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 -134:sc= -0.16 (180deg=-0.976) USER MOD Set 1.2: A 116 CYS SG : rot 160:sc= 0 USER MOD Set 2.1: A 79 SER OG : rot 180:sc= 0.0784 USER MOD Set 2.2: A 83 ASN : amide:sc= -0.493 X(o=-0.41,f=-0.058) USER MOD Single : A 33 SER OG : rot 26:sc= 0.492 USER MOD Single : A 37 LYS NZ :NH3+ -179:sc= -2.11 (180deg=-2.13) USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 47 HIS : no HD1:sc= -0.158 X(o=-0.16,f=-0.0045) USER MOD Single : A 48 LYS NZ :NH3+ -148:sc= 0.987 (180deg=0.163) USER MOD Single : A 49 HIS : no HD1:sc= -0.538 K(o=-0.54,f=-1.2) USER MOD Single : A 57 SER OG : rot 170: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 172:sc= -0.521! USER MOD Single : A 84 GLN : amide:sc= -10.4! C(o=-10!,f=-13!) USER MOD Single : A 87 SER OG : rot 180:sc= 0 USER MOD Single : A 89 MET CE :methyl -155:sc= -0.151 (180deg=-0.928) USER MOD Single : A 92 TYR OH : rot 180:sc= 0 USER MOD Single : A 94 GLN :FLIP amide:sc= -0.156 F(o=-1.6!,f=-0.16) USER MOD Single : A 98 HIS : no HE2:sc= -0.0258 K(o=-0.026,f=-8.6!) USER MOD Single : A 105 THR OG1 : rot -37:sc= 0.0669 USER MOD Single : A 106 THR OG1 : rot 126:sc= 0.398 USER MOD Single : A 114 GLN : amide:sc= -0.223 X(o=-0.22,f=-0.3) USER MOD Single : A 120 LYS NZ :NH3+ -170:sc= 0.881 (180deg=0.479) 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 K(o=0,f=-1.3!) USER MOD Single : A 129 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 133 N SER A 33 -0.105 -12.967 8.436 1.00 0.00 N ATOM 134 CA SER A 33 -0.456 -12.807 9.841 1.00 0.00 C ATOM 135 C SER A 33 -1.745 -13.542 10.160 1.00 0.00 C ATOM 136 O SER A 33 -1.827 -14.274 11.150 1.00 0.00 O ATOM 137 CB SER A 33 -0.617 -11.321 10.168 1.00 0.00 C ATOM 138 OG SER A 33 0.378 -10.580 9.470 1.00 0.00 O ATOM 0 HA SER A 33 0.345 -13.230 10.447 1.00 0.00 H new ATOM 0 HB2 SER A 33 -1.611 -10.978 9.881 1.00 0.00 H new ATOM 0 HB3 SER A 33 -0.522 -11.160 11.242 1.00 0.00 H new ATOM 0 HG SER A 33 0.653 -11.074 8.670 1.00 0.00 H new ATOM 144 N LEU A 34 -2.760 -13.345 9.323 1.00 0.00 N ATOM 145 CA LEU A 34 -4.050 -13.992 9.535 1.00 0.00 C ATOM 146 C LEU A 34 -3.854 -15.416 10.044 1.00 0.00 C ATOM 147 O LEU A 34 -4.577 -15.871 10.932 1.00 0.00 O ATOM 148 CB LEU A 34 -4.837 -14.022 8.222 1.00 0.00 C ATOM 149 CG LEU A 34 -6.172 -14.735 8.442 1.00 0.00 C ATOM 150 CD1 LEU A 34 -6.957 -14.025 9.547 1.00 0.00 C ATOM 151 CD2 LEU A 34 -6.983 -14.709 7.145 1.00 0.00 C ATOM 0 H LEU A 34 -2.715 -12.747 8.498 1.00 0.00 H new ATOM 0 HA LEU A 34 -4.606 -13.424 10.281 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -5.010 -13.006 7.866 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -4.261 -14.536 7.452 1.00 0.00 H new ATOM 0 HG LEU A 34 -5.986 -15.768 8.736 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -7.908 -14.534 9.702 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -6.380 -14.043 10.472 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -7.143 -12.991 9.255 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -7.935 -15.217 7.301 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -7.167 -13.675 6.852 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -6.426 -15.216 6.357 1.00 0.00 H new ATOM 163 N GLU A 35 -2.877 -16.114 9.477 1.00 0.00 N ATOM 164 CA GLU A 35 -2.599 -17.487 9.883 1.00 0.00 C ATOM 165 C GLU A 35 -2.094 -17.526 11.324 1.00 0.00 C ATOM 166 O GLU A 35 -2.522 -18.364 12.118 1.00 0.00 O ATOM 167 CB GLU A 35 -1.546 -18.100 8.958 1.00 0.00 C ATOM 168 CG GLU A 35 -1.651 -19.626 9.005 1.00 0.00 C ATOM 169 CD GLU A 35 -2.884 -20.087 8.233 1.00 0.00 C ATOM 170 OE1 GLU A 35 -3.515 -19.249 7.610 1.00 0.00 O ATOM 171 OE2 GLU A 35 -3.177 -21.270 8.275 1.00 0.00 O ATOM 0 H GLU A 35 -2.268 -15.756 8.741 1.00 0.00 H new ATOM 0 HA GLU A 35 -3.523 -18.062 9.816 1.00 0.00 H new ATOM 0 HB2 GLU A 35 -1.693 -17.746 7.938 1.00 0.00 H new ATOM 0 HB3 GLU A 35 -0.549 -17.784 9.265 1.00 0.00 H new ATOM 0 HG2 GLU A 35 -0.755 -20.074 8.576 1.00 0.00 H new ATOM 0 HG3 GLU A 35 -1.712 -19.963 10.040 1.00 0.00 H new ATOM 178 N GLU A 36 -1.186 -16.615 11.654 1.00 0.00 N ATOM 179 CA GLU A 36 -0.632 -16.556 13.003 1.00 0.00 C ATOM 180 C GLU A 36 -1.716 -16.196 14.013 1.00 0.00 C ATOM 181 O GLU A 36 -1.785 -16.775 15.097 1.00 0.00 O ATOM 182 CB GLU A 36 0.488 -15.515 13.063 1.00 0.00 C ATOM 183 CG GLU A 36 1.676 -15.993 12.227 1.00 0.00 C ATOM 184 CD GLU A 36 2.764 -14.925 12.208 1.00 0.00 C ATOM 185 OE1 GLU A 36 2.578 -13.906 12.854 1.00 0.00 O ATOM 186 OE2 GLU A 36 3.767 -15.141 11.549 1.00 0.00 O ATOM 0 H GLU A 36 -0.820 -15.912 11.012 1.00 0.00 H new ATOM 0 HA GLU A 36 -0.230 -17.538 13.253 1.00 0.00 H new ATOM 0 HB2 GLU A 36 0.128 -14.557 12.688 1.00 0.00 H new ATOM 0 HB3 GLU A 36 0.797 -15.357 14.096 1.00 0.00 H new ATOM 0 HG2 GLU A 36 2.072 -16.920 12.640 1.00 0.00 H new ATOM 0 HG3 GLU A 36 1.351 -16.211 11.210 1.00 0.00 H new ATOM 193 N LYS A 37 -2.567 -15.242 13.646 1.00 0.00 N ATOM 194 CA LYS A 37 -3.645 -14.817 14.534 1.00 0.00 C ATOM 195 C LYS A 37 -4.512 -16.005 14.932 1.00 0.00 C ATOM 196 O LYS A 37 -4.811 -16.194 16.112 1.00 0.00 O ATOM 197 CB LYS A 37 -4.510 -13.768 13.829 1.00 0.00 C ATOM 198 CG LYS A 37 -3.926 -12.374 14.068 1.00 0.00 C ATOM 199 CD LYS A 37 -4.415 -11.422 12.980 1.00 0.00 C ATOM 200 CE LYS A 37 -3.504 -11.538 11.757 1.00 0.00 C ATOM 201 NZ LYS A 37 -4.246 -11.093 10.540 1.00 0.00 N ATOM 0 H LYS A 37 -2.533 -14.754 12.751 1.00 0.00 H new ATOM 0 HA LYS A 37 -3.204 -14.387 15.434 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -4.553 -13.977 12.760 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -5.532 -13.814 14.204 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -4.226 -12.006 15.049 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -2.837 -12.419 14.064 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -5.442 -11.662 12.706 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -4.415 -10.397 13.351 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -2.612 -10.927 11.896 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -3.170 -12.568 11.636 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 -3.633 -11.188 9.705 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -5.094 -11.682 10.415 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -4.529 -10.098 10.650 1.00 0.00 H new ATOM 215 N ILE A 38 -4.905 -16.804 13.948 1.00 0.00 N ATOM 216 CA ILE A 38 -5.734 -17.975 14.213 1.00 0.00 C ATOM 217 C ILE A 38 -4.986 -18.977 15.085 1.00 0.00 C ATOM 218 O ILE A 38 -5.544 -19.533 16.029 1.00 0.00 O ATOM 219 CB ILE A 38 -6.136 -18.638 12.895 1.00 0.00 C ATOM 220 CG1 ILE A 38 -7.088 -17.717 12.129 1.00 0.00 C ATOM 221 CG2 ILE A 38 -6.836 -19.967 13.185 1.00 0.00 C ATOM 222 CD1 ILE A 38 -7.275 -18.246 10.706 1.00 0.00 C ATOM 0 H ILE A 38 -4.666 -16.665 12.966 1.00 0.00 H new ATOM 0 HA ILE A 38 -6.629 -17.651 14.743 1.00 0.00 H new ATOM 0 HB ILE A 38 -5.245 -18.820 12.294 1.00 0.00 H new ATOM 0 HG12 ILE A 38 -8.050 -17.666 12.639 1.00 0.00 H new ATOM 0 HG13 ILE A 38 -6.687 -16.704 12.102 1.00 0.00 H new ATOM 0 HG21 ILE A 38 -7.123 -20.440 12.246 1.00 0.00 H new ATOM 0 HG22 ILE A 38 -6.158 -20.624 13.730 1.00 0.00 H new ATOM 0 HG23 ILE A 38 -7.727 -19.785 13.786 1.00 0.00 H new ATOM 0 HD11 ILE A 38 -7.953 -17.590 10.160 1.00 0.00 H new ATOM 0 HD12 ILE A 38 -6.311 -18.274 10.199 1.00 0.00 H new ATOM 0 HD13 ILE A 38 -7.695 -19.251 10.744 1.00 0.00 H new ATOM 234 N LYS A 39 -3.717 -19.202 14.761 1.00 0.00 N ATOM 235 CA LYS A 39 -2.900 -20.143 15.521 1.00 0.00 C ATOM 236 C LYS A 39 -2.781 -19.691 16.972 1.00 0.00 C ATOM 237 O LYS A 39 -2.816 -20.511 17.891 1.00 0.00 O ATOM 238 CB LYS A 39 -1.505 -20.240 14.898 1.00 0.00 C ATOM 239 CG LYS A 39 -1.606 -20.912 13.526 1.00 0.00 C ATOM 240 CD LYS A 39 -0.296 -20.709 12.760 1.00 0.00 C ATOM 241 CE LYS A 39 0.724 -21.759 13.193 1.00 0.00 C ATOM 242 NZ LYS A 39 1.813 -21.842 12.181 1.00 0.00 N ATOM 0 H LYS A 39 -3.234 -18.750 13.984 1.00 0.00 H new ATOM 0 HA LYS A 39 -3.379 -21.122 15.494 1.00 0.00 H new ATOM 0 HB2 LYS A 39 -1.070 -19.246 14.797 1.00 0.00 H new ATOM 0 HB3 LYS A 39 -0.844 -20.813 15.548 1.00 0.00 H new ATOM 0 HG2 LYS A 39 -1.809 -21.976 13.645 1.00 0.00 H new ATOM 0 HG3 LYS A 39 -2.438 -20.490 12.963 1.00 0.00 H new ATOM 0 HD2 LYS A 39 -0.476 -20.784 11.688 1.00 0.00 H new ATOM 0 HD3 LYS A 39 0.095 -19.709 12.949 1.00 0.00 H new ATOM 0 HE2 LYS A 39 1.138 -21.499 14.167 1.00 0.00 H new ATOM 0 HE3 LYS A 39 0.239 -22.729 13.301 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 2.508 -22.557 12.476 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 1.411 -22.109 11.260 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 2.282 -20.917 12.099 1.00 0.00 H new ATOM 256 N LEU A 40 -2.634 -18.384 17.172 1.00 0.00 N ATOM 257 CA LEU A 40 -2.513 -17.839 18.519 1.00 0.00 C ATOM 258 C LEU A 40 -3.821 -18.002 19.289 1.00 0.00 C ATOM 259 O LEU A 40 -3.830 -18.471 20.425 1.00 0.00 O ATOM 260 CB LEU A 40 -2.142 -16.356 18.448 1.00 0.00 C ATOM 261 CG LEU A 40 -2.040 -15.787 19.864 1.00 0.00 C ATOM 262 CD1 LEU A 40 -1.002 -16.579 20.662 1.00 0.00 C ATOM 263 CD2 LEU A 40 -1.615 -14.318 19.793 1.00 0.00 C ATOM 0 H LEU A 40 -2.596 -17.689 16.426 1.00 0.00 H new ATOM 0 HA LEU A 40 -1.730 -18.388 19.042 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -1.193 -16.232 17.926 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -2.893 -15.809 17.878 1.00 0.00 H new ATOM 0 HG LEU A 40 -3.010 -15.863 20.356 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -0.931 -16.172 21.671 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -1.303 -17.625 20.713 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -0.032 -16.505 20.171 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -1.542 -13.911 20.802 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -0.646 -14.243 19.300 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -2.355 -13.752 19.226 1.00 0.00 H new ATOM 275 N MET A 41 -4.923 -17.613 18.657 1.00 0.00 N ATOM 276 CA MET A 41 -6.235 -17.717 19.288 1.00 0.00 C ATOM 277 C MET A 41 -6.617 -19.181 19.480 1.00 0.00 C ATOM 278 O MET A 41 -7.337 -19.527 20.417 1.00 0.00 O ATOM 279 CB MET A 41 -7.286 -17.016 18.429 1.00 0.00 C ATOM 280 CG MET A 41 -6.995 -15.515 18.385 1.00 0.00 C ATOM 281 SD MET A 41 -7.132 -14.821 20.051 1.00 0.00 S ATOM 282 CE MET A 41 -8.932 -14.946 20.200 1.00 0.00 C ATOM 0 H MET A 41 -4.935 -17.225 17.714 1.00 0.00 H new ATOM 0 HA MET A 41 -6.191 -17.234 20.264 1.00 0.00 H new ATOM 0 HB2 MET A 41 -7.279 -17.428 17.420 1.00 0.00 H new ATOM 0 HB3 MET A 41 -8.281 -17.192 18.838 1.00 0.00 H new ATOM 0 HG2 MET A 41 -5.995 -15.340 17.988 1.00 0.00 H new ATOM 0 HG3 MET A 41 -7.696 -15.018 17.714 1.00 0.00 H new ATOM 0 HE1 MET A 41 -9.330 -14.012 20.597 1.00 0.00 H new ATOM 0 HE2 MET A 41 -9.366 -15.137 19.219 1.00 0.00 H new ATOM 0 HE3 MET A 41 -9.185 -15.764 20.875 1.00 0.00 H new ATOM 292 N ARG A 42 -6.136 -20.035 18.584 1.00 0.00 N ATOM 293 CA ARG A 42 -6.437 -21.460 18.662 1.00 0.00 C ATOM 294 C ARG A 42 -5.830 -22.067 19.923 1.00 0.00 C ATOM 295 O ARG A 42 -6.220 -23.153 20.350 1.00 0.00 O ATOM 296 CB ARG A 42 -5.883 -22.179 17.429 1.00 0.00 C ATOM 297 CG ARG A 42 -6.832 -21.971 16.246 1.00 0.00 C ATOM 298 CD ARG A 42 -7.920 -23.046 16.270 1.00 0.00 C ATOM 299 NE ARG A 42 -7.337 -24.359 16.012 1.00 0.00 N ATOM 300 CZ ARG A 42 -8.087 -25.455 16.011 1.00 0.00 C ATOM 301 NH1 ARG A 42 -7.542 -26.619 15.778 1.00 0.00 N ATOM 302 NH2 ARG A 42 -9.368 -25.371 16.244 1.00 0.00 N ATOM 0 H ARG A 42 -5.540 -19.769 17.800 1.00 0.00 H new ATOM 0 HA ARG A 42 -7.519 -21.583 18.698 1.00 0.00 H new ATOM 0 HB2 ARG A 42 -4.892 -21.795 17.186 1.00 0.00 H new ATOM 0 HB3 ARG A 42 -5.770 -23.243 17.636 1.00 0.00 H new ATOM 0 HG2 ARG A 42 -7.283 -20.980 16.298 1.00 0.00 H new ATOM 0 HG3 ARG A 42 -6.278 -22.020 15.309 1.00 0.00 H new ATOM 0 HD2 ARG A 42 -8.420 -23.046 17.239 1.00 0.00 H new ATOM 0 HD3 ARG A 42 -8.678 -22.823 15.520 1.00 0.00 H new ATOM 0 HE ARG A 42 -6.336 -24.436 15.829 1.00 0.00 H new ATOM 0 HH11 ARG A 42 -6.540 -26.686 15.597 1.00 0.00 H new ATOM 0 HH12 ARG A 42 -8.118 -27.461 15.777 1.00 0.00 H new ATOM 0 HH21 ARG A 42 -9.795 -24.463 16.427 1.00 0.00 H new ATOM 0 HH22 ARG A 42 -9.943 -26.214 16.243 1.00 0.00 H new ATOM 316 N LEU A 43 -4.872 -21.359 20.513 1.00 0.00 N ATOM 317 CA LEU A 43 -4.220 -21.833 21.727 1.00 0.00 C ATOM 318 C LEU A 43 -4.881 -21.235 22.963 1.00 0.00 C ATOM 319 O LEU A 43 -5.016 -21.898 23.991 1.00 0.00 O ATOM 320 CB LEU A 43 -2.737 -21.463 21.703 1.00 0.00 C ATOM 321 CG LEU A 43 -1.958 -22.516 20.909 1.00 0.00 C ATOM 322 CD1 LEU A 43 -0.496 -22.083 20.785 1.00 0.00 C ATOM 323 CD2 LEU A 43 -2.030 -23.862 21.641 1.00 0.00 C ATOM 0 H LEU A 43 -4.532 -20.460 20.172 1.00 0.00 H new ATOM 0 HA LEU A 43 -4.321 -22.918 21.770 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -2.604 -20.480 21.251 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -2.351 -21.401 22.720 1.00 0.00 H new ATOM 0 HG LEU A 43 -2.393 -22.617 19.915 1.00 0.00 H new ATOM 0 HD11 LEU A 43 0.059 -22.832 20.220 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -0.443 -21.125 20.267 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -0.061 -21.983 21.779 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -1.476 -24.613 21.077 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -1.594 -23.760 22.635 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -3.071 -24.172 21.732 1.00 0.00 H new ATOM 335 N VAL A 44 -5.281 -19.972 22.858 1.00 0.00 N ATOM 336 CA VAL A 44 -5.917 -19.290 23.977 1.00 0.00 C ATOM 337 C VAL A 44 -7.237 -19.972 24.334 1.00 0.00 C ATOM 338 O VAL A 44 -7.520 -20.216 25.508 1.00 0.00 O ATOM 339 CB VAL A 44 -6.180 -17.826 23.615 1.00 0.00 C ATOM 340 CG1 VAL A 44 -6.802 -17.104 24.812 1.00 0.00 C ATOM 341 CG2 VAL A 44 -4.861 -17.150 23.238 1.00 0.00 C ATOM 0 H VAL A 44 -5.177 -19.405 22.017 1.00 0.00 H new ATOM 0 HA VAL A 44 -5.249 -19.337 24.837 1.00 0.00 H new ATOM 0 HB VAL A 44 -6.867 -17.780 22.770 1.00 0.00 H new ATOM 0 HG11 VAL A 44 -6.988 -16.062 24.552 1.00 0.00 H new ATOM 0 HG12 VAL A 44 -7.743 -17.585 25.078 1.00 0.00 H new ATOM 0 HG13 VAL A 44 -6.118 -17.150 25.660 1.00 0.00 H new ATOM 0 HG21 VAL A 44 -5.047 -16.107 22.980 1.00 0.00 H new ATOM 0 HG22 VAL A 44 -4.173 -17.198 24.082 1.00 0.00 H new ATOM 0 HG23 VAL A 44 -4.421 -17.662 22.382 1.00 0.00 H new ATOM 351 N VAL A 45 -8.038 -20.272 23.321 1.00 0.00 N ATOM 352 CA VAL A 45 -9.324 -20.925 23.536 1.00 0.00 C ATOM 353 C VAL A 45 -9.121 -22.325 24.107 1.00 0.00 C ATOM 354 O VAL A 45 -9.851 -22.756 24.998 1.00 0.00 O ATOM 355 CB VAL A 45 -10.100 -21.008 22.223 1.00 0.00 C ATOM 356 CG1 VAL A 45 -11.310 -21.925 22.403 1.00 0.00 C ATOM 357 CG2 VAL A 45 -10.577 -19.608 21.826 1.00 0.00 C ATOM 0 H VAL A 45 -7.822 -20.075 22.344 1.00 0.00 H new ATOM 0 HA VAL A 45 -9.896 -20.333 24.250 1.00 0.00 H new ATOM 0 HB VAL A 45 -9.453 -21.409 21.442 1.00 0.00 H new ATOM 0 HG11 VAL A 45 -11.864 -21.984 21.466 1.00 0.00 H new ATOM 0 HG12 VAL A 45 -10.972 -22.921 22.689 1.00 0.00 H new ATOM 0 HG13 VAL A 45 -11.958 -21.524 23.183 1.00 0.00 H new ATOM 0 HG21 VAL A 45 -11.131 -19.665 20.889 1.00 0.00 H new ATOM 0 HG22 VAL A 45 -11.224 -19.209 22.607 1.00 0.00 H new ATOM 0 HG23 VAL A 45 -9.715 -18.952 21.699 1.00 0.00 H new ATOM 367 N ARG A 46 -8.129 -23.033 23.579 1.00 0.00 N ATOM 368 CA ARG A 46 -7.841 -24.388 24.034 1.00 0.00 C ATOM 369 C ARG A 46 -7.347 -24.370 25.477 1.00 0.00 C ATOM 370 O ARG A 46 -7.290 -25.405 26.141 1.00 0.00 O ATOM 371 CB ARG A 46 -6.782 -25.029 23.137 1.00 0.00 C ATOM 372 CG ARG A 46 -6.584 -26.492 23.544 1.00 0.00 C ATOM 373 CD ARG A 46 -7.901 -27.253 23.373 1.00 0.00 C ATOM 374 NE ARG A 46 -7.639 -28.649 23.052 1.00 0.00 N ATOM 375 CZ ARG A 46 -8.497 -29.606 23.394 1.00 0.00 C ATOM 376 NH1 ARG A 46 -8.239 -30.850 23.094 1.00 0.00 N ATOM 377 NH2 ARG A 46 -9.594 -29.301 24.030 1.00 0.00 N ATOM 0 H ARG A 46 -7.514 -22.694 22.840 1.00 0.00 H new ATOM 0 HA ARG A 46 -8.759 -24.973 23.981 1.00 0.00 H new ATOM 0 HB2 ARG A 46 -7.090 -24.970 22.093 1.00 0.00 H new ATOM 0 HB3 ARG A 46 -5.841 -24.486 23.223 1.00 0.00 H new ATOM 0 HG2 ARG A 46 -5.806 -26.949 22.932 1.00 0.00 H new ATOM 0 HG3 ARG A 46 -6.250 -26.550 24.580 1.00 0.00 H new ATOM 0 HD2 ARG A 46 -8.489 -27.187 24.289 1.00 0.00 H new ATOM 0 HD3 ARG A 46 -8.493 -26.795 22.581 1.00 0.00 H new ATOM 0 HE ARG A 46 -6.783 -28.897 22.556 1.00 0.00 H new ATOM 0 HH11 ARG A 46 -7.380 -31.087 22.598 1.00 0.00 H new ATOM 0 HH12 ARG A 46 -8.896 -31.585 23.356 1.00 0.00 H new ATOM 0 HH21 ARG A 46 -9.794 -28.329 24.265 1.00 0.00 H new ATOM 0 HH22 ARG A 46 -10.252 -30.035 24.292 1.00 0.00 H new ATOM 391 N HIS A 47 -6.988 -23.185 25.960 1.00 0.00 N ATOM 392 CA HIS A 47 -6.498 -23.044 27.327 1.00 0.00 C ATOM 393 C HIS A 47 -7.249 -21.934 28.055 1.00 0.00 C ATOM 394 O HIS A 47 -6.704 -21.285 28.947 1.00 0.00 O ATOM 395 CB HIS A 47 -5.001 -22.729 27.315 1.00 0.00 C ATOM 396 CG HIS A 47 -4.248 -23.894 26.734 1.00 0.00 C ATOM 397 ND1 HIS A 47 -3.181 -23.725 25.866 1.00 0.00 N ATOM 398 CD2 HIS A 47 -4.395 -25.251 26.888 1.00 0.00 C ATOM 399 CE1 HIS A 47 -2.732 -24.949 25.533 1.00 0.00 C ATOM 400 NE2 HIS A 47 -3.437 -25.915 26.128 1.00 0.00 N ATOM 0 H HIS A 47 -7.026 -22.314 25.430 1.00 0.00 H new ATOM 0 HA HIS A 47 -6.667 -23.984 27.852 1.00 0.00 H new ATOM 0 HB2 HIS A 47 -4.812 -21.831 26.727 1.00 0.00 H new ATOM 0 HB3 HIS A 47 -4.653 -22.526 28.328 1.00 0.00 H new ATOM 0 HD2 HIS A 47 -5.141 -25.730 27.505 1.00 0.00 H new ATOM 0 HE1 HIS A 47 -1.902 -25.129 24.866 1.00 0.00 H new ATOM 0 HE2 HIS A 47 -3.302 -26.923 26.043 1.00 0.00 H new ATOM 407 N LYS A 48 -8.502 -21.721 27.667 1.00 0.00 N ATOM 408 CA LYS A 48 -9.318 -20.685 28.290 1.00 0.00 C ATOM 409 C LYS A 48 -9.700 -21.087 29.711 1.00 0.00 C ATOM 410 O LYS A 48 -9.897 -20.239 30.578 1.00 0.00 O ATOM 411 CB LYS A 48 -10.585 -20.452 27.465 1.00 0.00 C ATOM 412 CG LYS A 48 -11.430 -21.727 27.453 1.00 0.00 C ATOM 413 CD LYS A 48 -12.666 -21.513 26.578 1.00 0.00 C ATOM 414 CE LYS A 48 -13.502 -22.793 26.554 1.00 0.00 C ATOM 415 NZ LYS A 48 -14.710 -22.582 25.706 1.00 0.00 N ATOM 0 H LYS A 48 -8.972 -22.247 26.930 1.00 0.00 H new ATOM 0 HA LYS A 48 -8.736 -19.764 28.329 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -11.159 -19.627 27.886 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -10.321 -20.169 26.446 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -10.842 -22.562 27.072 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -11.731 -21.986 28.468 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -13.260 -20.685 26.965 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -12.366 -21.243 25.566 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -12.909 -23.620 26.162 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -13.799 -23.065 27.567 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -15.499 -23.148 26.078 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -14.971 -21.575 25.718 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -14.504 -22.875 24.730 1.00 0.00 H new ATOM 429 N HIS A 49 -9.803 -22.390 29.945 1.00 0.00 N ATOM 430 CA HIS A 49 -10.159 -22.895 31.266 1.00 0.00 C ATOM 431 C HIS A 49 -8.999 -22.716 32.240 1.00 0.00 C ATOM 432 O HIS A 49 -9.205 -22.427 33.419 1.00 0.00 O ATOM 433 CB HIS A 49 -10.532 -24.375 31.178 1.00 0.00 C ATOM 434 CG HIS A 49 -11.858 -24.518 30.482 1.00 0.00 C ATOM 435 ND1 HIS A 49 -12.097 -25.505 29.540 1.00 0.00 N ATOM 436 CD2 HIS A 49 -13.027 -23.806 30.582 1.00 0.00 C ATOM 437 CE1 HIS A 49 -13.364 -25.363 29.113 1.00 0.00 C ATOM 438 NE2 HIS A 49 -13.977 -24.341 29.717 1.00 0.00 N ATOM 0 H HIS A 49 -9.646 -23.112 29.242 1.00 0.00 H new ATOM 0 HA HIS A 49 -11.015 -22.327 31.631 1.00 0.00 H new ATOM 0 HB2 HIS A 49 -9.763 -24.923 30.634 1.00 0.00 H new ATOM 0 HB3 HIS A 49 -10.585 -24.808 32.177 1.00 0.00 H new ATOM 0 HD2 HIS A 49 -13.186 -22.959 31.233 1.00 0.00 H new ATOM 0 HE1 HIS A 49 -13.829 -25.997 28.373 1.00 0.00 H new ATOM 0 HE2 HIS A 49 -14.935 -24.022 29.575 1.00 0.00 H new ATOM 445 N GLU A 50 -7.781 -22.894 31.740 1.00 0.00 N ATOM 446 CA GLU A 50 -6.596 -22.757 32.579 1.00 0.00 C ATOM 447 C GLU A 50 -6.523 -21.358 33.179 1.00 0.00 C ATOM 448 O GLU A 50 -6.392 -20.368 32.460 1.00 0.00 O ATOM 449 CB GLU A 50 -5.337 -23.024 31.749 1.00 0.00 C ATOM 450 CG GLU A 50 -5.296 -24.499 31.343 1.00 0.00 C ATOM 451 CD GLU A 50 -4.093 -24.757 30.442 1.00 0.00 C ATOM 452 OE1 GLU A 50 -3.352 -23.821 30.191 1.00 0.00 O ATOM 453 OE2 GLU A 50 -3.929 -25.889 30.016 1.00 0.00 O ATOM 0 H GLU A 50 -7.589 -23.131 30.767 1.00 0.00 H new ATOM 0 HA GLU A 50 -6.660 -23.484 33.389 1.00 0.00 H new ATOM 0 HB2 GLU A 50 -5.333 -22.391 30.861 1.00 0.00 H new ATOM 0 HB3 GLU A 50 -4.448 -22.770 32.326 1.00 0.00 H new ATOM 0 HG2 GLU A 50 -5.237 -25.128 32.231 1.00 0.00 H new ATOM 0 HG3 GLU A 50 -6.215 -24.767 30.822 1.00 0.00 H new ATOM 567 N SER A 57 -0.711 -13.067 35.007 1.00 0.00 N ATOM 568 CA SER A 57 0.197 -13.262 33.885 1.00 0.00 C ATOM 569 C SER A 57 0.489 -14.745 33.673 1.00 0.00 C ATOM 570 O SER A 57 0.775 -15.174 32.558 1.00 0.00 O ATOM 571 CB SER A 57 1.509 -12.518 34.140 1.00 0.00 C ATOM 572 OG SER A 57 2.364 -12.669 33.012 1.00 0.00 O ATOM 0 HA SER A 57 -0.281 -12.867 32.988 1.00 0.00 H new ATOM 0 HB2 SER A 57 1.312 -11.462 34.322 1.00 0.00 H new ATOM 0 HB3 SER A 57 1.995 -12.910 35.034 1.00 0.00 H new ATOM 0 HG SER A 57 3.132 -12.067 33.101 1.00 0.00 H new ATOM 578 N GLU A 58 0.428 -15.531 34.744 1.00 0.00 N ATOM 579 CA GLU A 58 0.703 -16.955 34.629 1.00 0.00 C ATOM 580 C GLU A 58 0.008 -17.539 33.402 1.00 0.00 C ATOM 581 O GLU A 58 0.453 -18.543 32.845 1.00 0.00 O ATOM 582 CB GLU A 58 0.229 -17.686 35.884 1.00 0.00 C ATOM 583 CG GLU A 58 0.561 -19.174 35.764 1.00 0.00 C ATOM 584 CD GLU A 58 0.209 -19.893 37.060 1.00 0.00 C ATOM 585 OE1 GLU A 58 -0.430 -19.279 37.899 1.00 0.00 O ATOM 586 OE2 GLU A 58 0.582 -21.046 37.195 1.00 0.00 O ATOM 0 H GLU A 58 0.195 -15.212 35.684 1.00 0.00 H new ATOM 0 HA GLU A 58 1.779 -17.088 34.520 1.00 0.00 H new ATOM 0 HB2 GLU A 58 0.711 -17.265 36.767 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -0.845 -17.551 36.012 1.00 0.00 H new ATOM 0 HG2 GLU A 58 0.008 -19.613 34.933 1.00 0.00 H new ATOM 0 HG3 GLU A 58 1.621 -19.302 35.544 1.00 0.00 H new ATOM 593 N PHE A 59 -1.083 -16.904 32.988 1.00 0.00 N ATOM 594 CA PHE A 59 -1.832 -17.371 31.827 1.00 0.00 C ATOM 595 C PHE A 59 -1.146 -16.933 30.536 1.00 0.00 C ATOM 596 O PHE A 59 -0.636 -17.762 29.782 1.00 0.00 O ATOM 597 CB PHE A 59 -3.256 -16.814 31.867 1.00 0.00 C ATOM 598 CG PHE A 59 -3.969 -17.162 30.582 1.00 0.00 C ATOM 599 CD1 PHE A 59 -4.142 -18.504 30.221 1.00 0.00 C ATOM 600 CD2 PHE A 59 -4.457 -16.146 29.753 1.00 0.00 C ATOM 601 CE1 PHE A 59 -4.804 -18.829 29.030 1.00 0.00 C ATOM 602 CE2 PHE A 59 -5.119 -16.471 28.562 1.00 0.00 C ATOM 603 CZ PHE A 59 -5.292 -17.813 28.201 1.00 0.00 C ATOM 0 H PHE A 59 -1.466 -16.071 33.435 1.00 0.00 H new ATOM 0 HA PHE A 59 -1.868 -18.460 31.854 1.00 0.00 H new ATOM 0 HB2 PHE A 59 -3.796 -17.228 32.719 1.00 0.00 H new ATOM 0 HB3 PHE A 59 -3.231 -15.732 32.000 1.00 0.00 H new ATOM 0 HD1 PHE A 59 -3.765 -19.288 30.861 1.00 0.00 H new ATOM 0 HD2 PHE A 59 -4.323 -15.111 30.031 1.00 0.00 H new ATOM 0 HE1 PHE A 59 -4.938 -19.864 28.752 1.00 0.00 H new ATOM 0 HE2 PHE A 59 -5.496 -15.687 27.922 1.00 0.00 H new ATOM 0 HZ PHE A 59 -5.802 -18.064 27.283 1.00 0.00 H new ATOM 613 N TYR A 60 -1.139 -15.628 30.289 1.00 0.00 N ATOM 614 CA TYR A 60 -0.517 -15.093 29.083 1.00 0.00 C ATOM 615 C TYR A 60 0.946 -15.522 29.003 1.00 0.00 C ATOM 616 O TYR A 60 1.500 -15.670 27.914 1.00 0.00 O ATOM 617 CB TYR A 60 -0.601 -13.565 29.092 1.00 0.00 C ATOM 618 CG TYR A 60 -2.039 -13.139 29.255 1.00 0.00 C ATOM 619 CD1 TYR A 60 -2.525 -12.795 30.521 1.00 0.00 C ATOM 620 CD2 TYR A 60 -2.887 -13.090 28.142 1.00 0.00 C ATOM 621 CE1 TYR A 60 -3.860 -12.401 30.676 1.00 0.00 C ATOM 622 CE2 TYR A 60 -4.222 -12.696 28.297 1.00 0.00 C ATOM 623 CZ TYR A 60 -4.708 -12.352 29.563 1.00 0.00 C ATOM 624 OH TYR A 60 -6.024 -11.963 29.717 1.00 0.00 O ATOM 0 H TYR A 60 -1.553 -14.926 30.902 1.00 0.00 H new ATOM 0 HA TYR A 60 -1.048 -15.483 28.215 1.00 0.00 H new ATOM 0 HB2 TYR A 60 0.003 -13.162 29.905 1.00 0.00 H new ATOM 0 HB3 TYR A 60 -0.195 -13.163 28.164 1.00 0.00 H new ATOM 0 HD1 TYR A 60 -1.870 -12.833 31.379 1.00 0.00 H new ATOM 0 HD2 TYR A 60 -2.512 -13.356 27.165 1.00 0.00 H new ATOM 0 HE1 TYR A 60 -4.235 -12.135 31.653 1.00 0.00 H new ATOM 0 HE2 TYR A 60 -4.877 -12.658 27.439 1.00 0.00 H new ATOM 0 HH TYR A 60 -6.475 -11.982 28.847 1.00 0.00 H new ATOM 634 N ALA A 61 1.565 -15.720 30.161 1.00 0.00 N ATOM 635 CA ALA A 61 2.963 -16.134 30.210 1.00 0.00 C ATOM 636 C ALA A 61 3.119 -17.561 29.691 1.00 0.00 C ATOM 637 O ALA A 61 4.209 -17.971 29.295 1.00 0.00 O ATOM 638 CB ALA A 61 3.484 -16.050 31.646 1.00 0.00 C ATOM 0 H ALA A 61 1.125 -15.602 31.073 1.00 0.00 H new ATOM 0 HA ALA A 61 3.542 -15.464 29.575 1.00 0.00 H new ATOM 0 HB1 ALA A 61 4.528 -16.361 31.673 1.00 0.00 H new ATOM 0 HB2 ALA A 61 3.402 -15.024 32.003 1.00 0.00 H new ATOM 0 HB3 ALA A 61 2.894 -16.706 32.286 1.00 0.00 H new ATOM 644 N LYS A 62 2.023 -18.312 29.701 1.00 0.00 N ATOM 645 CA LYS A 62 2.049 -19.691 29.231 1.00 0.00 C ATOM 646 C LYS A 62 1.696 -19.758 27.748 1.00 0.00 C ATOM 647 O LYS A 62 2.233 -20.583 27.008 1.00 0.00 O ATOM 648 CB LYS A 62 1.060 -20.537 30.034 1.00 0.00 C ATOM 649 CG LYS A 62 1.506 -22.001 30.017 1.00 0.00 C ATOM 650 CD LYS A 62 0.593 -22.827 30.923 1.00 0.00 C ATOM 651 CE LYS A 62 0.974 -22.596 32.386 1.00 0.00 C ATOM 652 NZ LYS A 62 0.329 -23.636 33.236 1.00 0.00 N ATOM 0 H LYS A 62 1.111 -17.991 30.027 1.00 0.00 H new ATOM 0 HA LYS A 62 3.056 -20.084 29.371 1.00 0.00 H new ATOM 0 HB2 LYS A 62 1.005 -20.175 31.061 1.00 0.00 H new ATOM 0 HB3 LYS A 62 0.060 -20.446 29.610 1.00 0.00 H new ATOM 0 HG2 LYS A 62 1.473 -22.390 28.999 1.00 0.00 H new ATOM 0 HG3 LYS A 62 2.539 -22.081 30.355 1.00 0.00 H new ATOM 0 HD2 LYS A 62 -0.448 -22.547 30.759 1.00 0.00 H new ATOM 0 HD3 LYS A 62 0.681 -23.885 30.677 1.00 0.00 H new ATOM 0 HE2 LYS A 62 2.057 -22.636 32.502 1.00 0.00 H new ATOM 0 HE3 LYS A 62 0.656 -21.603 32.703 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 0.587 -23.480 34.231 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 -0.704 -23.577 33.133 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 0.653 -24.578 32.938 1.00 0.00 H new ATOM 666 N ILE A 63 0.785 -18.888 27.322 1.00 0.00 N ATOM 667 CA ILE A 63 0.363 -18.866 25.926 1.00 0.00 C ATOM 668 C ILE A 63 1.539 -18.520 25.016 1.00 0.00 C ATOM 669 O ILE A 63 1.775 -19.190 24.011 1.00 0.00 O ATOM 670 CB ILE A 63 -0.745 -17.826 25.737 1.00 0.00 C ATOM 671 CG1 ILE A 63 -1.974 -18.242 26.551 1.00 0.00 C ATOM 672 CG2 ILE A 63 -1.122 -17.745 24.254 1.00 0.00 C ATOM 673 CD1 ILE A 63 -2.445 -19.629 26.106 1.00 0.00 C ATOM 0 H ILE A 63 0.329 -18.196 27.917 1.00 0.00 H new ATOM 0 HA ILE A 63 -0.010 -19.855 25.662 1.00 0.00 H new ATOM 0 HB ILE A 63 -0.393 -16.852 26.076 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -1.731 -18.254 27.613 1.00 0.00 H new ATOM 0 HG13 ILE A 63 -2.775 -17.515 26.415 1.00 0.00 H new ATOM 0 HG21 ILE A 63 -1.911 -17.005 24.119 1.00 0.00 H new ATOM 0 HG22 ILE A 63 -0.248 -17.454 23.672 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -1.476 -18.718 23.915 1.00 0.00 H new ATOM 0 HD11 ILE A 63 -3.319 -19.920 26.688 1.00 0.00 H new ATOM 0 HD12 ILE A 63 -2.706 -19.603 25.048 1.00 0.00 H new ATOM 0 HD13 ILE A 63 -1.646 -20.353 26.265 1.00 0.00 H new ATOM 685 N ALA A 64 2.277 -17.477 25.380 1.00 0.00 N ATOM 686 CA ALA A 64 3.429 -17.055 24.590 1.00 0.00 C ATOM 687 C ALA A 64 4.529 -18.108 24.643 1.00 0.00 C ATOM 688 O ALA A 64 5.454 -18.095 23.831 1.00 0.00 O ATOM 689 CB ALA A 64 3.965 -15.723 25.119 1.00 0.00 C ATOM 0 H ALA A 64 2.101 -16.912 26.210 1.00 0.00 H new ATOM 0 HA ALA A 64 3.111 -16.932 23.555 1.00 0.00 H new ATOM 0 HB1 ALA A 64 4.825 -15.415 24.524 1.00 0.00 H new ATOM 0 HB2 ALA A 64 3.186 -14.964 25.051 1.00 0.00 H new ATOM 0 HB3 ALA A 64 4.267 -15.840 26.160 1.00 0.00 H new ATOM 695 N ARG A 65 4.425 -19.018 25.607 1.00 0.00 N ATOM 696 CA ARG A 65 5.418 -20.075 25.756 1.00 0.00 C ATOM 697 C ARG A 65 5.121 -21.232 24.805 1.00 0.00 C ATOM 698 O ARG A 65 6.016 -21.745 24.136 1.00 0.00 O ATOM 699 CB ARG A 65 5.427 -20.584 27.197 1.00 0.00 C ATOM 700 CG ARG A 65 6.531 -21.631 27.364 1.00 0.00 C ATOM 701 CD ARG A 65 6.525 -22.155 28.800 1.00 0.00 C ATOM 702 NE ARG A 65 6.928 -21.102 29.725 1.00 0.00 N ATOM 703 CZ ARG A 65 6.978 -21.318 31.035 1.00 0.00 C ATOM 704 NH1 ARG A 65 7.342 -20.360 31.842 1.00 0.00 N ATOM 705 NH2 ARG A 65 6.664 -22.492 31.514 1.00 0.00 N ATOM 0 H ARG A 65 3.669 -19.045 26.291 1.00 0.00 H new ATOM 0 HA ARG A 65 6.397 -19.663 25.511 1.00 0.00 H new ATOM 0 HB2 ARG A 65 5.591 -19.755 27.885 1.00 0.00 H new ATOM 0 HB3 ARG A 65 4.459 -21.019 27.446 1.00 0.00 H new ATOM 0 HG2 ARG A 65 6.376 -22.453 26.665 1.00 0.00 H new ATOM 0 HG3 ARG A 65 7.501 -21.192 27.130 1.00 0.00 H new ATOM 0 HD2 ARG A 65 5.529 -22.514 29.059 1.00 0.00 H new ATOM 0 HD3 ARG A 65 7.203 -23.004 28.887 1.00 0.00 H new ATOM 0 HE ARG A 65 7.176 -20.183 29.359 1.00 0.00 H new ATOM 0 HH11 ARG A 65 7.589 -19.444 31.468 1.00 0.00 H new ATOM 0 HH12 ARG A 65 7.380 -20.527 32.848 1.00 0.00 H new ATOM 0 HH21 ARG A 65 6.381 -23.241 30.883 1.00 0.00 H new ATOM 0 HH22 ARG A 65 6.702 -22.659 32.519 1.00 0.00 H new ATOM 719 N ILE A 66 3.856 -21.637 24.756 1.00 0.00 N ATOM 720 CA ILE A 66 3.447 -22.734 23.885 1.00 0.00 C ATOM 721 C ILE A 66 3.210 -22.232 22.464 1.00 0.00 C ATOM 722 O ILE A 66 3.200 -23.009 21.516 1.00 0.00 O ATOM 723 CB ILE A 66 2.173 -23.382 24.423 1.00 0.00 C ATOM 724 CG1 ILE A 66 2.468 -24.049 25.769 1.00 0.00 C ATOM 725 CG2 ILE A 66 1.678 -24.436 23.430 1.00 0.00 C ATOM 726 CD1 ILE A 66 1.154 -24.463 26.432 1.00 0.00 C ATOM 0 H ILE A 66 3.101 -21.226 25.305 1.00 0.00 H new ATOM 0 HA ILE A 66 4.247 -23.474 23.865 1.00 0.00 H new ATOM 0 HB ILE A 66 1.406 -22.619 24.556 1.00 0.00 H new ATOM 0 HG12 ILE A 66 3.105 -24.922 25.623 1.00 0.00 H new ATOM 0 HG13 ILE A 66 3.013 -23.362 26.416 1.00 0.00 H new ATOM 0 HG21 ILE A 66 0.769 -24.899 23.814 1.00 0.00 H new ATOM 0 HG22 ILE A 66 1.467 -23.962 22.471 1.00 0.00 H new ATOM 0 HG23 ILE A 66 2.445 -25.199 23.297 1.00 0.00 H new ATOM 0 HD11 ILE A 66 1.364 -24.938 27.390 1.00 0.00 H new ATOM 0 HD12 ILE A 66 0.534 -23.581 26.592 1.00 0.00 H new ATOM 0 HD13 ILE A 66 0.626 -25.165 25.787 1.00 0.00 H new ATOM 738 N GLY A 67 3.014 -20.925 22.331 1.00 0.00 N ATOM 739 CA GLY A 67 2.772 -20.329 21.021 1.00 0.00 C ATOM 740 C GLY A 67 4.071 -20.193 20.238 1.00 0.00 C ATOM 741 O GLY A 67 4.064 -19.994 19.027 1.00 0.00 O ATOM 0 H GLY A 67 3.018 -20.262 23.106 1.00 0.00 H new ATOM 0 HA2 GLY A 67 2.068 -20.945 20.461 1.00 0.00 H new ATOM 0 HA3 GLY A 67 2.311 -19.349 21.142 1.00 0.00 H new ATOM 745 N TYR A 68 5.194 -20.296 20.941 1.00 0.00 N ATOM 746 CA TYR A 68 6.501 -20.182 20.299 1.00 0.00 C ATOM 747 C TYR A 68 7.246 -21.509 20.365 1.00 0.00 C ATOM 748 O TYR A 68 8.316 -21.662 19.773 1.00 0.00 O ATOM 749 CB TYR A 68 7.327 -19.094 20.986 1.00 0.00 C ATOM 750 CG TYR A 68 8.704 -19.042 20.369 1.00 0.00 C ATOM 751 CD1 TYR A 68 8.899 -18.390 19.145 1.00 0.00 C ATOM 752 CD2 TYR A 68 9.787 -19.647 21.020 1.00 0.00 C ATOM 753 CE1 TYR A 68 10.175 -18.343 18.572 1.00 0.00 C ATOM 754 CE2 TYR A 68 11.063 -19.599 20.447 1.00 0.00 C ATOM 755 CZ TYR A 68 11.257 -18.946 19.223 1.00 0.00 C ATOM 756 OH TYR A 68 12.516 -18.899 18.659 1.00 0.00 O ATOM 0 H TYR A 68 5.227 -20.457 21.948 1.00 0.00 H new ATOM 0 HA TYR A 68 6.350 -19.915 19.253 1.00 0.00 H new ATOM 0 HB2 TYR A 68 6.834 -18.128 20.882 1.00 0.00 H new ATOM 0 HB3 TYR A 68 7.403 -19.300 22.054 1.00 0.00 H new ATOM 0 HD1 TYR A 68 8.064 -17.923 18.643 1.00 0.00 H new ATOM 0 HD2 TYR A 68 9.637 -20.150 21.964 1.00 0.00 H new ATOM 0 HE1 TYR A 68 10.325 -17.841 17.627 1.00 0.00 H new ATOM 0 HE2 TYR A 68 11.898 -20.065 20.949 1.00 0.00 H new ATOM 0 HH TYR A 68 13.153 -19.365 19.240 1.00 0.00 H new ATOM 766 N GLU A 69 6.678 -22.468 21.089 1.00 0.00 N ATOM 767 CA GLU A 69 7.300 -23.781 21.226 1.00 0.00 C ATOM 768 C GLU A 69 6.500 -24.834 20.468 1.00 0.00 C ATOM 769 O GLU A 69 6.816 -26.023 20.520 1.00 0.00 O ATOM 770 CB GLU A 69 7.386 -24.167 22.704 1.00 0.00 C ATOM 771 CG GLU A 69 8.384 -23.251 23.414 1.00 0.00 C ATOM 772 CD GLU A 69 8.410 -23.565 24.906 1.00 0.00 C ATOM 773 OE1 GLU A 69 7.693 -24.464 25.314 1.00 0.00 O ATOM 774 OE2 GLU A 69 9.146 -22.903 25.618 1.00 0.00 O ATOM 0 H GLU A 69 5.794 -22.363 21.587 1.00 0.00 H new ATOM 0 HA GLU A 69 8.304 -23.732 20.805 1.00 0.00 H new ATOM 0 HB2 GLU A 69 6.404 -24.083 23.170 1.00 0.00 H new ATOM 0 HB3 GLU A 69 7.698 -25.207 22.802 1.00 0.00 H new ATOM 0 HG2 GLU A 69 9.379 -23.384 22.989 1.00 0.00 H new ATOM 0 HG3 GLU A 69 8.108 -22.208 23.258 1.00 0.00 H new ATOM 781 N ASP A 70 5.462 -24.391 19.766 1.00 0.00 N ATOM 782 CA ASP A 70 4.623 -25.306 19.001 1.00 0.00 C ATOM 783 C ASP A 70 4.167 -24.654 17.699 1.00 0.00 C ATOM 784 O ASP A 70 4.227 -25.264 16.633 1.00 0.00 O ATOM 785 CB ASP A 70 3.401 -25.711 19.828 1.00 0.00 C ATOM 786 CG ASP A 70 3.814 -26.679 20.931 1.00 0.00 C ATOM 787 OD1 ASP A 70 4.898 -27.231 20.832 1.00 0.00 O ATOM 788 OD2 ASP A 70 3.041 -26.856 21.858 1.00 0.00 O ATOM 0 H ASP A 70 5.183 -23.411 19.711 1.00 0.00 H new ATOM 0 HA ASP A 70 5.209 -26.193 18.763 1.00 0.00 H new ATOM 0 HB2 ASP A 70 2.938 -24.826 20.264 1.00 0.00 H new ATOM 0 HB3 ASP A 70 2.655 -26.177 19.185 1.00 0.00 H new ATOM 793 N GLU A 71 3.706 -23.410 17.798 1.00 0.00 N ATOM 794 CA GLU A 71 3.238 -22.685 16.621 1.00 0.00 C ATOM 795 C GLU A 71 4.409 -22.011 15.910 1.00 0.00 C ATOM 796 O GLU A 71 4.326 -21.689 14.725 1.00 0.00 O ATOM 797 CB GLU A 71 2.213 -21.629 17.034 1.00 0.00 C ATOM 798 CG GLU A 71 1.030 -22.309 17.725 1.00 0.00 C ATOM 799 CD GLU A 71 0.273 -23.190 16.736 1.00 0.00 C ATOM 800 OE1 GLU A 71 0.584 -23.121 15.559 1.00 0.00 O ATOM 801 OE2 GLU A 71 -0.603 -23.921 17.169 1.00 0.00 O ATOM 0 H GLU A 71 3.647 -22.887 18.672 1.00 0.00 H new ATOM 0 HA GLU A 71 2.772 -23.395 15.938 1.00 0.00 H new ATOM 0 HB2 GLU A 71 2.673 -20.904 17.706 1.00 0.00 H new ATOM 0 HB3 GLU A 71 1.869 -21.079 16.158 1.00 0.00 H new ATOM 0 HG2 GLU A 71 1.386 -22.912 18.561 1.00 0.00 H new ATOM 0 HG3 GLU A 71 0.359 -21.555 18.138 1.00 0.00 H new ATOM 808 N GLY A 72 5.497 -21.800 16.643 1.00 0.00 N ATOM 809 CA GLY A 72 6.674 -21.169 16.071 1.00 0.00 C ATOM 810 C GLY A 72 6.312 -19.903 15.309 1.00 0.00 C ATOM 811 O GLY A 72 6.010 -19.948 14.115 1.00 0.00 O ATOM 0 H GLY A 72 5.586 -22.055 17.627 1.00 0.00 H new ATOM 0 HA2 GLY A 72 7.381 -20.928 16.865 1.00 0.00 H new ATOM 0 HA3 GLY A 72 7.174 -21.868 15.401 1.00 0.00 H new ATOM 893 N GLU A 78 5.497 -11.549 27.985 1.00 0.00 N ATOM 894 CA GLU A 78 4.273 -11.507 28.782 1.00 0.00 C ATOM 895 C GLU A 78 3.428 -10.302 28.383 1.00 0.00 C ATOM 896 O GLU A 78 2.269 -10.445 27.995 1.00 0.00 O ATOM 897 CB GLU A 78 4.623 -11.428 30.266 1.00 0.00 C ATOM 898 CG GLU A 78 5.271 -12.742 30.707 1.00 0.00 C ATOM 899 CD GLU A 78 5.718 -12.639 32.162 1.00 0.00 C ATOM 900 OE1 GLU A 78 5.492 -11.599 32.758 1.00 0.00 O ATOM 901 OE2 GLU A 78 6.279 -13.602 32.658 1.00 0.00 O ATOM 0 HA GLU A 78 3.700 -12.416 28.598 1.00 0.00 H new ATOM 0 HB2 GLU A 78 5.303 -10.596 30.446 1.00 0.00 H new ATOM 0 HB3 GLU A 78 3.724 -11.238 30.853 1.00 0.00 H new ATOM 0 HG2 GLU A 78 4.563 -13.563 30.592 1.00 0.00 H new ATOM 0 HG3 GLU A 78 6.126 -12.967 30.070 1.00 0.00 H new ATOM 908 N SER A 79 4.022 -9.116 28.473 1.00 0.00 N ATOM 909 CA SER A 79 3.314 -7.894 28.109 1.00 0.00 C ATOM 910 C SER A 79 2.760 -8.005 26.689 1.00 0.00 C ATOM 911 O SER A 79 1.570 -7.780 26.463 1.00 0.00 O ATOM 912 CB SER A 79 4.278 -6.705 28.177 1.00 0.00 C ATOM 913 OG SER A 79 3.702 -5.595 27.498 1.00 0.00 O ATOM 0 H SER A 79 4.981 -8.976 28.791 1.00 0.00 H new ATOM 0 HA SER A 79 2.489 -7.746 28.806 1.00 0.00 H new ATOM 0 HB2 SER A 79 4.481 -6.445 29.216 1.00 0.00 H new ATOM 0 HB3 SER A 79 5.233 -6.969 27.722 1.00 0.00 H new ATOM 0 HG SER A 79 4.315 -4.832 27.540 1.00 0.00 H new ATOM 919 N ALA A 80 3.620 -8.363 25.741 1.00 0.00 N ATOM 920 CA ALA A 80 3.194 -8.505 24.353 1.00 0.00 C ATOM 921 C ALA A 80 2.051 -9.509 24.242 1.00 0.00 C ATOM 922 O ALA A 80 1.226 -9.425 23.333 1.00 0.00 O ATOM 923 CB ALA A 80 4.372 -8.971 23.492 1.00 0.00 C ATOM 0 H ALA A 80 4.607 -8.559 25.906 1.00 0.00 H new ATOM 0 HA ALA A 80 2.845 -7.535 23.998 1.00 0.00 H new ATOM 0 HB1 ALA A 80 4.047 -9.075 22.457 1.00 0.00 H new ATOM 0 HB2 ALA A 80 5.176 -8.237 23.548 1.00 0.00 H new ATOM 0 HB3 ALA A 80 4.732 -9.933 23.858 1.00 0.00 H new ATOM 929 N CYS A 81 2.012 -10.459 25.170 1.00 0.00 N ATOM 930 CA CYS A 81 0.965 -11.474 25.167 1.00 0.00 C ATOM 931 C CYS A 81 -0.368 -10.870 25.591 1.00 0.00 C ATOM 932 O CYS A 81 -1.415 -11.510 25.481 1.00 0.00 O ATOM 933 CB CYS A 81 1.338 -12.612 26.117 1.00 0.00 C ATOM 934 SG CYS A 81 0.261 -14.035 25.803 1.00 0.00 S ATOM 0 H CYS A 81 2.688 -10.547 25.929 1.00 0.00 H new ATOM 0 HA CYS A 81 0.867 -11.865 24.154 1.00 0.00 H new ATOM 0 HB2 CYS A 81 2.381 -12.893 25.974 1.00 0.00 H new ATOM 0 HB3 CYS A 81 1.235 -12.285 27.152 1.00 0.00 H new ATOM 0 HG CYS A 81 0.686 -15.059 26.482 1.00 0.00 H new ATOM 940 N ARG A 82 -0.326 -9.633 26.076 1.00 0.00 N ATOM 941 CA ARG A 82 -1.538 -8.951 26.514 1.00 0.00 C ATOM 942 C ARG A 82 -1.948 -7.886 25.504 1.00 0.00 C ATOM 943 O ARG A 82 -3.107 -7.503 25.441 1.00 0.00 O ATOM 944 CB ARG A 82 -1.310 -8.303 27.881 1.00 0.00 C ATOM 945 CG ARG A 82 -1.232 -9.390 28.955 1.00 0.00 C ATOM 946 CD ARG A 82 -0.977 -8.743 30.318 1.00 0.00 C ATOM 947 NE ARG A 82 -0.964 -9.760 31.364 1.00 0.00 N ATOM 948 CZ ARG A 82 -1.049 -9.425 32.647 1.00 0.00 C ATOM 949 NH1 ARG A 82 -1.037 -10.352 33.566 1.00 0.00 N ATOM 950 NH2 ARG A 82 -1.145 -8.169 32.990 1.00 0.00 N ATOM 0 H ARG A 82 0.529 -9.085 26.175 1.00 0.00 H new ATOM 0 HA ARG A 82 -2.338 -9.687 26.592 1.00 0.00 H new ATOM 0 HB2 ARG A 82 -0.388 -7.721 27.870 1.00 0.00 H new ATOM 0 HB3 ARG A 82 -2.121 -7.611 28.107 1.00 0.00 H new ATOM 0 HG2 ARG A 82 -2.161 -9.960 28.979 1.00 0.00 H new ATOM 0 HG3 ARG A 82 -0.433 -10.093 28.719 1.00 0.00 H new ATOM 0 HD2 ARG A 82 -0.025 -8.213 30.304 1.00 0.00 H new ATOM 0 HD3 ARG A 82 -1.750 -8.004 30.528 1.00 0.00 H new ATOM 0 HE ARG A 82 -0.888 -10.744 31.106 1.00 0.00 H new ATOM 0 HH11 ARG A 82 -0.962 -11.334 33.299 1.00 0.00 H new ATOM 0 HH12 ARG A 82 -1.102 -10.095 34.551 1.00 0.00 H new ATOM 0 HH21 ARG A 82 -1.155 -7.444 32.273 1.00 0.00 H new ATOM 0 HH22 ARG A 82 -1.210 -7.913 33.975 1.00 0.00 H new ATOM 964 N ASN A 83 -0.981 -7.410 24.727 1.00 0.00 N ATOM 965 CA ASN A 83 -1.251 -6.385 23.724 1.00 0.00 C ATOM 966 C ASN A 83 -1.727 -7.023 22.422 1.00 0.00 C ATOM 967 O ASN A 83 -2.705 -6.580 21.821 1.00 0.00 O ATOM 968 CB ASN A 83 0.011 -5.565 23.462 1.00 0.00 C ATOM 969 CG ASN A 83 0.592 -5.072 24.786 1.00 0.00 C ATOM 970 OD1 ASN A 83 -0.130 -4.514 25.612 1.00 0.00 O ATOM 971 ND2 ASN A 83 1.861 -5.244 25.034 1.00 0.00 N ATOM 0 H ASN A 83 -0.009 -7.715 24.771 1.00 0.00 H new ATOM 0 HA ASN A 83 -2.036 -5.730 24.103 1.00 0.00 H new ATOM 0 HB2 ASN A 83 0.747 -6.172 22.935 1.00 0.00 H new ATOM 0 HB3 ASN A 83 -0.222 -4.717 22.818 1.00 0.00 H new ATOM 0 HD21 ASN A 83 2.258 -4.916 25.915 1.00 0.00 H new ATOM 0 HD22 ASN A 83 2.457 -5.707 24.347 1.00 0.00 H new ATOM 978 N GLN A 84 -1.024 -8.067 21.990 1.00 0.00 N ATOM 979 CA GLN A 84 -1.379 -8.756 20.753 1.00 0.00 C ATOM 980 C GLN A 84 -2.812 -9.273 20.820 1.00 0.00 C ATOM 981 O GLN A 84 -3.665 -8.869 20.030 1.00 0.00 O ATOM 982 CB GLN A 84 -0.425 -9.928 20.519 1.00 0.00 C ATOM 983 CG GLN A 84 0.845 -9.423 19.839 1.00 0.00 C ATOM 984 CD GLN A 84 1.487 -8.324 20.680 1.00 0.00 C ATOM 985 OE1 GLN A 84 0.923 -7.238 20.819 1.00 0.00 O ATOM 986 NE2 GLN A 84 2.638 -8.544 21.254 1.00 0.00 N ATOM 0 H GLN A 84 -0.212 -8.452 22.473 1.00 0.00 H new ATOM 0 HA GLN A 84 -1.298 -8.048 19.928 1.00 0.00 H new ATOM 0 HB2 GLN A 84 -0.177 -10.404 21.468 1.00 0.00 H new ATOM 0 HB3 GLN A 84 -0.906 -10.684 19.899 1.00 0.00 H new ATOM 0 HG2 GLN A 84 1.547 -10.246 19.705 1.00 0.00 H new ATOM 0 HG3 GLN A 84 0.608 -9.041 18.846 1.00 0.00 H new ATOM 0 HE21 GLN A 84 3.102 -9.445 21.137 1.00 0.00 H new ATOM 0 HE22 GLN A 84 3.073 -7.815 21.820 1.00 0.00 H new ATOM 995 N ILE A 85 -3.073 -10.160 21.774 1.00 0.00 N ATOM 996 CA ILE A 85 -4.408 -10.727 21.934 1.00 0.00 C ATOM 997 C ILE A 85 -5.442 -9.619 22.101 1.00 0.00 C ATOM 998 O ILE A 85 -6.544 -9.704 21.559 1.00 0.00 O ATOM 999 CB ILE A 85 -4.442 -11.643 23.158 1.00 0.00 C ATOM 1000 CG1 ILE A 85 -3.589 -12.885 22.890 1.00 0.00 C ATOM 1001 CG2 ILE A 85 -5.885 -12.067 23.438 1.00 0.00 C ATOM 1002 CD1 ILE A 85 -3.398 -13.665 24.191 1.00 0.00 C ATOM 0 H ILE A 85 -2.384 -10.500 22.444 1.00 0.00 H new ATOM 0 HA ILE A 85 -4.647 -11.303 21.040 1.00 0.00 H new ATOM 0 HB ILE A 85 -4.046 -11.109 24.022 1.00 0.00 H new ATOM 0 HG12 ILE A 85 -4.071 -13.516 22.143 1.00 0.00 H new ATOM 0 HG13 ILE A 85 -2.621 -12.593 22.483 1.00 0.00 H new ATOM 0 HG21 ILE A 85 -5.910 -12.720 24.310 1.00 0.00 H new ATOM 0 HG22 ILE A 85 -6.493 -11.183 23.629 1.00 0.00 H new ATOM 0 HG23 ILE A 85 -6.282 -12.601 22.574 1.00 0.00 H new ATOM 0 HD11 ILE A 85 -2.790 -14.549 23.999 1.00 0.00 H new ATOM 0 HD12 ILE A 85 -2.897 -13.033 24.924 1.00 0.00 H new ATOM 0 HD13 ILE A 85 -4.370 -13.970 24.579 1.00 0.00 H new ATOM 1014 N ILE A 86 -5.077 -8.580 22.843 1.00 0.00 N ATOM 1015 CA ILE A 86 -5.980 -7.458 23.055 1.00 0.00 C ATOM 1016 C ILE A 86 -6.310 -6.767 21.737 1.00 0.00 C ATOM 1017 O ILE A 86 -7.458 -6.430 21.474 1.00 0.00 O ATOM 1018 CB ILE A 86 -5.354 -6.451 24.031 1.00 0.00 C ATOM 1019 CG1 ILE A 86 -5.834 -6.743 25.457 1.00 0.00 C ATOM 1020 CG2 ILE A 86 -5.736 -5.025 23.631 1.00 0.00 C ATOM 1021 CD1 ILE A 86 -5.587 -5.516 26.343 1.00 0.00 C ATOM 0 H ILE A 86 -4.171 -8.492 23.303 1.00 0.00 H new ATOM 0 HA ILE A 86 -6.905 -7.844 23.482 1.00 0.00 H new ATOM 0 HB ILE A 86 -4.269 -6.547 23.994 1.00 0.00 H new ATOM 0 HG12 ILE A 86 -6.895 -6.992 25.451 1.00 0.00 H new ATOM 0 HG13 ILE A 86 -5.306 -7.607 25.860 1.00 0.00 H new ATOM 0 HG21 ILE A 86 -5.287 -4.319 24.329 1.00 0.00 H new ATOM 0 HG22 ILE A 86 -5.373 -4.820 22.624 1.00 0.00 H new ATOM 0 HG23 ILE A 86 -6.821 -4.919 23.654 1.00 0.00 H new ATOM 0 HD11 ILE A 86 -5.929 -5.725 27.357 1.00 0.00 H new ATOM 0 HD12 ILE A 86 -4.521 -5.287 26.359 1.00 0.00 H new ATOM 0 HD13 ILE A 86 -6.135 -4.663 25.944 1.00 0.00 H new ATOM 1033 N SER A 87 -5.283 -6.533 20.930 1.00 0.00 N ATOM 1034 CA SER A 87 -5.472 -5.859 19.652 1.00 0.00 C ATOM 1035 C SER A 87 -6.463 -6.634 18.787 1.00 0.00 C ATOM 1036 O SER A 87 -7.361 -6.048 18.182 1.00 0.00 O ATOM 1037 CB SER A 87 -4.136 -5.754 18.918 1.00 0.00 C ATOM 1038 OG SER A 87 -4.375 -5.454 17.549 1.00 0.00 O ATOM 0 H SER A 87 -4.319 -6.797 21.135 1.00 0.00 H new ATOM 0 HA SER A 87 -5.865 -4.860 19.840 1.00 0.00 H new ATOM 0 HB2 SER A 87 -3.519 -4.977 19.370 1.00 0.00 H new ATOM 0 HB3 SER A 87 -3.585 -6.690 19.006 1.00 0.00 H new ATOM 0 HG SER A 87 -3.520 -5.384 17.075 1.00 0.00 H new ATOM 1044 N ILE A 88 -6.298 -7.951 18.739 1.00 0.00 N ATOM 1045 CA ILE A 88 -7.188 -8.793 17.948 1.00 0.00 C ATOM 1046 C ILE A 88 -8.639 -8.575 18.361 1.00 0.00 C ATOM 1047 O ILE A 88 -9.550 -8.727 17.562 1.00 0.00 O ATOM 1048 CB ILE A 88 -6.817 -10.265 18.135 1.00 0.00 C ATOM 1049 CG1 ILE A 88 -5.362 -10.482 17.713 1.00 0.00 C ATOM 1050 CG2 ILE A 88 -7.733 -11.137 17.275 1.00 0.00 C ATOM 1051 CD1 ILE A 88 -4.925 -11.898 18.093 1.00 0.00 C ATOM 0 H ILE A 88 -5.563 -8.456 19.234 1.00 0.00 H new ATOM 0 HA ILE A 88 -7.077 -8.521 16.898 1.00 0.00 H new ATOM 0 HB ILE A 88 -6.936 -10.538 19.183 1.00 0.00 H new ATOM 0 HG12 ILE A 88 -5.258 -10.334 16.638 1.00 0.00 H new ATOM 0 HG13 ILE A 88 -4.718 -9.749 18.199 1.00 0.00 H new ATOM 0 HG21 ILE A 88 -7.468 -12.186 17.409 1.00 0.00 H new ATOM 0 HG22 ILE A 88 -8.769 -10.983 17.576 1.00 0.00 H new ATOM 0 HG23 ILE A 88 -7.616 -10.864 16.226 1.00 0.00 H new ATOM 0 HD11 ILE A 88 -3.889 -12.052 17.792 1.00 0.00 H new ATOM 0 HD12 ILE A 88 -5.013 -12.029 19.172 1.00 0.00 H new ATOM 0 HD13 ILE A 88 -5.561 -12.623 17.586 1.00 0.00 H new ATOM 1063 N MET A 89 -8.846 -8.230 19.627 1.00 0.00 N ATOM 1064 CA MET A 89 -10.196 -7.998 20.132 1.00 0.00 C ATOM 1065 C MET A 89 -10.795 -6.740 19.510 1.00 0.00 C ATOM 1066 O MET A 89 -11.890 -6.775 18.949 1.00 0.00 O ATOM 1067 CB MET A 89 -10.159 -7.844 21.654 1.00 0.00 C ATOM 1068 CG MET A 89 -9.722 -9.164 22.291 1.00 0.00 C ATOM 1069 SD MET A 89 -10.952 -10.444 21.935 1.00 0.00 S ATOM 1070 CE MET A 89 -12.251 -9.818 23.029 1.00 0.00 C ATOM 0 H MET A 89 -8.105 -8.106 20.317 1.00 0.00 H new ATOM 0 HA MET A 89 -10.817 -8.853 19.863 1.00 0.00 H new ATOM 0 HB2 MET A 89 -9.469 -7.048 21.933 1.00 0.00 H new ATOM 0 HB3 MET A 89 -11.143 -7.557 22.025 1.00 0.00 H new ATOM 0 HG2 MET A 89 -8.748 -9.463 21.903 1.00 0.00 H new ATOM 0 HG3 MET A 89 -9.611 -9.041 23.368 1.00 0.00 H new ATOM 0 HE1 MET A 89 -12.909 -10.637 23.319 1.00 0.00 H new ATOM 0 HE2 MET A 89 -11.798 -9.384 23.920 1.00 0.00 H new ATOM 0 HE3 MET A 89 -12.830 -9.055 22.508 1.00 0.00 H new ATOM 1080 N ARG A 90 -10.065 -5.633 19.604 1.00 0.00 N ATOM 1081 CA ARG A 90 -10.539 -4.370 19.049 1.00 0.00 C ATOM 1082 C ARG A 90 -11.029 -4.568 17.618 1.00 0.00 C ATOM 1083 O ARG A 90 -12.056 -4.018 17.225 1.00 0.00 O ATOM 1084 CB ARG A 90 -9.407 -3.339 19.063 1.00 0.00 C ATOM 1085 CG ARG A 90 -9.936 -1.993 18.565 1.00 0.00 C ATOM 1086 CD ARG A 90 -8.798 -0.971 18.547 1.00 0.00 C ATOM 1087 NE ARG A 90 -7.786 -1.359 17.570 1.00 0.00 N ATOM 1088 CZ ARG A 90 -6.503 -1.065 17.754 1.00 0.00 C ATOM 1089 NH1 ARG A 90 -5.617 -1.424 16.867 1.00 0.00 N ATOM 1090 NH2 ARG A 90 -6.130 -0.417 18.824 1.00 0.00 N ATOM 0 H ARG A 90 -9.151 -5.584 20.055 1.00 0.00 H new ATOM 0 HA ARG A 90 -11.367 -4.011 19.660 1.00 0.00 H new ATOM 0 HB2 ARG A 90 -9.009 -3.234 20.072 1.00 0.00 H new ATOM 0 HB3 ARG A 90 -8.586 -3.676 18.430 1.00 0.00 H new ATOM 0 HG2 ARG A 90 -10.356 -2.103 17.565 1.00 0.00 H new ATOM 0 HG3 ARG A 90 -10.741 -1.645 19.212 1.00 0.00 H new ATOM 0 HD2 ARG A 90 -9.190 0.016 18.302 1.00 0.00 H new ATOM 0 HD3 ARG A 90 -8.349 -0.899 19.537 1.00 0.00 H new ATOM 0 HE ARG A 90 -8.068 -1.865 16.731 1.00 0.00 H new ATOM 0 HH11 ARG A 90 -5.908 -1.931 16.031 1.00 0.00 H new ATOM 0 HH12 ARG A 90 -4.633 -1.198 17.009 1.00 0.00 H new ATOM 0 HH21 ARG A 90 -6.823 -0.137 19.518 1.00 0.00 H new ATOM 0 HH22 ARG A 90 -5.146 -0.191 18.966 1.00 0.00 H new ATOM 1104 N VAL A 91 -10.291 -5.351 16.846 1.00 0.00 N ATOM 1105 CA VAL A 91 -10.662 -5.614 15.459 1.00 0.00 C ATOM 1106 C VAL A 91 -11.921 -6.473 15.393 1.00 0.00 C ATOM 1107 O VAL A 91 -12.777 -6.270 14.541 1.00 0.00 O ATOM 1108 CB VAL A 91 -9.510 -6.322 14.736 1.00 0.00 C ATOM 1109 CG1 VAL A 91 -8.174 -5.857 15.327 1.00 0.00 C ATOM 1110 CG2 VAL A 91 -9.649 -7.837 14.907 1.00 0.00 C ATOM 0 H VAL A 91 -9.435 -5.815 17.152 1.00 0.00 H new ATOM 0 HA VAL A 91 -10.865 -4.662 14.968 1.00 0.00 H new ATOM 0 HB VAL A 91 -9.542 -6.076 13.675 1.00 0.00 H new ATOM 0 HG11 VAL A 91 -7.354 -6.360 14.814 1.00 0.00 H new ATOM 0 HG12 VAL A 91 -8.075 -4.779 15.199 1.00 0.00 H new ATOM 0 HG13 VAL A 91 -8.141 -6.101 16.389 1.00 0.00 H new ATOM 0 HG21 VAL A 91 -8.829 -8.338 14.392 1.00 0.00 H new ATOM 0 HG22 VAL A 91 -9.619 -8.088 15.967 1.00 0.00 H new ATOM 0 HG23 VAL A 91 -10.598 -8.165 14.483 1.00 0.00 H new ATOM 1120 N TYR A 92 -12.012 -7.446 16.296 1.00 0.00 N ATOM 1121 CA TYR A 92 -13.158 -8.340 16.333 1.00 0.00 C ATOM 1122 C TYR A 92 -14.427 -7.560 16.648 1.00 0.00 C ATOM 1123 O TYR A 92 -15.475 -7.806 16.063 1.00 0.00 O ATOM 1124 CB TYR A 92 -12.945 -9.430 17.385 1.00 0.00 C ATOM 1125 CG TYR A 92 -14.201 -10.257 17.513 1.00 0.00 C ATOM 1126 CD1 TYR A 92 -14.525 -11.199 16.530 1.00 0.00 C ATOM 1127 CD2 TYR A 92 -15.042 -10.080 18.618 1.00 0.00 C ATOM 1128 CE1 TYR A 92 -15.691 -11.965 16.652 1.00 0.00 C ATOM 1129 CE2 TYR A 92 -16.208 -10.847 18.739 1.00 0.00 C ATOM 1130 CZ TYR A 92 -16.532 -11.789 17.757 1.00 0.00 C ATOM 1131 OH TYR A 92 -17.681 -12.544 17.876 1.00 0.00 O ATOM 0 H TYR A 92 -11.306 -7.632 17.009 1.00 0.00 H new ATOM 0 HA TYR A 92 -13.264 -8.807 15.354 1.00 0.00 H new ATOM 0 HB2 TYR A 92 -12.106 -10.065 17.101 1.00 0.00 H new ATOM 0 HB3 TYR A 92 -12.694 -8.980 18.345 1.00 0.00 H new ATOM 0 HD1 TYR A 92 -13.876 -11.335 15.678 1.00 0.00 H new ATOM 0 HD2 TYR A 92 -14.792 -9.353 19.376 1.00 0.00 H new ATOM 0 HE1 TYR A 92 -15.941 -12.692 15.893 1.00 0.00 H new ATOM 0 HE2 TYR A 92 -16.857 -10.711 19.591 1.00 0.00 H new ATOM 0 HH TYR A 92 -18.150 -12.298 18.701 1.00 0.00 H new ATOM 1141 N GLU A 93 -14.322 -6.622 17.583 1.00 0.00 N ATOM 1142 CA GLU A 93 -15.468 -5.811 17.974 1.00 0.00 C ATOM 1143 C GLU A 93 -15.797 -4.788 16.891 1.00 0.00 C ATOM 1144 O GLU A 93 -16.964 -4.486 16.641 1.00 0.00 O ATOM 1145 CB GLU A 93 -15.175 -5.089 19.290 1.00 0.00 C ATOM 1146 CG GLU A 93 -15.013 -6.118 20.410 1.00 0.00 C ATOM 1147 CD GLU A 93 -16.322 -6.870 20.623 1.00 0.00 C ATOM 1148 OE1 GLU A 93 -17.348 -6.365 20.198 1.00 0.00 O ATOM 1149 OE2 GLU A 93 -16.280 -7.939 21.209 1.00 0.00 O ATOM 0 H GLU A 93 -13.459 -6.405 18.082 1.00 0.00 H new ATOM 0 HA GLU A 93 -16.326 -6.470 18.106 1.00 0.00 H new ATOM 0 HB2 GLU A 93 -14.268 -4.492 19.196 1.00 0.00 H new ATOM 0 HB3 GLU A 93 -15.986 -4.401 19.528 1.00 0.00 H new ATOM 0 HG2 GLU A 93 -14.218 -6.820 20.158 1.00 0.00 H new ATOM 0 HG3 GLU A 93 -14.717 -5.619 21.333 1.00 0.00 H new ATOM 1156 N GLN A 94 -14.758 -4.256 16.253 1.00 0.00 N ATOM 1157 CA GLN A 94 -14.949 -3.265 15.199 1.00 0.00 C ATOM 1158 C GLN A 94 -15.666 -3.882 14.003 1.00 0.00 C ATOM 1159 O GLN A 94 -16.694 -3.376 13.556 1.00 0.00 O ATOM 1160 CB GLN A 94 -13.595 -2.711 14.752 1.00 0.00 C ATOM 1161 CG GLN A 94 -13.125 -1.645 15.745 1.00 0.00 C ATOM 1162 CD GLN A 94 -11.726 -1.167 15.373 1.00 0.00 C ATOM 1163 OE1 GLN A 94 -11.029 -1.837 14.496 1.00 0.00 O flip ATOM 1164 NE2 GLN A 94 -11.253 -0.158 15.897 1.00 0.00 N flip ATOM 0 H GLN A 94 -13.784 -4.492 16.445 1.00 0.00 H new ATOM 0 HA GLN A 94 -15.561 -2.456 15.596 1.00 0.00 H new ATOM 0 HB2 GLN A 94 -12.863 -3.516 14.693 1.00 0.00 H new ATOM 0 HB3 GLN A 94 -13.678 -2.282 13.754 1.00 0.00 H new ATOM 0 HG2 GLN A 94 -13.818 -0.804 15.743 1.00 0.00 H new ATOM 0 HG3 GLN A 94 -13.122 -2.054 16.756 1.00 0.00 H new ATOM 0 HE21 GLN A 94 -11.799 0.365 16.582 1.00 0.00 H new ATOM 0 HE22 GLN A 94 -10.315 0.155 15.646 1.00 0.00 H new ATOM 1173 N ARG A 95 -15.119 -4.980 13.494 1.00 0.00 N ATOM 1174 CA ARG A 95 -15.717 -5.660 12.351 1.00 0.00 C ATOM 1175 C ARG A 95 -17.022 -6.338 12.750 1.00 0.00 C ATOM 1176 O ARG A 95 -17.773 -6.812 11.899 1.00 0.00 O ATOM 1177 CB ARG A 95 -14.745 -6.704 11.795 1.00 0.00 C ATOM 1178 CG ARG A 95 -13.670 -6.010 10.957 1.00 0.00 C ATOM 1179 CD ARG A 95 -12.697 -7.054 10.408 1.00 0.00 C ATOM 1180 NE ARG A 95 -11.714 -6.420 9.538 1.00 0.00 N ATOM 1181 CZ ARG A 95 -10.976 -7.137 8.697 1.00 0.00 C ATOM 1182 NH1 ARG A 95 -10.103 -6.545 7.927 1.00 0.00 N ATOM 1183 NH2 ARG A 95 -11.123 -8.432 8.641 1.00 0.00 N ATOM 0 H ARG A 95 -14.269 -5.416 13.851 1.00 0.00 H new ATOM 0 HA ARG A 95 -15.929 -4.916 11.583 1.00 0.00 H new ATOM 0 HB2 ARG A 95 -14.282 -7.257 12.613 1.00 0.00 H new ATOM 0 HB3 ARG A 95 -15.284 -7.429 11.185 1.00 0.00 H new ATOM 0 HG2 ARG A 95 -14.132 -5.461 10.136 1.00 0.00 H new ATOM 0 HG3 ARG A 95 -13.133 -5.282 11.565 1.00 0.00 H new ATOM 0 HD2 ARG A 95 -12.192 -7.559 11.231 1.00 0.00 H new ATOM 0 HD3 ARG A 95 -13.245 -7.816 9.854 1.00 0.00 H new ATOM 0 HE ARG A 95 -11.590 -5.408 9.575 1.00 0.00 H new ATOM 0 HH11 ARG A 95 -9.988 -5.533 7.971 1.00 0.00 H new ATOM 0 HH12 ARG A 95 -9.536 -7.095 7.281 1.00 0.00 H new ATOM 0 HH21 ARG A 95 -11.805 -8.894 9.243 1.00 0.00 H new ATOM 0 HH22 ARG A 95 -10.556 -8.982 7.995 1.00 0.00 H new ATOM 1197 N LEU A 96 -17.285 -6.382 14.051 1.00 0.00 N ATOM 1198 CA LEU A 96 -18.506 -6.997 14.558 1.00 0.00 C ATOM 1199 C LEU A 96 -19.683 -6.036 14.442 1.00 0.00 C ATOM 1200 O LEU A 96 -20.814 -6.451 14.194 1.00 0.00 O ATOM 1201 CB LEU A 96 -18.318 -7.414 16.015 1.00 0.00 C ATOM 1202 CG LEU A 96 -19.641 -7.939 16.571 1.00 0.00 C ATOM 1203 CD1 LEU A 96 -20.152 -9.081 15.692 1.00 0.00 C ATOM 1204 CD2 LEU A 96 -19.425 -8.453 17.997 1.00 0.00 C ATOM 0 H LEU A 96 -16.672 -6.001 14.771 1.00 0.00 H new ATOM 0 HA LEU A 96 -18.719 -7.881 13.957 1.00 0.00 H new ATOM 0 HB2 LEU A 96 -17.550 -8.184 16.088 1.00 0.00 H new ATOM 0 HB3 LEU A 96 -17.975 -6.565 16.606 1.00 0.00 H new ATOM 0 HG LEU A 96 -20.375 -7.133 16.579 1.00 0.00 H new ATOM 0 HD11 LEU A 96 -21.096 -9.453 16.091 1.00 0.00 H new ATOM 0 HD12 LEU A 96 -20.306 -8.717 14.676 1.00 0.00 H new ATOM 0 HD13 LEU A 96 -19.419 -9.888 15.681 1.00 0.00 H new ATOM 0 HD21 LEU A 96 -20.368 -8.828 18.395 1.00 0.00 H new ATOM 0 HD22 LEU A 96 -18.690 -9.258 17.986 1.00 0.00 H new ATOM 0 HD23 LEU A 96 -19.063 -7.640 18.626 1.00 0.00 H new ATOM 1216 N ALA A 97 -19.411 -4.751 14.638 1.00 0.00 N ATOM 1217 CA ALA A 97 -20.457 -3.741 14.563 1.00 0.00 C ATOM 1218 C ALA A 97 -20.699 -3.330 13.114 1.00 0.00 C ATOM 1219 O ALA A 97 -21.804 -2.922 12.751 1.00 0.00 O ATOM 1220 CB ALA A 97 -20.055 -2.510 15.381 1.00 0.00 C ATOM 0 H ALA A 97 -18.482 -4.387 14.848 1.00 0.00 H new ATOM 0 HA ALA A 97 -21.375 -4.165 14.970 1.00 0.00 H new ATOM 0 HB1 ALA A 97 -20.843 -1.759 15.320 1.00 0.00 H new ATOM 0 HB2 ALA A 97 -19.908 -2.797 16.422 1.00 0.00 H new ATOM 0 HB3 ALA A 97 -19.128 -2.096 14.984 1.00 0.00 H new ATOM 1226 N HIS A 98 -19.662 -3.440 12.291 1.00 0.00 N ATOM 1227 CA HIS A 98 -19.775 -3.065 10.887 1.00 0.00 C ATOM 1228 C HIS A 98 -21.028 -3.673 10.266 1.00 0.00 C ATOM 1229 O HIS A 98 -21.877 -2.954 9.737 1.00 0.00 O ATOM 1230 CB HIS A 98 -18.541 -3.550 10.120 1.00 0.00 C ATOM 1231 CG HIS A 98 -17.450 -2.516 10.211 1.00 0.00 C ATOM 1232 ND1 HIS A 98 -16.589 -2.444 11.295 1.00 0.00 N ATOM 1233 CD2 HIS A 98 -17.072 -1.504 9.364 1.00 0.00 C ATOM 1234 CE1 HIS A 98 -15.743 -1.421 11.074 1.00 0.00 C ATOM 1235 NE2 HIS A 98 -15.994 -0.814 9.911 1.00 0.00 N ATOM 0 H HIS A 98 -18.742 -3.782 12.568 1.00 0.00 H new ATOM 0 HA HIS A 98 -19.844 -1.979 10.825 1.00 0.00 H new ATOM 0 HB2 HIS A 98 -18.193 -4.497 10.532 1.00 0.00 H new ATOM 0 HB3 HIS A 98 -18.797 -3.732 9.076 1.00 0.00 H new ATOM 0 HD1 HIS A 98 -16.595 -3.055 12.112 1.00 0.00 H new ATOM 0 HD2 HIS A 98 -17.540 -1.278 8.417 1.00 0.00 H new ATOM 0 HE1 HIS A 98 -14.957 -1.127 11.754 1.00 0.00 H new ATOM 1343 N THR A 105 -17.222 -12.954 2.756 1.00 0.00 N ATOM 1344 CA THR A 105 -16.982 -13.910 3.831 1.00 0.00 C ATOM 1345 C THR A 105 -15.983 -14.975 3.389 1.00 0.00 C ATOM 1346 O THR A 105 -15.863 -15.273 2.201 1.00 0.00 O ATOM 1347 CB THR A 105 -18.297 -14.583 4.235 1.00 0.00 C ATOM 1348 OG1 THR A 105 -18.813 -15.312 3.130 1.00 0.00 O ATOM 1349 CG2 THR A 105 -19.307 -13.516 4.662 1.00 0.00 C ATOM 0 HA THR A 105 -16.570 -13.371 4.684 1.00 0.00 H new ATOM 0 HB THR A 105 -18.117 -15.264 5.067 1.00 0.00 H new ATOM 0 HG1 THR A 105 -18.634 -14.820 2.301 1.00 0.00 H new ATOM 0 HG21 THR A 105 -20.243 -13.995 4.949 1.00 0.00 H new ATOM 0 HG22 THR A 105 -18.910 -12.958 5.510 1.00 0.00 H new ATOM 0 HG23 THR A 105 -19.489 -12.834 3.831 1.00 0.00 H new ATOM 1357 N THR A 106 -15.266 -15.543 4.352 1.00 0.00 N ATOM 1358 CA THR A 106 -14.275 -16.571 4.050 1.00 0.00 C ATOM 1359 C THR A 106 -14.160 -17.559 5.210 1.00 0.00 C ATOM 1360 O THR A 106 -14.666 -17.308 6.301 1.00 0.00 O ATOM 1361 CB THR A 106 -12.910 -15.923 3.791 1.00 0.00 C ATOM 1362 OG1 THR A 106 -11.962 -16.427 4.722 1.00 0.00 O ATOM 1363 CG2 THR A 106 -13.022 -14.405 3.946 1.00 0.00 C ATOM 0 H THR A 106 -15.351 -15.312 5.342 1.00 0.00 H new ATOM 0 HA THR A 106 -14.596 -17.109 3.158 1.00 0.00 H new ATOM 0 HB THR A 106 -12.585 -16.158 2.777 1.00 0.00 H new ATOM 0 HG1 THR A 106 -11.189 -16.788 4.239 1.00 0.00 H new ATOM 0 HG21 THR A 106 -12.050 -13.948 3.761 1.00 0.00 H new ATOM 0 HG22 THR A 106 -13.747 -14.019 3.230 1.00 0.00 H new ATOM 0 HG23 THR A 106 -13.349 -14.166 4.958 1.00 0.00 H new ATOM 1371 N PRO A 107 -13.506 -18.668 4.995 1.00 0.00 N ATOM 1372 CA PRO A 107 -13.332 -19.701 6.054 1.00 0.00 C ATOM 1373 C PRO A 107 -12.351 -19.255 7.136 1.00 0.00 C ATOM 1374 O PRO A 107 -12.546 -19.533 8.318 1.00 0.00 O ATOM 1375 CB PRO A 107 -12.796 -20.915 5.294 1.00 0.00 C ATOM 1376 CG PRO A 107 -12.145 -20.365 4.068 1.00 0.00 C ATOM 1377 CD PRO A 107 -12.858 -19.054 3.734 1.00 0.00 C ATOM 0 HA PRO A 107 -14.262 -19.905 6.584 1.00 0.00 H new ATOM 0 HB2 PRO A 107 -12.082 -21.473 5.900 1.00 0.00 H new ATOM 0 HB3 PRO A 107 -13.601 -21.603 5.035 1.00 0.00 H new ATOM 0 HG2 PRO A 107 -11.082 -20.193 4.239 1.00 0.00 H new ATOM 0 HG3 PRO A 107 -12.225 -21.069 3.240 1.00 0.00 H new ATOM 0 HD2 PRO A 107 -12.155 -18.292 3.398 1.00 0.00 H new ATOM 0 HD3 PRO A 107 -13.588 -19.189 2.936 1.00 0.00 H new ATOM 1385 N GLU A 108 -11.296 -18.561 6.719 1.00 0.00 N ATOM 1386 CA GLU A 108 -10.291 -18.082 7.660 1.00 0.00 C ATOM 1387 C GLU A 108 -10.876 -17.009 8.570 1.00 0.00 C ATOM 1388 O GLU A 108 -10.741 -17.076 9.792 1.00 0.00 O ATOM 1389 CB GLU A 108 -9.093 -17.511 6.899 1.00 0.00 C ATOM 1390 CG GLU A 108 -8.390 -18.632 6.130 1.00 0.00 C ATOM 1391 CD GLU A 108 -9.041 -18.815 4.763 1.00 0.00 C ATOM 1392 OE1 GLU A 108 -10.039 -18.160 4.512 1.00 0.00 O ATOM 1393 OE2 GLU A 108 -8.532 -19.607 3.988 1.00 0.00 O ATOM 0 H GLU A 108 -11.116 -18.320 5.744 1.00 0.00 H new ATOM 0 HA GLU A 108 -9.965 -18.923 8.273 1.00 0.00 H new ATOM 0 HB2 GLU A 108 -9.424 -16.735 6.209 1.00 0.00 H new ATOM 0 HB3 GLU A 108 -8.397 -17.042 7.595 1.00 0.00 H new ATOM 0 HG2 GLU A 108 -7.333 -18.394 6.010 1.00 0.00 H new ATOM 0 HG3 GLU A 108 -8.445 -19.562 6.696 1.00 0.00 H new ATOM 1400 N GLU A 109 -11.529 -16.021 7.968 1.00 0.00 N ATOM 1401 CA GLU A 109 -12.132 -14.938 8.734 1.00 0.00 C ATOM 1402 C GLU A 109 -13.234 -15.475 9.642 1.00 0.00 C ATOM 1403 O GLU A 109 -13.452 -14.962 10.740 1.00 0.00 O ATOM 1404 CB GLU A 109 -12.714 -13.886 7.787 1.00 0.00 C ATOM 1405 CG GLU A 109 -13.283 -12.723 8.601 1.00 0.00 C ATOM 1406 CD GLU A 109 -13.832 -11.652 7.665 1.00 0.00 C ATOM 1407 OE1 GLU A 109 -13.517 -11.703 6.488 1.00 0.00 O ATOM 1408 OE2 GLU A 109 -14.562 -10.797 8.139 1.00 0.00 O ATOM 0 H GLU A 109 -11.654 -15.948 6.958 1.00 0.00 H new ATOM 0 HA GLU A 109 -11.359 -14.480 9.351 1.00 0.00 H new ATOM 0 HB2 GLU A 109 -11.941 -13.525 7.109 1.00 0.00 H new ATOM 0 HB3 GLU A 109 -13.496 -14.329 7.171 1.00 0.00 H new ATOM 0 HG2 GLU A 109 -14.074 -13.082 9.260 1.00 0.00 H new ATOM 0 HG3 GLU A 109 -12.506 -12.299 9.237 1.00 0.00 H new ATOM 1415 N ASP A 110 -13.929 -16.506 9.173 1.00 0.00 N ATOM 1416 CA ASP A 110 -15.009 -17.102 9.951 1.00 0.00 C ATOM 1417 C ASP A 110 -14.457 -17.772 11.207 1.00 0.00 C ATOM 1418 O ASP A 110 -14.977 -17.579 12.304 1.00 0.00 O ATOM 1419 CB ASP A 110 -15.752 -18.137 9.104 1.00 0.00 C ATOM 1420 CG ASP A 110 -16.820 -17.450 8.256 1.00 0.00 C ATOM 1421 OD1 ASP A 110 -17.007 -16.257 8.430 1.00 0.00 O ATOM 1422 OD2 ASP A 110 -17.433 -18.125 7.446 1.00 0.00 O ATOM 0 H ASP A 110 -13.766 -16.943 8.266 1.00 0.00 H new ATOM 0 HA ASP A 110 -15.699 -16.311 10.247 1.00 0.00 H new ATOM 0 HB2 ASP A 110 -15.048 -18.664 8.460 1.00 0.00 H new ATOM 0 HB3 ASP A 110 -16.214 -18.884 9.750 1.00 0.00 H new ATOM 1427 N GLU A 111 -13.399 -18.560 11.035 1.00 0.00 N ATOM 1428 CA GLU A 111 -12.787 -19.255 12.163 1.00 0.00 C ATOM 1429 C GLU A 111 -12.332 -18.258 13.222 1.00 0.00 C ATOM 1430 O GLU A 111 -12.673 -18.389 14.398 1.00 0.00 O ATOM 1431 CB GLU A 111 -11.586 -20.071 11.681 1.00 0.00 C ATOM 1432 CG GLU A 111 -10.989 -20.844 12.858 1.00 0.00 C ATOM 1433 CD GLU A 111 -9.815 -21.693 12.384 1.00 0.00 C ATOM 1434 OE1 GLU A 111 -9.374 -21.486 11.265 1.00 0.00 O ATOM 1435 OE2 GLU A 111 -9.373 -22.538 13.146 1.00 0.00 O ATOM 0 H GLU A 111 -12.951 -18.732 10.135 1.00 0.00 H new ATOM 0 HA GLU A 111 -13.529 -19.922 12.602 1.00 0.00 H new ATOM 0 HB2 GLU A 111 -11.894 -20.763 10.897 1.00 0.00 H new ATOM 0 HB3 GLU A 111 -10.835 -19.411 11.247 1.00 0.00 H new ATOM 0 HG2 GLU A 111 -10.657 -20.149 13.629 1.00 0.00 H new ATOM 0 HG3 GLU A 111 -11.750 -21.481 13.309 1.00 0.00 H new ATOM 1442 N LEU A 112 -11.567 -17.257 12.798 1.00 0.00 N ATOM 1443 CA LEU A 112 -11.071 -16.246 13.725 1.00 0.00 C ATOM 1444 C LEU A 112 -12.224 -15.637 14.515 1.00 0.00 C ATOM 1445 O LEU A 112 -12.123 -15.450 15.729 1.00 0.00 O ATOM 1446 CB LEU A 112 -10.347 -15.140 12.947 1.00 0.00 C ATOM 1447 CG LEU A 112 -9.857 -14.068 13.922 1.00 0.00 C ATOM 1448 CD1 LEU A 112 -8.934 -14.706 14.963 1.00 0.00 C ATOM 1449 CD2 LEU A 112 -9.088 -12.993 13.151 1.00 0.00 C ATOM 0 H LEU A 112 -11.279 -17.125 11.828 1.00 0.00 H new ATOM 0 HA LEU A 112 -10.377 -16.721 14.419 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -9.504 -15.559 12.397 1.00 0.00 H new ATOM 0 HB3 LEU A 112 -11.019 -14.698 12.212 1.00 0.00 H new ATOM 0 HG LEU A 112 -10.712 -13.616 14.424 1.00 0.00 H new ATOM 0 HD11 LEU A 112 -8.585 -13.942 15.657 1.00 0.00 H new ATOM 0 HD12 LEU A 112 -9.480 -15.473 15.512 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -8.078 -15.159 14.462 1.00 0.00 H new ATOM 0 HD21 LEU A 112 -8.738 -12.228 13.844 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -8.233 -13.446 12.649 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -9.744 -12.538 12.409 1.00 0.00 H new ATOM 1461 N ASP A 113 -13.316 -15.331 13.824 1.00 0.00 N ATOM 1462 CA ASP A 113 -14.481 -14.747 14.479 1.00 0.00 C ATOM 1463 C ASP A 113 -15.008 -15.676 15.566 1.00 0.00 C ATOM 1464 O ASP A 113 -15.323 -15.237 16.672 1.00 0.00 O ATOM 1465 CB ASP A 113 -15.583 -14.490 13.447 1.00 0.00 C ATOM 1466 CG ASP A 113 -15.359 -13.142 12.764 1.00 0.00 C ATOM 1467 OD1 ASP A 113 -14.453 -12.437 13.176 1.00 0.00 O ATOM 1468 OD2 ASP A 113 -16.095 -12.835 11.841 1.00 0.00 O ATOM 0 H ASP A 113 -13.419 -15.476 12.820 1.00 0.00 H new ATOM 0 HA ASP A 113 -14.183 -13.804 14.938 1.00 0.00 H new ATOM 0 HB2 ASP A 113 -15.588 -15.287 12.703 1.00 0.00 H new ATOM 0 HB3 ASP A 113 -16.558 -14.502 13.934 1.00 0.00 H new ATOM 1473 N GLN A 114 -15.099 -16.963 15.245 1.00 0.00 N ATOM 1474 CA GLN A 114 -15.589 -17.946 16.207 1.00 0.00 C ATOM 1475 C GLN A 114 -14.671 -18.010 17.421 1.00 0.00 C ATOM 1476 O GLN A 114 -15.134 -17.996 18.563 1.00 0.00 O ATOM 1477 CB GLN A 114 -15.665 -19.325 15.549 1.00 0.00 C ATOM 1478 CG GLN A 114 -16.723 -19.309 14.444 1.00 0.00 C ATOM 1479 CD GLN A 114 -18.101 -19.053 15.046 1.00 0.00 C ATOM 1480 OE1 GLN A 114 -18.518 -19.757 15.965 1.00 0.00 O ATOM 1481 NE2 GLN A 114 -18.836 -18.081 14.580 1.00 0.00 N ATOM 0 H GLN A 114 -14.843 -17.348 14.336 1.00 0.00 H new ATOM 0 HA GLN A 114 -16.584 -17.644 16.534 1.00 0.00 H new ATOM 0 HB2 GLN A 114 -14.694 -19.595 15.133 1.00 0.00 H new ATOM 0 HB3 GLN A 114 -15.914 -20.081 16.294 1.00 0.00 H new ATOM 0 HG2 GLN A 114 -16.486 -18.535 13.714 1.00 0.00 H new ATOM 0 HG3 GLN A 114 -16.720 -20.261 13.912 1.00 0.00 H new ATOM 0 HE21 GLN A 114 -18.488 -17.499 13.818 1.00 0.00 H new ATOM 0 HE22 GLN A 114 -19.758 -17.903 14.978 1.00 0.00 H new ATOM 1490 N LEU A 115 -13.368 -18.077 17.171 1.00 0.00 N ATOM 1491 CA LEU A 115 -12.395 -18.148 18.255 1.00 0.00 C ATOM 1492 C LEU A 115 -12.527 -16.931 19.166 1.00 0.00 C ATOM 1493 O LEU A 115 -12.476 -17.054 20.390 1.00 0.00 O ATOM 1494 CB LEU A 115 -10.978 -18.197 17.677 1.00 0.00 C ATOM 1495 CG LEU A 115 -10.781 -19.513 16.923 1.00 0.00 C ATOM 1496 CD1 LEU A 115 -9.496 -19.441 16.097 1.00 0.00 C ATOM 1497 CD2 LEU A 115 -10.679 -20.667 17.923 1.00 0.00 C ATOM 0 H LEU A 115 -12.963 -18.084 16.235 1.00 0.00 H new ATOM 0 HA LEU A 115 -12.585 -19.051 18.836 1.00 0.00 H new ATOM 0 HB2 LEU A 115 -10.818 -17.353 17.006 1.00 0.00 H new ATOM 0 HB3 LEU A 115 -10.244 -18.111 18.478 1.00 0.00 H new ATOM 0 HG LEU A 115 -11.631 -19.681 16.261 1.00 0.00 H new ATOM 0 HD11 LEU A 115 -9.356 -20.379 15.560 1.00 0.00 H new ATOM 0 HD12 LEU A 115 -9.568 -18.621 15.383 1.00 0.00 H new ATOM 0 HD13 LEU A 115 -8.647 -19.272 16.759 1.00 0.00 H new ATOM 0 HD21 LEU A 115 -10.539 -21.604 17.384 1.00 0.00 H new ATOM 0 HD22 LEU A 115 -9.831 -20.499 18.587 1.00 0.00 H new ATOM 0 HD23 LEU A 115 -11.595 -20.721 18.511 1.00 0.00 H new ATOM 1509 N CYS A 116 -12.702 -15.759 18.564 1.00 0.00 N ATOM 1510 CA CYS A 116 -12.847 -14.530 19.335 1.00 0.00 C ATOM 1511 C CYS A 116 -14.103 -14.583 20.198 1.00 0.00 C ATOM 1512 O CYS A 116 -14.091 -14.158 21.354 1.00 0.00 O ATOM 1513 CB CYS A 116 -12.925 -13.328 18.390 1.00 0.00 C ATOM 1514 SG CYS A 116 -11.259 -12.886 17.838 1.00 0.00 S ATOM 0 H CYS A 116 -12.747 -15.635 17.553 1.00 0.00 H new ATOM 0 HA CYS A 116 -11.978 -14.426 19.985 1.00 0.00 H new ATOM 0 HB2 CYS A 116 -13.553 -13.567 17.532 1.00 0.00 H new ATOM 0 HB3 CYS A 116 -13.388 -12.482 18.898 1.00 0.00 H new ATOM 0 HG CYS A 116 -11.336 -12.182 16.748 1.00 0.00 H new ATOM 1520 N ASP A 117 -15.184 -15.108 19.630 1.00 0.00 N ATOM 1521 CA ASP A 117 -16.443 -15.211 20.361 1.00 0.00 C ATOM 1522 C ASP A 117 -16.276 -16.096 21.591 1.00 0.00 C ATOM 1523 O ASP A 117 -16.728 -15.750 22.683 1.00 0.00 O ATOM 1524 CB ASP A 117 -17.526 -15.796 19.451 1.00 0.00 C ATOM 1525 CG ASP A 117 -18.891 -15.667 20.117 1.00 0.00 C ATOM 1526 OD1 ASP A 117 -19.310 -14.546 20.355 1.00 0.00 O ATOM 1527 OD2 ASP A 117 -19.499 -16.692 20.381 1.00 0.00 O ATOM 0 H ASP A 117 -15.215 -15.466 18.675 1.00 0.00 H new ATOM 0 HA ASP A 117 -16.739 -14.213 20.684 1.00 0.00 H new ATOM 0 HB2 ASP A 117 -17.529 -15.275 18.493 1.00 0.00 H new ATOM 0 HB3 ASP A 117 -17.311 -16.844 19.243 1.00 0.00 H new ATOM 1532 N GLU A 118 -15.623 -17.240 21.407 1.00 0.00 N ATOM 1533 CA GLU A 118 -15.405 -18.167 22.511 1.00 0.00 C ATOM 1534 C GLU A 118 -14.553 -17.517 23.595 1.00 0.00 C ATOM 1535 O GLU A 118 -14.868 -17.605 24.781 1.00 0.00 O ATOM 1536 CB GLU A 118 -14.708 -19.431 21.999 1.00 0.00 C ATOM 1537 CG GLU A 118 -14.719 -20.499 23.095 1.00 0.00 C ATOM 1538 CD GLU A 118 -14.264 -21.836 22.524 1.00 0.00 C ATOM 1539 OE1 GLU A 118 -14.240 -21.961 21.311 1.00 0.00 O ATOM 1540 OE2 GLU A 118 -13.947 -22.716 23.307 1.00 0.00 O ATOM 0 H GLU A 118 -15.239 -17.545 20.512 1.00 0.00 H new ATOM 0 HA GLU A 118 -16.373 -18.432 22.937 1.00 0.00 H new ATOM 0 HB2 GLU A 118 -15.215 -19.803 21.109 1.00 0.00 H new ATOM 0 HB3 GLU A 118 -13.682 -19.202 21.710 1.00 0.00 H new ATOM 0 HG2 GLU A 118 -14.062 -20.200 23.912 1.00 0.00 H new ATOM 0 HG3 GLU A 118 -15.722 -20.594 23.511 1.00 0.00 H new ATOM 1547 N TRP A 119 -13.475 -16.859 23.179 1.00 0.00 N ATOM 1548 CA TRP A 119 -12.585 -16.193 24.122 1.00 0.00 C ATOM 1549 C TRP A 119 -13.312 -15.052 24.829 1.00 0.00 C ATOM 1550 O TRP A 119 -13.138 -14.838 26.028 1.00 0.00 O ATOM 1551 CB TRP A 119 -11.359 -15.647 23.391 1.00 0.00 C ATOM 1552 CG TRP A 119 -10.555 -14.803 24.326 1.00 0.00 C ATOM 1553 CD1 TRP A 119 -10.383 -13.466 24.214 1.00 0.00 C ATOM 1554 CD2 TRP A 119 -9.812 -15.212 25.511 1.00 0.00 C ATOM 1555 NE1 TRP A 119 -9.583 -13.028 25.254 1.00 0.00 N ATOM 1556 CE2 TRP A 119 -9.205 -14.068 26.080 1.00 0.00 C ATOM 1557 CE3 TRP A 119 -9.608 -16.454 26.141 1.00 0.00 C ATOM 1558 CZ2 TRP A 119 -8.423 -14.153 27.234 1.00 0.00 C ATOM 1559 CZ3 TRP A 119 -8.821 -16.542 27.300 1.00 0.00 C ATOM 1560 CH2 TRP A 119 -8.230 -15.393 27.845 1.00 0.00 C ATOM 0 H TRP A 119 -13.198 -16.773 22.201 1.00 0.00 H new ATOM 0 HA TRP A 119 -12.265 -16.922 24.867 1.00 0.00 H new ATOM 0 HB2 TRP A 119 -10.752 -16.470 23.013 1.00 0.00 H new ATOM 0 HB3 TRP A 119 -11.670 -15.058 22.528 1.00 0.00 H new ATOM 0 HD1 TRP A 119 -10.802 -12.842 23.439 1.00 0.00 H new ATOM 0 HE1 TRP A 119 -9.306 -12.056 25.394 1.00 0.00 H new ATOM 0 HE3 TRP A 119 -10.060 -17.345 25.730 1.00 0.00 H new ATOM 0 HZ2 TRP A 119 -7.971 -13.265 27.651 1.00 0.00 H new ATOM 0 HZ3 TRP A 119 -8.670 -17.500 27.775 1.00 0.00 H new ATOM 0 HH2 TRP A 119 -7.626 -15.468 28.737 1.00 0.00 H new ATOM 1571 N LYS A 120 -14.126 -14.321 24.074 1.00 0.00 N ATOM 1572 CA LYS A 120 -14.875 -13.203 24.635 1.00 0.00 C ATOM 1573 C LYS A 120 -15.833 -13.693 25.716 1.00 0.00 C ATOM 1574 O LYS A 120 -16.039 -13.021 26.728 1.00 0.00 O ATOM 1575 CB LYS A 120 -15.663 -12.495 23.533 1.00 0.00 C ATOM 1576 CG LYS A 120 -16.344 -11.252 24.109 1.00 0.00 C ATOM 1577 CD LYS A 120 -17.086 -10.513 22.993 1.00 0.00 C ATOM 1578 CE LYS A 120 -17.754 -9.261 23.566 1.00 0.00 C ATOM 1579 NZ LYS A 120 -18.461 -8.533 22.476 1.00 0.00 N ATOM 0 H LYS A 120 -14.283 -14.481 23.079 1.00 0.00 H new ATOM 0 HA LYS A 120 -14.169 -12.502 25.080 1.00 0.00 H new ATOM 0 HB2 LYS A 120 -14.996 -12.212 22.719 1.00 0.00 H new ATOM 0 HB3 LYS A 120 -16.409 -13.170 23.114 1.00 0.00 H new ATOM 0 HG2 LYS A 120 -17.041 -11.538 24.896 1.00 0.00 H new ATOM 0 HG3 LYS A 120 -15.602 -10.596 24.564 1.00 0.00 H new ATOM 0 HD2 LYS A 120 -16.391 -10.237 22.200 1.00 0.00 H new ATOM 0 HD3 LYS A 120 -17.836 -11.166 22.546 1.00 0.00 H new ATOM 0 HE2 LYS A 120 -18.459 -9.538 24.350 1.00 0.00 H new ATOM 0 HE3 LYS A 120 -17.006 -8.614 24.024 1.00 0.00 H new ATOM 0 HZ1 LYS A 120 -18.770 -7.603 22.823 1.00 0.00 H new ATOM 0 HZ2 LYS A 120 -17.817 -8.405 21.669 1.00 0.00 H new ATOM 0 HZ3 LYS A 120 -19.291 -9.082 22.173 1.00 0.00 H new ATOM 1593 N ALA A 121 -16.419 -14.865 25.493 1.00 0.00 N ATOM 1594 CA ALA A 121 -17.355 -15.434 26.457 1.00 0.00 C ATOM 1595 C ALA A 121 -16.642 -15.768 27.763 1.00 0.00 C ATOM 1596 O ALA A 121 -17.150 -15.485 28.848 1.00 0.00 O ATOM 1597 CB ALA A 121 -17.989 -16.702 25.881 1.00 0.00 C ATOM 0 H ALA A 121 -16.265 -15.435 24.661 1.00 0.00 H new ATOM 0 HA ALA A 121 -18.133 -14.698 26.659 1.00 0.00 H new ATOM 0 HB1 ALA A 121 -18.687 -17.122 26.606 1.00 0.00 H new ATOM 0 HB2 ALA A 121 -18.523 -16.457 24.963 1.00 0.00 H new ATOM 0 HB3 ALA A 121 -17.209 -17.432 25.663 1.00 0.00 H new ATOM 1603 N ARG A 122 -15.464 -16.370 27.650 1.00 0.00 N ATOM 1604 CA ARG A 122 -14.692 -16.738 28.828 1.00 0.00 C ATOM 1605 C ARG A 122 -14.359 -15.499 29.657 1.00 0.00 C ATOM 1606 O ARG A 122 -14.452 -15.520 30.886 1.00 0.00 O ATOM 1607 CB ARG A 122 -13.397 -17.432 28.408 1.00 0.00 C ATOM 1608 CG ARG A 122 -12.632 -17.896 29.655 1.00 0.00 C ATOM 1609 CD ARG A 122 -11.153 -17.522 29.525 1.00 0.00 C ATOM 1610 NE ARG A 122 -10.903 -16.236 30.165 1.00 0.00 N ATOM 1611 CZ ARG A 122 -9.706 -15.939 30.661 1.00 0.00 C ATOM 1612 NH1 ARG A 122 -9.505 -14.784 31.233 1.00 0.00 N ATOM 1613 NH2 ARG A 122 -8.733 -16.803 30.575 1.00 0.00 N ATOM 0 H ARG A 122 -15.026 -16.612 26.761 1.00 0.00 H new ATOM 0 HA ARG A 122 -15.290 -17.419 29.433 1.00 0.00 H new ATOM 0 HB2 ARG A 122 -13.621 -18.286 27.768 1.00 0.00 H new ATOM 0 HB3 ARG A 122 -12.780 -16.749 27.824 1.00 0.00 H new ATOM 0 HG2 ARG A 122 -13.056 -17.434 30.546 1.00 0.00 H new ATOM 0 HG3 ARG A 122 -12.735 -18.974 29.776 1.00 0.00 H new ATOM 0 HD2 ARG A 122 -10.533 -18.292 29.984 1.00 0.00 H new ATOM 0 HD3 ARG A 122 -10.873 -17.474 28.473 1.00 0.00 H new ATOM 0 HE ARG A 122 -11.658 -15.554 30.233 1.00 0.00 H new ATOM 0 HH11 ARG A 122 -10.266 -14.109 31.300 1.00 0.00 H new ATOM 0 HH12 ARG A 122 -8.586 -14.556 31.614 1.00 0.00 H new ATOM 0 HH21 ARG A 122 -8.891 -17.706 30.127 1.00 0.00 H new ATOM 0 HH22 ARG A 122 -7.814 -16.576 30.955 1.00 0.00 H new ATOM 1627 N LEU A 123 -13.971 -14.426 28.980 1.00 0.00 N ATOM 1628 CA LEU A 123 -13.629 -13.186 29.663 1.00 0.00 C ATOM 1629 C LEU A 123 -14.841 -12.634 30.406 1.00 0.00 C ATOM 1630 O LEU A 123 -14.719 -12.122 31.517 1.00 0.00 O ATOM 1631 CB LEU A 123 -13.134 -12.151 28.652 1.00 0.00 C ATOM 1632 CG LEU A 123 -11.771 -12.584 28.105 1.00 0.00 C ATOM 1633 CD1 LEU A 123 -11.366 -11.662 26.952 1.00 0.00 C ATOM 1634 CD2 LEU A 123 -10.724 -12.497 29.219 1.00 0.00 C ATOM 0 H LEU A 123 -13.886 -14.389 27.964 1.00 0.00 H new ATOM 0 HA LEU A 123 -12.838 -13.396 30.383 1.00 0.00 H new ATOM 0 HB2 LEU A 123 -13.850 -12.052 27.836 1.00 0.00 H new ATOM 0 HB3 LEU A 123 -13.054 -11.173 29.126 1.00 0.00 H new ATOM 0 HG LEU A 123 -11.834 -13.610 27.744 1.00 0.00 H new ATOM 0 HD11 LEU A 123 -10.396 -11.971 26.563 1.00 0.00 H new ATOM 0 HD12 LEU A 123 -12.111 -11.723 26.159 1.00 0.00 H new ATOM 0 HD13 LEU A 123 -11.303 -10.635 27.312 1.00 0.00 H new ATOM 0 HD21 LEU A 123 -9.753 -12.805 28.831 1.00 0.00 H new ATOM 0 HD22 LEU A 123 -10.661 -11.470 29.580 1.00 0.00 H new ATOM 0 HD23 LEU A 123 -11.011 -13.154 30.040 1.00 0.00 H new ATOM 1646 N SER A 124 -16.009 -12.739 29.782 1.00 0.00 N ATOM 1647 CA SER A 124 -17.240 -12.249 30.391 1.00 0.00 C ATOM 1648 C SER A 124 -17.615 -13.102 31.600 1.00 0.00 C ATOM 1649 O SER A 124 -18.063 -12.585 32.623 1.00 0.00 O ATOM 1650 CB SER A 124 -18.376 -12.274 29.372 1.00 0.00 C ATOM 1651 OG SER A 124 -19.556 -11.752 29.971 1.00 0.00 O ATOM 0 H SER A 124 -16.129 -13.157 28.859 1.00 0.00 H new ATOM 0 HA SER A 124 -17.076 -11.223 30.721 1.00 0.00 H new ATOM 0 HB2 SER A 124 -18.107 -11.684 28.496 1.00 0.00 H new ATOM 0 HB3 SER A 124 -18.549 -13.294 29.028 1.00 0.00 H new ATOM 0 HG SER A 124 -20.287 -11.765 29.319 1.00 0.00 H new ATOM 1657 N GLU A 125 -17.432 -14.412 31.472 1.00 0.00 N ATOM 1658 CA GLU A 125 -17.758 -15.329 32.557 1.00 0.00 C ATOM 1659 C GLU A 125 -16.944 -14.993 33.803 1.00 0.00 C ATOM 1660 O GLU A 125 -17.463 -15.013 34.919 1.00 0.00 O ATOM 1661 CB GLU A 125 -17.467 -16.770 32.130 1.00 0.00 C ATOM 1662 CG GLU A 125 -17.851 -17.726 33.261 1.00 0.00 C ATOM 1663 CD GLU A 125 -17.588 -19.167 32.837 1.00 0.00 C ATOM 1664 OE1 GLU A 125 -16.511 -19.425 32.322 1.00 0.00 O ATOM 1665 OE2 GLU A 125 -18.465 -19.991 33.034 1.00 0.00 O ATOM 0 H GLU A 125 -17.062 -14.860 30.634 1.00 0.00 H new ATOM 0 HA GLU A 125 -18.818 -15.226 32.788 1.00 0.00 H new ATOM 0 HB2 GLU A 125 -18.028 -17.013 31.228 1.00 0.00 H new ATOM 0 HB3 GLU A 125 -16.410 -16.882 31.888 1.00 0.00 H new ATOM 0 HG2 GLU A 125 -17.277 -17.491 34.157 1.00 0.00 H new ATOM 0 HG3 GLU A 125 -18.904 -17.599 33.514 1.00 0.00 H new ATOM 1672 N LEU A 126 -15.668 -14.684 33.604 1.00 0.00 N ATOM 1673 CA LEU A 126 -14.789 -14.339 34.716 1.00 0.00 C ATOM 1674 C LEU A 126 -15.202 -13.006 35.332 1.00 0.00 C ATOM 1675 O LEU A 126 -15.089 -12.807 36.541 1.00 0.00 O ATOM 1676 CB LEU A 126 -13.341 -14.261 34.236 1.00 0.00 C ATOM 1677 CG LEU A 126 -12.862 -15.657 33.833 1.00 0.00 C ATOM 1678 CD1 LEU A 126 -11.498 -15.549 33.148 1.00 0.00 C ATOM 1679 CD2 LEU A 126 -12.737 -16.536 35.080 1.00 0.00 C ATOM 0 H LEU A 126 -15.220 -14.665 32.688 1.00 0.00 H new ATOM 0 HA LEU A 126 -14.873 -15.116 35.475 1.00 0.00 H new ATOM 0 HB2 LEU A 126 -13.264 -13.580 33.389 1.00 0.00 H new ATOM 0 HB3 LEU A 126 -12.706 -13.861 35.026 1.00 0.00 H new ATOM 0 HG LEU A 126 -13.581 -16.103 33.146 1.00 0.00 H new ATOM 0 HD11 LEU A 126 -11.156 -16.543 32.860 1.00 0.00 H new ATOM 0 HD12 LEU A 126 -11.586 -14.924 32.259 1.00 0.00 H new ATOM 0 HD13 LEU A 126 -10.780 -15.103 33.836 1.00 0.00 H new ATOM 0 HD21 LEU A 126 -12.396 -17.530 34.792 1.00 0.00 H new ATOM 0 HD22 LEU A 126 -12.018 -16.091 35.768 1.00 0.00 H new ATOM 0 HD23 LEU A 126 -13.708 -16.613 35.569 1.00 0.00 H new ATOM 1691 N GLN A 127 -15.674 -12.094 34.488 1.00 0.00 N ATOM 1692 CA GLN A 127 -16.099 -10.780 34.958 1.00 0.00 C ATOM 1693 C GLN A 127 -17.328 -10.900 35.852 1.00 0.00 C ATOM 1694 O GLN A 127 -17.418 -10.246 36.891 1.00 0.00 O ATOM 1695 CB GLN A 127 -16.418 -9.876 33.767 1.00 0.00 C ATOM 1696 CG GLN A 127 -15.116 -9.431 33.098 1.00 0.00 C ATOM 1697 CD GLN A 127 -15.425 -8.626 31.840 1.00 0.00 C ATOM 1698 OE1 GLN A 127 -16.590 -8.368 31.537 1.00 0.00 O ATOM 1699 NE2 GLN A 127 -14.444 -8.214 31.084 1.00 0.00 N ATOM 0 H GLN A 127 -15.771 -12.239 33.483 1.00 0.00 H new ATOM 0 HA GLN A 127 -15.285 -10.343 35.537 1.00 0.00 H new ATOM 0 HB2 GLN A 127 -17.043 -10.408 33.050 1.00 0.00 H new ATOM 0 HB3 GLN A 127 -16.984 -9.006 34.099 1.00 0.00 H new ATOM 0 HG2 GLN A 127 -14.529 -8.828 33.791 1.00 0.00 H new ATOM 0 HG3 GLN A 127 -14.512 -10.302 32.843 1.00 0.00 H new ATOM 0 HE21 GLN A 127 -13.480 -8.429 31.337 1.00 0.00 H new ATOM 0 HE22 GLN A 127 -14.642 -7.677 30.240 1.00 0.00 H new ATOM 1708 N GLN A 128 -18.270 -11.744 35.443 1.00 0.00 N ATOM 1709 CA GLN A 128 -19.493 -11.944 36.214 1.00 0.00 C ATOM 1710 C GLN A 128 -19.160 -12.395 37.633 1.00 0.00 C ATOM 1711 O GLN A 128 -19.822 -12.000 38.592 1.00 0.00 O ATOM 1712 CB GLN A 128 -20.376 -12.989 35.535 1.00 0.00 C ATOM 1713 CG GLN A 128 -20.918 -12.424 34.220 1.00 0.00 C ATOM 1714 CD GLN A 128 -21.743 -13.484 33.498 1.00 0.00 C ATOM 1715 OE1 GLN A 128 -21.948 -14.578 34.026 1.00 0.00 O ATOM 1716 NE2 GLN A 128 -22.230 -13.226 32.316 1.00 0.00 N ATOM 0 H GLN A 128 -18.212 -12.297 34.588 1.00 0.00 H new ATOM 0 HA GLN A 128 -20.030 -10.997 36.262 1.00 0.00 H new ATOM 0 HB2 GLN A 128 -19.803 -13.896 35.344 1.00 0.00 H new ATOM 0 HB3 GLN A 128 -21.201 -13.265 36.192 1.00 0.00 H new ATOM 0 HG2 GLN A 128 -21.532 -11.546 34.418 1.00 0.00 H new ATOM 0 HG3 GLN A 128 -20.093 -12.100 33.586 1.00 0.00 H new ATOM 0 HE21 GLN A 128 -22.059 -12.320 31.881 1.00 0.00 H new ATOM 0 HE22 GLN A 128 -22.782 -13.931 31.827 1.00 0.00 H new ATOM 1725 N TYR A 129 -18.129 -13.225 37.757 1.00 0.00 N ATOM 1726 CA TYR A 129 -17.708 -13.716 39.063 1.00 0.00 C ATOM 1727 C TYR A 129 -17.175 -12.569 39.919 1.00 0.00 C ATOM 1728 O TYR A 129 -17.404 -12.525 41.127 1.00 0.00 O ATOM 1729 CB TYR A 129 -16.624 -14.781 38.900 1.00 0.00 C ATOM 1730 CG TYR A 129 -17.268 -16.120 38.632 1.00 0.00 C ATOM 1731 CD1 TYR A 129 -17.113 -16.736 37.385 1.00 0.00 C ATOM 1732 CD2 TYR A 129 -18.021 -16.745 39.633 1.00 0.00 C ATOM 1733 CE1 TYR A 129 -17.712 -17.977 37.138 1.00 0.00 C ATOM 1734 CE2 TYR A 129 -18.620 -17.986 39.386 1.00 0.00 C ATOM 1735 CZ TYR A 129 -18.465 -18.603 38.139 1.00 0.00 C ATOM 1736 OH TYR A 129 -19.055 -19.826 37.896 1.00 0.00 O ATOM 0 H TYR A 129 -17.573 -13.569 36.974 1.00 0.00 H new ATOM 0 HA TYR A 129 -18.573 -14.156 39.560 1.00 0.00 H new ATOM 0 HB2 TYR A 129 -15.959 -14.515 38.079 1.00 0.00 H new ATOM 0 HB3 TYR A 129 -16.013 -14.834 39.801 1.00 0.00 H new ATOM 0 HD1 TYR A 129 -16.531 -16.254 36.613 1.00 0.00 H new ATOM 0 HD2 TYR A 129 -18.140 -16.270 40.596 1.00 0.00 H new ATOM 0 HE1 TYR A 129 -17.593 -18.452 36.175 1.00 0.00 H new ATOM 0 HE2 TYR A 129 -19.202 -18.468 40.158 1.00 0.00 H new ATOM 0 HH TYR A 129 -19.539 -20.120 38.696 1.00 0.00 H new ATOM 1746 N ARG A 130 -16.462 -11.646 39.284 1.00 0.00 N ATOM 1747 CA ARG A 130 -15.901 -10.504 39.995 1.00 0.00 C ATOM 1748 C ARG A 130 -17.010 -9.674 40.634 1.00 0.00 C ATOM 1749 O ARG A 130 -16.888 -9.228 41.775 1.00 0.00 O ATOM 1750 CB ARG A 130 -15.098 -9.629 39.031 1.00 0.00 C ATOM 1751 CG ARG A 130 -14.450 -8.478 39.803 1.00 0.00 C ATOM 1752 CD ARG A 130 -13.670 -7.589 38.834 1.00 0.00 C ATOM 1753 NE ARG A 130 -12.917 -6.580 39.570 1.00 0.00 N ATOM 1754 CZ ARG A 130 -12.173 -5.678 38.937 1.00 0.00 C ATOM 1755 NH1 ARG A 130 -11.509 -4.785 39.618 1.00 0.00 N ATOM 1756 NH2 ARG A 130 -12.107 -5.687 37.633 1.00 0.00 N ATOM 0 H ARG A 130 -16.260 -11.665 38.284 1.00 0.00 H new ATOM 0 HA ARG A 130 -15.243 -10.877 40.779 1.00 0.00 H new ATOM 0 HB2 ARG A 130 -14.332 -10.225 38.535 1.00 0.00 H new ATOM 0 HB3 ARG A 130 -15.750 -9.236 38.251 1.00 0.00 H new ATOM 0 HG2 ARG A 130 -15.215 -7.893 40.314 1.00 0.00 H new ATOM 0 HG3 ARG A 130 -13.783 -8.871 40.570 1.00 0.00 H new ATOM 0 HD2 ARG A 130 -12.990 -8.198 38.238 1.00 0.00 H new ATOM 0 HD3 ARG A 130 -14.357 -7.106 38.139 1.00 0.00 H new ATOM 0 HE ARG A 130 -12.962 -6.566 40.589 1.00 0.00 H new ATOM 0 HH11 ARG A 130 -11.560 -4.779 40.637 1.00 0.00 H new ATOM 0 HH12 ARG A 130 -10.938 -4.093 39.132 1.00 0.00 H new ATOM 0 HH21 ARG A 130 -12.626 -6.386 37.101 1.00 0.00 H new ATOM 0 HH22 ARG A 130 -11.537 -4.995 37.146 1.00 0.00 H new ATOM 1770 N GLU A 131 -18.092 -9.469 39.889 1.00 0.00 N ATOM 1771 CA GLU A 131 -19.216 -8.688 40.393 1.00 0.00 C ATOM 1772 C GLU A 131 -19.833 -9.361 41.614 1.00 0.00 C ATOM 1773 O GLU A 131 -20.286 -8.691 42.541 1.00 0.00 O ATOM 1774 CB GLU A 131 -20.278 -8.538 39.300 1.00 0.00 C ATOM 1775 CG GLU A 131 -19.732 -7.658 38.174 1.00 0.00 C ATOM 1776 CD GLU A 131 -20.747 -7.573 37.040 1.00 0.00 C ATOM 1777 OE1 GLU A 131 -21.806 -8.163 37.175 1.00 0.00 O ATOM 1778 OE2 GLU A 131 -20.451 -6.918 36.054 1.00 0.00 O ATOM 0 H GLU A 131 -18.214 -9.829 38.943 1.00 0.00 H new ATOM 0 HA GLU A 131 -18.849 -7.703 40.683 1.00 0.00 H new ATOM 0 HB2 GLU A 131 -20.553 -9.518 38.909 1.00 0.00 H new ATOM 0 HB3 GLU A 131 -21.183 -8.095 39.716 1.00 0.00 H new ATOM 0 HG2 GLU A 131 -19.515 -6.660 38.554 1.00 0.00 H new ATOM 0 HG3 GLU A 131 -18.793 -8.069 37.803 1.00 0.00 H new