128 19.325 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -2.324 -13.627 19.245 1.00 0.00 H new ATOM 275 N MET A 41 -4.898 -17.486 18.644 1.00 0.00 N ATOM 276 CA MET A 41 -6.205 -17.599 19.281 1.00 0.00 C ATOM 277 C MET A 41 -6.584 -19.065 19.455 1.00 0.00 C ATOM 278 O MET A 41 -7.297 -19.427 20.392 1.00 0.00 O ATOM 279 CB MET A 41 -7.263 -16.885 18.440 1.00 0.00 C ATOM 280 CG MET A 41 -6.970 -15.384 18.412 1.00 0.00 C ATOM 281 SD MET A 41 -7.089 -14.708 20.088 1.00 0.00 S ATOM 282 CE MET A 41 -8.888 -14.822 20.250 1.00 0.00 C ATOM 0 H MET A 41 -4.917 -17.085 17.706 1.00 0.00 H new ATOM 0 HA MET A 41 -6.155 -17.129 20.263 1.00 0.00 H new ATOM 0 HB2 MET A 41 -7.266 -17.284 17.426 1.00 0.00 H new ATOM 0 HB3 MET A 41 -8.254 -17.064 18.856 1.00 0.00 H new ATOM 0 HG2 MET A 41 -5.974 -15.206 18.007 1.00 0.00 H new ATOM 0 HG3 MET A 41 -7.677 -14.878 17.754 1.00 0.00 H new ATOM 0 HE1 MET A 41 -9.272 -13.904 20.694 1.00 0.00 H new ATOM 0 HE2 MET A 41 -9.334 -14.964 19.265 1.00 0.00 H new ATOM 0 HE3 MET A 41 -9.143 -15.668 20.889 1.00 0.00 H new ATOM 292 N ARG A 42 -6.109 -19.903 18.542 1.00 0.00 N ATOM 293 CA ARG A 42 -6.407 -21.327 18.603 1.00 0.00 C ATOM 294 C ARG A 42 -5.793 -21.953 19.849 1.00 0.00 C ATOM 295 O ARG A 42 -6.184 -23.046 20.262 1.00 0.00 O ATOM 296 CB ARG A 42 -5.869 -22.036 17.353 1.00 0.00 C ATOM 297 CG ARG A 42 -6.951 -22.074 16.268 1.00 0.00 C ATOM 298 CD ARG A 42 -6.670 -23.229 15.314 1.00 0.00 C ATOM 299 NE ARG A 42 -5.364 -23.065 14.680 1.00 0.00 N ATOM 300 CZ ARG A 42 -5.253 -22.750 13.394 1.00 0.00 C ATOM 301 NH1 ARG A 42 -4.073 -22.609 12.856 1.00 0.00 N ATOM 302 NH2 ARG A 42 -6.325 -22.582 12.669 1.00 0.00 N ATOM 0 H ARG A 42 -5.521 -19.624 17.757 1.00 0.00 H new ATOM 0 HA ARG A 42 -7.490 -21.446 18.647 1.00 0.00 H new ATOM 0 HB2 ARG A 42 -4.987 -21.516 16.981 1.00 0.00 H new ATOM 0 HB3 ARG A 42 -5.559 -23.050 17.605 1.00 0.00 H new ATOM 0 HG2 ARG A 42 -7.934 -22.195 16.723 1.00 0.00 H new ATOM 0 HG3 ARG A 42 -6.966 -21.131 15.721 1.00 0.00 H new ATOM 0 HD2 ARG A 42 -6.700 -24.173 15.858 1.00 0.00 H new ATOM 0 HD3 ARG A 42 -7.447 -23.275 14.551 1.00 0.00 H new ATOM 0 HE ARG A 42 -4.519 -23.195 15.237 1.00 0.00 H new ATOM 0 HH11 ARG A 42 -3.235 -22.741 13.423 1.00 0.00 H new ATOM 0 HH12 ARG A 42 -3.988 -22.367 11.869 1.00 0.00 H new ATOM 0 HH21 ARG A 42 -7.248 -22.692 13.090 1.00 0.00 H new ATOM 0 HH22 ARG A 42 -6.240 -22.340 11.682 1.00 0.00 H new ATOM 316 N LEU A 43 -4.832 -21.257 20.439 1.00 0.00 N ATOM 317 CA LEU A 43 -4.174 -21.748 21.642 1.00 0.00 C ATOM 318 C LEU A 43 -4.829 -21.171 22.891 1.00 0.00 C ATOM 319 O LEU A 43 -4.953 -21.852 23.910 1.00 0.00 O ATOM 320 CB LEU A 43 -2.688 -21.379 21.615 1.00 0.00 C ATOM 321 CG LEU A 43 -1.909 -22.435 20.826 1.00 0.00 C ATOM 322 CD1 LEU A 43 -0.450 -22.000 20.699 1.00 0.00 C ATOM 323 CD2 LEU A 43 -1.978 -23.782 21.563 1.00 0.00 C ATOM 0 H LEU A 43 -4.491 -20.355 20.107 1.00 0.00 H new ATOM 0 HA LEU A 43 -4.275 -22.833 21.669 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -2.555 -20.398 21.158 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -2.301 -21.312 22.632 1.00 0.00 H new ATOM 0 HG LEU A 43 -2.346 -22.542 19.833 1.00 0.00 H new ATOM 0 HD11 LEU A 43 0.106 -22.751 20.138 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -0.399 -21.045 20.176 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -0.014 -21.894 21.692 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -1.423 -24.533 21.001 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -1.541 -23.676 22.556 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -3.019 -24.093 21.656 1.00 0.00 H new ATOM 335 N VAL A 44 -5.228 -19.908 22.809 1.00 0.00 N ATOM 336 CA VAL A 44 -5.858 -19.244 23.944 1.00 0.00 C ATOM 337 C VAL A 44 -7.172 -19.936 24.300 1.00 0.00 C ATOM 338 O VAL A 44 -7.448 -20.198 25.470 1.00 0.00 O ATOM 339 CB VAL A 44 -6.123 -17.776 23.607 1.00 0.00 C ATOM 340 CG1 VAL A 44 -6.728 -17.067 24.821 1.00 0.00 C ATOM 341 CG2 VAL A 44 -4.807 -17.095 23.223 1.00 0.00 C ATOM 0 H VAL A 44 -5.128 -19.327 21.977 1.00 0.00 H new ATOM 0 HA VAL A 44 -5.185 -19.301 24.800 1.00 0.00 H new ATOM 0 HB VAL A 44 -6.821 -17.719 22.772 1.00 0.00 H new ATOM 0 HG11 VAL A 44 -6.915 -16.021 24.576 1.00 0.00 H new ATOM 0 HG12 VAL A 44 -7.667 -17.549 25.094 1.00 0.00 H new ATOM 0 HG13 VAL A 44 -6.034 -17.125 25.659 1.00 0.00 H new ATOM 0 HG21 VAL A 44 -4.995 -16.049 22.983 1.00 0.00 H new ATOM 0 HG22 VAL A 44 -4.109 -17.156 24.058 1.00 0.00 H new ATOM 0 HG23 VAL A 44 -4.378 -17.595 22.355 1.00 0.00 H new ATOM 351 N VAL A 45 -7.980 -20.218 23.285 1.00 0.00 N ATOM 352 CA VAL A 45 -9.262 -20.876 23.499 1.00 0.00 C ATOM 353 C VAL A 45 -9.054 -22.283 24.048 1.00 0.00 C ATOM 354 O VAL A 45 -9.778 -22.729 24.936 1.00 0.00 O ATOM 355 CB VAL A 45 -10.047 -20.939 22.191 1.00 0.00 C ATOM 356 CG1 VAL A 45 -11.260 -21.853 22.365 1.00 0.00 C ATOM 357 CG2 VAL A 45 -10.522 -19.532 21.814 1.00 0.00 C ATOM 0 H VAL A 45 -7.771 -20.002 22.310 1.00 0.00 H new ATOM 0 HA VAL A 45 -9.830 -20.296 24.227 1.00 0.00 H new ATOM 0 HB VAL A 45 -9.406 -21.333 21.403 1.00 0.00 H new ATOM 0 HG11 VAL A 45 -11.819 -21.897 21.431 1.00 0.00 H new ATOM 0 HG12 VAL A 45 -10.925 -22.855 22.635 1.00 0.00 H new ATOM 0 HG13 VAL A 45 -11.902 -21.460 23.154 1.00 0.00 H new ATOM 0 HG21 VAL A 45 -11.083 -19.575 20.880 1.00 0.00 H new ATOM 0 HG22 VAL A 45 -11.163 -19.140 22.604 1.00 0.00 H new ATOM 0 HG23 VAL A 45 -9.659 -18.878 21.689 1.00 0.00 H new ATOM 367 N ARG A 46 -8.067 -22.982 23.501 1.00 0.00 N ATOM 368 CA ARG A 46 -7.776 -24.342 23.934 1.00 0.00 C ATOM 369 C ARG A 46 -7.274 -24.347 25.375 1.00 0.00 C ATOM 370 O ARG A 46 -7.215 -25.391 26.024 1.00 0.00 O ATOM 371 CB ARG A 46 -6.722 -24.970 23.019 1.00 0.00 C ATOM 372 CG ARG A 46 -6.596 -26.465 23.327 1.00 0.00 C ATOM 373 CD ARG A 46 -7.918 -27.168 23.002 1.00 0.00 C ATOM 374 NE ARG A 46 -7.668 -28.539 22.581 1.00 0.00 N ATOM 375 CZ ARG A 46 -8.604 -29.475 22.700 1.00 0.00 C ATOM 376 NH1 ARG A 46 -8.357 -30.697 22.314 1.00 0.00 N ATOM 377 NH2 ARG A 46 -9.770 -29.172 23.202 1.00 0.00 N ATOM 0 H ARG A 46 -7.458 -22.632 22.761 1.00 0.00 H new ATOM 0 HA ARG A 46 -8.695 -24.926 23.879 1.00 0.00 H new ATOM 0 HB2 ARG A 46 -7.001 -24.826 21.975 1.00 0.00 H new ATOM 0 HB3 ARG A 46 -5.761 -24.477 23.163 1.00 0.00 H new ATOM 0 HG2 ARG A 46 -5.787 -26.901 22.741 1.00 0.00 H new ATOM 0 HG3 ARG A 46 -6.343 -26.611 24.377 1.00 0.00 H new ATOM 0 HD2 ARG A 46 -8.567 -27.161 23.878 1.00 0.00 H new ATOM 0 HD3 ARG A 46 -8.442 -26.627 22.213 1.00 0.00 H new ATOM 0 HE ARG A 46 -6.759 -28.785 22.188 1.00 0.00 H new ATOM 0 HH11 ARG A 46 -7.446 -30.933 21.921 1.00 0.00 H new ATOM 0 HH12 ARG A 46 -9.075 -31.416 22.405 1.00 0.00 H new ATOM 0 HH21 ARG A 46 -9.963 -28.217 23.503 1.00 0.00 H new ATOM 0 HH22 ARG A 46 -10.488 -29.890 23.293 1.00 0.00 H new ATOM 391 N HIS A 47 -6.909 -23.171 25.872 1.00 0.00 N ATOM 392 CA HIS A 47 -6.411 -23.051 27.239 1.00 0.00 C ATOM 393 C HIS A 47 -7.160 -21.954 27.989 1.00 0.00 C ATOM 394 O HIS A 47 -6.615 -21.324 28.890 1.00 0.00 O ATOM 395 CB HIS A 47 -4.915 -22.734 27.221 1.00 0.00 C ATOM 396 CG HIS A 47 -4.165 -23.889 26.616 1.00 0.00 C ATOM 397 ND1 HIS A 47 -4.392 -25.243 26.637 1.00 0.00 N flip ATOM 398 CD2 HIS A 47 -3.010 -23.711 25.871 1.00 0.00 C flip ATOM 399 CE1 HIS A 47 -3.396 -25.897 25.917 1.00 0.00 C flip ATOM 400 NE2 HIS A 47 -2.589 -24.927 25.477 1.00 0.00 N flip ATOM 0 H HIS A 47 -6.947 -22.293 25.355 1.00 0.00 H new ATOM 0 HA HIS A 47 -6.575 -23.999 27.752 1.00 0.00 H new ATOM 0 HB2 HIS A 47 -4.732 -21.826 26.646 1.00 0.00 H new ATOM 0 HB3 HIS A 47 -4.560 -22.547 28.234 1.00 0.00 H new ATOM 0 HD1 HIS A 47 -5.172 -25.700 27.109 1.00 0.00 H new ATOM 0 HD2 HIS A 47 -2.534 -22.768 25.647 1.00 0.00 H new ATOM 0 HE1 HIS A 47 -3.297 -26.959 25.750 1.00 0.00 H new ATOM 407 N LYS A 48 -8.414 -21.734 27.612 1.00 0.00 N ATOM 408 CA LYS A 48 -9.230 -20.710 28.258 1.00 0.00 C ATOM 409 C LYS A 48 -9.598 -21.136 29.677 1.00 0.00 C ATOM 410 O LYS A 48 -9.784 -20.303 30.561 1.00 0.00 O ATOM 411 CB LYS A 48 -10.502 -20.470 27.439 1.00 0.00 C ATOM 412 CG LYS A 48 -11.328 -21.751 27.391 1.00 0.00 C ATOM 413 CD LYS A 48 -12.551 -21.533 26.498 1.00 0.00 C ATOM 414 CE LYS A 48 -13.374 -22.821 26.437 1.00 0.00 C ATOM 415 NZ LYS A 48 -14.560 -22.612 25.559 1.00 0.00 N ATOM 0 H LYS A 48 -8.887 -22.247 26.867 1.00 0.00 H new ATOM 0 HA LYS A 48 -8.655 -19.786 28.311 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -11.087 -19.665 27.884 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -10.242 -20.155 26.428 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -10.724 -22.572 27.005 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -11.643 -22.032 28.396 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -13.160 -20.718 26.889 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -12.236 -21.242 25.496 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -12.763 -23.638 26.053 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -13.695 -23.108 27.438 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -15.314 -23.276 25.830 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -14.903 -21.636 25.666 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -14.292 -22.778 24.568 1.00 0.00 H new ATOM 429 N HIS A 49 -9.699 -22.441 29.888 1.00 0.00 N ATOM 430 CA HIS A 49 -10.040 -22.967 31.205 1.00 0.00 C ATOM 431 C HIS A 49 -8.864 -22.822 32.163 1.00 0.00 C ATOM 432 O HIS A 49 -9.049 -22.558 33.352 1.00 0.00 O ATOM 433 CB HIS A 49 -10.435 -24.441 31.093 1.00 0.00 C ATOM 434 CG HIS A 49 -11.773 -24.555 30.409 1.00 0.00 C ATOM 435 ND1 HIS A 49 -12.261 -25.762 29.935 1.00 0.00 N ATOM 436 CD2 HIS A 49 -12.734 -23.620 30.112 1.00 0.00 C ATOM 437 CE1 HIS A 49 -13.465 -25.525 29.383 1.00 0.00 C ATOM 438 NE2 HIS A 49 -13.801 -24.235 29.464 1.00 0.00 N ATOM 0 H HIS A 49 -9.551 -23.151 29.171 1.00 0.00 H new ATOM 0 HA HIS A 49 -10.882 -22.395 31.596 1.00 0.00 H new ATOM 0 HB2 HIS A 49 -9.679 -24.989 30.530 1.00 0.00 H new ATOM 0 HB3 HIS A 49 -10.482 -24.892 32.084 1.00 0.00 H new ATOM 0 HD2 HIS A 49 -12.671 -22.567 30.346 1.00 0.00 H new ATOM 0 HE1 HIS A 49 -14.084 -26.285 28.930 1.00 0.00 H new ATOM 0 HE2 HIS A 49 -14.656 -23.795 29.124 1.00 0.00 H new ATOM 445 N GLU A 50 -7.656 -23.003 31.640 1.00 0.00 N ATOM 446 CA GLU A 50 -6.457 -22.898 32.462 1.00 0.00 C ATOM 447 C GLU A 50 -6.463 -21.597 33.256 1.00 0.00 C ATOM 448 O GLU A 50 -6.410 -20.508 32.685 1.00 0.00 O ATOM 449 CB GLU A 50 -5.211 -22.950 31.576 1.00 0.00 C ATOM 450 CG GLU A 50 -5.081 -24.343 30.956 1.00 0.00 C ATOM 451 CD GLU A 50 -3.889 -24.383 30.006 1.00 0.00 C ATOM 452 OE1 GLU A 50 -3.209 -23.376 29.898 1.00 0.00 O ATOM 453 OE2 GLU A 50 -3.675 -25.419 29.399 1.00 0.00 O ATOM 0 H GLU A 50 -7.482 -23.221 30.659 1.00 0.00 H new ATOM 0 HA GLU A 50 -6.443 -23.736 33.159 1.00 0.00 H new ATOM 0 HB2 GLU A 50 -5.278 -22.196 30.791 1.00 0.00 H new ATOM 0 HB3 GLU A 50 -4.323 -22.719 32.165 1.00 0.00 H new ATOM 0 HG2 GLU A 50 -4.956 -25.089 31.741 1.00 0.00 H new ATOM 0 HG3 GLU A 50 -5.994 -24.597 30.418 1.00 0.00 H new ATOM 567 N SER A 57 -0.310 -13.191 35.244 1.00 0.00 N ATOM 568 CA SER A 57 0.341 -13.358 33.951 1.00 0.00 C ATOM 569 C SER A 57 0.630 -14.830 33.680 1.00 0.00 C ATOM 570 O SER A 57 0.917 -15.217 32.547 1.00 0.00 O ATOM 571 CB SER A 57 1.652 -12.572 33.920 1.00 0.00 C ATOM 572 OG SER A 57 1.376 -11.206 33.644 1.00 0.00 O ATOM 0 HA SER A 57 -0.331 -12.981 33.180 1.00 0.00 H new ATOM 0 HB2 SER A 57 2.167 -12.664 34.876 1.00 0.00 H new ATOM 0 HB3 SER A 57 2.316 -12.981 33.159 1.00 0.00 H new ATOM 0 HG SER A 57 2.215 -10.700 33.625 1.00 0.00 H new ATOM 578 N GLU A 58 0.564 -15.646 34.726 1.00 0.00 N ATOM 579 CA GLU A 58 0.834 -17.071 34.583 1.00 0.00 C ATOM 580 C GLU A 58 0.130 -17.636 33.355 1.00 0.00 C ATOM 581 O GLU A 58 0.572 -18.630 32.778 1.00 0.00 O ATOM 582 CB GLU A 58 0.372 -17.821 35.833 1.00 0.00 C ATOM 583 CG GLU A 58 0.837 -19.276 35.755 1.00 0.00 C ATOM 584 CD GLU A 58 0.721 -19.933 37.123 1.00 0.00 C ATOM 585 OE1 GLU A 58 0.190 -19.297 38.020 1.00 0.00 O ATOM 586 OE2 GLU A 58 1.164 -21.062 37.257 1.00 0.00 O ATOM 0 H GLU A 58 0.328 -15.349 35.673 1.00 0.00 H new ATOM 0 HA GLU A 58 1.909 -17.203 34.459 1.00 0.00 H new ATOM 0 HB2 GLU A 58 0.778 -17.346 36.726 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -0.714 -17.779 35.915 1.00 0.00 H new ATOM 0 HG2 GLU A 58 0.234 -19.821 35.028 1.00 0.00 H new ATOM 0 HG3 GLU A 58 1.870 -19.318 35.408 1.00 0.00 H new ATOM 593 N PHE A 59 -0.964 -16.997 32.959 1.00 0.00 N ATOM 594 CA PHE A 59 -1.720 -17.445 31.796 1.00 0.00 C ATOM 595 C PHE A 59 -1.043 -16.988 30.506 1.00 0.00 C ATOM 596 O PHE A 59 -0.540 -17.804 29.734 1.00 0.00 O ATOM 597 CB PHE A 59 -3.143 -16.890 31.853 1.00 0.00 C ATOM 598 CG PHE A 59 -3.855 -17.202 30.560 1.00 0.00 C ATOM 599 CD1 PHE A 59 -4.096 -18.532 30.198 1.00 0.00 C ATOM 600 CD2 PHE A 59 -4.278 -16.161 29.724 1.00 0.00 C ATOM 601 CE1 PHE A 59 -4.759 -18.822 28.999 1.00 0.00 C ATOM 602 CE2 PHE A 59 -4.941 -16.451 28.526 1.00 0.00 C ATOM 603 CZ PHE A 59 -5.182 -17.782 28.164 1.00 0.00 C ATOM 0 H PHE A 59 -1.346 -16.172 33.422 1.00 0.00 H new ATOM 0 HA PHE A 59 -1.755 -18.534 31.807 1.00 0.00 H new ATOM 0 HB2 PHE A 59 -3.682 -17.328 32.693 1.00 0.00 H new ATOM 0 HB3 PHE A 59 -3.119 -15.813 32.017 1.00 0.00 H new ATOM 0 HD1 PHE A 59 -3.771 -19.335 30.843 1.00 0.00 H new ATOM 0 HD2 PHE A 59 -4.093 -15.134 30.004 1.00 0.00 H new ATOM 0 HE1 PHE A 59 -4.944 -19.849 28.719 1.00 0.00 H new ATOM 0 HE2 PHE A 59 -5.267 -15.648 27.881 1.00 0.00 H new ATOM 0 HZ PHE A 59 -5.694 -18.006 27.240 1.00 0.00 H new ATOM 613 N TYR A 60 -1.036 -15.679 30.281 1.00 0.00 N ATOM 614 CA TYR A 60 -0.426 -15.124 29.079 1.00 0.00 C ATOM 615 C TYR A 60 1.037 -15.550 28.981 1.00 0.00 C ATOM 616 O TYR A 60 1.584 -15.681 27.886 1.00 0.00 O ATOM 617 CB TYR A 60 -0.514 -13.599 29.116 1.00 0.00 C ATOM 618 CG TYR A 60 -1.935 -13.178 29.384 1.00 0.00 C ATOM 619 CD1 TYR A 60 -2.414 -13.147 30.699 1.00 0.00 C ATOM 620 CD2 TYR A 60 -2.777 -12.820 28.324 1.00 0.00 C ATOM 621 CE1 TYR A 60 -3.734 -12.757 30.954 1.00 0.00 C ATOM 622 CE2 TYR A 60 -4.097 -12.431 28.579 1.00 0.00 C ATOM 623 CZ TYR A 60 -4.576 -12.399 29.894 1.00 0.00 C ATOM 624 OH TYR A 60 -5.875 -12.013 30.146 1.00 0.00 O ATOM 0 H TYR A 60 -1.443 -14.987 30.910 1.00 0.00 H new ATOM 0 HA TYR A 60 -0.962 -15.500 28.207 1.00 0.00 H new ATOM 0 HB2 TYR A 60 0.144 -13.206 29.891 1.00 0.00 H new ATOM 0 HB3 TYR A 60 -0.174 -13.183 28.168 1.00 0.00 H new ATOM 0 HD1 TYR A 60 -1.765 -13.424 31.517 1.00 0.00 H new ATOM 0 HD2 TYR A 60 -2.408 -12.844 27.309 1.00 0.00 H new ATOM 0 HE1 TYR A 60 -4.103 -12.732 31.969 1.00 0.00 H new ATOM 0 HE2 TYR A 60 -4.746 -12.155 27.761 1.00 0.00 H new ATOM 0 HH TYR A 60 -6.322 -11.797 29.301 1.00 0.00 H new ATOM 634 N ALA A 61 1.665 -15.763 30.133 1.00 0.00 N ATOM 635 CA ALA A 61 3.063 -16.178 30.166 1.00 0.00 C ATOM 636 C ALA A 61 3.217 -17.596 29.623 1.00 0.00 C ATOM 637 O ALA A 61 4.305 -17.999 29.211 1.00 0.00 O ATOM 638 CB ALA A 61 3.594 -16.117 31.599 1.00 0.00 C ATOM 0 H ALA A 61 1.232 -15.656 31.050 1.00 0.00 H new ATOM 0 HA ALA A 61 3.637 -15.497 29.537 1.00 0.00 H new ATOM 0 HB1 ALA A 61 4.638 -16.429 31.614 1.00 0.00 H new ATOM 0 HB2 ALA A 61 3.515 -15.096 31.973 1.00 0.00 H new ATOM 0 HB3 ALA A 61 3.008 -16.783 32.233 1.00 0.00 H new ATOM 644 N LYS A 62 2.122 -18.349 29.630 1.00 0.00 N ATOM 645 CA LYS A 62 2.146 -19.720 29.136 1.00 0.00 C ATOM 646 C LYS A 62 1.785 -19.763 27.655 1.00 0.00 C ATOM 647 O LYS A 62 2.315 -20.578 26.900 1.00 0.00 O ATOM 648 CB LYS A 62 1.163 -20.579 29.931 1.00 0.00 C ATOM 649 CG LYS A 62 1.605 -22.044 29.881 1.00 0.00 C ATOM 650 CD LYS A 62 0.698 -22.887 30.780 1.00 0.00 C ATOM 651 CE LYS A 62 1.094 -22.689 32.245 1.00 0.00 C ATOM 652 NZ LYS A 62 0.455 -23.744 33.078 1.00 0.00 N ATOM 0 H LYS A 62 1.213 -18.035 29.970 1.00 0.00 H new ATOM 0 HA LYS A 62 3.154 -20.114 29.262 1.00 0.00 H new ATOM 0 HB2 LYS A 62 1.119 -20.237 30.965 1.00 0.00 H new ATOM 0 HB3 LYS A 62 0.159 -20.477 29.519 1.00 0.00 H new ATOM 0 HG2 LYS A 62 1.561 -22.412 28.856 1.00 0.00 H new ATOM 0 HG3 LYS A 62 2.641 -22.133 30.208 1.00 0.00 H new ATOM 0 HD2 LYS A 62 -0.343 -22.600 30.633 1.00 0.00 H new ATOM 0 HD3 LYS A 62 0.780 -23.940 30.510 1.00 0.00 H new ATOM 0 HE2 LYS A 62 2.178 -22.735 32.349 1.00 0.00 H new ATOM 0 HE3 LYS A 62 0.782 -21.702 32.587 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 0.724 -23.610 34.074 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 -0.579 -23.680 32.987 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 0.773 -24.680 32.756 1.00 0.00 H new ATOM 666 N ILE A 63 0.871 -18.886 27.249 1.00 0.00 N ATOM 667 CA ILE A 63 0.441 -18.845 25.856 1.00 0.00 C ATOM 668 C ILE A 63 1.606 -18.482 24.944 1.00 0.00 C ATOM 669 O ILE A 63 1.835 -19.136 23.926 1.00 0.00 O ATOM 670 CB ILE A 63 -0.673 -17.805 25.690 1.00 0.00 C ATOM 671 CG1 ILE A 63 -1.896 -18.234 26.507 1.00 0.00 C ATOM 672 CG2 ILE A 63 -1.060 -17.700 24.213 1.00 0.00 C ATOM 673 CD1 ILE A 63 -2.370 -19.617 26.049 1.00 0.00 C ATOM 0 H ILE A 63 0.419 -18.203 27.856 1.00 0.00 H new ATOM 0 HA ILE A 63 0.071 -19.832 25.580 1.00 0.00 H new ATOM 0 HB ILE A 63 -0.320 -16.836 26.042 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -1.645 -18.259 27.567 1.00 0.00 H new ATOM 0 HG13 ILE A 63 -2.699 -17.506 26.386 1.00 0.00 H new ATOM 0 HG21 ILE A 63 -1.852 -16.960 24.096 1.00 0.00 H new ATOM 0 HG22 ILE A 63 -0.191 -17.396 23.630 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -1.413 -18.669 23.860 1.00 0.00 H new ATOM 0 HD11 ILE A 63 -3.240 -19.916 26.634 1.00 0.00 H new ATOM 0 HD12 ILE A 63 -2.639 -19.578 24.993 1.00 0.00 H new ATOM 0 HD13 ILE A 63 -1.569 -20.342 26.193 1.00 0.00 H new ATOM 685 N ALA A 64 2.347 -17.448 25.320 1.00 0.00 N ATOM 686 CA ALA A 64 3.494 -17.015 24.528 1.00 0.00 C ATOM 687 C ALA A 64 4.592 -18.072 24.554 1.00 0.00 C ATOM 688 O ALA A 64 5.511 -18.042 23.737 1.00 0.00 O ATOM 689 CB ALA A 64 4.035 -15.691 25.074 1.00 0.00 C ATOM 0 H ALA A 64 2.178 -16.896 26.161 1.00 0.00 H new ATOM 0 HA ALA A 64 3.170 -16.874 23.497 1.00 0.00 H new ATOM 0 HB1 ALA A 64 4.891 -15.374 24.478 1.00 0.00 H new ATOM 0 HB2 ALA A 64 3.256 -14.931 25.023 1.00 0.00 H new ATOM 0 HB3 ALA A 64 4.344 -15.824 26.111 1.00 0.00 H new ATOM 695 N ARG A 65 4.497 -18.991 25.507 1.00 0.00 N ATOM 696 CA ARG A 65 5.492 -20.049 25.634 1.00 0.00 C ATOM 697 C ARG A 65 5.189 -21.188 24.666 1.00 0.00 C ATOM 698 O ARG A 65 6.080 -21.689 23.982 1.00 0.00 O ATOM 699 CB ARG A 65 5.510 -20.580 27.067 1.00 0.00 C ATOM 700 CG ARG A 65 6.616 -21.627 27.210 1.00 0.00 C ATOM 701 CD ARG A 65 6.616 -22.180 28.636 1.00 0.00 C ATOM 702 NE ARG A 65 7.022 -21.144 29.579 1.00 0.00 N ATOM 703 CZ ARG A 65 7.080 -21.387 30.884 1.00 0.00 C ATOM 704 NH1 ARG A 65 7.447 -20.444 31.708 1.00 0.00 N ATOM 705 NH2 ARG A 65 6.770 -22.569 31.341 1.00 0.00 N ATOM 0 H ARG A 65 3.748 -19.026 26.198 1.00 0.00 H new ATOM 0 HA ARG A 65 6.470 -19.634 25.391 1.00 0.00 H new ATOM 0 HB2 ARG A 65 5.677 -19.761 27.767 1.00 0.00 H new ATOM 0 HB3 ARG A 65 4.544 -21.020 27.315 1.00 0.00 H new ATOM 0 HG2 ARG A 65 6.460 -22.435 26.495 1.00 0.00 H new ATOM 0 HG3 ARG A 65 7.584 -21.182 26.982 1.00 0.00 H new ATOM 0 HD2 ARG A 65 5.621 -22.545 28.892 1.00 0.00 H new ATOM 0 HD3 ARG A 65 7.295 -23.030 28.704 1.00 0.00 H new ATOM 0 HE ARG A 65 7.266 -20.217 29.231 1.00 0.00 H new ATOM 0 HH11 ARG A 65 7.689 -19.520 31.350 1.00 0.00 H new ATOM 0 HH12 ARG A 65 7.491 -20.631 32.710 1.00 0.00 H new ATOM 0 HH21 ARG A 65 6.483 -23.306 30.697 1.00 0.00 H new ATOM 0 HH22 ARG A 65 6.814 -22.756 32.343 1.00 0.00 H new ATOM 719 N ILE A 66 3.925 -21.595 24.620 1.00 0.00 N ATOM 720 CA ILE A 66 3.510 -22.677 23.735 1.00 0.00 C ATOM 721 C ILE A 66 3.265 -22.151 22.326 1.00 0.00 C ATOM 722 O ILE A 66 3.250 -22.913 21.365 1.00 0.00 O ATOM 723 CB ILE A 66 2.239 -23.336 24.271 1.00 0.00 C ATOM 724 CG1 ILE A 66 2.545 -24.024 25.603 1.00 0.00 C ATOM 725 CG2 ILE A 66 1.738 -24.373 23.265 1.00 0.00 C ATOM 726 CD1 ILE A 66 1.236 -24.450 26.270 1.00 0.00 C ATOM 0 H ILE A 66 3.174 -21.194 25.182 1.00 0.00 H new ATOM 0 HA ILE A 66 4.309 -23.418 23.698 1.00 0.00 H new ATOM 0 HB ILE A 66 1.472 -22.576 24.421 1.00 0.00 H new ATOM 0 HG12 ILE A 66 3.181 -24.894 25.438 1.00 0.00 H new ATOM 0 HG13 ILE A 66 3.095 -23.347 26.256 1.00 0.00 H new ATOM 0 HG21 ILE A 66 0.832 -24.843 23.647 1.00 0.00 H new ATOM 0 HG22 ILE A 66 1.520 -23.883 22.316 1.00 0.00 H new ATOM 0 HG23 ILE A 66 2.504 -25.133 23.114 1.00 0.00 H new ATOM 0 HD11 ILE A 66 1.454 -24.940 27.219 1.00 0.00 H new ATOM 0 HD12 ILE A 66 0.616 -23.571 26.449 1.00 0.00 H new ATOM 0 HD13 ILE A 66 0.704 -25.142 25.618 1.00 0.00 H new ATOM 738 N GLY A 67 3.064 -20.844 22.212 1.00 0.00 N ATOM 739 CA GLY A 67 2.814 -20.228 20.914 1.00 0.00 C ATOM 740 C GLY A 67 4.111 -20.079 20.127 1.00 0.00 C ATOM 741 O GLY A 67 4.098 -19.858 18.922 1.00 0.00 O ATOM 0 H GLY A 67 3.069 -20.193 22.997 1.00 0.00 H new ATOM 0 HA2 GLY A 67 2.108 -20.835 20.348 1.00 0.00 H new ATOM 0 HA3 GLY A 67 2.353 -19.250 21.053 1.00 0.00 H new ATOM 745 N TYR A 68 5.236 -20.193 20.819 1.00 0.00 N ATOM 746 CA TYR A 68 6.538 -20.067 20.169 1.00 0.00 C ATOM 747 C TYR A 68 7.285 -21.394 20.208 1.00 0.00 C ATOM 748 O TYR A 68 8.350 -21.537 19.607 1.00 0.00 O ATOM 749 CB TYR A 68 7.368 -18.990 20.868 1.00 0.00 C ATOM 750 CG TYR A 68 8.728 -18.903 20.218 1.00 0.00 C ATOM 751 CD1 TYR A 68 8.872 -18.269 18.978 1.00 0.00 C ATOM 752 CD2 TYR A 68 9.845 -19.455 20.855 1.00 0.00 C ATOM 753 CE1 TYR A 68 10.133 -18.188 18.375 1.00 0.00 C ATOM 754 CE2 TYR A 68 11.107 -19.373 20.253 1.00 0.00 C ATOM 755 CZ TYR A 68 11.250 -18.740 19.013 1.00 0.00 C ATOM 756 OH TYR A 68 12.494 -18.659 18.419 1.00 0.00 O ATOM 0 H TYR A 68 5.277 -20.371 21.823 1.00 0.00 H new ATOM 0 HA TYR A 68 6.379 -19.783 19.129 1.00 0.00 H new ATOM 0 HB2 TYR A 68 6.861 -18.027 20.806 1.00 0.00 H new ATOM 0 HB3 TYR A 68 7.473 -19.227 21.927 1.00 0.00 H new ATOM 0 HD1 TYR A 68 8.010 -17.842 18.487 1.00 0.00 H new ATOM 0 HD2 TYR A 68 9.734 -19.944 21.811 1.00 0.00 H new ATOM 0 HE1 TYR A 68 10.244 -17.700 17.418 1.00 0.00 H new ATOM 0 HE2 TYR A 68 11.969 -19.798 20.745 1.00 0.00 H new ATOM 0 HH TYR A 68 13.160 -19.091 18.994 1.00 0.00 H new ATOM 766 N GLU A 69 6.723 -22.365 20.922 1.00 0.00 N ATOM 767 CA GLU A 69 7.346 -23.681 21.034 1.00 0.00 C ATOM 768 C GLU A 69 6.543 -24.722 20.265 1.00 0.00 C ATOM 769 O GLU A 69 6.862 -25.910 20.294 1.00 0.00 O ATOM 770 CB GLU A 69 7.442 -24.089 22.505 1.00 0.00 C ATOM 771 CG GLU A 69 8.445 -23.183 23.223 1.00 0.00 C ATOM 772 CD GLU A 69 8.482 -23.522 24.709 1.00 0.00 C ATOM 773 OE1 GLU A 69 7.767 -24.426 25.108 1.00 0.00 O ATOM 774 OE2 GLU A 69 9.225 -22.872 25.426 1.00 0.00 O ATOM 0 H GLU A 69 5.843 -22.267 21.429 1.00 0.00 H new ATOM 0 HA GLU A 69 8.347 -23.626 20.607 1.00 0.00 H new ATOM 0 HB2 GLU A 69 6.463 -24.013 22.979 1.00 0.00 H new ATOM 0 HB3 GLU A 69 7.755 -25.130 22.585 1.00 0.00 H new ATOM 0 HG2 GLU A 69 9.437 -23.308 22.788 1.00 0.00 H new ATOM 0 HG3 GLU A 69 8.166 -22.138 23.087 1.00 0.00 H new ATOM 781 N ASP A 70 5.499 -24.269 19.578 1.00 0.00 N ATOM 782 CA ASP A 70 4.655 -25.172 18.803 1.00 0.00 C ATOM 783 C ASP A 70 4.191 -24.499 17.515 1.00 0.00 C ATOM 784 O ASP A 70 4.244 -25.094 16.439 1.00 0.00 O ATOM 785 CB ASP A 70 3.439 -25.593 19.631 1.00 0.00 C ATOM 786 CG ASP A 70 3.859 -26.578 20.717 1.00 0.00 C ATOM 787 OD1 ASP A 70 4.943 -27.126 20.603 1.00 0.00 O ATOM 788 OD2 ASP A 70 3.092 -26.769 21.646 1.00 0.00 O ATOM 0 H ASP A 70 5.218 -23.289 19.542 1.00 0.00 H new ATOM 0 HA ASP A 70 5.240 -26.055 18.546 1.00 0.00 H new ATOM 0 HB2 ASP A 70 2.977 -24.716 20.084 1.00 0.00 H new ATOM 0 HB3 ASP A 70 2.690 -26.050 18.985 1.00 0.00 H new ATOM 793 N GLU A 71 3.731 -23.258 17.635 1.00 0.00 N ATOM 794 CA GLU A 71 3.255 -22.517 16.473 1.00 0.00 C ATOM 795 C GLU A 71 4.417 -21.828 15.767 1.00 0.00 C ATOM 796 O GLU A 71 4.326 -21.487 14.588 1.00 0.00 O ATOM 797 CB GLU A 71 2.228 -21.469 16.911 1.00 0.00 C ATOM 798 CG GLU A 71 1.080 -22.155 17.650 1.00 0.00 C ATOM 799 CD GLU A 71 0.305 -23.069 16.705 1.00 0.00 C ATOM 800 OE1 GLU A 71 0.565 -23.005 15.515 1.00 0.00 O ATOM 801 OE2 GLU A 71 -0.532 -23.818 17.181 1.00 0.00 O ATOM 0 H GLU A 71 3.678 -22.748 18.517 1.00 0.00 H new ATOM 0 HA GLU A 71 2.788 -23.218 15.781 1.00 0.00 H new ATOM 0 HB2 GLU A 71 2.701 -20.730 17.558 1.00 0.00 H new ATOM 0 HB3 GLU A 71 1.846 -20.934 16.042 1.00 0.00 H new ATOM 0 HG2 GLU A 71 1.473 -22.735 18.485 1.00 0.00 H new ATOM 0 HG3 GLU A 71 0.410 -21.405 18.070 1.00 0.00 H new ATOM 808 N GLY A 72 5.509 -21.628 16.495 1.00 0.00 N ATOM 809 CA GLY A 72 6.682 -20.980 15.925 1.00 0.00 C ATOM 810 C GLY A 72 6.308 -19.683 15.217 1.00 0.00 C ATOM 811 O GLY A 72 6.349 -19.602 13.989 1.00 0.00 O ATOM 0 H GLY A 72 5.606 -21.903 17.473 1.00 0.00 H new ATOM 0 HA2 GLY A 72 7.404 -20.771 16.714 1.00 0.00 H new ATOM 0 HA3 GLY A 72 7.167 -21.655 15.220 1.00 0.00 H new ATOM 893 N GLU A 78 5.557 -11.596 27.960 1.00 0.00 N ATOM 894 CA GLU A 78 4.369 -11.528 28.805 1.00 0.00 C ATOM 895 C GLU A 78 3.518 -10.321 28.425 1.00 0.00 C ATOM 896 O GLU A 78 2.359 -10.464 28.034 1.00 0.00 O ATOM 897 CB GLU A 78 4.780 -11.424 30.274 1.00 0.00 C ATOM 898 CG GLU A 78 5.501 -12.706 30.695 1.00 0.00 C ATOM 899 CD GLU A 78 6.971 -12.634 30.294 1.00 0.00 C ATOM 900 OE1 GLU A 78 7.341 -11.670 29.643 1.00 0.00 O ATOM 901 OE2 GLU A 78 7.706 -13.542 30.645 1.00 0.00 O ATOM 0 HA GLU A 78 3.783 -12.435 28.657 1.00 0.00 H new ATOM 0 HB2 GLU A 78 5.432 -10.563 30.420 1.00 0.00 H new ATOM 0 HB3 GLU A 78 3.900 -11.267 30.898 1.00 0.00 H new ATOM 0 HG2 GLU A 78 5.416 -12.843 31.773 1.00 0.00 H new ATOM 0 HG3 GLU A 78 5.029 -13.569 30.225 1.00 0.00 H new ATOM 908 N SER A 79 4.107 -9.135 28.530 1.00 0.00 N ATOM 909 CA SER A 79 3.396 -7.907 28.188 1.00 0.00 C ATOM 910 C SER A 79 2.830 -7.993 26.774 1.00 0.00 C ATOM 911 O SER A 79 1.640 -7.764 26.558 1.00 0.00 O ATOM 912 CB SER A 79 4.356 -6.718 28.272 1.00 0.00 C ATOM 913 OG SER A 79 3.606 -5.515 28.377 1.00 0.00 O ATOM 0 H SER A 79 5.067 -8.997 28.846 1.00 0.00 H new ATOM 0 HA SER A 79 2.575 -7.774 28.892 1.00 0.00 H new ATOM 0 HB2 SER A 79 5.013 -6.827 29.135 1.00 0.00 H new ATOM 0 HB3 SER A 79 4.993 -6.687 27.388 1.00 0.00 H new ATOM 0 HG SER A 79 4.218 -4.752 28.433 1.00 0.00 H new ATOM 919 N ALA A 80 3.683 -8.339 25.816 1.00 0.00 N ATOM 920 CA ALA A 80 3.248 -8.458 24.428 1.00 0.00 C ATOM 921 C ALA A 80 2.103 -9.460 24.312 1.00 0.00 C ATOM 922 O ALA A 80 1.276 -9.363 23.409 1.00 0.00 O ATOM 923 CB ALA A 80 4.423 -8.909 23.551 1.00 0.00 C ATOM 0 H ALA A 80 4.671 -8.540 25.972 1.00 0.00 H new ATOM 0 HA ALA A 80 2.896 -7.484 24.088 1.00 0.00 H new ATOM 0 HB1 ALA A 80 4.092 -8.996 22.516 1.00 0.00 H new ATOM 0 HB2 ALA A 80 5.227 -8.176 23.614 1.00 0.00 H new ATOM 0 HB3 ALA A 80 4.786 -9.876 23.898 1.00 0.00 H new ATOM 929 N CYS A 81 2.071 -10.424 25.224 1.00 0.00 N ATOM 930 CA CYS A 81 1.030 -11.442 25.212 1.00 0.00 C ATOM 931 C CYS A 81 -0.303 -10.846 25.649 1.00 0.00 C ATOM 932 O CYS A 81 -1.349 -11.485 25.536 1.00 0.00 O ATOM 933 CB CYS A 81 1.412 -12.585 26.141 1.00 0.00 C ATOM 934 SG CYS A 81 3.150 -12.990 25.916 1.00 0.00 S ATOM 0 H CYS A 81 2.751 -10.522 25.978 1.00 0.00 H new ATOM 0 HA CYS A 81 0.927 -11.822 24.196 1.00 0.00 H new ATOM 0 HB2 CYS A 81 1.225 -12.303 27.177 1.00 0.00 H new ATOM 0 HB3 CYS A 81 0.795 -13.459 25.932 1.00 0.00 H new ATOM 0 HG CYS A 81 3.413 -13.081 24.646 1.00 0.00 H new ATOM 940 N ARG A 82 -0.258 -9.618 26.157 1.00 0.00 N ATOM 941 CA ARG A 82 -1.468 -8.943 26.612 1.00 0.00 C ATOM 942 C ARG A 82 -1.880 -7.865 25.625 1.00 0.00 C ATOM 943 O ARG A 82 -3.035 -7.484 25.580 1.00 0.00 O ATOM 944 CB ARG A 82 -1.229 -8.316 27.988 1.00 0.00 C ATOM 945 CG ARG A 82 -1.056 -9.422 29.033 1.00 0.00 C ATOM 946 CD ARG A 82 -2.425 -9.820 29.587 1.00 0.00 C ATOM 947 NE ARG A 82 -3.029 -8.696 30.293 1.00 0.00 N ATOM 948 CZ ARG A 82 -2.751 -8.458 31.571 1.00 0.00 C ATOM 949 NH1 ARG A 82 -3.304 -7.445 32.181 1.00 0.00 N ATOM 950 NH2 ARG A 82 -1.926 -9.236 32.215 1.00 0.00 N ATOM 0 H ARG A 82 0.598 -9.073 26.263 1.00 0.00 H new ATOM 0 HA ARG A 82 -2.269 -9.679 26.683 1.00 0.00 H new ATOM 0 HB2 ARG A 82 -0.341 -7.684 27.962 1.00 0.00 H new ATOM 0 HB3 ARG A 82 -2.068 -7.675 28.258 1.00 0.00 H new ATOM 0 HG2 ARG A 82 -0.568 -10.287 28.585 1.00 0.00 H new ATOM 0 HG3 ARG A 82 -0.412 -9.076 29.841 1.00 0.00 H new ATOM 0 HD2 ARG A 82 -3.076 -10.140 28.773 1.00 0.00 H new ATOM 0 HD3 ARG A 82 -2.319 -10.669 30.263 1.00 0.00 H new ATOM 0 HE ARG A 82 -3.676 -8.082 29.798 1.00 0.00 H new ATOM 0 HH11 ARG A 82 -3.949 -6.837 31.677 1.00 0.00 H new ATOM 0 HH12 ARG A 82 -3.091 -7.262 33.162 1.00 0.00 H new ATOM 0 HH21 ARG A 82 -1.494 -10.027 31.738 1.00 0.00 H new ATOM 0 HH22 ARG A 82 -1.713 -9.053 33.196 1.00 0.00 H new ATOM 964 N ASN A 83 -0.922 -7.374 24.847 1.00 0.00 N ATOM 965 CA ASN A 83 -1.202 -6.334 23.863 1.00 0.00 C ATOM 966 C ASN A 83 -1.688 -6.952 22.554 1.00 0.00 C ATOM 967 O ASN A 83 -2.669 -6.498 21.966 1.00 0.00 O ATOM 968 CB ASN A 83 0.059 -5.510 23.605 1.00 0.00 C ATOM 969 CG ASN A 83 0.679 -5.081 24.932 1.00 0.00 C ATOM 970 OD1 ASN A 83 -0.023 -4.604 25.824 1.00 0.00 O ATOM 971 ND2 ASN A 83 1.963 -5.226 25.116 1.00 0.00 N ATOM 0 H ASN A 83 0.051 -7.677 24.878 1.00 0.00 H new ATOM 0 HA ASN A 83 -1.985 -5.686 24.257 1.00 0.00 H new ATOM 0 HB2 ASN A 83 0.776 -6.097 23.031 1.00 0.00 H new ATOM 0 HB3 ASN A 83 -0.186 -4.632 23.007 1.00 0.00 H new ATOM 0 HD21 ASN A 83 2.387 -4.944 26.000 1.00 0.00 H new ATOM 0 HD22 ASN A 83 2.543 -5.621 24.376 1.00 0.00 H new ATOM 978 N GLN A 84 -0.986 -7.988 22.101 1.00 0.00 N ATOM 979 CA GLN A 84 -1.349 -8.658 20.857 1.00 0.00 C ATOM 980 C GLN A 84 -2.781 -9.176 20.924 1.00 0.00 C ATOM 981 O GLN A 84 -3.632 -8.757 20.151 1.00 0.00 O ATOM 982 CB GLN A 84 -0.393 -9.825 20.597 1.00 0.00 C ATOM 983 CG GLN A 84 -0.504 -10.844 21.727 1.00 0.00 C ATOM 984 CD GLN A 84 0.753 -11.699 21.782 1.00 0.00 C ATOM 985 OE1 GLN A 84 1.863 -11.180 21.666 1.00 0.00 O ATOM 986 NE2 GLN A 84 0.647 -12.987 21.960 1.00 0.00 N ATOM 0 H GLN A 84 -0.170 -8.378 22.572 1.00 0.00 H new ATOM 0 HA GLN A 84 -1.275 -7.938 20.042 1.00 0.00 H new ATOM 0 HB2 GLN A 84 -0.631 -10.297 19.644 1.00 0.00 H new ATOM 0 HB3 GLN A 84 0.631 -9.459 20.524 1.00 0.00 H new ATOM 0 HG2 GLN A 84 -0.646 -10.331 22.678 1.00 0.00 H new ATOM 0 HG3 GLN A 84 -1.378 -11.477 21.572 1.00 0.00 H new ATOM 0 HE21 GLN A 84 -0.274 -13.414 22.056 1.00 0.00 H new ATOM 0 HE22 GLN A 84 1.485 -13.567 22.003 1.00 0.00 H new ATOM 995 N ILE A 85 -3.042 -10.075 21.867 1.00 0.00 N ATOM 996 CA ILE A 85 -4.371 -10.644 22.028 1.00 0.00 C ATOM 997 C ILE A 85 -5.400 -9.540 22.215 1.00 0.00 C ATOM 998 O ILE A 85 -6.502 -9.615 21.676 1.00 0.00 O ATOM 999 CB ILE A 85 -4.396 -11.586 23.236 1.00 0.00 C ATOM 1000 CG1 ILE A 85 -3.820 -12.948 22.839 1.00 0.00 C ATOM 1001 CG2 ILE A 85 -5.836 -11.764 23.719 1.00 0.00 C ATOM 1002 CD1 ILE A 85 -3.475 -13.743 24.098 1.00 0.00 C ATOM 0 H ILE A 85 -2.350 -10.424 22.530 1.00 0.00 H new ATOM 0 HA ILE A 85 -4.619 -11.208 21.129 1.00 0.00 H new ATOM 0 HB ILE A 85 -3.794 -11.158 24.038 1.00 0.00 H new ATOM 0 HG12 ILE A 85 -4.542 -13.498 22.235 1.00 0.00 H new ATOM 0 HG13 ILE A 85 -2.929 -12.813 22.226 1.00 0.00 H new ATOM 0 HG21 ILE A 85 -5.851 -12.434 24.578 1.00 0.00 H new ATOM 0 HG22 ILE A 85 -6.246 -10.796 24.007 1.00 0.00 H new ATOM 0 HG23 ILE A 85 -6.439 -12.189 22.917 1.00 0.00 H new ATOM 0 HD11 ILE A 85 -3.065 -14.713 23.815 1.00 0.00 H new ATOM 0 HD12 ILE A 85 -2.738 -13.194 24.684 1.00 0.00 H new ATOM 0 HD13 ILE A 85 -4.376 -13.890 24.694 1.00 0.00 H new ATOM 1014 N ILE A 86 -5.032 -8.517 22.971 1.00 0.00 N ATOM 1015 CA ILE A 86 -5.937 -7.402 23.201 1.00 0.00 C ATOM 1016 C ILE A 86 -6.270 -6.697 21.892 1.00 0.00 C ATOM 1017 O ILE A 86 -7.416 -6.350 21.644 1.00 0.00 O ATOM 1018 CB ILE A 86 -5.309 -6.402 24.191 1.00 0.00 C ATOM 1019 CG1 ILE A 86 -5.761 -6.729 25.626 1.00 0.00 C ATOM 1020 CG2 ILE A 86 -5.708 -4.967 23.829 1.00 0.00 C ATOM 1021 CD1 ILE A 86 -5.513 -5.510 26.531 1.00 0.00 C ATOM 0 H ILE A 86 -4.125 -8.436 23.430 1.00 0.00 H new ATOM 0 HA ILE A 86 -6.860 -7.795 23.627 1.00 0.00 H new ATOM 0 HB ILE A 86 -4.224 -6.486 24.131 1.00 0.00 H new ATOM 0 HG12 ILE A 86 -6.819 -6.993 25.635 1.00 0.00 H new ATOM 0 HG13 ILE A 86 -5.214 -7.593 26.003 1.00 0.00 H new ATOM 0 HG21 ILE A 86 -5.256 -4.274 24.538 1.00 0.00 H new ATOM 0 HG22 ILE A 86 -5.359 -4.735 22.823 1.00 0.00 H new ATOM 0 HG23 ILE A 86 -6.793 -4.870 23.868 1.00 0.00 H new ATOM 0 HD11 ILE A 86 -5.833 -5.740 27.547 1.00 0.00 H new ATOM 0 HD12 ILE A 86 -4.450 -5.267 26.531 1.00 0.00 H new ATOM 0 HD13 ILE A 86 -6.080 -4.658 26.157 1.00 0.00 H new ATOM 1033 N SER A 87 -5.252 -6.451 21.086 1.00 0.00 N ATOM 1034 CA SER A 87 -5.452 -5.753 19.824 1.00 0.00 C ATOM 1035 C SER A 87 -6.445 -6.509 18.955 1.00 0.00 C ATOM 1036 O SER A 87 -7.347 -5.914 18.365 1.00 0.00 O ATOM 1037 CB SER A 87 -4.122 -5.633 19.088 1.00 0.00 C ATOM 1038 OG SER A 87 -4.386 -5.364 17.715 1.00 0.00 O ATOM 0 H SER A 87 -4.287 -6.720 21.278 1.00 0.00 H new ATOM 0 HA SER A 87 -5.847 -4.759 20.031 1.00 0.00 H new ATOM 0 HB2 SER A 87 -3.520 -4.834 19.521 1.00 0.00 H new ATOM 0 HB3 SER A 87 -3.549 -6.554 19.190 1.00 0.00 H new ATOM 0 HG SER A 87 -3.539 -5.283 17.229 1.00 0.00 H new ATOM 1044 N ILE A 88 -6.281 -7.825 18.888 1.00 0.00 N ATOM 1045 CA ILE A 88 -7.172 -8.656 18.092 1.00 0.00 C ATOM 1046 C ILE A 88 -8.620 -8.445 18.525 1.00 0.00 C ATOM 1047 O ILE A 88 -9.534 -8.599 17.741 1.00 0.00 O ATOM 1048 CB ILE A 88 -6.804 -10.131 18.249 1.00 0.00 C ATOM 1049 CG1 ILE A 88 -5.337 -10.331 17.871 1.00 0.00 C ATOM 1050 CG2 ILE A 88 -7.682 -10.984 17.335 1.00 0.00 C ATOM 1051 CD1 ILE A 88 -4.957 -11.802 18.038 1.00 0.00 C ATOM 0 H ILE A 88 -5.543 -8.336 19.373 1.00 0.00 H new ATOM 0 HA ILE A 88 -7.065 -8.369 17.046 1.00 0.00 H new ATOM 0 HB ILE A 88 -6.962 -10.432 19.285 1.00 0.00 H new ATOM 0 HG12 ILE A 88 -5.171 -10.018 16.840 1.00 0.00 H new ATOM 0 HG13 ILE A 88 -4.701 -9.708 18.500 1.00 0.00 H new ATOM 0 HG21 ILE A 88 -7.415 -12.034 17.451 1.00 0.00 H new ATOM 0 HG22 ILE A 88 -8.729 -10.844 17.602 1.00 0.00 H new ATOM 0 HG23 ILE A 88 -7.529 -10.683 16.299 1.00 0.00 H new ATOM 0 HD11 ILE A 88 -3.910 -11.940 17.767 1.00 0.00 H new ATOM 0 HD12 ILE A 88 -5.106 -12.101 19.076 1.00 0.00 H new ATOM 0 HD13 ILE A 88 -5.583 -12.415 17.390 1.00 0.00 H new ATOM 1063 N MET A 89 -8.819 -8.118 19.791 1.00 0.00 N ATOM 1064 CA MET A 89 -10.169 -7.898 20.306 1.00 0.00 C ATOM 1065 C MET A 89 -10.776 -6.630 19.711 1.00 0.00 C ATOM 1066 O MET A 89 -11.876 -6.656 19.160 1.00 0.00 O ATOM 1067 CB MET A 89 -10.126 -7.769 21.830 1.00 0.00 C ATOM 1068 CG MET A 89 -9.686 -9.098 22.444 1.00 0.00 C ATOM 1069 SD MET A 89 -10.914 -10.373 22.068 1.00 0.00 S ATOM 1070 CE MET A 89 -12.243 -9.715 23.106 1.00 0.00 C ATOM 0 H MET A 89 -8.075 -7.999 20.478 1.00 0.00 H new ATOM 0 HA MET A 89 -10.787 -8.750 20.023 1.00 0.00 H new ATOM 0 HB2 MET A 89 -9.435 -6.977 22.119 1.00 0.00 H new ATOM 0 HB3 MET A 89 -11.109 -7.489 22.209 1.00 0.00 H new ATOM 0 HG2 MET A 89 -8.712 -9.388 22.049 1.00 0.00 H new ATOM 0 HG3 MET A 89 -9.574 -8.993 23.523 1.00 0.00 H new ATOM 0 HE1 MET A 89 -12.888 -10.531 23.432 1.00 0.00 H new ATOM 0 HE2 MET A 89 -11.813 -9.222 23.978 1.00 0.00 H new ATOM 0 HE3 MET A 89 -12.829 -8.995 22.534 1.00 0.00 H new ATOM 1080 N ARG A 90 -10.043 -5.525 19.811 1.00 0.00 N ATOM 1081 CA ARG A 90 -10.523 -4.254 19.279 1.00 0.00 C ATOM 1082 C ARG A 90 -11.022 -4.429 17.851 1.00 0.00 C ATOM 1083 O ARG A 90 -12.053 -3.875 17.473 1.00 0.00 O ATOM 1084 CB ARG A 90 -9.392 -3.221 19.306 1.00 0.00 C ATOM 1085 CG ARG A 90 -9.915 -1.877 18.797 1.00 0.00 C ATOM 1086 CD ARG A 90 -8.842 -0.805 18.993 1.00 0.00 C ATOM 1087 NE ARG A 90 -7.651 -1.132 18.218 1.00 0.00 N ATOM 1088 CZ ARG A 90 -7.517 -0.731 16.958 1.00 0.00 C ATOM 1089 NH1 ARG A 90 -6.441 -1.037 16.287 1.00 0.00 N ATOM 1090 NH2 ARG A 90 -8.462 -0.030 16.392 1.00 0.00 N ATOM 0 H ARG A 90 -9.124 -5.483 20.251 1.00 0.00 H new ATOM 0 HA ARG A 90 -11.349 -3.906 19.899 1.00 0.00 H new ATOM 0 HB2 ARG A 90 -9.008 -3.113 20.320 1.00 0.00 H new ATOM 0 HB3 ARG A 90 -8.562 -3.559 18.685 1.00 0.00 H new ATOM 0 HG2 ARG A 90 -10.179 -1.953 17.742 1.00 0.00 H new ATOM 0 HG3 ARG A 90 -10.822 -1.601 19.334 1.00 0.00 H new ATOM 0 HD2 ARG A 90 -9.229 0.167 18.685 1.00 0.00 H new ATOM 0 HD3 ARG A 90 -8.586 -0.726 20.050 1.00 0.00 H new ATOM 0 HE ARG A 90 -6.907 -1.679 18.651 1.00 0.00 H new ATOM 0 HH11 ARG A 90 -5.702 -1.584 16.729 1.00 0.00 H new ATOM 0 HH12 ARG A 90 -6.338 -0.729 15.320 1.00 0.00 H new ATOM 0 HH21 ARG A 90 -9.303 0.210 16.917 1.00 0.00 H new ATOM 0 HH22 ARG A 90 -8.359 0.278 15.425 1.00 0.00 H new ATOM 1104 N VAL A 91 -10.290 -5.197 17.061 1.00 0.00 N ATOM 1105 CA VAL A 91 -10.674 -5.437 15.674 1.00 0.00 C ATOM 1106 C VAL A 91 -11.936 -6.296 15.602 1.00 0.00 C ATOM 1107 O VAL A 91 -12.796 -6.081 14.755 1.00 0.00 O ATOM 1108 CB VAL A 91 -9.524 -6.131 14.935 1.00 0.00 C ATOM 1109 CG1 VAL A 91 -8.181 -5.490 15.344 1.00 0.00 C ATOM 1110 CG2 VAL A 91 -9.508 -7.630 15.282 1.00 0.00 C ATOM 0 H VAL A 91 -9.431 -5.664 17.351 1.00 0.00 H new ATOM 0 HA VAL A 91 -10.885 -4.479 15.199 1.00 0.00 H new ATOM 0 HB VAL A 91 -9.668 -6.014 13.861 1.00 0.00 H new ATOM 0 HG11 VAL A 91 -7.366 -5.986 14.817 1.00 0.00 H new ATOM 0 HG12 VAL A 91 -8.190 -4.431 15.085 1.00 0.00 H new ATOM 0 HG13 VAL A 91 -8.038 -5.600 16.419 1.00 0.00 H new ATOM 0 HG21 VAL A 91 -8.688 -8.117 14.754 1.00 0.00 H new ATOM 0 HG22 VAL A 91 -9.371 -7.753 16.356 1.00 0.00 H new ATOM 0 HG23 VAL A 91 -10.453 -8.083 14.982 1.00 0.00 H new ATOM 1120 N TYR A 92 -12.023 -7.283 16.492 1.00 0.00 N ATOM 1121 CA TYR A 92 -13.160 -8.180 16.522 1.00 0.00 C ATOM 1122 C TYR A 92 -14.422 -7.407 16.856 1.00 0.00 C ATOM 1123 O TYR A 92 -15.466 -7.641 16.269 1.00 0.00 O ATOM 1124 CB TYR A 92 -12.936 -9.287 17.555 1.00 0.00 C ATOM 1125 CG TYR A 92 -14.191 -10.115 17.682 1.00 0.00 C ATOM 1126 CD1 TYR A 92 -14.519 -11.051 16.693 1.00 0.00 C ATOM 1127 CD2 TYR A 92 -15.029 -9.946 18.791 1.00 0.00 C ATOM 1128 CE1 TYR A 92 -15.684 -11.817 16.814 1.00 0.00 C ATOM 1129 CE2 TYR A 92 -16.195 -10.712 18.911 1.00 0.00 C ATOM 1130 CZ TYR A 92 -16.522 -11.648 17.922 1.00 0.00 C ATOM 1131 OH TYR A 92 -17.671 -12.403 18.041 1.00 0.00 O ATOM 0 H TYR A 92 -11.315 -7.476 17.200 1.00 0.00 H new ATOM 0 HA TYR A 92 -13.272 -8.636 15.538 1.00 0.00 H new ATOM 0 HB2 TYR A 92 -12.100 -9.918 17.253 1.00 0.00 H new ATOM 0 HB3 TYR A 92 -12.675 -8.852 18.520 1.00 0.00 H new ATOM 0 HD1 TYR A 92 -13.873 -11.182 15.837 1.00 0.00 H new ATOM 0 HD2 TYR A 92 -14.776 -9.225 19.554 1.00 0.00 H new ATOM 0 HE1 TYR A 92 -15.937 -12.539 16.052 1.00 0.00 H new ATOM 0 HE2 TYR A 92 -16.842 -10.581 19.766 1.00 0.00 H new ATOM 0 HH TYR A 92 -18.137 -12.161 18.869 1.00 0.00 H new ATOM 1141 N GLU A 93 -14.313 -6.487 17.808 1.00 0.00 N ATOM 1142 CA GLU A 93 -15.456 -5.680 18.217 1.00 0.00 C ATOM 1143 C GLU A 93 -15.794 -4.643 17.151 1.00 0.00 C ATOM 1144 O GLU A 93 -16.963 -4.338 16.914 1.00 0.00 O ATOM 1145 CB GLU A 93 -15.156 -4.979 19.542 1.00 0.00 C ATOM 1146 CG GLU A 93 -14.952 -6.028 20.638 1.00 0.00 C ATOM 1147 CD GLU A 93 -16.265 -6.750 20.924 1.00 0.00 C ATOM 1148 OE1 GLU A 93 -17.282 -6.312 20.411 1.00 0.00 O ATOM 1149 OE2 GLU A 93 -16.235 -7.730 21.650 1.00 0.00 O ATOM 0 H GLU A 93 -13.448 -6.282 18.309 1.00 0.00 H new ATOM 0 HA GLU A 93 -16.313 -6.341 18.344 1.00 0.00 H new ATOM 0 HB2 GLU A 93 -14.264 -4.360 19.445 1.00 0.00 H new ATOM 0 HB3 GLU A 93 -15.978 -4.314 19.808 1.00 0.00 H new ATOM 0 HG2 GLU A 93 -14.193 -6.746 20.328 1.00 0.00 H new ATOM 0 HG3 GLU A 93 -14.586 -5.550 21.546 1.00 0.00 H new ATOM 1156 N GLN A 94 -14.760 -4.099 16.516 1.00 0.00 N ATOM 1157 CA GLN A 94 -14.960 -3.094 15.478 1.00 0.00 C ATOM 1158 C GLN A 94 -15.683 -3.691 14.277 1.00 0.00 C ATOM 1159 O GLN A 94 -16.714 -3.178 13.845 1.00 0.00 O ATOM 1160 CB GLN A 94 -13.609 -2.527 15.031 1.00 0.00 C ATOM 1161 CG GLN A 94 -13.179 -1.408 15.982 1.00 0.00 C ATOM 1162 CD GLN A 94 -11.934 -0.716 15.441 1.00 0.00 C ATOM 1163 OE1 GLN A 94 -10.983 -0.367 16.264 1.00 0.00 O flip ATOM 1164 NE2 GLN A 94 -11.826 -0.484 14.237 1.00 0.00 N flip ATOM 0 H GLN A 94 -13.785 -4.334 16.700 1.00 0.00 H new ATOM 0 HA GLN A 94 -15.573 -2.294 15.893 1.00 0.00 H new ATOM 0 HB2 GLN A 94 -12.858 -3.317 15.020 1.00 0.00 H new ATOM 0 HB3 GLN A 94 -13.683 -2.144 14.013 1.00 0.00 H new ATOM 0 HG2 GLN A 94 -13.987 -0.685 16.095 1.00 0.00 H new ATOM 0 HG3 GLN A 94 -12.977 -1.818 16.972 1.00 0.00 H new ATOM 0 HE21 GLN A 94 -12.571 -0.758 13.596 1.00 0.00 H new ATOM 0 HE22 GLN A 94 -10.992 -0.018 13.880 1.00 0.00 H new ATOM 1173 N ARG A 95 -15.141 -4.781 13.749 1.00 0.00 N ATOM 1174 CA ARG A 95 -15.746 -5.442 12.598 1.00 0.00 C ATOM 1175 C ARG A 95 -17.047 -6.128 12.997 1.00 0.00 C ATOM 1176 O ARG A 95 -17.806 -6.584 12.141 1.00 0.00 O ATOM 1177 CB ARG A 95 -14.774 -6.476 12.021 1.00 0.00 C ATOM 1178 CG ARG A 95 -13.804 -5.792 11.056 1.00 0.00 C ATOM 1179 CD ARG A 95 -14.450 -5.683 9.673 1.00 0.00 C ATOM 1180 NE ARG A 95 -13.494 -5.145 8.712 1.00 0.00 N ATOM 1181 CZ ARG A 95 -13.420 -3.840 8.473 1.00 0.00 C ATOM 1182 NH1 ARG A 95 -12.556 -3.383 7.608 1.00 0.00 N ATOM 1183 NH2 ARG A 95 -14.210 -3.015 9.104 1.00 0.00 N ATOM 0 H ARG A 95 -14.290 -5.224 14.096 1.00 0.00 H new ATOM 0 HA ARG A 95 -15.965 -4.688 11.842 1.00 0.00 H new ATOM 0 HB2 ARG A 95 -14.221 -6.958 12.827 1.00 0.00 H new ATOM 0 HB3 ARG A 95 -15.327 -7.259 11.502 1.00 0.00 H new ATOM 0 HG2 ARG A 95 -13.544 -4.800 11.427 1.00 0.00 H new ATOM 0 HG3 ARG A 95 -12.877 -6.361 10.992 1.00 0.00 H new ATOM 0 HD2 ARG A 95 -14.793 -6.664 9.345 1.00 0.00 H new ATOM 0 HD3 ARG A 95 -15.328 -5.039 9.723 1.00 0.00 H new ATOM 0 HE ARG A 95 -12.871 -5.782 8.215 1.00 0.00 H new ATOM 0 HH11 ARG A 95 -11.938 -4.028 7.116 1.00 0.00 H new ATOM 0 HH12 ARG A 95 -12.499 -2.381 7.424 1.00 0.00 H new ATOM 0 HH21 ARG A 95 -14.884 -3.372 9.781 1.00 0.00 H new ATOM 0 HH22 ARG A 95 -14.153 -2.013 8.920 1.00 0.00 H new ATOM 1197 N LEU A 96 -17.298 -6.195 14.298 1.00 0.00 N ATOM 1198 CA LEU A 96 -18.517 -6.816 14.803 1.00 0.00 C ATOM 1199 C LEU A 96 -19.696 -5.855 14.705 1.00 0.00 C ATOM 1200 O LEU A 96 -20.829 -6.267 14.458 1.00 0.00 O ATOM 1201 CB LEU A 96 -18.324 -7.256 16.253 1.00 0.00 C ATOM 1202 CG LEU A 96 -19.641 -7.790 16.811 1.00 0.00 C ATOM 1203 CD1 LEU A 96 -20.155 -8.918 15.916 1.00 0.00 C ATOM 1204 CD2 LEU A 96 -19.413 -8.326 18.225 1.00 0.00 C ATOM 0 H LEU A 96 -16.678 -5.829 15.020 1.00 0.00 H new ATOM 0 HA LEU A 96 -18.732 -7.691 14.190 1.00 0.00 H new ATOM 0 HB2 LEU A 96 -17.555 -8.027 16.310 1.00 0.00 H new ATOM 0 HB3 LEU A 96 -17.978 -6.416 16.855 1.00 0.00 H new ATOM 0 HG LEU A 96 -20.376 -6.986 16.840 1.00 0.00 H new ATOM 0 HD11 LEU A 96 -21.095 -9.299 16.315 1.00 0.00 H new ATOM 0 HD12 LEU A 96 -20.316 -8.537 14.907 1.00 0.00 H new ATOM 0 HD13 LEU A 96 -19.421 -9.723 15.887 1.00 0.00 H new ATOM 0 HD21 LEU A 96 -20.352 -8.708 18.625 1.00 0.00 H new ATOM 0 HD22 LEU A 96 -18.678 -9.130 18.195 1.00 0.00 H new ATOM 0 HD23 LEU A 96 -19.046 -7.523 18.864 1.00 0.00 H new ATOM 1216 N ALA A 97 -19.423 -4.573 14.922 1.00 0.00 N ATOM 1217 CA ALA A 97 -20.472 -3.563 14.870 1.00 0.00 C ATOM 1218 C ALA A 97 -20.723 -3.126 13.432 1.00 0.00 C ATOM 1219 O ALA A 97 -21.828 -2.709 13.084 1.00 0.00 O ATOM 1220 CB ALA A 97 -20.065 -2.345 15.707 1.00 0.00 C ATOM 0 H ALA A 97 -18.493 -4.211 15.134 1.00 0.00 H new ATOM 0 HA ALA A 97 -21.387 -3.996 15.274 1.00 0.00 H new ATOM 0 HB1 ALA A 97 -20.854 -1.594 15.664 1.00 0.00 H new ATOM 0 HB2 ALA A 97 -19.911 -2.650 16.742 1.00 0.00 H new ATOM 0 HB3 ALA A 97 -19.141 -1.924 15.311 1.00 0.00 H new ATOM 1226 N HIS A 98 -19.691 -3.220 12.602 1.00 0.00 N ATOM 1227 CA HIS A 98 -19.810 -2.823 11.204 1.00 0.00 C ATOM 1228 C HIS A 98 -20.656 -3.823 10.427 1.00 0.00 C ATOM 1229 O HIS A 98 -20.542 -5.032 10.623 1.00 0.00 O ATOM 1230 CB HIS A 98 -18.421 -2.725 10.569 1.00 0.00 C ATOM 1231 CG HIS A 98 -17.725 -1.488 11.069 1.00 0.00 C ATOM 1232 ND1 HIS A 98 -17.080 -1.446 12.295 1.00 0.00 N ATOM 1233 CD2 HIS A 98 -17.566 -0.240 10.520 1.00 0.00 C ATOM 1234 CE1 HIS A 98 -16.567 -0.211 12.442 1.00 0.00 C ATOM 1235 NE2 HIS A 98 -16.834 0.565 11.388 1.00 0.00 N ATOM 0 H HIS A 98 -18.769 -3.565 12.870 1.00 0.00 H new ATOM 0 HA HIS A 98 -20.298 -1.849 11.166 1.00 0.00 H new ATOM 0 HB2 HIS A 98 -17.834 -3.610 10.815 1.00 0.00 H new ATOM 0 HB3 HIS A 98 -18.508 -2.692 9.483 1.00 0.00 H new ATOM 0 HD1 HIS A 98 -17.007 -2.212 12.964 1.00 0.00 H new ATOM 0 HD2 HIS A 98 -17.951 0.070 9.560 1.00 0.00 H new ATOM 0 HE1 HIS A 98 -16.007 0.114 13.307 1.00 0.00 H new ATOM 1343 N THR A 105 -18.211 -13.700 2.501 1.00 0.00 N ATOM 1344 CA THR A 105 -17.476 -14.093 3.696 1.00 0.00 C ATOM 1345 C THR A 105 -16.361 -15.071 3.343 1.00 0.00 C ATOM 1346 O THR A 105 -16.310 -15.593 2.229 1.00 0.00 O ATOM 1347 CB THR A 105 -18.425 -14.743 4.705 1.00 0.00 C ATOM 1348 OG1 THR A 105 -18.689 -16.082 4.310 1.00 0.00 O ATOM 1349 CG2 THR A 105 -19.735 -13.955 4.755 1.00 0.00 C ATOM 0 HA THR A 105 -17.035 -13.199 4.136 1.00 0.00 H new ATOM 0 HB THR A 105 -17.964 -14.740 5.693 1.00 0.00 H new ATOM 0 HG1 THR A 105 -19.296 -16.500 4.956 1.00 0.00 H new ATOM 0 HG21 THR A 105 -20.411 -14.418 5.474 1.00 0.00 H new ATOM 0 HG22 THR A 105 -19.531 -12.928 5.058 1.00 0.00 H new ATOM 0 HG23 THR A 105 -20.198 -13.956 3.768 1.00 0.00 H new ATOM 1357 N THR A 106 -15.469 -15.317 4.299 1.00 0.00 N ATOM 1358 CA THR A 106 -14.359 -16.239 4.078 1.00 0.00 C ATOM 1359 C THR A 106 -14.242 -17.225 5.240 1.00 0.00 C ATOM 1360 O THR A 106 -14.756 -16.979 6.330 1.00 0.00 O ATOM 1361 CB THR A 106 -13.049 -15.450 3.923 1.00 0.00 C ATOM 1362 OG1 THR A 106 -13.206 -14.160 4.489 1.00 0.00 O ATOM 1363 CG2 THR A 106 -12.700 -15.314 2.439 1.00 0.00 C ATOM 0 H THR A 106 -15.492 -14.894 5.227 1.00 0.00 H new ATOM 0 HA THR A 106 -14.549 -16.802 3.164 1.00 0.00 H new ATOM 0 HB THR A 106 -12.246 -15.980 4.436 1.00 0.00 H new ATOM 0 HG1 THR A 106 -12.371 -13.656 4.392 1.00 0.00 H new ATOM 0 HG21 THR A 106 -11.771 -14.754 2.334 1.00 0.00 H new ATOM 0 HG22 THR A 106 -12.578 -16.305 2.002 1.00 0.00 H new ATOM 0 HG23 THR A 106 -13.502 -14.786 1.923 1.00 0.00 H new ATOM 1371 N PRO A 107 -13.578 -18.331 5.020 1.00 0.00 N ATOM 1372 CA PRO A 107 -13.392 -19.378 6.067 1.00 0.00 C ATOM 1373 C PRO A 107 -12.402 -18.948 7.147 1.00 0.00 C ATOM 1374 O PRO A 107 -12.589 -19.247 8.327 1.00 0.00 O ATOM 1375 CB PRO A 107 -12.858 -20.582 5.284 1.00 0.00 C ATOM 1376 CG PRO A 107 -12.216 -20.014 4.062 1.00 0.00 C ATOM 1377 CD PRO A 107 -12.932 -18.703 3.752 1.00 0.00 C ATOM 0 HA PRO A 107 -14.318 -19.588 6.603 1.00 0.00 H new ATOM 0 HB2 PRO A 107 -12.140 -21.148 5.877 1.00 0.00 H new ATOM 0 HB3 PRO A 107 -13.664 -21.267 5.021 1.00 0.00 H new ATOM 0 HG2 PRO A 107 -11.153 -19.843 4.229 1.00 0.00 H new ATOM 0 HG3 PRO A 107 -12.300 -20.707 3.225 1.00 0.00 H new ATOM 0 HD2 PRO A 107 -12.231 -17.936 3.423 1.00 0.00 H new ATOM 0 HD3 PRO A 107 -13.664 -18.829 2.955 1.00 0.00 H new ATOM 1385 N GLU A 108 -11.351 -18.247 6.735 1.00 0.00 N ATOM 1386 CA GLU A 108 -10.340 -17.784 7.678 1.00 0.00 C ATOM 1387 C GLU A 108 -10.918 -16.725 8.608 1.00 0.00 C ATOM 1388 O GLU A 108 -10.774 -16.811 9.828 1.00 0.00 O ATOM 1389 CB GLU A 108 -9.146 -17.200 6.918 1.00 0.00 C ATOM 1390 CG GLU A 108 -8.449 -18.308 6.124 1.00 0.00 C ATOM 1391 CD GLU A 108 -9.110 -18.469 4.760 1.00 0.00 C ATOM 1392 OE1 GLU A 108 -10.111 -17.811 4.527 1.00 0.00 O ATOM 1393 OE2 GLU A 108 -8.605 -19.247 3.967 1.00 0.00 O ATOM 0 H GLU A 108 -11.178 -17.989 5.764 1.00 0.00 H new ATOM 0 HA GLU A 108 -10.012 -18.635 8.275 1.00 0.00 H new ATOM 0 HB2 GLU A 108 -9.482 -16.412 6.244 1.00 0.00 H new ATOM 0 HB3 GLU A 108 -8.445 -16.744 7.617 1.00 0.00 H new ATOM 0 HG2 GLU A 108 -7.393 -18.068 5.999 1.00 0.00 H new ATOM 0 HG3 GLU A 108 -8.499 -19.247 6.674 1.00 0.00 H new ATOM 1400 N GLU A 109 -11.577 -15.730 8.026 1.00 0.00 N ATOM 1401 CA GLU A 109 -12.174 -14.660 8.815 1.00 0.00 C ATOM 1402 C GLU A 109 -13.265 -15.215 9.726 1.00 0.00 C ATOM 1403 O GLU A 109 -13.477 -14.720 10.832 1.00 0.00 O ATOM 1404 CB GLU A 109 -12.767 -13.593 7.888 1.00 0.00 C ATOM 1405 CG GLU A 109 -13.995 -14.157 7.168 1.00 0.00 C ATOM 1406 CD GLU A 109 -14.620 -13.086 6.284 1.00 0.00 C ATOM 1407 OE1 GLU A 109 -13.875 -12.316 5.701 1.00 0.00 O ATOM 1408 OE2 GLU A 109 -15.836 -13.052 6.201 1.00 0.00 O ATOM 0 H GLU A 109 -11.711 -15.642 7.019 1.00 0.00 H new ATOM 0 HA GLU A 109 -11.397 -14.209 9.432 1.00 0.00 H new ATOM 0 HB2 GLU A 109 -13.045 -12.711 8.465 1.00 0.00 H new ATOM 0 HB3 GLU A 109 -12.021 -13.275 7.160 1.00 0.00 H new ATOM 0 HG2 GLU A 109 -13.709 -15.017 6.563 1.00 0.00 H new ATOM 0 HG3 GLU A 109 -14.724 -14.509 7.898 1.00 0.00 H new ATOM 1415 N ASP A 110 -13.968 -16.237 9.241 1.00 0.00 N ATOM 1416 CA ASP A 110 -15.042 -16.847 10.015 1.00 0.00 C ATOM 1417 C ASP A 110 -14.483 -17.534 11.256 1.00 0.00 C ATOM 1418 O ASP A 110 -14.997 -17.359 12.360 1.00 0.00 O ATOM 1419 CB ASP A 110 -15.791 -17.867 9.157 1.00 0.00 C ATOM 1420 CG ASP A 110 -16.639 -17.149 8.113 1.00 0.00 C ATOM 1421 OD1 ASP A 110 -16.836 -15.954 8.259 1.00 0.00 O ATOM 1422 OD2 ASP A 110 -17.079 -17.804 7.183 1.00 0.00 O ATOM 0 H ASP A 110 -13.814 -16.656 8.324 1.00 0.00 H new ATOM 0 HA ASP A 110 -15.731 -16.062 10.327 1.00 0.00 H new ATOM 0 HB2 ASP A 110 -15.081 -18.532 8.666 1.00 0.00 H new ATOM 0 HB3 ASP A 110 -16.426 -18.489 9.788 1.00 0.00 H new ATOM 1427 N GLU A 111 -13.424 -18.316 11.065 1.00 0.00 N ATOM 1428 CA GLU A 111 -12.805 -19.029 12.178 1.00 0.00 C ATOM 1429 C GLU A 111 -12.341 -18.050 13.250 1.00 0.00 C ATOM 1430 O GLU A 111 -12.670 -18.202 14.426 1.00 0.00 O ATOM 1431 CB GLU A 111 -11.606 -19.837 11.675 1.00 0.00 C ATOM 1432 CG GLU A 111 -11.003 -20.630 12.836 1.00 0.00 C ATOM 1433 CD GLU A 111 -9.831 -21.472 12.339 1.00 0.00 C ATOM 1434 OE1 GLU A 111 -9.397 -21.246 11.222 1.00 0.00 O ATOM 1435 OE2 GLU A 111 -9.386 -22.329 13.084 1.00 0.00 O ATOM 0 H GLU A 111 -12.980 -18.471 10.160 1.00 0.00 H new ATOM 0 HA GLU A 111 -13.545 -19.702 12.611 1.00 0.00 H new ATOM 0 HB2 GLU A 111 -11.918 -20.515 10.881 1.00 0.00 H new ATOM 0 HB3 GLU A 111 -10.857 -19.170 11.249 1.00 0.00 H new ATOM 0 HG2 GLU A 111 -10.666 -19.948 13.617 1.00 0.00 H new ATOM 0 HG3 GLU A 111 -11.762 -21.274 13.280 1.00 0.00 H new ATOM 1442 N LEU A 112 -11.585 -17.040 12.835 1.00 0.00 N ATOM 1443 CA LEU A 112 -11.081 -16.045 13.774 1.00 0.00 C ATOM 1444 C LEU A 112 -12.229 -15.449 14.582 1.00 0.00 C ATOM 1445 O LEU A 112 -12.121 -15.279 15.797 1.00 0.00 O ATOM 1446 CB LEU A 112 -10.364 -14.927 13.011 1.00 0.00 C ATOM 1447 CG LEU A 112 -9.864 -13.870 13.999 1.00 0.00 C ATOM 1448 CD1 LEU A 112 -8.933 -14.524 15.022 1.00 0.00 C ATOM 1449 CD2 LEU A 112 -9.102 -12.782 13.239 1.00 0.00 C ATOM 0 H LEU A 112 -11.310 -16.889 11.865 1.00 0.00 H new ATOM 0 HA LEU A 112 -10.381 -16.531 14.454 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -9.526 -15.337 12.447 1.00 0.00 H new ATOM 0 HB3 LEU A 112 -11.042 -14.473 12.289 1.00 0.00 H new ATOM 0 HG LEU A 112 -10.715 -13.426 14.516 1.00 0.00 H new ATOM 0 HD11 LEU A 112 -8.578 -13.770 15.725 1.00 0.00 H new ATOM 0 HD12 LEU A 112 -9.475 -15.299 15.564 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -8.082 -14.969 14.507 1.00 0.00 H new ATOM 0 HD21 LEU A 112 -8.746 -12.029 13.942 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -8.252 -13.227 12.722 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -9.765 -12.314 12.511 1.00 0.00 H new ATOM 1461 N ASP A 113 -13.326 -15.133 13.904 1.00 0.00 N ATOM 1462 CA ASP A 113 -14.486 -14.561 14.576 1.00 0.00 C ATOM 1463 C ASP A 113 -15.007 -15.508 15.651 1.00 0.00 C ATOM 1464 O ASP A 113 -15.315 -15.086 16.766 1.00 0.00 O ATOM 1465 CB ASP A 113 -15.597 -14.285 13.554 1.00 0.00 C ATOM 1466 CG ASP A 113 -15.379 -12.926 12.889 1.00 0.00 C ATOM 1467 OD1 ASP A 113 -14.667 -12.118 13.463 1.00 0.00 O ATOM 1468 OD2 ASP A 113 -15.926 -12.714 11.819 1.00 0.00 O ATOM 0 H ASP A 113 -13.437 -15.262 12.898 1.00 0.00 H new ATOM 0 HA ASP A 113 -14.184 -13.627 15.049 1.00 0.00 H new ATOM 0 HB2 ASP A 113 -15.608 -15.070 12.798 1.00 0.00 H new ATOM 0 HB3 ASP A 113 -16.568 -14.304 14.048 1.00 0.00 H new ATOM 1473 N GLN A 114 -15.097 -16.790 15.311 1.00 0.00 N ATOM 1474 CA GLN A 114 -15.582 -17.787 16.260 1.00 0.00 C ATOM 1475 C GLN A 114 -14.654 -17.871 17.467 1.00 0.00 C ATOM 1476 O GLN A 114 -15.110 -17.880 18.611 1.00 0.00 O ATOM 1477 CB GLN A 114 -15.660 -19.156 15.581 1.00 0.00 C ATOM 1478 CG GLN A 114 -16.728 -19.124 14.487 1.00 0.00 C ATOM 1479 CD GLN A 114 -18.102 -18.889 15.106 1.00 0.00 C ATOM 1480 OE1 GLN A 114 -18.502 -19.607 16.022 1.00 0.00 O ATOM 1481 NE2 GLN A 114 -18.852 -17.919 14.659 1.00 0.00 N ATOM 0 H GLN A 114 -14.843 -17.161 14.395 1.00 0.00 H new ATOM 0 HA GLN A 114 -16.575 -17.490 16.597 1.00 0.00 H new ATOM 0 HB2 GLN A 114 -14.692 -19.416 15.152 1.00 0.00 H new ATOM 0 HB3 GLN A 114 -15.900 -19.925 16.316 1.00 0.00 H new ATOM 0 HG2 GLN A 114 -16.503 -18.334 13.771 1.00 0.00 H new ATOM 0 HG3 GLN A 114 -16.724 -20.064 13.936 1.00 0.00 H new ATOM 0 HE21 GLN A 114 -18.519 -17.325 13.900 1.00 0.00 H new ATOM 0 HE22 GLN A 114 -19.771 -17.755 15.069 1.00 0.00 H new ATOM 1490 N LEU A 115 -13.353 -17.928 17.207 1.00 0.00 N ATOM 1491 CA LEU A 115 -12.374 -18.016 18.283 1.00 0.00 C ATOM 1492 C LEU A 115 -12.499 -16.815 19.213 1.00 0.00 C ATOM 1493 O LEU A 115 -12.439 -16.957 20.435 1.00 0.00 O ATOM 1494 CB LEU A 115 -10.961 -18.057 17.696 1.00 0.00 C ATOM 1495 CG LEU A 115 -10.759 -19.372 16.940 1.00 0.00 C ATOM 1496 CD1 LEU A 115 -9.424 -19.332 16.192 1.00 0.00 C ATOM 1497 CD2 LEU A 115 -10.755 -20.540 17.932 1.00 0.00 C ATOM 0 H LEU A 115 -12.954 -17.915 16.268 1.00 0.00 H new ATOM 0 HA LEU A 115 -12.562 -18.927 18.851 1.00 0.00 H new ATOM 0 HB2 LEU A 115 -10.811 -17.212 17.024 1.00 0.00 H new ATOM 0 HB3 LEU A 115 -10.222 -17.966 18.492 1.00 0.00 H new ATOM 0 HG LEU A 115 -11.571 -19.507 16.226 1.00 0.00 H new ATOM 0 HD11 LEU A 115 -9.280 -20.269 15.654 1.00 0.00 H new ATOM 0 HD12 LEU A 115 -9.428 -18.503 15.484 1.00 0.00 H new ATOM 0 HD13 LEU A 115 -8.611 -19.195 16.905 1.00 0.00 H new ATOM 0 HD21 LEU A 115 -10.611 -21.476 17.392 1.00 0.00 H new ATOM 0 HD22 LEU A 115 -9.944 -20.406 18.648 1.00 0.00 H new ATOM 0 HD23 LEU A 115 -11.707 -20.570 18.462 1.00 0.00 H new ATOM 1509 N CYS A 116 -12.680 -15.635 18.631 1.00 0.00 N ATOM 1510 CA CYS A 116 -12.819 -14.418 19.423 1.00 0.00 C ATOM 1511 C CYS A 116 -14.070 -14.485 20.294 1.00 0.00 C ATOM 1512 O CYS A 116 -14.052 -14.078 21.456 1.00 0.00 O ATOM 1513 CB CYS A 116 -12.905 -13.202 18.499 1.00 0.00 C ATOM 1514 SG CYS A 116 -11.333 -12.997 17.625 1.00 0.00 S ATOM 0 H CYS A 116 -12.734 -15.495 17.622 1.00 0.00 H new ATOM 0 HA CYS A 116 -11.945 -14.325 20.068 1.00 0.00 H new ATOM 0 HB2 CYS A 116 -13.717 -13.332 17.784 1.00 0.00 H new ATOM 0 HB3 CYS A 116 -13.131 -12.307 19.078 1.00 0.00 H new ATOM 0 HG CYS A 116 -11.253 -13.870 16.665 1.00 0.00 H new ATOM 1520 N ASP A 117 -15.155 -15.003 19.725 1.00 0.00 N ATOM 1521 CA ASP A 117 -16.408 -15.118 20.461 1.00 0.00 C ATOM 1522 C ASP A 117 -16.232 -16.023 21.677 1.00 0.00 C ATOM 1523 O ASP A 117 -16.679 -15.695 22.776 1.00 0.00 O ATOM 1524 CB ASP A 117 -17.497 -15.690 19.551 1.00 0.00 C ATOM 1525 CG ASP A 117 -18.811 -15.804 20.317 1.00 0.00 C ATOM 1526 OD1 ASP A 117 -18.799 -15.566 21.513 1.00 0.00 O ATOM 1527 OD2 ASP A 117 -19.810 -16.129 19.696 1.00 0.00 O ATOM 0 H ASP A 117 -15.191 -15.347 18.765 1.00 0.00 H new ATOM 0 HA ASP A 117 -16.702 -14.125 20.800 1.00 0.00 H new ATOM 0 HB2 ASP A 117 -17.629 -15.048 18.680 1.00 0.00 H new ATOM 0 HB3 ASP A 117 -17.196 -16.670 19.182 1.00 0.00 H new ATOM 1532 N GLU A 118 -15.579 -17.163 21.471 1.00 0.00 N ATOM 1533 CA GLU A 118 -15.354 -18.108 22.559 1.00 0.00 C ATOM 1534 C GLU A 118 -14.494 -17.474 23.647 1.00 0.00 C ATOM 1535 O GLU A 118 -14.802 -17.579 24.834 1.00 0.00 O ATOM 1536 CB GLU A 118 -14.661 -19.363 22.022 1.00 0.00 C ATOM 1537 CG GLU A 118 -14.660 -20.445 23.103 1.00 0.00 C ATOM 1538 CD GLU A 118 -14.214 -21.775 22.508 1.00 0.00 C ATOM 1539 OE1 GLU A 118 -14.202 -21.881 21.292 1.00 0.00 O ATOM 1540 OE2 GLU A 118 -13.892 -22.668 23.274 1.00 0.00 O ATOM 0 H GLU A 118 -15.200 -17.453 20.570 1.00 0.00 H new ATOM 0 HA GLU A 118 -16.318 -18.381 22.988 1.00 0.00 H new ATOM 0 HB2 GLU A 118 -15.176 -19.723 21.132 1.00 0.00 H new ATOM 0 HB3 GLU A 118 -13.639 -19.129 21.726 1.00 0.00 H new ATOM 0 HG2 GLU A 118 -13.992 -20.158 23.915 1.00 0.00 H new ATOM 0 HG3 GLU A 118 -15.658 -20.545 23.530 1.00 0.00 H new ATOM 1547 N TRP A 119 -13.420 -16.810 23.234 1.00 0.00 N ATOM 1548 CA TRP A 119 -12.526 -16.155 24.182 1.00 0.00 C ATOM 1549 C TRP A 119 -13.252 -15.028 24.912 1.00 0.00 C ATOM 1550 O TRP A 119 -13.068 -14.833 26.113 1.00 0.00 O ATOM 1551 CB TRP A 119 -11.305 -15.596 23.450 1.00 0.00 C ATOM 1552 CG TRP A 119 -10.566 -14.660 24.353 1.00 0.00 C ATOM 1553 CD1 TRP A 119 -10.602 -13.310 24.268 1.00 0.00 C ATOM 1554 CD2 TRP A 119 -9.688 -14.976 25.472 1.00 0.00 C ATOM 1555 NE1 TRP A 119 -9.802 -12.778 25.263 1.00 0.00 N ATOM 1556 CE2 TRP A 119 -9.216 -13.765 26.031 1.00 0.00 C ATOM 1557 CE3 TRP A 119 -9.258 -16.185 26.050 1.00 0.00 C ATOM 1558 CZ2 TRP A 119 -8.350 -13.753 27.125 1.00 0.00 C ATOM 1559 CZ3 TRP A 119 -8.386 -16.176 27.151 1.00 0.00 C ATOM 1560 CH2 TRP A 119 -7.934 -14.962 27.687 1.00 0.00 C ATOM 0 H TRP A 119 -13.148 -16.711 22.256 1.00 0.00 H new ATOM 0 HA TRP A 119 -12.199 -16.893 24.915 1.00 0.00 H new ATOM 0 HB2 TRP A 119 -10.650 -16.410 23.139 1.00 0.00 H new ATOM 0 HB3 TRP A 119 -11.618 -15.074 22.545 1.00 0.00 H new ATOM 0 HD1 TRP A 119 -11.164 -12.741 23.542 1.00 0.00 H new ATOM 0 HE1 TRP A 119 -9.662 -11.779 25.411 1.00 0.00 H new ATOM 0 HE3 TRP A 119 -9.601 -17.125 25.644 1.00 0.00 H new ATOM 0 HZ2 TRP A 119 -8.004 -12.815 27.534 1.00 0.00 H new ATOM 0 HZ3 TRP A 119 -8.062 -17.109 27.587 1.00 0.00 H new ATOM 0 HH2 TRP A 119 -7.264 -14.962 28.534 1.00 0.00 H new ATOM 1571 N LYS A 120 -14.071 -14.287 24.174 1.00 0.00 N ATOM 1572 CA LYS A 120 -14.814 -13.177 24.757 1.00 0.00 C ATOM 1573 C LYS A 120 -15.764 -13.685 25.837 1.00 0.00 C ATOM 1574 O LYS A 120 -15.962 -13.029 26.860 1.00 0.00 O ATOM 1575 CB LYS A 120 -15.609 -12.451 23.670 1.00 0.00 C ATOM 1576 CG LYS A 120 -16.289 -11.219 24.271 1.00 0.00 C ATOM 1577 CD LYS A 120 -17.034 -10.460 23.171 1.00 0.00 C ATOM 1578 CE LYS A 120 -17.698 -9.218 23.768 1.00 0.00 C ATOM 1579 NZ LYS A 120 -18.407 -8.469 22.693 1.00 0.00 N ATOM 0 H LYS A 120 -14.236 -14.433 23.178 1.00 0.00 H new ATOM 0 HA LYS A 120 -14.105 -12.482 25.208 1.00 0.00 H new ATOM 0 HB2 LYS A 120 -14.946 -12.153 22.857 1.00 0.00 H new ATOM 0 HB3 LYS A 120 -16.356 -13.120 23.243 1.00 0.00 H new ATOM 0 HG2 LYS A 120 -16.984 -11.520 25.055 1.00 0.00 H new ATOM 0 HG3 LYS A 120 -15.546 -10.571 24.736 1.00 0.00 H new ATOM 0 HD2 LYS A 120 -16.341 -10.171 22.381 1.00 0.00 H new ATOM 0 HD3 LYS A 120 -17.786 -11.104 22.715 1.00 0.00 H new ATOM 0 HE2 LYS A 120 -18.401 -9.508 24.548 1.00 0.00 H new ATOM 0 HE3 LYS A 120 -16.948 -8.581 24.236 1.00 0.00 H new ATOM 0 HZ1 LYS A 120 -18.743 -7.559 23.068 1.00 0.00 H new ATOM 0 HZ2 LYS A 120 -17.755 -8.298 21.901 1.00 0.00 H new ATOM 0 HZ3 LYS A 120 -19.219 -9.026 22.359 1.00 0.00 H new ATOM 1593 N ALA A 121 -16.351 -14.853 25.599 1.00 0.00 N ATOM 1594 CA ALA A 121 -17.280 -15.438 26.559 1.00 0.00 C ATOM 1595 C ALA A 121 -16.560 -15.794 27.855 1.00 0.00 C ATOM 1596 O ALA A 121 -17.060 -15.529 28.949 1.00 0.00 O ATOM 1597 CB ALA A 121 -17.917 -16.697 25.968 1.00 0.00 C ATOM 0 H ALA A 121 -16.202 -15.409 24.757 1.00 0.00 H new ATOM 0 HA ALA A 121 -18.056 -14.704 26.777 1.00 0.00 H new ATOM 0 HB1 ALA A 121 -18.610 -17.128 26.691 1.00 0.00 H new ATOM 0 HB2 ALA A 121 -18.457 -16.438 25.057 1.00 0.00 H new ATOM 0 HB3 ALA A 121 -17.138 -17.423 25.734 1.00 0.00 H new ATOM 1603 N ARG A 122 -15.382 -16.392 27.726 1.00 0.00 N ATOM 1604 CA ARG A 122 -14.605 -16.777 28.893 1.00 0.00 C ATOM 1605 C ARG A 122 -14.267 -15.548 29.737 1.00 0.00 C ATOM 1606 O ARG A 122 -14.351 -15.587 30.965 1.00 0.00 O ATOM 1607 CB ARG A 122 -13.316 -17.461 28.451 1.00 0.00 C ATOM 1608 CG ARG A 122 -12.483 -17.858 29.689 1.00 0.00 C ATOM 1609 CD ARG A 122 -10.990 -17.605 29.426 1.00 0.00 C ATOM 1610 NE ARG A 122 -10.435 -16.766 30.479 1.00 0.00 N ATOM 1611 CZ ARG A 122 -10.000 -15.537 30.221 1.00 0.00 C ATOM 1612 NH1 ARG A 122 -9.499 -14.808 31.180 1.00 0.00 N ATOM 1613 NH2 ARG A 122 -10.075 -15.059 29.009 1.00 0.00 N ATOM 0 H ARG A 122 -14.948 -16.619 26.831 1.00 0.00 H new ATOM 0 HA ARG A 122 -15.197 -17.467 29.494 1.00 0.00 H new ATOM 0 HB2 ARG A 122 -13.548 -18.346 27.858 1.00 0.00 H new ATOM 0 HB3 ARG A 122 -12.739 -16.792 27.812 1.00 0.00 H new ATOM 0 HG2 ARG A 122 -12.810 -17.284 30.556 1.00 0.00 H new ATOM 0 HG3 ARG A 122 -12.645 -18.910 29.924 1.00 0.00 H new ATOM 0 HD2 ARG A 122 -10.454 -18.553 29.384 1.00 0.00 H new ATOM 0 HD3 ARG A 122 -10.859 -17.122 28.458 1.00 0.00 H new ATOM 0 HE ARG A 122 -10.379 -17.128 31.431 1.00 0.00 H new ATOM 0 HH11 ARG A 122 -9.441 -15.181 32.127 1.00 0.00 H new ATOM 0 HH12 ARG A 122 -9.165 -13.865 30.982 1.00 0.00 H new ATOM 0 HH21 ARG A 122 -10.468 -15.629 28.259 1.00 0.00 H new ATOM 0 HH22 ARG A 122 -9.741 -14.116 28.811 1.00 0.00 H new ATOM 1627 N LEU A 123 -13.884 -14.466 29.074 1.00 0.00 N ATOM 1628 CA LEU A 123 -13.541 -13.237 29.775 1.00 0.00 C ATOM 1629 C LEU A 123 -14.746 -12.700 30.534 1.00 0.00 C ATOM 1630 O LEU A 123 -14.615 -12.211 31.655 1.00 0.00 O ATOM 1631 CB LEU A 123 -13.046 -12.183 28.778 1.00 0.00 C ATOM 1632 CG LEU A 123 -11.558 -12.396 28.498 1.00 0.00 C ATOM 1633 CD1 LEU A 123 -11.110 -11.469 27.368 1.00 0.00 C ATOM 1634 CD2 LEU A 123 -10.748 -12.081 29.766 1.00 0.00 C ATOM 0 H LEU A 123 -13.803 -14.414 28.059 1.00 0.00 H new ATOM 0 HA LEU A 123 -12.747 -13.458 30.489 1.00 0.00 H new ATOM 0 HB2 LEU A 123 -13.614 -12.251 27.850 1.00 0.00 H new ATOM 0 HB3 LEU A 123 -13.211 -11.183 29.180 1.00 0.00 H new ATOM 0 HG LEU A 123 -11.391 -13.432 28.205 1.00 0.00 H new ATOM 0 HD11 LEU A 123 -10.049 -11.623 27.170 1.00 0.00 H new ATOM 0 HD12 LEU A 123 -11.683 -11.690 26.467 1.00 0.00 H new ATOM 0 HD13 LEU A 123 -11.278 -10.432 27.660 1.00 0.00 H new ATOM 0 HD21 LEU A 123 -9.687 -12.233 29.567 1.00 0.00 H new ATOM 0 HD22 LEU A 123 -10.918 -11.045 30.058 1.00 0.00 H new ATOM 0 HD23 LEU A 123 -11.064 -12.742 30.573 1.00 0.00 H new ATOM 1646 N SER A 124 -15.915 -12.792 29.917 1.00 0.00 N ATOM 1647 CA SER A 124 -17.142 -12.316 30.543 1.00 0.00 C ATOM 1648 C SER A 124 -17.506 -13.187 31.742 1.00 0.00 C ATOM 1649 O SER A 124 -17.949 -12.686 32.775 1.00 0.00 O ATOM 1650 CB SER A 124 -18.285 -12.325 29.531 1.00 0.00 C ATOM 1651 OG SER A 124 -19.460 -11.815 30.146 1.00 0.00 O ATOM 0 H SER A 124 -16.041 -13.190 28.986 1.00 0.00 H new ATOM 0 HA SER A 124 -16.978 -11.296 30.889 1.00 0.00 H new ATOM 0 HB2 SER A 124 -18.023 -11.720 28.663 1.00 0.00 H new ATOM 0 HB3 SER A 124 -18.460 -13.339 29.171 1.00 0.00 H new ATOM 0 HG SER A 124 -20.196 -11.818 29.499 1.00 0.00 H new ATOM 1657 N GLU A 125 -17.322 -14.495 31.591 1.00 0.00 N ATOM 1658 CA GLU A 125 -17.642 -15.430 32.665 1.00 0.00 C ATOM 1659 C GLU A 125 -16.820 -15.114 33.910 1.00 0.00 C ATOM 1660 O GLU A 125 -17.333 -15.146 35.027 1.00 0.00 O ATOM 1661 CB GLU A 125 -17.353 -16.863 32.212 1.00 0.00 C ATOM 1662 CG GLU A 125 -17.749 -17.838 33.322 1.00 0.00 C ATOM 1663 CD GLU A 125 -17.504 -19.273 32.867 1.00 0.00 C ATOM 1664 OE1 GLU A 125 -16.849 -19.448 31.852 1.00 0.00 O ATOM 1665 OE2 GLU A 125 -17.974 -20.175 33.540 1.00 0.00 O ATOM 0 H GLU A 125 -16.956 -14.929 30.743 1.00 0.00 H new ATOM 0 HA GLU A 125 -18.700 -15.331 32.906 1.00 0.00 H new ATOM 0 HB2 GLU A 125 -17.908 -17.087 31.301 1.00 0.00 H new ATOM 0 HB3 GLU A 125 -16.295 -16.975 31.976 1.00 0.00 H new ATOM 0 HG2 GLU A 125 -17.172 -17.630 34.223 1.00 0.00 H new ATOM 0 HG3 GLU A 125 -18.800 -17.703 33.578 1.00 0.00 H new ATOM 1672 N LEU A 126 -15.545 -14.803 33.707 1.00 0.00 N ATOM 1673 CA LEU A 126 -14.660 -14.468 34.816 1.00 0.00 C ATOM 1674 C LEU A 126 -15.072 -13.148 35.457 1.00 0.00 C ATOM 1675 O LEU A 126 -14.952 -12.970 36.669 1.00 0.00 O ATOM 1676 CB LEU A 126 -13.214 -14.382 34.331 1.00 0.00 C ATOM 1677 CG LEU A 126 -12.706 -15.785 33.989 1.00 0.00 C ATOM 1678 CD1 LEU A 126 -11.336 -15.681 33.318 1.00 0.00 C ATOM 1679 CD2 LEU A 126 -12.585 -16.615 35.274 1.00 0.00 C ATOM 0 H LEU A 126 -15.102 -14.776 32.788 1.00 0.00 H new ATOM 0 HA LEU A 126 -14.739 -15.256 35.565 1.00 0.00 H new ATOM 0 HB2 LEU A 126 -13.151 -13.737 33.454 1.00 0.00 H new ATOM 0 HB3 LEU A 126 -12.587 -13.934 35.102 1.00 0.00 H new ATOM 0 HG LEU A 126 -13.408 -16.269 33.310 1.00 0.00 H new ATOM 0 HD11 LEU A 126 -10.974 -16.680 33.074 1.00 0.00 H new ATOM 0 HD12 LEU A 126 -11.422 -15.093 32.404 1.00 0.00 H new ATOM 0 HD13 LEU A 126 -10.634 -15.196 33.997 1.00 0.00 H new ATOM 0 HD21 LEU A 126 -12.223 -17.614 35.029 1.00 0.00 H new ATOM 0 HD22 LEU A 126 -11.884 -16.132 35.955 1.00 0.00 H new ATOM 0 HD23 LEU A 126 -13.562 -16.690 35.752 1.00 0.00 H new ATOM 1691 N GLN A 127 -15.547 -12.222 34.631 1.00 0.00 N ATOM 1692 CA GLN A 127 -15.972 -10.917 35.124 1.00 0.00 C ATOM 1693 C GLN A 127 -17.194 -11.052 36.025 1.00 0.00 C ATOM 1694 O GLN A 127 -17.277 -10.414 37.073 1.00 0.00 O ATOM 1695 CB GLN A 127 -16.299 -9.994 33.950 1.00 0.00 C ATOM 1696 CG GLN A 127 -15.001 -9.540 33.278 1.00 0.00 C ATOM 1697 CD GLN A 127 -15.319 -8.720 32.032 1.00 0.00 C ATOM 1698 OE1 GLN A 127 -16.486 -8.454 31.743 1.00 0.00 O ATOM 1699 NE2 GLN A 127 -14.345 -8.302 31.272 1.00 0.00 N ATOM 0 H GLN A 127 -15.647 -12.349 33.624 1.00 0.00 H new ATOM 0 HA GLN A 127 -15.155 -10.489 35.705 1.00 0.00 H new ATOM 0 HB2 GLN A 127 -16.931 -10.514 33.230 1.00 0.00 H new ATOM 0 HB3 GLN A 127 -16.861 -9.128 34.300 1.00 0.00 H new ATOM 0 HG2 GLN A 127 -14.410 -8.945 33.974 1.00 0.00 H new ATOM 0 HG3 GLN A 127 -14.398 -10.407 33.009 1.00 0.00 H new ATOM 0 HE21 GLN A 127 -13.379 -8.523 31.513 1.00 0.00 H new ATOM 0 HE22 GLN A 127 -14.549 -7.754 30.437 1.00 0.00 H new ATOM 1708 N GLN A 128 -18.138 -11.889 35.609 1.00 0.00 N ATOM 1709 CA GLN A 128 -19.354 -12.102 36.386 1.00 0.00 C ATOM 1710 C GLN A 128 -19.012 -12.577 37.794 1.00 0.00 C ATOM 1711 O GLN A 128 -19.667 -12.197 38.764 1.00 0.00 O ATOM 1712 CB GLN A 128 -20.241 -13.139 35.695 1.00 0.00 C ATOM 1713 CG GLN A 128 -20.793 -12.554 34.393 1.00 0.00 C ATOM 1714 CD GLN A 128 -21.614 -13.606 33.656 1.00 0.00 C ATOM 1715 OE1 GLN A 128 -21.080 -14.638 33.248 1.00 0.00 O ATOM 1716 NE2 GLN A 128 -22.889 -13.406 33.459 1.00 0.00 N ATOM 0 H GLN A 128 -18.086 -12.428 34.744 1.00 0.00 H new ATOM 0 HA GLN A 128 -19.890 -11.156 36.454 1.00 0.00 H new ATOM 0 HB2 GLN A 128 -19.667 -14.042 35.486 1.00 0.00 H new ATOM 0 HB3 GLN A 128 -21.061 -13.428 36.353 1.00 0.00 H new ATOM 0 HG2 GLN A 128 -21.412 -11.683 34.609 1.00 0.00 H new ATOM 0 HG3 GLN A 128 -19.973 -12.213 33.761 1.00 0.00 H new ATOM 0 HE21 GLN A 128 -23.329 -12.551 33.798 1.00 0.00 H new ATOM 0 HE22 GLN A 128 -23.445 -14.105 32.966 1.00 0.00 H new ATOM 1725 N TYR A 129 -17.982 -13.409 37.897 1.00 0.00 N ATOM 1726 CA TYR A 129 -17.557 -13.926 39.192 1.00 0.00 C ATOM 1727 C TYR A 129 -16.636 -12.933 39.894 1.00 0.00 C ATOM 1728 O TYR A 129 -16.614 -12.852 41.122 1.00 0.00 O ATOM 1729 CB TYR A 129 -16.832 -15.261 39.011 1.00 0.00 C ATOM 1730 CG TYR A 129 -17.829 -16.331 38.638 1.00 0.00 C ATOM 1731 CD1 TYR A 129 -17.751 -16.957 37.388 1.00 0.00 C ATOM 1732 CD2 TYR A 129 -18.833 -16.696 39.542 1.00 0.00 C ATOM 1733 CE1 TYR A 129 -18.676 -17.949 37.043 1.00 0.00 C ATOM 1734 CE2 TYR A 129 -19.759 -17.688 39.197 1.00 0.00 C ATOM 1735 CZ TYR A 129 -19.680 -18.315 37.947 1.00 0.00 C ATOM 1736 OH TYR A 129 -20.593 -19.292 37.607 1.00 0.00 O ATOM 0 H TYR A 129 -17.429 -13.738 37.105 1.00 0.00 H new ATOM 0 HA TYR A 129 -18.443 -14.076 39.808 1.00 0.00 H new ATOM 0 HB2 TYR A 129 -16.072 -15.171 38.235 1.00 0.00 H new ATOM 0 HB3 TYR A 129 -16.317 -15.535 39.932 1.00 0.00 H new ATOM 0 HD1 TYR A 129 -16.977 -16.674 36.690 1.00 0.00 H new ATOM 0 HD2 TYR A 129 -18.894 -16.212 40.506 1.00 0.00 H new ATOM 0 HE1 TYR A 129 -18.615 -18.432 36.079 1.00 0.00 H new ATOM 0 HE2 TYR A 129 -20.534 -17.970 39.895 1.00 0.00 H new ATOM 0 HH TYR A 129 -21.221 -19.425 38.348 1.00 0.00 H new ATOM 1746 N ARG A 130 -15.872 -12.185 39.105 1.00 0.00 N ATOM 1747 CA ARG A 130 -14.946 -11.205 39.661 1.00 0.00 C ATOM 1748 C ARG A 130 -15.707 -10.079 40.351 1.00 0.00 C ATOM 1749 O ARG A 130 -15.147 -9.343 41.163 1.00 0.00 O ATOM 1750 CB ARG A 130 -14.068 -10.627 38.550 1.00 0.00 C ATOM 1751 CG ARG A 130 -13.031 -9.680 39.156 1.00 0.00 C ATOM 1752 CD ARG A 130 -12.108 -9.158 38.054 1.00 0.00 C ATOM 1753 NE ARG A 130 -11.022 -8.377 38.633 1.00 0.00 N ATOM 1754 CZ ARG A 130 -11.154 -7.073 38.854 1.00 0.00 C ATOM 1755 NH1 ARG A 130 -10.167 -6.395 39.374 1.00 0.00 N ATOM 1756 NH2 ARG A 130 -12.272 -6.470 38.552 1.00 0.00 N ATOM 0 H ARG A 130 -15.875 -12.238 38.086 1.00 0.00 H new ATOM 0 HA ARG A 130 -14.316 -11.705 40.397 1.00 0.00 H new ATOM 0 HB2 ARG A 130 -13.569 -11.432 38.011 1.00 0.00 H new ATOM 0 HB3 ARG A 130 -14.684 -10.093 37.826 1.00 0.00 H new ATOM 0 HG2 ARG A 130 -13.530 -8.847 39.652 1.00 0.00 H new ATOM 0 HG3 ARG A 130 -12.448 -10.201 39.916 1.00 0.00 H new ATOM 0 HD2 ARG A 130 -11.701 -9.994 37.485 1.00 0.00 H new ATOM 0 HD3 ARG A 130 -12.676 -8.543 37.356 1.00 0.00 H new ATOM 0 HE ARG A 130 -10.145 -8.839 38.873 1.00 0.00 H new ATOM 0 HH11 ARG A 130 -9.294 -6.866 39.611 1.00 0.00 H new ATOM 0 HH12 ARG A 130 -10.269 -5.394 39.543 1.00 0.00 H new ATOM 0 HH21 ARG A 130 -13.044 -7.000 38.147 1.00 0.00 H new ATOM 0 HH22 ARG A 130 -12.374 -5.469 38.721 1.00 0.00 H new ATOM 1770 N GLU A 131 -16.988 -9.950 40.022 1.00 0.00 N ATOM 1771 CA GLU A 131 -17.816 -8.908 40.615 1.00 0.00 C ATOM 1772 C GLU A 131 -17.485 -8.736 42.094 1.00 0.00 C ATOM 1773 O GLU A 131 -17.655 -7.653 42.655 1.00 0.00 O ATOM 1774 CB GLU A 131 -19.296 -9.266 40.461 1.00 0.00 C ATOM 1775 CG GLU A 131 -19.686 -9.205 38.983 1.00 0.00 C ATOM 1776 CD GLU A 131 -21.138 -9.636 38.809 1.00 0.00 C ATOM 1777 OE1 GLU A 131 -21.770 -9.939 39.808 1.00 0.00 O ATOM 1778 OE2 GLU A 131 -21.598 -9.658 37.679 1.00 0.00 O ATOM 0 H GLU A 131 -17.472 -10.549 39.353 1.00 0.00 H new ATOM 0 HA GLU A 131 -17.612 -7.971 40.097 1.00 0.00 H new ATOM 0 HB2 GLU A 131 -19.482 -10.265 40.856 1.00 0.00 H new ATOM 0 HB3 GLU A 131 -19.910 -8.575 41.039 1.00 0.00 H new ATOM 0 HG2 GLU A 131 -19.551 -8.192 38.604 1.00 0.00 H new ATOM 0 HG3 GLU A 131 -19.033 -9.853 38.399 1.00 0.00 H new