USER MOD reduce.3.24.130724 H: found=0, std=0, add=957, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 954 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 79 CYS SG : rot 10:sc= -0.0495 USER MOD Set 1.2: A 88 MET CE :methyl -135:sc= -1.16 (180deg=-0.631) USER MOD Set 2.1: A 67 THR OG1 : rot -64:sc= 1.41 USER MOD Set 2.2: A 113 TYR OH : rot 180:sc= 0 USER MOD Single : A 12 SER OG : rot 180:sc= 0 USER MOD Single : A 13 GLN : amide:sc= -0.071 X(o=-0.071,f=-0.4) USER MOD Single : A 22 LYS NZ :NH3+ 175:sc= 0.4 (180deg=0.364) USER MOD Single : A 25 GLN : amide:sc= 0.588 K(o=0.59,f=-0.27) USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 GLN : amide:sc= -0.224 X(o=-0.22,f=-0.074) USER MOD Single : A 56 ASN : amide:sc= -0.063 X(o=-0.063,f=-0.25) USER MOD Single : A 60 SER OG : rot 180:sc= 0 USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 MET CE :methyl 158:sc= -0.186 (180deg=-0.38) USER MOD Single : A 72 CYS SG : rot 180:sc= 0 USER MOD Single : A 75 MET CE :methyl -172:sc= -0.182 (180deg=-0.356) USER MOD Single : A 78 SER OG : rot 83:sc= 1.25 USER MOD Single : A 80 GLN : amide:sc=-0.00938 X(o=-0.0094,f=0) USER MOD Single : A 81 THR OG1 : rot 180:sc= 0.118 USER MOD Single : A 84 SER OG : rot 180:sc= 0 USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 HIS : no HE2:sc= -1.84 K(o=-1.8,f=-2.4) USER MOD Single : A 104 SER OG : rot 180:sc= 0 USER MOD Single : A 106 HIS : no HD1:sc= -0.543 K(o=-0.54,f=-1.7) USER MOD Single : A 110 THR OG1 : rot 180:sc= 0.0129 USER MOD Single : A 112 THR OG1 : rot 180:sc= 0 USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 118 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 126 THR OG1 : rot 160:sc= 0 USER MOD Single : A 131 HIS : no HD1:sc= -0.41 X(o=-0.41,f=-0.14) USER MOD Single : A 132 HIS : no HE2:sc= -0.459 K(o=-0.46,f=-3.5!) USER MOD Single : A 134 HIS : no HE2:sc= 0.388 K(o=0.39,f=-1.6) USER MOD ----------------------------------------------------------------- ATOM 122 N GLY A 10 21.252 -31.203 10.604 1.00 0.00 N ATOM 123 CA GLY A 10 20.383 -32.022 9.769 1.00 0.00 C ATOM 124 C GLY A 10 18.944 -31.528 9.871 1.00 0.00 C ATOM 125 O GLY A 10 18.200 -31.588 8.891 1.00 0.00 O ATOM 0 HA2 GLY A 10 20.717 -31.981 8.732 1.00 0.00 H new ATOM 0 HA3 GLY A 10 20.441 -33.064 10.082 1.00 0.00 H new ATOM 129 N VAL A 11 18.572 -31.008 11.041 1.00 0.00 N ATOM 130 CA VAL A 11 17.271 -30.450 11.372 1.00 0.00 C ATOM 131 C VAL A 11 17.530 -28.980 11.722 1.00 0.00 C ATOM 132 O VAL A 11 18.600 -28.655 12.256 1.00 0.00 O ATOM 133 CB VAL A 11 16.621 -31.303 12.487 1.00 0.00 C ATOM 134 CG1 VAL A 11 17.428 -31.340 13.797 1.00 0.00 C ATOM 135 CG2 VAL A 11 15.185 -30.868 12.783 1.00 0.00 C ATOM 0 H VAL A 11 19.217 -30.965 11.830 1.00 0.00 H new ATOM 0 HA VAL A 11 16.545 -30.477 10.559 1.00 0.00 H new ATOM 0 HB VAL A 11 16.614 -32.315 12.083 1.00 0.00 H new ATOM 0 HG11 VAL A 11 16.907 -31.958 14.528 1.00 0.00 H new ATOM 0 HG12 VAL A 11 18.415 -31.761 13.605 1.00 0.00 H new ATOM 0 HG13 VAL A 11 17.535 -30.328 14.187 1.00 0.00 H new ATOM 0 HG21 VAL A 11 14.770 -31.495 13.572 1.00 0.00 H new ATOM 0 HG22 VAL A 11 15.179 -29.827 13.106 1.00 0.00 H new ATOM 0 HG23 VAL A 11 14.580 -30.971 11.882 1.00 0.00 H new ATOM 145 N SER A 12 16.586 -28.092 11.420 1.00 0.00 N ATOM 146 CA SER A 12 16.672 -26.660 11.659 1.00 0.00 C ATOM 147 C SER A 12 15.726 -26.246 12.787 1.00 0.00 C ATOM 148 O SER A 12 14.794 -25.476 12.576 1.00 0.00 O ATOM 149 CB SER A 12 16.405 -25.936 10.332 1.00 0.00 C ATOM 150 OG SER A 12 17.539 -26.072 9.500 1.00 0.00 O ATOM 0 H SER A 12 15.705 -28.365 10.984 1.00 0.00 H new ATOM 0 HA SER A 12 17.668 -26.377 12.000 1.00 0.00 H new ATOM 0 HB2 SER A 12 15.526 -26.357 9.843 1.00 0.00 H new ATOM 0 HB3 SER A 12 16.195 -24.882 10.513 1.00 0.00 H new ATOM 0 HG SER A 12 17.377 -25.614 8.649 1.00 0.00 H new ATOM 156 N GLN A 13 15.975 -26.778 13.983 1.00 0.00 N ATOM 157 CA GLN A 13 15.211 -26.516 15.190 1.00 0.00 C ATOM 158 C GLN A 13 15.535 -25.092 15.663 1.00 0.00 C ATOM 159 O GLN A 13 14.734 -24.175 15.496 1.00 0.00 O ATOM 160 CB GLN A 13 15.592 -27.606 16.215 1.00 0.00 C ATOM 161 CG GLN A 13 14.702 -27.625 17.461 1.00 0.00 C ATOM 162 CD GLN A 13 13.280 -28.080 17.150 1.00 0.00 C ATOM 163 OE1 GLN A 13 13.057 -29.025 16.394 1.00 0.00 O ATOM 164 NE2 GLN A 13 12.280 -27.438 17.711 1.00 0.00 N ATOM 0 H GLN A 13 16.746 -27.428 14.138 1.00 0.00 H new ATOM 0 HA GLN A 13 14.133 -26.561 15.036 1.00 0.00 H new ATOM 0 HB2 GLN A 13 15.542 -28.581 15.730 1.00 0.00 H new ATOM 0 HB3 GLN A 13 16.627 -27.456 16.522 1.00 0.00 H new ATOM 0 HG2 GLN A 13 15.139 -28.289 18.207 1.00 0.00 H new ATOM 0 HG3 GLN A 13 14.674 -26.628 17.900 1.00 0.00 H new ATOM 0 HE21 GLN A 13 12.464 -26.655 18.338 1.00 0.00 H new ATOM 0 HE22 GLN A 13 11.320 -27.723 17.520 1.00 0.00 H new ATOM 173 N ALA A 14 16.749 -24.882 16.184 1.00 0.00 N ATOM 174 CA ALA A 14 17.199 -23.576 16.665 1.00 0.00 C ATOM 175 C ALA A 14 17.462 -22.628 15.490 1.00 0.00 C ATOM 176 O ALA A 14 17.454 -21.410 15.654 1.00 0.00 O ATOM 177 CB ALA A 14 18.459 -23.765 17.516 1.00 0.00 C ATOM 0 H ALA A 14 17.448 -25.618 16.283 1.00 0.00 H new ATOM 0 HA ALA A 14 16.419 -23.124 17.279 1.00 0.00 H new ATOM 0 HB1 ALA A 14 18.802 -22.796 17.879 1.00 0.00 H new ATOM 0 HB2 ALA A 14 18.232 -24.411 18.364 1.00 0.00 H new ATOM 0 HB3 ALA A 14 19.241 -24.223 16.911 1.00 0.00 H new ATOM 183 N LEU A 15 17.690 -23.166 14.287 1.00 0.00 N ATOM 184 CA LEU A 15 17.941 -22.383 13.078 1.00 0.00 C ATOM 185 C LEU A 15 16.737 -21.492 12.759 1.00 0.00 C ATOM 186 O LEU A 15 16.932 -20.392 12.239 1.00 0.00 O ATOM 187 CB LEU A 15 18.225 -23.313 11.888 1.00 0.00 C ATOM 188 CG LEU A 15 19.671 -23.800 11.680 1.00 0.00 C ATOM 189 CD1 LEU A 15 20.602 -22.650 11.282 1.00 0.00 C ATOM 190 CD2 LEU A 15 20.234 -24.544 12.895 1.00 0.00 C ATOM 0 H LEU A 15 17.705 -24.173 14.126 1.00 0.00 H new ATOM 0 HA LEU A 15 18.813 -21.753 13.254 1.00 0.00 H new ATOM 0 HB2 LEU A 15 17.588 -24.192 11.992 1.00 0.00 H new ATOM 0 HB3 LEU A 15 17.912 -22.798 10.980 1.00 0.00 H new ATOM 0 HG LEU A 15 19.627 -24.515 10.858 1.00 0.00 H new ATOM 0 HD11 LEU A 15 21.614 -23.032 11.144 1.00 0.00 H new ATOM 0 HD12 LEU A 15 20.252 -22.204 10.351 1.00 0.00 H new ATOM 0 HD13 LEU A 15 20.604 -21.895 12.068 1.00 0.00 H new ATOM 0 HD21 LEU A 15 21.256 -24.862 12.686 1.00 0.00 H new ATOM 0 HD22 LEU A 15 20.230 -23.882 13.761 1.00 0.00 H new ATOM 0 HD23 LEU A 15 19.618 -25.419 13.104 1.00 0.00 H new ATOM 202 N LEU A 16 15.516 -21.948 13.075 1.00 0.00 N ATOM 203 CA LEU A 16 14.282 -21.201 12.845 1.00 0.00 C ATOM 204 C LEU A 16 14.261 -19.924 13.672 1.00 0.00 C ATOM 205 O LEU A 16 13.660 -18.943 13.243 1.00 0.00 O ATOM 206 CB LEU A 16 13.062 -22.036 13.256 1.00 0.00 C ATOM 207 CG LEU A 16 12.594 -23.033 12.189 1.00 0.00 C ATOM 208 CD1 LEU A 16 11.744 -24.107 12.871 1.00 0.00 C ATOM 209 CD2 LEU A 16 11.770 -22.340 11.101 1.00 0.00 C ATOM 0 H LEU A 16 15.362 -22.861 13.504 1.00 0.00 H new ATOM 0 HA LEU A 16 14.243 -20.964 11.782 1.00 0.00 H new ATOM 0 HB2 LEU A 16 13.301 -22.583 14.168 1.00 0.00 H new ATOM 0 HB3 LEU A 16 12.239 -21.363 13.494 1.00 0.00 H new ATOM 0 HG LEU A 16 13.468 -23.477 11.712 1.00 0.00 H new ATOM 0 HD11 LEU A 16 11.401 -24.826 12.127 1.00 0.00 H new ATOM 0 HD12 LEU A 16 12.342 -24.620 13.624 1.00 0.00 H new ATOM 0 HD13 LEU A 16 10.882 -23.640 13.348 1.00 0.00 H new ATOM 0 HD21 LEU A 16 11.454 -23.075 10.360 1.00 0.00 H new ATOM 0 HD22 LEU A 16 10.892 -21.876 11.550 1.00 0.00 H new ATOM 0 HD23 LEU A 16 12.377 -21.575 10.617 1.00 0.00 H new ATOM 221 N GLU A 17 14.889 -19.928 14.849 1.00 0.00 N ATOM 222 CA GLU A 17 14.939 -18.765 15.723 1.00 0.00 C ATOM 223 C GLU A 17 15.834 -17.715 15.060 1.00 0.00 C ATOM 224 O GLU A 17 15.526 -16.526 15.035 1.00 0.00 O ATOM 225 CB GLU A 17 15.479 -19.167 17.112 1.00 0.00 C ATOM 226 CG GLU A 17 14.621 -20.232 17.822 1.00 0.00 C ATOM 227 CD GLU A 17 15.209 -20.655 19.175 1.00 0.00 C ATOM 228 OE1 GLU A 17 16.427 -20.941 19.232 1.00 0.00 O ATOM 229 OE2 GLU A 17 14.450 -20.719 20.175 1.00 0.00 O ATOM 0 H GLU A 17 15.377 -20.743 15.220 1.00 0.00 H new ATOM 0 HA GLU A 17 13.942 -18.351 15.871 1.00 0.00 H new ATOM 0 HB2 GLU A 17 16.495 -19.545 17.002 1.00 0.00 H new ATOM 0 HB3 GLU A 17 15.536 -18.279 17.742 1.00 0.00 H new ATOM 0 HG2 GLU A 17 13.615 -19.841 17.973 1.00 0.00 H new ATOM 0 HG3 GLU A 17 14.530 -21.108 17.179 1.00 0.00 H new ATOM 236 N ARG A 18 16.939 -18.143 14.443 1.00 0.00 N ATOM 237 CA ARG A 18 17.903 -17.256 13.779 1.00 0.00 C ATOM 238 C ARG A 18 17.333 -16.522 12.576 1.00 0.00 C ATOM 239 O ARG A 18 17.966 -15.583 12.091 1.00 0.00 O ATOM 240 CB ARG A 18 19.166 -18.020 13.394 1.00 0.00 C ATOM 241 CG ARG A 18 19.635 -18.891 14.557 1.00 0.00 C ATOM 242 CD ARG A 18 21.090 -19.290 14.384 1.00 0.00 C ATOM 243 NE ARG A 18 21.998 -18.209 14.815 1.00 0.00 N ATOM 244 CZ ARG A 18 22.193 -17.825 16.088 1.00 0.00 C ATOM 245 NH1 ARG A 18 21.631 -18.489 17.092 1.00 0.00 N ATOM 246 NH2 ARG A 18 22.949 -16.761 16.337 1.00 0.00 N ATOM 0 H ARG A 18 17.194 -19.129 14.389 1.00 0.00 H new ATOM 0 HA ARG A 18 18.154 -16.488 14.510 1.00 0.00 H new ATOM 0 HB2 ARG A 18 18.971 -18.642 12.521 1.00 0.00 H new ATOM 0 HB3 ARG A 18 19.953 -17.319 13.116 1.00 0.00 H new ATOM 0 HG2 ARG A 18 19.511 -18.349 15.495 1.00 0.00 H new ATOM 0 HG3 ARG A 18 19.014 -19.785 14.621 1.00 0.00 H new ATOM 0 HD2 ARG A 18 21.293 -20.191 14.963 1.00 0.00 H new ATOM 0 HD3 ARG A 18 21.281 -19.533 13.339 1.00 0.00 H new ATOM 0 HE ARG A 18 22.518 -17.715 14.090 1.00 0.00 H new ATOM 0 HH11 ARG A 18 21.044 -19.301 16.901 1.00 0.00 H new ATOM 0 HH12 ARG A 18 21.787 -18.187 18.054 1.00 0.00 H new ATOM 0 HH21 ARG A 18 23.374 -16.246 15.566 1.00 0.00 H new ATOM 0 HH22 ARG A 18 23.104 -16.460 17.299 1.00 0.00 H new ATOM 260 N ILE A 19 16.172 -16.935 12.081 1.00 0.00 N ATOM 261 CA ILE A 19 15.498 -16.292 10.957 1.00 0.00 C ATOM 262 C ILE A 19 15.230 -14.829 11.346 1.00 0.00 C ATOM 263 O ILE A 19 15.512 -13.935 10.552 1.00 0.00 O ATOM 264 CB ILE A 19 14.228 -17.067 10.554 1.00 0.00 C ATOM 265 CG1 ILE A 19 14.572 -18.513 10.126 1.00 0.00 C ATOM 266 CG2 ILE A 19 13.422 -16.357 9.452 1.00 0.00 C ATOM 267 CD1 ILE A 19 15.385 -18.654 8.829 1.00 0.00 C ATOM 0 H ILE A 19 15.664 -17.737 12.454 1.00 0.00 H new ATOM 0 HA ILE A 19 16.126 -16.302 10.066 1.00 0.00 H new ATOM 0 HB ILE A 19 13.595 -17.103 11.440 1.00 0.00 H new ATOM 0 HG12 ILE A 19 15.128 -18.988 10.934 1.00 0.00 H new ATOM 0 HG13 ILE A 19 13.641 -19.068 10.011 1.00 0.00 H new ATOM 0 HG21 ILE A 19 12.539 -16.948 9.209 1.00 0.00 H new ATOM 0 HG22 ILE A 19 13.114 -15.372 9.804 1.00 0.00 H new ATOM 0 HG23 ILE A 19 14.041 -16.247 8.562 1.00 0.00 H new ATOM 0 HD11 ILE A 19 15.568 -19.709 8.627 1.00 0.00 H new ATOM 0 HD12 ILE A 19 14.827 -18.217 8.001 1.00 0.00 H new ATOM 0 HD13 ILE A 19 16.338 -18.135 8.938 1.00 0.00 H new ATOM 279 N ARG A 20 14.764 -14.539 12.571 1.00 0.00 N ATOM 280 CA ARG A 20 14.526 -13.145 12.966 1.00 0.00 C ATOM 281 C ARG A 20 15.834 -12.348 12.953 1.00 0.00 C ATOM 282 O ARG A 20 15.846 -11.177 12.576 1.00 0.00 O ATOM 283 CB ARG A 20 13.785 -13.057 14.315 1.00 0.00 C ATOM 284 CG ARG A 20 14.538 -13.643 15.529 1.00 0.00 C ATOM 285 CD ARG A 20 14.870 -12.623 16.626 1.00 0.00 C ATOM 286 NE ARG A 20 13.998 -12.729 17.809 1.00 0.00 N ATOM 287 CZ ARG A 20 14.032 -11.905 18.866 1.00 0.00 C ATOM 288 NH1 ARG A 20 14.833 -10.844 18.858 1.00 0.00 N ATOM 289 NH2 ARG A 20 13.266 -12.144 19.925 1.00 0.00 N ATOM 0 H ARG A 20 14.550 -15.232 13.288 1.00 0.00 H new ATOM 0 HA ARG A 20 13.866 -12.686 12.229 1.00 0.00 H new ATOM 0 HB2 ARG A 20 13.562 -12.010 14.519 1.00 0.00 H new ATOM 0 HB3 ARG A 20 12.830 -13.573 14.219 1.00 0.00 H new ATOM 0 HG2 ARG A 20 13.936 -14.441 15.963 1.00 0.00 H new ATOM 0 HG3 ARG A 20 15.465 -14.097 15.180 1.00 0.00 H new ATOM 0 HD2 ARG A 20 15.907 -12.758 16.935 1.00 0.00 H new ATOM 0 HD3 ARG A 20 14.789 -11.618 16.213 1.00 0.00 H new ATOM 0 HE ARG A 20 13.316 -13.487 17.825 1.00 0.00 H new ATOM 0 HH11 ARG A 20 15.423 -10.656 18.047 1.00 0.00 H new ATOM 0 HH12 ARG A 20 14.858 -10.218 19.663 1.00 0.00 H new ATOM 0 HH21 ARG A 20 12.650 -12.957 19.936 1.00 0.00 H new ATOM 0 HH22 ARG A 20 13.294 -11.515 20.727 1.00 0.00 H new ATOM 303 N ALA A 21 16.953 -12.980 13.315 1.00 0.00 N ATOM 304 CA ALA A 21 18.264 -12.353 13.344 1.00 0.00 C ATOM 305 C ALA A 21 18.846 -12.117 11.943 1.00 0.00 C ATOM 306 O ALA A 21 19.881 -11.462 11.840 1.00 0.00 O ATOM 307 CB ALA A 21 19.228 -13.209 14.168 1.00 0.00 C ATOM 0 H ALA A 21 16.967 -13.959 13.600 1.00 0.00 H new ATOM 0 HA ALA A 21 18.139 -11.373 13.805 1.00 0.00 H new ATOM 0 HB1 ALA A 21 20.210 -12.735 14.187 1.00 0.00 H new ATOM 0 HB2 ALA A 21 18.851 -13.304 15.186 1.00 0.00 H new ATOM 0 HB3 ALA A 21 19.311 -14.198 13.718 1.00 0.00 H new ATOM 313 N LYS A 22 18.231 -12.623 10.864 1.00 0.00 N ATOM 314 CA LYS A 22 18.746 -12.432 9.501 1.00 0.00 C ATOM 315 C LYS A 22 18.884 -10.958 9.156 1.00 0.00 C ATOM 316 O LYS A 22 19.824 -10.582 8.463 1.00 0.00 O ATOM 317 CB LYS A 22 17.842 -13.101 8.457 1.00 0.00 C ATOM 318 CG LYS A 22 17.767 -14.625 8.604 1.00 0.00 C ATOM 319 CD LYS A 22 18.924 -15.419 7.995 1.00 0.00 C ATOM 320 CE LYS A 22 20.227 -15.433 8.805 1.00 0.00 C ATOM 321 NZ LYS A 22 20.041 -16.001 10.160 1.00 0.00 N ATOM 0 H LYS A 22 17.372 -13.170 10.910 1.00 0.00 H new ATOM 0 HA LYS A 22 19.730 -12.900 9.478 1.00 0.00 H new ATOM 0 HB2 LYS A 22 16.837 -12.686 8.538 1.00 0.00 H new ATOM 0 HB3 LYS A 22 18.209 -12.857 7.460 1.00 0.00 H new ATOM 0 HG2 LYS A 22 17.708 -14.864 9.666 1.00 0.00 H new ATOM 0 HG3 LYS A 22 16.838 -14.968 8.148 1.00 0.00 H new ATOM 0 HD2 LYS A 22 18.597 -16.449 7.852 1.00 0.00 H new ATOM 0 HD3 LYS A 22 19.138 -15.012 7.007 1.00 0.00 H new ATOM 0 HE2 LYS A 22 20.978 -16.014 8.270 1.00 0.00 H new ATOM 0 HE3 LYS A 22 20.611 -14.416 8.889 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 20.962 -16.068 10.638 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 19.409 -15.385 10.711 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 19.621 -16.949 10.084 1.00 0.00 H new ATOM 335 N GLU A 23 17.983 -10.136 9.684 1.00 0.00 N ATOM 336 CA GLU A 23 17.993 -8.705 9.427 1.00 0.00 C ATOM 337 C GLU A 23 18.771 -7.959 10.508 1.00 0.00 C ATOM 338 O GLU A 23 19.427 -6.966 10.198 1.00 0.00 O ATOM 339 CB GLU A 23 16.558 -8.171 9.291 1.00 0.00 C ATOM 340 CG GLU A 23 15.702 -8.977 8.299 1.00 0.00 C ATOM 341 CD GLU A 23 16.430 -9.245 6.983 1.00 0.00 C ATOM 342 OE1 GLU A 23 16.900 -8.273 6.351 1.00 0.00 O ATOM 343 OE2 GLU A 23 16.582 -10.434 6.619 1.00 0.00 O ATOM 0 H GLU A 23 17.230 -10.444 10.299 1.00 0.00 H new ATOM 0 HA GLU A 23 18.505 -8.529 8.481 1.00 0.00 H new ATOM 0 HB2 GLU A 23 16.078 -8.185 10.270 1.00 0.00 H new ATOM 0 HB3 GLU A 23 16.594 -7.131 8.968 1.00 0.00 H new ATOM 0 HG2 GLU A 23 15.420 -9.926 8.755 1.00 0.00 H new ATOM 0 HG3 GLU A 23 14.779 -8.434 8.096 1.00 0.00 H new ATOM 350 N VAL A 24 18.793 -8.450 11.755 1.00 0.00 N ATOM 351 CA VAL A 24 19.507 -7.771 12.837 1.00 0.00 C ATOM 352 C VAL A 24 21.001 -7.624 12.536 1.00 0.00 C ATOM 353 O VAL A 24 21.570 -6.570 12.805 1.00 0.00 O ATOM 354 CB VAL A 24 19.158 -8.373 14.215 1.00 0.00 C ATOM 355 CG1 VAL A 24 20.132 -9.452 14.698 1.00 0.00 C ATOM 356 CG2 VAL A 24 19.077 -7.275 15.281 1.00 0.00 C ATOM 0 H VAL A 24 18.325 -9.312 12.035 1.00 0.00 H new ATOM 0 HA VAL A 24 19.152 -6.742 12.896 1.00 0.00 H new ATOM 0 HB VAL A 24 18.190 -8.854 14.074 1.00 0.00 H new ATOM 0 HG11 VAL A 24 19.813 -9.820 15.673 1.00 0.00 H new ATOM 0 HG12 VAL A 24 20.145 -10.276 13.985 1.00 0.00 H new ATOM 0 HG13 VAL A 24 21.133 -9.028 14.780 1.00 0.00 H new ATOM 0 HG21 VAL A 24 18.830 -7.721 16.244 1.00 0.00 H new ATOM 0 HG22 VAL A 24 20.038 -6.766 15.353 1.00 0.00 H new ATOM 0 HG23 VAL A 24 18.305 -6.556 15.005 1.00 0.00 H new ATOM 366 N GLN A 25 21.632 -8.625 11.910 1.00 0.00 N ATOM 367 CA GLN A 25 23.053 -8.565 11.546 1.00 0.00 C ATOM 368 C GLN A 25 23.346 -7.397 10.581 1.00 0.00 C ATOM 369 O GLN A 25 24.504 -7.026 10.387 1.00 0.00 O ATOM 370 CB GLN A 25 23.499 -9.891 10.902 1.00 0.00 C ATOM 371 CG GLN A 25 22.523 -10.344 9.804 1.00 0.00 C ATOM 372 CD GLN A 25 23.136 -11.199 8.699 1.00 0.00 C ATOM 373 OE1 GLN A 25 24.233 -11.749 8.812 1.00 0.00 O ATOM 374 NE2 GLN A 25 22.440 -11.316 7.589 1.00 0.00 N ATOM 0 H GLN A 25 21.174 -9.496 11.642 1.00 0.00 H new ATOM 0 HA GLN A 25 23.617 -8.398 12.464 1.00 0.00 H new ATOM 0 HB2 GLN A 25 24.496 -9.773 10.477 1.00 0.00 H new ATOM 0 HB3 GLN A 25 23.569 -10.663 11.668 1.00 0.00 H new ATOM 0 HG2 GLN A 25 21.714 -10.907 10.270 1.00 0.00 H new ATOM 0 HG3 GLN A 25 22.076 -9.459 9.351 1.00 0.00 H new ATOM 0 HE21 GLN A 25 21.533 -10.857 7.505 1.00 0.00 H new ATOM 0 HE22 GLN A 25 22.807 -11.866 6.812 1.00 0.00 H new ATOM 383 N LYS A 26 22.316 -6.855 9.926 1.00 0.00 N ATOM 384 CA LYS A 26 22.397 -5.747 8.991 1.00 0.00 C ATOM 385 C LYS A 26 21.990 -4.461 9.707 1.00 0.00 C ATOM 386 O LYS A 26 22.651 -3.439 9.550 1.00 0.00 O ATOM 387 CB LYS A 26 21.498 -6.072 7.792 1.00 0.00 C ATOM 388 CG LYS A 26 21.920 -5.302 6.538 1.00 0.00 C ATOM 389 CD LYS A 26 21.057 -5.691 5.330 1.00 0.00 C ATOM 390 CE LYS A 26 19.559 -5.416 5.514 1.00 0.00 C ATOM 391 NZ LYS A 26 19.233 -3.993 5.741 1.00 0.00 N ATOM 0 H LYS A 26 21.362 -7.198 10.044 1.00 0.00 H new ATOM 0 HA LYS A 26 23.412 -5.599 8.621 1.00 0.00 H new ATOM 0 HB2 LYS A 26 21.535 -7.143 7.590 1.00 0.00 H new ATOM 0 HB3 LYS A 26 20.464 -5.829 8.037 1.00 0.00 H new ATOM 0 HG2 LYS A 26 21.834 -4.231 6.720 1.00 0.00 H new ATOM 0 HG3 LYS A 26 22.968 -5.505 6.319 1.00 0.00 H new ATOM 0 HD2 LYS A 26 21.410 -5.146 4.455 1.00 0.00 H new ATOM 0 HD3 LYS A 26 21.198 -6.752 5.123 1.00 0.00 H new ATOM 0 HE2 LYS A 26 19.025 -5.764 4.630 1.00 0.00 H new ATOM 0 HE3 LYS A 26 19.194 -6.001 6.358 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 18.205 -3.886 5.856 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 19.714 -3.660 6.601 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 19.550 -3.430 4.926 1.00 0.00 H new ATOM 405 N GLN A 27 20.920 -4.490 10.510 1.00 0.00 N ATOM 406 CA GLN A 27 20.443 -3.324 11.252 1.00 0.00 C ATOM 407 C GLN A 27 21.414 -2.889 12.350 1.00 0.00 C ATOM 408 O GLN A 27 21.417 -1.711 12.711 1.00 0.00 O ATOM 409 CB GLN A 27 19.052 -3.587 11.843 1.00 0.00 C ATOM 410 CG GLN A 27 17.928 -3.449 10.807 1.00 0.00 C ATOM 411 CD GLN A 27 17.689 -1.986 10.437 1.00 0.00 C ATOM 412 OE1 GLN A 27 16.996 -1.251 11.133 1.00 0.00 O ATOM 413 NE2 GLN A 27 18.297 -1.492 9.375 1.00 0.00 N ATOM 0 H GLN A 27 20.360 -5.329 10.662 1.00 0.00 H new ATOM 0 HA GLN A 27 20.378 -2.503 10.538 1.00 0.00 H new ATOM 0 HB2 GLN A 27 19.027 -4.591 12.268 1.00 0.00 H new ATOM 0 HB3 GLN A 27 18.873 -2.890 12.662 1.00 0.00 H new ATOM 0 HG2 GLN A 27 18.185 -4.015 9.912 1.00 0.00 H new ATOM 0 HG3 GLN A 27 17.009 -3.880 11.205 1.00 0.00 H new ATOM 0 HE21 GLN A 27 18.875 -2.096 8.791 1.00 0.00 H new ATOM 0 HE22 GLN A 27 18.189 -0.506 9.138 1.00 0.00 H new ATOM 422 N LEU A 28 22.238 -3.793 12.881 1.00 0.00 N ATOM 423 CA LEU A 28 23.220 -3.469 13.918 1.00 0.00 C ATOM 424 C LEU A 28 24.360 -2.629 13.345 1.00 0.00 C ATOM 425 O LEU A 28 25.145 -2.056 14.102 1.00 0.00 O ATOM 426 CB LEU A 28 23.799 -4.759 14.518 1.00 0.00 C ATOM 427 CG LEU A 28 22.858 -5.406 15.546 1.00 0.00 C ATOM 428 CD1 LEU A 28 23.295 -6.855 15.784 1.00 0.00 C ATOM 429 CD2 LEU A 28 22.872 -4.637 16.873 1.00 0.00 C ATOM 0 H LEU A 28 22.244 -4.774 12.603 1.00 0.00 H new ATOM 0 HA LEU A 28 22.713 -2.896 14.694 1.00 0.00 H new ATOM 0 HB2 LEU A 28 24.000 -5.470 13.717 1.00 0.00 H new ATOM 0 HB3 LEU A 28 24.754 -4.537 14.994 1.00 0.00 H new ATOM 0 HG LEU A 28 21.842 -5.380 15.152 1.00 0.00 H new ATOM 0 HD11 LEU A 28 22.631 -7.320 16.513 1.00 0.00 H new ATOM 0 HD12 LEU A 28 23.248 -7.408 14.846 1.00 0.00 H new ATOM 0 HD13 LEU A 28 24.317 -6.869 16.163 1.00 0.00 H new ATOM 0 HD21 LEU A 28 22.197 -5.119 17.580 1.00 0.00 H new ATOM 0 HD22 LEU A 28 23.883 -4.634 17.281 1.00 0.00 H new ATOM 0 HD23 LEU A 28 22.547 -3.611 16.702 1.00 0.00 H new ATOM 441 N ALA A 29 24.479 -2.567 12.021 1.00 0.00 N ATOM 442 CA ALA A 29 25.495 -1.826 11.298 1.00 0.00 C ATOM 443 C ALA A 29 24.867 -0.683 10.500 1.00 0.00 C ATOM 444 O ALA A 29 23.646 -0.597 10.328 1.00 0.00 O ATOM 445 CB ALA A 29 26.202 -2.794 10.347 1.00 0.00 C ATOM 0 H ALA A 29 23.836 -3.057 11.399 1.00 0.00 H new ATOM 0 HA ALA A 29 26.205 -1.393 12.003 1.00 0.00 H new ATOM 0 HB1 ALA A 29 26.972 -2.260 9.791 1.00 0.00 H new ATOM 0 HB2 ALA A 29 26.661 -3.598 10.922 1.00 0.00 H new ATOM 0 HB3 ALA A 29 25.477 -3.214 9.650 1.00 0.00 H new ATOM 451 N ARG A 30 25.712 0.230 10.026 1.00 0.00 N ATOM 452 CA ARG A 30 25.270 1.351 9.209 1.00 0.00 C ATOM 453 C ARG A 30 25.019 0.836 7.794 1.00 0.00 C ATOM 454 O ARG A 30 25.354 -0.304 7.462 1.00 0.00 O ATOM 455 CB ARG A 30 26.302 2.492 9.216 1.00 0.00 C ATOM 456 CG ARG A 30 27.587 2.270 8.397 1.00 0.00 C ATOM 457 CD ARG A 30 28.482 1.112 8.862 1.00 0.00 C ATOM 458 NE ARG A 30 29.818 1.219 8.252 1.00 0.00 N ATOM 459 CZ ARG A 30 30.489 0.319 7.527 1.00 0.00 C ATOM 460 NH1 ARG A 30 29.979 -0.882 7.272 1.00 0.00 N ATOM 461 NH2 ARG A 30 31.689 0.630 7.052 1.00 0.00 N ATOM 0 H ARG A 30 26.717 0.211 10.198 1.00 0.00 H new ATOM 0 HA ARG A 30 24.350 1.767 9.619 1.00 0.00 H new ATOM 0 HB2 ARG A 30 25.814 3.394 8.845 1.00 0.00 H new ATOM 0 HB3 ARG A 30 26.587 2.686 10.250 1.00 0.00 H new ATOM 0 HG2 ARG A 30 27.308 2.094 7.358 1.00 0.00 H new ATOM 0 HG3 ARG A 30 28.173 3.189 8.419 1.00 0.00 H new ATOM 0 HD2 ARG A 30 28.569 1.125 9.948 1.00 0.00 H new ATOM 0 HD3 ARG A 30 28.026 0.160 8.590 1.00 0.00 H new ATOM 0 HE ARG A 30 30.299 2.105 8.404 1.00 0.00 H new ATOM 0 HH11 ARG A 30 29.058 -1.132 7.632 1.00 0.00 H new ATOM 0 HH12 ARG A 30 30.509 -1.554 6.716 1.00 0.00 H new ATOM 0 HH21 ARG A 30 32.090 1.548 7.242 1.00 0.00 H new ATOM 0 HH22 ARG A 30 32.210 -0.049 6.497 1.00 0.00 H new ATOM 724 N GLU A 45 2.175 2.636 -5.363 1.00 0.00 N ATOM 725 CA GLU A 45 1.469 2.240 -6.570 1.00 0.00 C ATOM 726 C GLU A 45 0.594 0.993 -6.379 1.00 0.00 C ATOM 727 O GLU A 45 -0.003 0.529 -7.345 1.00 0.00 O ATOM 728 CB GLU A 45 2.427 2.106 -7.757 1.00 0.00 C ATOM 729 CG GLU A 45 3.389 0.925 -7.634 1.00 0.00 C ATOM 730 CD GLU A 45 3.824 0.453 -9.013 1.00 0.00 C ATOM 731 OE1 GLU A 45 4.797 1.020 -9.566 1.00 0.00 O ATOM 732 OE2 GLU A 45 3.148 -0.439 -9.579 1.00 0.00 O ATOM 0 HA GLU A 45 0.773 3.046 -6.801 1.00 0.00 H new ATOM 0 HB2 GLU A 45 1.845 1.997 -8.672 1.00 0.00 H new ATOM 0 HB3 GLU A 45 3.004 3.026 -7.854 1.00 0.00 H new ATOM 0 HG2 GLU A 45 4.262 1.217 -7.050 1.00 0.00 H new ATOM 0 HG3 GLU A 45 2.906 0.108 -7.098 1.00 0.00 H new ATOM 739 N ARG A 46 0.531 0.387 -5.183 1.00 0.00 N ATOM 740 CA ARG A 46 -0.325 -0.786 -4.991 1.00 0.00 C ATOM 741 C ARG A 46 -1.803 -0.403 -4.919 1.00 0.00 C ATOM 742 O ARG A 46 -2.632 -1.297 -4.799 1.00 0.00 O ATOM 743 CB ARG A 46 0.075 -1.615 -3.769 1.00 0.00 C ATOM 744 CG ARG A 46 1.310 -2.474 -4.037 1.00 0.00 C ATOM 745 CD ARG A 46 1.408 -3.614 -3.025 1.00 0.00 C ATOM 746 NE ARG A 46 1.449 -3.154 -1.624 1.00 0.00 N ATOM 747 CZ ARG A 46 1.906 -3.893 -0.609 1.00 0.00 C ATOM 748 NH1 ARG A 46 2.218 -5.172 -0.798 1.00 0.00 N ATOM 749 NH2 ARG A 46 2.082 -3.340 0.586 1.00 0.00 N ATOM 0 H ARG A 46 1.049 0.683 -4.356 1.00 0.00 H new ATOM 0 HA ARG A 46 -0.176 -1.413 -5.870 1.00 0.00 H new ATOM 0 HB2 ARG A 46 0.272 -0.949 -2.929 1.00 0.00 H new ATOM 0 HB3 ARG A 46 -0.757 -2.257 -3.479 1.00 0.00 H new ATOM 0 HG2 ARG A 46 1.263 -2.881 -5.047 1.00 0.00 H new ATOM 0 HG3 ARG A 46 2.207 -1.856 -3.984 1.00 0.00 H new ATOM 0 HD2 ARG A 46 0.555 -4.280 -3.156 1.00 0.00 H new ATOM 0 HD3 ARG A 46 2.304 -4.199 -3.234 1.00 0.00 H new ATOM 0 HE ARG A 46 1.108 -2.215 -1.418 1.00 0.00 H new ATOM 0 HH11 ARG A 46 2.109 -5.593 -1.721 1.00 0.00 H new ATOM 0 HH12 ARG A 46 2.567 -5.732 -0.020 1.00 0.00 H new ATOM 0 HH21 ARG A 46 1.868 -2.353 0.728 1.00 0.00 H new ATOM 0 HH22 ARG A 46 2.431 -3.903 1.362 1.00 0.00 H new ATOM 763 N LEU A 47 -2.155 0.885 -4.980 1.00 0.00 N ATOM 764 CA LEU A 47 -3.533 1.382 -4.952 1.00 0.00 C ATOM 765 C LEU A 47 -4.432 0.539 -5.878 1.00 0.00 C ATOM 766 O LEU A 47 -5.380 -0.078 -5.385 1.00 0.00 O ATOM 767 CB LEU A 47 -3.547 2.878 -5.321 1.00 0.00 C ATOM 768 CG LEU A 47 -3.065 3.775 -4.173 1.00 0.00 C ATOM 769 CD1 LEU A 47 -2.604 5.124 -4.712 1.00 0.00 C ATOM 770 CD2 LEU A 47 -4.187 4.001 -3.171 1.00 0.00 C ATOM 0 H LEU A 47 -1.466 1.634 -5.053 1.00 0.00 H new ATOM 0 HA LEU A 47 -3.941 1.283 -3.946 1.00 0.00 H new ATOM 0 HB2 LEU A 47 -2.913 3.039 -6.193 1.00 0.00 H new ATOM 0 HB3 LEU A 47 -4.559 3.169 -5.604 1.00 0.00 H new ATOM 0 HG LEU A 47 -2.231 3.275 -3.680 1.00 0.00 H new ATOM 0 HD11 LEU A 47 -2.265 5.749 -3.886 1.00 0.00 H new ATOM 0 HD12 LEU A 47 -1.784 4.974 -5.414 1.00 0.00 H new ATOM 0 HD13 LEU A 47 -3.433 5.615 -5.222 1.00 0.00 H new ATOM 0 HD21 LEU A 47 -3.830 4.639 -2.363 1.00 0.00 H new ATOM 0 HD22 LEU A 47 -5.028 4.483 -3.669 1.00 0.00 H new ATOM 0 HD23 LEU A 47 -4.508 3.043 -2.762 1.00 0.00 H new ATOM 782 N PRO A 48 -4.149 0.433 -7.191 1.00 0.00 N ATOM 783 CA PRO A 48 -4.962 -0.372 -8.097 1.00 0.00 C ATOM 784 C PRO A 48 -4.869 -1.855 -7.760 1.00 0.00 C ATOM 785 O PRO A 48 -5.876 -2.555 -7.848 1.00 0.00 O ATOM 786 CB PRO A 48 -4.385 -0.134 -9.494 1.00 0.00 C ATOM 787 CG PRO A 48 -2.945 0.306 -9.234 1.00 0.00 C ATOM 788 CD PRO A 48 -3.083 1.089 -7.936 1.00 0.00 C ATOM 0 HA PRO A 48 -6.012 -0.091 -8.022 1.00 0.00 H new ATOM 0 HB2 PRO A 48 -4.422 -1.039 -10.100 1.00 0.00 H new ATOM 0 HB3 PRO A 48 -4.945 0.632 -10.031 1.00 0.00 H new ATOM 0 HG2 PRO A 48 -2.271 -0.544 -9.128 1.00 0.00 H new ATOM 0 HG3 PRO A 48 -2.554 0.923 -10.043 1.00 0.00 H new ATOM 0 HD2 PRO A 48 -2.150 1.081 -7.373 1.00 0.00 H new ATOM 0 HD3 PRO A 48 -3.328 2.133 -8.133 1.00 0.00 H new ATOM 796 N GLU A 49 -3.665 -2.314 -7.401 1.00 0.00 N ATOM 797 CA GLU A 49 -3.317 -3.682 -7.051 1.00 0.00 C ATOM 798 C GLU A 49 -4.202 -4.223 -5.922 1.00 0.00 C ATOM 799 O GLU A 49 -4.613 -5.383 -5.987 1.00 0.00 O ATOM 800 CB GLU A 49 -1.810 -3.757 -6.726 1.00 0.00 C ATOM 801 CG GLU A 49 -1.264 -5.167 -6.982 1.00 0.00 C ATOM 802 CD GLU A 49 0.258 -5.309 -6.873 1.00 0.00 C ATOM 803 OE1 GLU A 49 1.015 -4.427 -7.343 1.00 0.00 O ATOM 804 OE2 GLU A 49 0.710 -6.384 -6.409 1.00 0.00 O ATOM 0 H GLU A 49 -2.859 -1.692 -7.346 1.00 0.00 H new ATOM 0 HA GLU A 49 -3.510 -4.333 -7.904 1.00 0.00 H new ATOM 0 HB2 GLU A 49 -1.266 -3.036 -7.336 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -1.645 -3.482 -5.684 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -1.728 -5.853 -6.273 1.00 0.00 H new ATOM 0 HG3 GLU A 49 -1.571 -5.483 -7.979 1.00 0.00 H new ATOM 811 N LEU A 50 -4.515 -3.403 -4.913 1.00 0.00 N ATOM 812 CA LEU A 50 -5.366 -3.774 -3.787 1.00 0.00 C ATOM 813 C LEU A 50 -6.835 -3.684 -4.206 1.00 0.00 C ATOM 814 O LEU A 50 -7.575 -4.636 -3.977 1.00 0.00 O ATOM 815 CB LEU A 50 -5.132 -2.870 -2.557 1.00 0.00 C ATOM 816 CG LEU A 50 -4.161 -3.346 -1.458 1.00 0.00 C ATOM 817 CD1 LEU A 50 -4.542 -4.712 -0.879 1.00 0.00 C ATOM 818 CD2 LEU A 50 -2.717 -3.374 -1.953 1.00 0.00 C ATOM 0 H LEU A 50 -4.174 -2.443 -4.859 1.00 0.00 H new ATOM 0 HA LEU A 50 -5.110 -4.795 -3.504 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -4.773 -1.907 -2.919 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -6.100 -2.694 -2.088 1.00 0.00 H new ATOM 0 HG LEU A 50 -4.243 -2.613 -0.655 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -3.823 -4.995 -0.110 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -5.538 -4.656 -0.441 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -4.536 -5.458 -1.673 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -2.064 -3.715 -1.150 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -2.636 -4.055 -2.800 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -2.419 -2.372 -2.263 1.00 0.00 H new ATOM 830 N ALA A 51 -7.261 -2.590 -4.853 1.00 0.00 N ATOM 831 CA ALA A 51 -8.641 -2.383 -5.290 1.00 0.00 C ATOM 832 C ALA A 51 -9.193 -3.578 -6.080 1.00 0.00 C ATOM 833 O ALA A 51 -10.282 -4.075 -5.774 1.00 0.00 O ATOM 834 CB ALA A 51 -8.731 -1.089 -6.110 1.00 0.00 C ATOM 0 H ALA A 51 -6.643 -1.814 -5.089 1.00 0.00 H new ATOM 0 HA ALA A 51 -9.264 -2.292 -4.400 1.00 0.00 H new ATOM 0 HB1 ALA A 51 -9.760 -0.935 -6.435 1.00 0.00 H new ATOM 0 HB2 ALA A 51 -8.415 -0.246 -5.495 1.00 0.00 H new ATOM 0 HB3 ALA A 51 -8.082 -1.165 -6.982 1.00 0.00 H new ATOM 840 N ARG A 52 -8.451 -4.038 -7.097 1.00 0.00 N ATOM 841 CA ARG A 52 -8.865 -5.177 -7.926 1.00 0.00 C ATOM 842 C ARG A 52 -9.045 -6.428 -7.093 1.00 0.00 C ATOM 843 O ARG A 52 -10.078 -7.092 -7.163 1.00 0.00 O ATOM 844 CB ARG A 52 -7.895 -5.403 -9.086 1.00 0.00 C ATOM 845 CG ARG A 52 -6.382 -5.530 -8.846 1.00 0.00 C ATOM 846 CD ARG A 52 -5.549 -5.261 -10.119 1.00 0.00 C ATOM 847 NE ARG A 52 -5.784 -3.923 -10.694 1.00 0.00 N ATOM 848 CZ ARG A 52 -5.375 -3.475 -11.890 1.00 0.00 C ATOM 849 NH1 ARG A 52 -4.534 -4.174 -12.654 1.00 0.00 N ATOM 850 NH2 ARG A 52 -5.812 -2.300 -12.331 1.00 0.00 N ATOM 0 H ARG A 52 -7.554 -3.634 -7.366 1.00 0.00 H new ATOM 0 HA ARG A 52 -9.835 -4.935 -8.359 1.00 0.00 H new ATOM 0 HB2 ARG A 52 -8.214 -6.313 -9.595 1.00 0.00 H new ATOM 0 HB3 ARG A 52 -8.038 -4.579 -9.786 1.00 0.00 H new ATOM 0 HG2 ARG A 52 -6.082 -4.829 -8.067 1.00 0.00 H new ATOM 0 HG3 ARG A 52 -6.160 -6.531 -8.477 1.00 0.00 H new ATOM 0 HD2 ARG A 52 -4.490 -5.367 -9.882 1.00 0.00 H new ATOM 0 HD3 ARG A 52 -5.785 -6.018 -10.867 1.00 0.00 H new ATOM 0 HE ARG A 52 -6.315 -3.268 -10.120 1.00 0.00 H new ATOM 0 HH11 ARG A 52 -4.184 -5.076 -12.333 1.00 0.00 H new ATOM 0 HH12 ARG A 52 -4.241 -3.806 -13.559 1.00 0.00 H new ATOM 0 HH21 ARG A 52 -6.453 -1.748 -11.761 1.00 0.00 H new ATOM 0 HH22 ARG A 52 -5.507 -1.951 -13.239 1.00 0.00 H new ATOM 864 N VAL A 53 -8.018 -6.717 -6.311 1.00 0.00 N ATOM 865 CA VAL A 53 -7.973 -7.857 -5.396 1.00 0.00 C ATOM 866 C VAL A 53 -9.185 -7.821 -4.463 1.00 0.00 C ATOM 867 O VAL A 53 -9.926 -8.794 -4.463 1.00 0.00 O ATOM 868 CB VAL A 53 -6.636 -7.941 -4.637 1.00 0.00 C ATOM 869 CG1 VAL A 53 -6.683 -8.953 -3.485 1.00 0.00 C ATOM 870 CG2 VAL A 53 -5.549 -8.396 -5.611 1.00 0.00 C ATOM 0 H VAL A 53 -7.168 -6.154 -6.291 1.00 0.00 H new ATOM 0 HA VAL A 53 -8.029 -8.775 -5.981 1.00 0.00 H new ATOM 0 HB VAL A 53 -6.430 -6.954 -4.223 1.00 0.00 H new ATOM 0 HG11 VAL A 53 -5.717 -8.976 -2.981 1.00 0.00 H new ATOM 0 HG12 VAL A 53 -7.456 -8.660 -2.775 1.00 0.00 H new ATOM 0 HG13 VAL A 53 -6.909 -9.943 -3.880 1.00 0.00 H new ATOM 0 HG21 VAL A 53 -4.595 -8.460 -5.088 1.00 0.00 H new ATOM 0 HG22 VAL A 53 -5.808 -9.375 -6.014 1.00 0.00 H new ATOM 0 HG23 VAL A 53 -5.467 -7.678 -6.427 1.00 0.00 H new ATOM 880 N LEU A 54 -9.442 -6.726 -3.738 1.00 0.00 N ATOM 881 CA LEU A 54 -10.573 -6.593 -2.815 1.00 0.00 C ATOM 882 C LEU A 54 -11.857 -7.075 -3.486 1.00 0.00 C ATOM 883 O LEU A 54 -12.513 -8.021 -3.050 1.00 0.00 O ATOM 884 CB LEU A 54 -10.688 -5.130 -2.340 1.00 0.00 C ATOM 885 CG LEU A 54 -11.916 -4.942 -1.427 1.00 0.00 C ATOM 886 CD1 LEU A 54 -11.579 -4.032 -0.239 1.00 0.00 C ATOM 887 CD2 LEU A 54 -13.156 -4.363 -2.120 1.00 0.00 C ATOM 0 H LEU A 54 -8.857 -5.891 -3.778 1.00 0.00 H new ATOM 0 HA LEU A 54 -10.407 -7.218 -1.937 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -9.783 -4.846 -1.802 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -10.767 -4.469 -3.203 1.00 0.00 H new ATOM 0 HG LEU A 54 -12.164 -5.954 -1.106 1.00 0.00 H new ATOM 0 HD11 LEU A 54 -12.461 -3.914 0.391 1.00 0.00 H new ATOM 0 HD12 LEU A 54 -10.774 -4.478 0.344 1.00 0.00 H new ATOM 0 HD13 LEU A 54 -11.263 -3.056 -0.607 1.00 0.00 H new ATOM 0 HD21 LEU A 54 -13.966 -4.268 -1.397 1.00 0.00 H new ATOM 0 HD22 LEU A 54 -12.919 -3.381 -2.530 1.00 0.00 H new ATOM 0 HD23 LEU A 54 -13.466 -5.028 -2.927 1.00 0.00 H new ATOM 899 N ARG A 55 -12.186 -6.428 -4.600 1.00 0.00 N ATOM 900 CA ARG A 55 -13.362 -6.743 -5.411 1.00 0.00 C ATOM 901 C ARG A 55 -13.347 -8.228 -5.787 1.00 0.00 C ATOM 902 O ARG A 55 -14.406 -8.852 -5.743 1.00 0.00 O ATOM 903 CB ARG A 55 -13.396 -5.798 -6.624 1.00 0.00 C ATOM 904 CG ARG A 55 -14.721 -5.811 -7.404 1.00 0.00 C ATOM 905 CD ARG A 55 -14.743 -6.870 -8.512 1.00 0.00 C ATOM 906 NE ARG A 55 -15.937 -6.741 -9.361 1.00 0.00 N ATOM 907 CZ ARG A 55 -16.194 -7.436 -10.474 1.00 0.00 C ATOM 908 NH1 ARG A 55 -15.470 -8.498 -10.817 1.00 0.00 N ATOM 909 NH2 ARG A 55 -17.197 -7.038 -11.242 1.00 0.00 N ATOM 0 H ARG A 55 -11.634 -5.656 -4.973 1.00 0.00 H new ATOM 0 HA ARG A 55 -14.284 -6.580 -4.852 1.00 0.00 H new ATOM 0 HB2 ARG A 55 -13.200 -4.782 -6.283 1.00 0.00 H new ATOM 0 HB3 ARG A 55 -12.587 -6.068 -7.302 1.00 0.00 H new ATOM 0 HG2 ARG A 55 -15.543 -5.997 -6.713 1.00 0.00 H new ATOM 0 HG3 ARG A 55 -14.889 -4.828 -7.843 1.00 0.00 H new ATOM 0 HD2 ARG A 55 -13.847 -6.774 -9.126 1.00 0.00 H new ATOM 0 HD3 ARG A 55 -14.719 -7.864 -8.066 1.00 0.00 H new ATOM 0 HE ARG A 55 -16.636 -6.056 -9.073 1.00 0.00 H new ATOM 0 HH11 ARG A 55 -14.696 -8.801 -10.225 1.00 0.00 H new ATOM 0 HH12 ARG A 55 -15.688 -9.010 -11.672 1.00 0.00 H new ATOM 0 HH21 ARG A 55 -17.749 -6.222 -10.978 1.00 0.00 H new ATOM 0 HH22 ARG A 55 -17.418 -7.548 -12.098 1.00 0.00 H new ATOM 923 N ASN A 56 -12.194 -8.790 -6.167 1.00 0.00 N ATOM 924 CA ASN A 56 -12.061 -10.201 -6.522 1.00 0.00 C ATOM 925 C ASN A 56 -12.477 -11.068 -5.338 1.00 0.00 C ATOM 926 O ASN A 56 -13.348 -11.922 -5.509 1.00 0.00 O ATOM 927 CB ASN A 56 -10.647 -10.585 -7.005 1.00 0.00 C ATOM 928 CG ASN A 56 -10.531 -10.620 -8.518 1.00 0.00 C ATOM 929 OD1 ASN A 56 -11.353 -11.223 -9.206 1.00 0.00 O ATOM 930 ND2 ASN A 56 -9.536 -9.965 -9.094 1.00 0.00 N ATOM 0 H ASN A 56 -11.320 -8.269 -6.236 1.00 0.00 H new ATOM 0 HA ASN A 56 -12.724 -10.379 -7.369 1.00 0.00 H new ATOM 0 HB2 ASN A 56 -9.926 -9.872 -6.606 1.00 0.00 H new ATOM 0 HB3 ASN A 56 -10.384 -11.563 -6.602 1.00 0.00 H new ATOM 0 HD21 ASN A 56 -9.450 -9.960 -10.110 1.00 0.00 H new ATOM 0 HD22 ASN A 56 -8.855 -9.465 -8.522 1.00 0.00 H new ATOM 937 N VAL A 57 -11.895 -10.852 -4.152 1.00 0.00 N ATOM 938 CA VAL A 57 -12.231 -11.621 -2.958 1.00 0.00 C ATOM 939 C VAL A 57 -13.729 -11.473 -2.677 1.00 0.00 C ATOM 940 O VAL A 57 -14.383 -12.487 -2.465 1.00 0.00 O ATOM 941 CB VAL A 57 -11.334 -11.293 -1.746 1.00 0.00 C ATOM 942 CG1 VAL A 57 -11.459 -12.423 -0.712 1.00 0.00 C ATOM 943 CG2 VAL A 57 -9.841 -11.190 -2.095 1.00 0.00 C ATOM 0 H VAL A 57 -11.181 -10.140 -3.998 1.00 0.00 H new ATOM 0 HA VAL A 57 -12.021 -12.674 -3.148 1.00 0.00 H new ATOM 0 HB VAL A 57 -11.673 -10.326 -1.373 1.00 0.00 H new ATOM 0 HG11 VAL A 57 -10.828 -12.200 0.149 1.00 0.00 H new ATOM 0 HG12 VAL A 57 -12.497 -12.508 -0.389 1.00 0.00 H new ATOM 0 HG13 VAL A 57 -11.141 -13.364 -1.161 1.00 0.00 H new ATOM 0 HG21 VAL A 57 -9.272 -10.957 -1.195 1.00 0.00 H new ATOM 0 HG22 VAL A 57 -9.497 -12.139 -2.506 1.00 0.00 H new ATOM 0 HG23 VAL A 57 -9.693 -10.400 -2.832 1.00 0.00 H new ATOM 953 N PHE A 58 -14.326 -10.275 -2.749 1.00 0.00 N ATOM 954 CA PHE A 58 -15.765 -10.101 -2.507 1.00 0.00 C ATOM 955 C PHE A 58 -16.586 -10.957 -3.480 1.00 0.00 C ATOM 956 O PHE A 58 -17.558 -11.604 -3.076 1.00 0.00 O ATOM 957 CB PHE A 58 -16.180 -8.628 -2.599 1.00 0.00 C ATOM 958 CG PHE A 58 -16.233 -7.899 -1.271 1.00 0.00 C ATOM 959 CD1 PHE A 58 -15.057 -7.382 -0.710 1.00 0.00 C ATOM 960 CD2 PHE A 58 -17.465 -7.695 -0.621 1.00 0.00 C ATOM 961 CE1 PHE A 58 -15.111 -6.598 0.455 1.00 0.00 C ATOM 962 CE2 PHE A 58 -17.525 -6.923 0.559 1.00 0.00 C ATOM 963 CZ PHE A 58 -16.348 -6.344 1.071 1.00 0.00 C ATOM 0 H PHE A 58 -13.833 -9.411 -2.973 1.00 0.00 H new ATOM 0 HA PHE A 58 -15.970 -10.438 -1.491 1.00 0.00 H new ATOM 0 HB2 PHE A 58 -15.482 -8.109 -3.255 1.00 0.00 H new ATOM 0 HB3 PHE A 58 -17.162 -8.570 -3.069 1.00 0.00 H new ATOM 0 HD1 PHE A 58 -14.104 -7.587 -1.176 1.00 0.00 H new ATOM 0 HD2 PHE A 58 -18.366 -8.130 -1.026 1.00 0.00 H new ATOM 0 HE1 PHE A 58 -14.203 -6.191 0.876 1.00 0.00 H new ATOM 0 HE2 PHE A 58 -18.467 -6.777 1.066 1.00 0.00 H new ATOM 0 HZ PHE A 58 -16.396 -5.703 1.939 1.00 0.00 H new ATOM 973 N VAL A 59 -16.230 -10.965 -4.768 1.00 0.00 N ATOM 974 CA VAL A 59 -16.934 -11.770 -5.767 1.00 0.00 C ATOM 975 C VAL A 59 -16.801 -13.251 -5.398 1.00 0.00 C ATOM 976 O VAL A 59 -17.782 -13.990 -5.469 1.00 0.00 O ATOM 977 CB VAL A 59 -16.391 -11.481 -7.186 1.00 0.00 C ATOM 978 CG1 VAL A 59 -16.930 -12.455 -8.246 1.00 0.00 C ATOM 979 CG2 VAL A 59 -16.766 -10.070 -7.653 1.00 0.00 C ATOM 0 H VAL A 59 -15.454 -10.420 -5.143 1.00 0.00 H new ATOM 0 HA VAL A 59 -17.991 -11.506 -5.774 1.00 0.00 H new ATOM 0 HB VAL A 59 -15.311 -11.595 -7.098 1.00 0.00 H new ATOM 0 HG11 VAL A 59 -16.512 -12.200 -9.220 1.00 0.00 H new ATOM 0 HG12 VAL A 59 -16.643 -13.473 -7.984 1.00 0.00 H new ATOM 0 HG13 VAL A 59 -18.017 -12.383 -8.287 1.00 0.00 H new ATOM 0 HG21 VAL A 59 -16.369 -9.900 -8.654 1.00 0.00 H new ATOM 0 HG22 VAL A 59 -17.851 -9.969 -7.672 1.00 0.00 H new ATOM 0 HG23 VAL A 59 -16.345 -9.336 -6.966 1.00 0.00 H new ATOM 989 N SER A 60 -15.613 -13.697 -4.999 1.00 0.00 N ATOM 990 CA SER A 60 -15.352 -15.081 -4.639 1.00 0.00 C ATOM 991 C SER A 60 -16.053 -15.467 -3.331 1.00 0.00 C ATOM 992 O SER A 60 -16.519 -16.601 -3.201 1.00 0.00 O ATOM 993 CB SER A 60 -13.827 -15.274 -4.533 1.00 0.00 C ATOM 994 OG SER A 60 -13.389 -16.417 -5.248 1.00 0.00 O ATOM 0 H SER A 60 -14.794 -13.095 -4.917 1.00 0.00 H new ATOM 0 HA SER A 60 -15.755 -15.738 -5.409 1.00 0.00 H new ATOM 0 HB2 SER A 60 -13.321 -14.389 -4.918 1.00 0.00 H new ATOM 0 HB3 SER A 60 -13.545 -15.371 -3.485 1.00 0.00 H new ATOM 0 HG SER A 60 -12.417 -16.506 -5.159 1.00 0.00 H new ATOM 1000 N GLU A 61 -16.286 -14.510 -2.432 1.00 0.00 N ATOM 1001 CA GLU A 61 -16.889 -14.760 -1.134 1.00 0.00 C ATOM 1002 C GLU A 61 -18.353 -15.195 -1.126 1.00 0.00 C ATOM 1003 O GLU A 61 -18.817 -15.714 -0.113 1.00 0.00 O ATOM 1004 CB GLU A 61 -16.728 -13.482 -0.307 1.00 0.00 C ATOM 1005 CG GLU A 61 -16.702 -13.740 1.200 1.00 0.00 C ATOM 1006 CD GLU A 61 -15.602 -14.699 1.642 1.00 0.00 C ATOM 1007 OE1 GLU A 61 -14.428 -14.487 1.276 1.00 0.00 O ATOM 1008 OE2 GLU A 61 -15.878 -15.550 2.521 1.00 0.00 O ATOM 0 H GLU A 61 -16.056 -13.529 -2.592 1.00 0.00 H new ATOM 0 HA GLU A 61 -16.366 -15.622 -0.719 1.00 0.00 H new ATOM 0 HB2 GLU A 61 -15.805 -12.981 -0.600 1.00 0.00 H new ATOM 0 HB3 GLU A 61 -17.547 -12.801 -0.539 1.00 0.00 H new ATOM 0 HG2 GLU A 61 -16.573 -12.790 1.719 1.00 0.00 H new ATOM 0 HG3 GLU A 61 -17.667 -14.143 1.507 1.00 0.00 H new ATOM 1015 N ARG A 62 -19.101 -15.003 -2.220 1.00 0.00 N ATOM 1016 CA ARG A 62 -20.527 -15.368 -2.291 1.00 0.00 C ATOM 1017 C ARG A 62 -21.381 -14.562 -1.284 1.00 0.00 C ATOM 1018 O ARG A 62 -22.527 -14.928 -1.022 1.00 0.00 O ATOM 1019 CB ARG A 62 -20.687 -16.897 -2.200 1.00 0.00 C ATOM 1020 CG ARG A 62 -22.050 -17.440 -2.666 1.00 0.00 C ATOM 1021 CD ARG A 62 -21.965 -18.960 -2.662 1.00 0.00 C ATOM 1022 NE ARG A 62 -23.255 -19.603 -2.947 1.00 0.00 N ATOM 1023 CZ ARG A 62 -23.523 -20.907 -2.815 1.00 0.00 C ATOM 1024 NH1 ARG A 62 -22.587 -21.745 -2.392 1.00 0.00 N ATOM 1025 NH2 ARG A 62 -24.725 -21.379 -3.119 1.00 0.00 N ATOM 0 H ARG A 62 -18.739 -14.592 -3.080 1.00 0.00 H new ATOM 0 HA ARG A 62 -20.927 -15.081 -3.263 1.00 0.00 H new ATOM 0 HB2 ARG A 62 -19.904 -17.365 -2.797 1.00 0.00 H new ATOM 0 HB3 ARG A 62 -20.526 -17.203 -1.166 1.00 0.00 H new ATOM 0 HG2 ARG A 62 -22.845 -17.099 -2.003 1.00 0.00 H new ATOM 0 HG3 ARG A 62 -22.288 -17.072 -3.664 1.00 0.00 H new ATOM 0 HD2 ARG A 62 -21.233 -19.280 -3.403 1.00 0.00 H new ATOM 0 HD3 ARG A 62 -21.603 -19.297 -1.690 1.00 0.00 H new ATOM 0 HE ARG A 62 -24.012 -19.003 -3.274 1.00 0.00 H new ATOM 0 HH11 ARG A 62 -21.656 -21.397 -2.165 1.00 0.00 H new ATOM 0 HH12 ARG A 62 -22.798 -22.738 -2.294 1.00 0.00 H new ATOM 0 HH21 ARG A 62 -25.451 -20.747 -3.456 1.00 0.00 H new ATOM 0 HH22 ARG A 62 -24.923 -22.374 -3.016 1.00 0.00 H new ATOM 1039 N LYS A 63 -20.867 -13.493 -0.664 1.00 0.00 N ATOM 1040 CA LYS A 63 -21.604 -12.644 0.275 1.00 0.00 C ATOM 1041 C LYS A 63 -21.146 -11.203 0.029 1.00 0.00 C ATOM 1042 O LYS A 63 -19.985 -10.902 0.290 1.00 0.00 O ATOM 1043 CB LYS A 63 -21.515 -13.080 1.758 1.00 0.00 C ATOM 1044 CG LYS A 63 -20.141 -13.521 2.273 1.00 0.00 C ATOM 1045 CD LYS A 63 -19.979 -13.481 3.807 1.00 0.00 C ATOM 1046 CE LYS A 63 -20.834 -14.516 4.541 1.00 0.00 C ATOM 1047 NZ LYS A 63 -20.512 -14.614 5.987 1.00 0.00 N ATOM 0 H LYS A 63 -19.904 -13.189 -0.806 1.00 0.00 H new ATOM 0 HA LYS A 63 -22.672 -12.743 0.081 1.00 0.00 H new ATOM 0 HB2 LYS A 63 -21.858 -12.250 2.376 1.00 0.00 H new ATOM 0 HB3 LYS A 63 -22.214 -13.902 1.912 1.00 0.00 H new ATOM 0 HG2 LYS A 63 -19.949 -14.537 1.928 1.00 0.00 H new ATOM 0 HG3 LYS A 63 -19.379 -12.883 1.825 1.00 0.00 H new ATOM 0 HD2 LYS A 63 -18.931 -13.645 4.058 1.00 0.00 H new ATOM 0 HD3 LYS A 63 -20.241 -12.486 4.166 1.00 0.00 H new ATOM 0 HE2 LYS A 63 -21.887 -14.257 4.426 1.00 0.00 H new ATOM 0 HE3 LYS A 63 -20.693 -15.492 4.076 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 -21.122 -15.330 6.431 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 -19.516 -14.888 6.103 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 -20.673 -13.693 6.442 1.00 0.00 H new ATOM 1061 N PRO A 64 -22.001 -10.301 -0.491 1.00 0.00 N ATOM 1062 CA PRO A 64 -21.628 -8.916 -0.761 1.00 0.00 C ATOM 1063 C PRO A 64 -21.443 -8.044 0.491 1.00 0.00 C ATOM 1064 O PRO A 64 -21.072 -6.874 0.337 1.00 0.00 O ATOM 1065 CB PRO A 64 -22.755 -8.358 -1.635 1.00 0.00 C ATOM 1066 CG PRO A 64 -23.974 -9.140 -1.166 1.00 0.00 C ATOM 1067 CD PRO A 64 -23.392 -10.519 -0.863 1.00 0.00 C ATOM 0 HA PRO A 64 -20.650 -8.897 -1.242 1.00 0.00 H new ATOM 0 HB2 PRO A 64 -22.884 -7.285 -1.490 1.00 0.00 H new ATOM 0 HB3 PRO A 64 -22.558 -8.515 -2.696 1.00 0.00 H new ATOM 0 HG2 PRO A 64 -24.429 -8.690 -0.284 1.00 0.00 H new ATOM 0 HG3 PRO A 64 -24.746 -9.186 -1.934 1.00 0.00 H new ATOM 0 HD2 PRO A 64 -23.940 -11.003 -0.055 1.00 0.00 H new ATOM 0 HD3 PRO A 64 -23.464 -11.172 -1.733 1.00 0.00 H new ATOM 1075 N ALA A 65 -21.749 -8.556 1.689 1.00 0.00 N ATOM 1076 CA ALA A 65 -21.615 -7.860 2.962 1.00 0.00 C ATOM 1077 C ALA A 65 -20.872 -8.791 3.915 1.00 0.00 C ATOM 1078 O ALA A 65 -21.242 -9.969 3.995 1.00 0.00 O ATOM 1079 CB ALA A 65 -22.992 -7.474 3.514 1.00 0.00 C ATOM 0 H ALA A 65 -22.110 -9.504 1.796 1.00 0.00 H new ATOM 0 HA ALA A 65 -21.057 -6.932 2.839 1.00 0.00 H new ATOM 0 HB1 ALA A 65 -22.870 -6.955 4.465 1.00 0.00 H new ATOM 0 HB2 ALA A 65 -23.497 -6.818 2.805 1.00 0.00 H new ATOM 0 HB3 ALA A 65 -23.589 -8.374 3.665 1.00 0.00 H new ATOM 1085 N LEU A 66 -19.849 -8.295 4.618 1.00 0.00 N ATOM 1086 CA LEU A 66 -19.018 -9.071 5.548 1.00 0.00 C ATOM 1087 C LEU A 66 -18.889 -8.365 6.892 1.00 0.00 C ATOM 1088 O LEU A 66 -19.078 -7.155 6.984 1.00 0.00 O ATOM 1089 CB LEU A 66 -17.584 -9.238 5.004 1.00 0.00 C ATOM 1090 CG LEU A 66 -17.421 -9.495 3.497 1.00 0.00 C ATOM 1091 CD1 LEU A 66 -15.935 -9.484 3.168 1.00 0.00 C ATOM 1092 CD2 LEU A 66 -17.996 -10.832 3.055 1.00 0.00 C ATOM 0 H LEU A 66 -19.567 -7.317 4.555 1.00 0.00 H new ATOM 0 HA LEU A 66 -19.509 -10.038 5.661 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -17.023 -8.338 5.254 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -17.116 -10.065 5.539 1.00 0.00 H new ATOM 0 HG LEU A 66 -17.968 -8.712 2.971 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -15.797 -9.665 2.102 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -15.512 -8.514 3.429 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -15.431 -10.265 3.737 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -17.850 -10.954 1.982 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -17.489 -11.639 3.584 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -19.062 -10.863 3.282 1.00 0.00 H new ATOM 1104 N THR A 67 -18.539 -9.117 7.931 1.00 0.00 N ATOM 1105 CA THR A 67 -18.349 -8.578 9.268 1.00 0.00 C ATOM 1106 C THR A 67 -16.989 -7.886 9.314 1.00 0.00 C ATOM 1107 O THR A 67 -16.080 -8.302 8.590 1.00 0.00 O ATOM 1108 CB THR A 67 -18.314 -9.732 10.293 1.00 0.00 C ATOM 1109 OG1 THR A 67 -19.089 -10.851 9.891 1.00 0.00 O ATOM 1110 CG2 THR A 67 -18.725 -9.250 11.686 1.00 0.00 C ATOM 0 H THR A 67 -18.379 -10.122 7.866 1.00 0.00 H new ATOM 0 HA THR A 67 -19.160 -7.889 9.502 1.00 0.00 H new ATOM 0 HB THR A 67 -17.279 -10.071 10.339 1.00 0.00 H new ATOM 0 HG1 THR A 67 -20.033 -10.594 9.842 1.00 0.00 H new ATOM 0 HG21 THR A 67 -18.690 -10.086 12.385 1.00 0.00 H new ATOM 0 HG22 THR A 67 -18.040 -8.470 12.018 1.00 0.00 H new ATOM 0 HG23 THR A 67 -19.738 -8.850 11.648 1.00 0.00 H new ATOM 1118 N MET A 68 -16.805 -6.911 10.210 1.00 0.00 N ATOM 1119 CA MET A 68 -15.531 -6.211 10.350 1.00 0.00 C ATOM 1120 C MET A 68 -14.437 -7.228 10.704 1.00 0.00 C ATOM 1121 O MET A 68 -13.369 -7.234 10.102 1.00 0.00 O ATOM 1122 CB MET A 68 -15.639 -5.107 11.408 1.00 0.00 C ATOM 1123 CG MET A 68 -14.455 -4.136 11.324 1.00 0.00 C ATOM 1124 SD MET A 68 -14.333 -3.163 9.791 1.00 0.00 S ATOM 1125 CE MET A 68 -15.864 -2.202 9.870 1.00 0.00 C ATOM 0 H MET A 68 -17.530 -6.589 10.852 1.00 0.00 H new ATOM 0 HA MET A 68 -15.268 -5.730 9.408 1.00 0.00 H new ATOM 0 HB2 MET A 68 -16.571 -4.559 11.271 1.00 0.00 H new ATOM 0 HB3 MET A 68 -15.675 -5.555 12.401 1.00 0.00 H new ATOM 0 HG2 MET A 68 -14.515 -3.446 12.166 1.00 0.00 H new ATOM 0 HG3 MET A 68 -13.534 -4.706 11.444 1.00 0.00 H new ATOM 0 HE1 MET A 68 -15.766 -1.310 9.252 1.00 0.00 H new ATOM 0 HE2 MET A 68 -16.693 -2.808 9.504 1.00 0.00 H new ATOM 0 HE3 MET A 68 -16.057 -1.909 10.902 1.00 0.00 H new ATOM 1135 N GLU A 69 -14.739 -8.145 11.628 1.00 0.00 N ATOM 1136 CA GLU A 69 -13.841 -9.201 12.086 1.00 0.00 C ATOM 1137 C GLU A 69 -13.345 -10.055 10.915 1.00 0.00 C ATOM 1138 O GLU A 69 -12.159 -10.367 10.791 1.00 0.00 O ATOM 1139 CB GLU A 69 -14.637 -10.077 13.066 1.00 0.00 C ATOM 1140 CG GLU A 69 -13.846 -11.279 13.598 1.00 0.00 C ATOM 1141 CD GLU A 69 -14.760 -12.170 14.435 1.00 0.00 C ATOM 1142 OE1 GLU A 69 -15.434 -13.051 13.845 1.00 0.00 O ATOM 1143 OE2 GLU A 69 -14.841 -11.961 15.662 1.00 0.00 O ATOM 0 H GLU A 69 -15.647 -8.170 12.091 1.00 0.00 H new ATOM 0 HA GLU A 69 -12.964 -8.763 12.563 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -14.960 -9.464 13.908 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -15.538 -10.437 12.569 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -13.429 -11.848 12.767 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -13.006 -10.935 14.202 1.00 0.00 H new ATOM 1150 N VAL A 70 -14.292 -10.456 10.072 1.00 0.00 N ATOM 1151 CA VAL A 70 -14.073 -11.282 8.906 1.00 0.00 C ATOM 1152 C VAL A 70 -13.149 -10.554 7.931 1.00 0.00 C ATOM 1153 O VAL A 70 -12.090 -11.093 7.609 1.00 0.00 O ATOM 1154 CB VAL A 70 -15.449 -11.684 8.341 1.00 0.00 C ATOM 1155 CG1 VAL A 70 -15.361 -12.365 6.982 1.00 0.00 C ATOM 1156 CG2 VAL A 70 -16.169 -12.640 9.306 1.00 0.00 C ATOM 0 H VAL A 70 -15.272 -10.199 10.195 1.00 0.00 H new ATOM 0 HA VAL A 70 -13.554 -12.211 9.140 1.00 0.00 H new ATOM 0 HB VAL A 70 -16.004 -10.754 8.224 1.00 0.00 H new ATOM 0 HG11 VAL A 70 -16.363 -12.623 6.639 1.00 0.00 H new ATOM 0 HG12 VAL A 70 -14.895 -11.688 6.266 1.00 0.00 H new ATOM 0 HG13 VAL A 70 -14.762 -13.272 7.067 1.00 0.00 H new ATOM 0 HG21 VAL A 70 -17.139 -12.913 8.891 1.00 0.00 H new ATOM 0 HG22 VAL A 70 -15.567 -13.538 9.445 1.00 0.00 H new ATOM 0 HG23 VAL A 70 -16.312 -12.147 10.268 1.00 0.00 H new ATOM 1166 N VAL A 71 -13.513 -9.351 7.463 1.00 0.00 N ATOM 1167 CA VAL A 71 -12.663 -8.612 6.523 1.00 0.00 C ATOM 1168 C VAL A 71 -11.278 -8.309 7.116 1.00 0.00 C ATOM 1169 O VAL A 71 -10.303 -8.235 6.383 1.00 0.00 O ATOM 1170 CB VAL A 71 -13.368 -7.351 5.982 1.00 0.00 C ATOM 1171 CG1 VAL A 71 -13.730 -6.333 7.062 1.00 0.00 C ATOM 1172 CG2 VAL A 71 -12.517 -6.659 4.908 1.00 0.00 C ATOM 0 H VAL A 71 -14.379 -8.876 7.717 1.00 0.00 H new ATOM 0 HA VAL A 71 -12.491 -9.261 5.664 1.00 0.00 H new ATOM 0 HB VAL A 71 -14.301 -7.712 5.550 1.00 0.00 H new ATOM 0 HG11 VAL A 71 -14.222 -5.475 6.603 1.00 0.00 H new ATOM 0 HG12 VAL A 71 -14.403 -6.794 7.785 1.00 0.00 H new ATOM 0 HG13 VAL A 71 -12.824 -6.003 7.569 1.00 0.00 H new ATOM 0 HG21 VAL A 71 -13.039 -5.774 4.545 1.00 0.00 H new ATOM 0 HG22 VAL A 71 -11.559 -6.365 5.336 1.00 0.00 H new ATOM 0 HG23 VAL A 71 -12.348 -7.346 4.079 1.00 0.00 H new ATOM 1182 N CYS A 72 -11.164 -8.158 8.428 1.00 0.00 N ATOM 1183 CA CYS A 72 -9.918 -7.857 9.123 1.00 0.00 C ATOM 1184 C CYS A 72 -8.916 -8.988 8.868 1.00 0.00 C ATOM 1185 O CYS A 72 -7.804 -8.758 8.362 1.00 0.00 O ATOM 1186 CB CYS A 72 -10.235 -7.635 10.610 1.00 0.00 C ATOM 1187 SG CYS A 72 -8.778 -7.134 11.555 1.00 0.00 S ATOM 0 H CYS A 72 -11.961 -8.244 9.059 1.00 0.00 H new ATOM 0 HA CYS A 72 -9.453 -6.943 8.752 1.00 0.00 H new ATOM 0 HB2 CYS A 72 -11.007 -6.871 10.704 1.00 0.00 H new ATOM 0 HB3 CYS A 72 -10.642 -8.553 11.033 1.00 0.00 H new ATOM 0 HG CYS A 72 -9.107 -6.960 12.800 1.00 0.00 H new ATOM 1193 N ALA A 73 -9.319 -10.213 9.227 1.00 0.00 N ATOM 1194 CA ALA A 73 -8.486 -11.390 9.033 1.00 0.00 C ATOM 1195 C ALA A 73 -8.246 -11.629 7.536 1.00 0.00 C ATOM 1196 O ALA A 73 -7.158 -12.030 7.130 1.00 0.00 O ATOM 1197 CB ALA A 73 -9.162 -12.606 9.674 1.00 0.00 C ATOM 0 H ALA A 73 -10.224 -10.408 9.655 1.00 0.00 H new ATOM 0 HA ALA A 73 -7.519 -11.231 9.511 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -8.538 -13.488 9.529 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -9.295 -12.428 10.741 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -10.134 -12.769 9.209 1.00 0.00 H new ATOM 1203 N ARG A 74 -9.241 -11.348 6.695 1.00 0.00 N ATOM 1204 CA ARG A 74 -9.159 -11.540 5.256 1.00 0.00 C ATOM 1205 C ARG A 74 -8.224 -10.576 4.555 1.00 0.00 C ATOM 1206 O ARG A 74 -7.500 -10.995 3.655 1.00 0.00 O ATOM 1207 CB ARG A 74 -10.576 -11.411 4.694 1.00 0.00 C ATOM 1208 CG ARG A 74 -11.177 -12.808 4.536 1.00 0.00 C ATOM 1209 CD ARG A 74 -10.657 -13.441 3.237 1.00 0.00 C ATOM 1210 NE ARG A 74 -11.063 -14.845 3.138 1.00 0.00 N ATOM 1211 CZ ARG A 74 -11.081 -15.551 2.007 1.00 0.00 C ATOM 1212 NH1 ARG A 74 -10.466 -15.106 0.918 1.00 0.00 N ATOM 1213 NH2 ARG A 74 -11.739 -16.699 1.989 1.00 0.00 N ATOM 0 H ARG A 74 -10.139 -10.975 7.004 1.00 0.00 H new ATOM 0 HA ARG A 74 -8.736 -12.527 5.071 1.00 0.00 H new ATOM 0 HB2 ARG A 74 -11.193 -10.809 5.362 1.00 0.00 H new ATOM 0 HB3 ARG A 74 -10.554 -10.899 3.732 1.00 0.00 H new ATOM 0 HG2 ARG A 74 -10.909 -13.430 5.390 1.00 0.00 H new ATOM 0 HG3 ARG A 74 -12.265 -12.748 4.514 1.00 0.00 H new ATOM 0 HD2 ARG A 74 -11.039 -12.887 2.380 1.00 0.00 H new ATOM 0 HD3 ARG A 74 -9.570 -13.370 3.203 1.00 0.00 H new ATOM 0 HE ARG A 74 -11.353 -15.316 3.995 1.00 0.00 H new ATOM 0 HH11 ARG A 74 -9.972 -14.214 0.940 1.00 0.00 H new ATOM 0 HH12 ARG A 74 -10.488 -15.656 0.059 1.00 0.00 H new ATOM 0 HH21 ARG A 74 -12.218 -17.026 2.828 1.00 0.00 H new ATOM 0 HH22 ARG A 74 -11.767 -17.257 1.136 1.00 0.00 H new ATOM 1227 N MET A 75 -8.237 -9.304 4.931 1.00 0.00 N ATOM 1228 CA MET A 75 -7.393 -8.292 4.325 1.00 0.00 C ATOM 1229 C MET A 75 -5.951 -8.592 4.668 1.00 0.00 C ATOM 1230 O MET A 75 -5.106 -8.497 3.781 1.00 0.00 O ATOM 1231 CB MET A 75 -7.803 -6.886 4.773 1.00 0.00 C ATOM 1232 CG MET A 75 -9.104 -6.477 4.092 1.00 0.00 C ATOM 1233 SD MET A 75 -8.987 -6.171 2.313 1.00 0.00 S ATOM 1234 CE MET A 75 -10.644 -6.745 1.873 1.00 0.00 C ATOM 0 H MET A 75 -8.840 -8.946 5.672 1.00 0.00 H new ATOM 0 HA MET A 75 -7.513 -8.317 3.242 1.00 0.00 H new ATOM 0 HB2 MET A 75 -7.927 -6.863 5.856 1.00 0.00 H new ATOM 0 HB3 MET A 75 -7.015 -6.174 4.527 1.00 0.00 H new ATOM 0 HG2 MET A 75 -9.844 -7.259 4.261 1.00 0.00 H new ATOM 0 HG3 MET A 75 -9.479 -5.574 4.575 1.00 0.00 H new ATOM 0 HE1 MET A 75 -10.741 -6.778 0.788 1.00 0.00 H new ATOM 0 HE2 MET A 75 -10.804 -7.742 2.282 1.00 0.00 H new ATOM 0 HE3 MET A 75 -11.387 -6.061 2.283 1.00 0.00 H new ATOM 1244 N VAL A 76 -5.646 -8.959 5.916 1.00 0.00 N ATOM 1245 CA VAL A 76 -4.254 -9.270 6.216 1.00 0.00 C ATOM 1246 C VAL A 76 -3.856 -10.583 5.511 1.00 0.00 C ATOM 1247 O VAL A 76 -2.751 -10.685 4.973 1.00 0.00 O ATOM 1248 CB VAL A 76 -4.025 -9.228 7.732 1.00 0.00 C ATOM 1249 CG1 VAL A 76 -4.687 -10.386 8.474 1.00 0.00 C ATOM 1250 CG2 VAL A 76 -2.536 -9.154 8.050 1.00 0.00 C ATOM 0 H VAL A 76 -6.303 -9.044 6.691 1.00 0.00 H new ATOM 0 HA VAL A 76 -3.577 -8.516 5.814 1.00 0.00 H new ATOM 0 HB VAL A 76 -4.509 -8.321 8.093 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -4.486 -10.296 9.542 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -5.763 -10.359 8.304 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -4.285 -11.330 8.107 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -2.396 -9.125 9.131 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -2.033 -10.031 7.642 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -2.113 -8.253 7.605 1.00 0.00 H new ATOM 1260 N ASP A 77 -4.773 -11.559 5.425 1.00 0.00 N ATOM 1261 CA ASP A 77 -4.516 -12.848 4.773 1.00 0.00 C ATOM 1262 C ASP A 77 -4.327 -12.692 3.268 1.00 0.00 C ATOM 1263 O ASP A 77 -3.672 -13.526 2.638 1.00 0.00 O ATOM 1264 CB ASP A 77 -5.659 -13.849 5.010 1.00 0.00 C ATOM 1265 CG ASP A 77 -5.619 -14.554 6.362 1.00 0.00 C ATOM 1266 OD1 ASP A 77 -4.575 -14.545 7.056 1.00 0.00 O ATOM 1267 OD2 ASP A 77 -6.613 -15.248 6.681 1.00 0.00 O ATOM 0 H ASP A 77 -5.715 -11.474 5.807 1.00 0.00 H new ATOM 0 HA ASP A 77 -3.599 -13.229 5.222 1.00 0.00 H new ATOM 0 HB2 ASP A 77 -6.609 -13.323 4.918 1.00 0.00 H new ATOM 0 HB3 ASP A 77 -5.634 -14.602 4.222 1.00 0.00 H new ATOM 1272 N SER A 78 -4.879 -11.627 2.683 1.00 0.00 N ATOM 1273 CA SER A 78 -4.786 -11.315 1.267 1.00 0.00 C ATOM 1274 C SER A 78 -3.350 -10.965 0.869 1.00 0.00 C ATOM 1275 O SER A 78 -3.023 -10.977 -0.321 1.00 0.00 O ATOM 1276 CB SER A 78 -5.729 -10.144 0.955 1.00 0.00 C ATOM 1277 OG SER A 78 -7.070 -10.584 1.024 1.00 0.00 O ATOM 0 H SER A 78 -5.420 -10.938 3.206 1.00 0.00 H new ATOM 0 HA SER A 78 -5.080 -12.192 0.690 1.00 0.00 H new ATOM 0 HB2 SER A 78 -5.565 -9.333 1.664 1.00 0.00 H new ATOM 0 HB3 SER A 78 -5.516 -9.747 -0.038 1.00 0.00 H new ATOM 0 HG SER A 78 -7.369 -10.576 1.957 1.00 0.00 H new ATOM 1283 N CYS A 79 -2.487 -10.680 1.847 1.00 0.00 N ATOM 1284 CA CYS A 79 -1.105 -10.312 1.654 1.00 0.00 C ATOM 1285 C CYS A 79 -0.185 -11.045 2.623 1.00 0.00 C ATOM 1286 O CYS A 79 0.506 -10.435 3.438 1.00 0.00 O ATOM 1287 CB CYS A 79 -0.999 -8.799 1.728 1.00 0.00 C ATOM 1288 SG CYS A 79 -1.677 -8.046 0.220 1.00 0.00 S ATOM 0 H CYS A 79 -2.755 -10.704 2.831 1.00 0.00 H new ATOM 0 HA CYS A 79 -0.763 -10.626 0.668 1.00 0.00 H new ATOM 0 HB2 CYS A 79 -1.539 -8.432 2.601 1.00 0.00 H new ATOM 0 HB3 CYS A 79 0.044 -8.506 1.852 1.00 0.00 H new ATOM 0 HG CYS A 79 -2.291 -8.953 -0.480 1.00 0.00 H new ATOM 1294 N GLN A 80 -0.143 -12.371 2.510 1.00 0.00 N ATOM 1295 CA GLN A 80 0.720 -13.253 3.296 1.00 0.00 C ATOM 1296 C GLN A 80 2.101 -13.206 2.606 1.00 0.00 C ATOM 1297 O GLN A 80 2.690 -14.216 2.229 1.00 0.00 O ATOM 1298 CB GLN A 80 0.107 -14.666 3.427 1.00 0.00 C ATOM 1299 CG GLN A 80 -0.563 -15.209 2.155 1.00 0.00 C ATOM 1300 CD GLN A 80 -1.153 -16.613 2.271 1.00 0.00 C ATOM 1301 OE1 GLN A 80 -0.994 -17.424 1.361 1.00 0.00 O ATOM 1302 NE2 GLN A 80 -1.886 -16.940 3.320 1.00 0.00 N ATOM 0 H GLN A 80 -0.728 -12.879 1.847 1.00 0.00 H new ATOM 0 HA GLN A 80 0.826 -12.930 4.331 1.00 0.00 H new ATOM 0 HB2 GLN A 80 0.893 -15.359 3.729 1.00 0.00 H new ATOM 0 HB3 GLN A 80 -0.631 -14.652 4.229 1.00 0.00 H new ATOM 0 HG2 GLN A 80 -1.358 -14.523 1.863 1.00 0.00 H new ATOM 0 HG3 GLN A 80 0.171 -15.208 1.350 1.00 0.00 H new ATOM 0 HE21 GLN A 80 -2.020 -16.270 4.077 1.00 0.00 H new ATOM 0 HE22 GLN A 80 -2.318 -17.863 3.373 1.00 0.00 H new ATOM 1311 N THR A 81 2.604 -11.992 2.395 1.00 0.00 N ATOM 1312 CA THR A 81 3.835 -11.611 1.758 1.00 0.00 C ATOM 1313 C THR A 81 4.687 -11.081 2.904 1.00 0.00 C ATOM 1314 O THR A 81 4.922 -11.818 3.874 1.00 0.00 O ATOM 1315 CB THR A 81 3.495 -10.638 0.586 1.00 0.00 C ATOM 1316 OG1 THR A 81 4.594 -9.894 0.094 1.00 0.00 O ATOM 1317 CG2 THR A 81 2.385 -9.641 0.911 1.00 0.00 C ATOM 0 H THR A 81 2.090 -11.168 2.707 1.00 0.00 H new ATOM 0 HA THR A 81 4.407 -12.396 1.264 1.00 0.00 H new ATOM 0 HB THR A 81 3.161 -11.332 -0.185 1.00 0.00 H new ATOM 0 HG1 THR A 81 4.295 -9.313 -0.637 1.00 0.00 H new ATOM 0 HG21 THR A 81 2.207 -9.000 0.047 1.00 0.00 H new ATOM 0 HG22 THR A 81 1.471 -10.182 1.156 1.00 0.00 H new ATOM 0 HG23 THR A 81 2.684 -9.028 1.762 1.00 0.00 H new ATOM 1325 N ALA A 82 5.066 -9.808 2.852 1.00 0.00 N ATOM 1326 CA ALA A 82 5.887 -9.152 3.837 1.00 0.00 C ATOM 1327 C ALA A 82 5.558 -7.662 3.903 1.00 0.00 C ATOM 1328 O ALA A 82 6.258 -6.807 3.355 1.00 0.00 O ATOM 1329 CB ALA A 82 7.328 -9.425 3.443 1.00 0.00 C ATOM 0 H ALA A 82 4.793 -9.190 2.088 1.00 0.00 H new ATOM 0 HA ALA A 82 5.704 -9.532 4.842 1.00 0.00 H new ATOM 0 HB1 ALA A 82 7.998 -8.948 4.159 1.00 0.00 H new ATOM 0 HB2 ALA A 82 7.507 -10.500 3.439 1.00 0.00 H new ATOM 0 HB3 ALA A 82 7.516 -9.022 2.448 1.00 0.00 H new ATOM 1335 N LEU A 83 4.416 -7.361 4.513 1.00 0.00 N ATOM 1336 CA LEU A 83 3.865 -6.043 4.767 1.00 0.00 C ATOM 1337 C LEU A 83 3.260 -6.095 6.173 1.00 0.00 C ATOM 1338 O LEU A 83 3.112 -7.180 6.746 1.00 0.00 O ATOM 1339 CB LEU A 83 2.832 -5.647 3.699 1.00 0.00 C ATOM 1340 CG LEU A 83 1.805 -6.721 3.260 1.00 0.00 C ATOM 1341 CD1 LEU A 83 1.027 -7.403 4.384 1.00 0.00 C ATOM 1342 CD2 LEU A 83 0.862 -6.091 2.242 1.00 0.00 C ATOM 0 H LEU A 83 3.806 -8.096 4.870 1.00 0.00 H new ATOM 0 HA LEU A 83 4.636 -5.274 4.713 1.00 0.00 H new ATOM 0 HB2 LEU A 83 2.278 -4.785 4.071 1.00 0.00 H new ATOM 0 HB3 LEU A 83 3.375 -5.319 2.812 1.00 0.00 H new ATOM 0 HG LEU A 83 2.381 -7.538 2.825 1.00 0.00 H new ATOM 0 HD11 LEU A 83 0.339 -8.134 3.959 1.00 0.00 H new ATOM 0 HD12 LEU A 83 1.723 -7.907 5.055 1.00 0.00 H new ATOM 0 HD13 LEU A 83 0.463 -6.655 4.942 1.00 0.00 H new ATOM 0 HD21 LEU A 83 0.129 -6.830 1.919 1.00 0.00 H new ATOM 0 HD22 LEU A 83 0.347 -5.245 2.698 1.00 0.00 H new ATOM 0 HD23 LEU A 83 1.434 -5.746 1.381 1.00 0.00 H new ATOM 1354 N SER A 84 2.936 -4.934 6.736 1.00 0.00 N ATOM 1355 CA SER A 84 2.339 -4.805 8.056 1.00 0.00 C ATOM 1356 C SER A 84 0.838 -4.513 7.902 1.00 0.00 C ATOM 1357 O SER A 84 0.423 -4.013 6.843 1.00 0.00 O ATOM 1358 CB SER A 84 3.098 -3.710 8.807 1.00 0.00 C ATOM 1359 OG SER A 84 4.354 -4.208 9.242 1.00 0.00 O ATOM 0 H SER A 84 3.086 -4.037 6.273 1.00 0.00 H new ATOM 0 HA SER A 84 2.418 -5.724 8.637 1.00 0.00 H new ATOM 0 HB2 SER A 84 3.244 -2.846 8.159 1.00 0.00 H new ATOM 0 HB3 SER A 84 2.514 -3.372 9.663 1.00 0.00 H new ATOM 0 HG SER A 84 4.837 -3.503 9.721 1.00 0.00 H new ATOM 1365 N PRO A 85 0.020 -4.778 8.939 1.00 0.00 N ATOM 1366 CA PRO A 85 -1.415 -4.553 8.873 1.00 0.00 C ATOM 1367 C PRO A 85 -1.761 -3.069 8.782 1.00 0.00 C ATOM 1368 O PRO A 85 -2.752 -2.729 8.137 1.00 0.00 O ATOM 1369 CB PRO A 85 -1.998 -5.208 10.124 1.00 0.00 C ATOM 1370 CG PRO A 85 -0.841 -5.204 11.122 1.00 0.00 C ATOM 1371 CD PRO A 85 0.387 -5.357 10.227 1.00 0.00 C ATOM 0 HA PRO A 85 -1.840 -4.990 7.969 1.00 0.00 H new ATOM 0 HB2 PRO A 85 -2.854 -4.650 10.504 1.00 0.00 H new ATOM 0 HB3 PRO A 85 -2.344 -6.221 9.919 1.00 0.00 H new ATOM 0 HG2 PRO A 85 -0.808 -4.279 11.697 1.00 0.00 H new ATOM 0 HG3 PRO A 85 -0.923 -6.022 11.838 1.00 0.00 H new ATOM 0 HD2 PRO A 85 1.248 -4.843 10.655 1.00 0.00 H new ATOM 0 HD3 PRO A 85 0.663 -6.406 10.119 1.00 0.00 H new ATOM 1379 N GLY A 86 -0.938 -2.178 9.344 1.00 0.00 N ATOM 1380 CA GLY A 86 -1.182 -0.747 9.300 1.00 0.00 C ATOM 1381 C GLY A 86 -1.350 -0.266 7.864 1.00 0.00 C ATOM 1382 O GLY A 86 -2.305 0.454 7.581 1.00 0.00 O ATOM 0 H GLY A 86 -0.085 -2.437 9.841 1.00 0.00 H new ATOM 0 HA2 GLY A 86 -2.078 -0.509 9.874 1.00 0.00 H new ATOM 0 HA3 GLY A 86 -0.353 -0.218 9.770 1.00 0.00 H new ATOM 1386 N GLU A 87 -0.492 -0.708 6.938 1.00 0.00 N ATOM 1387 CA GLU A 87 -0.572 -0.315 5.534 1.00 0.00 C ATOM 1388 C GLU A 87 -1.869 -0.828 4.899 1.00 0.00 C ATOM 1389 O GLU A 87 -2.442 -0.165 4.028 1.00 0.00 O ATOM 1390 CB GLU A 87 0.615 -0.925 4.762 1.00 0.00 C ATOM 1391 CG GLU A 87 1.997 -0.344 5.053 1.00 0.00 C ATOM 1392 CD GLU A 87 2.201 1.019 4.398 1.00 0.00 C ATOM 1393 OE1 GLU A 87 1.394 1.939 4.644 1.00 0.00 O ATOM 1394 OE2 GLU A 87 3.182 1.154 3.621 1.00 0.00 O ATOM 0 H GLU A 87 0.275 -1.348 7.144 1.00 0.00 H new ATOM 0 HA GLU A 87 -0.548 0.774 5.483 1.00 0.00 H new ATOM 0 HB2 GLU A 87 0.644 -1.994 4.973 1.00 0.00 H new ATOM 0 HB3 GLU A 87 0.418 -0.816 3.695 1.00 0.00 H new ATOM 0 HG2 GLU A 87 2.130 -0.250 6.131 1.00 0.00 H new ATOM 0 HG3 GLU A 87 2.761 -1.034 4.696 1.00 0.00 H new ATOM 1401 N MET A 88 -2.304 -2.030 5.289 1.00 0.00 N ATOM 1402 CA MET A 88 -3.519 -2.656 4.784 1.00 0.00 C ATOM 1403 C MET A 88 -4.686 -1.766 5.177 1.00 0.00 C ATOM 1404 O MET A 88 -5.504 -1.393 4.341 1.00 0.00 O ATOM 1405 CB MET A 88 -3.675 -4.078 5.368 1.00 0.00 C ATOM 1406 CG MET A 88 -4.664 -4.966 4.601 1.00 0.00 C ATOM 1407 SD MET A 88 -4.366 -5.130 2.829 1.00 0.00 S ATOM 1408 CE MET A 88 -2.893 -6.161 2.900 1.00 0.00 C ATOM 0 H MET A 88 -1.810 -2.600 5.976 1.00 0.00 H new ATOM 0 HA MET A 88 -3.480 -2.761 3.700 1.00 0.00 H new ATOM 0 HB2 MET A 88 -2.699 -4.564 5.378 1.00 0.00 H new ATOM 0 HB3 MET A 88 -4.003 -3.999 6.405 1.00 0.00 H new ATOM 0 HG2 MET A 88 -4.649 -5.961 5.046 1.00 0.00 H new ATOM 0 HG3 MET A 88 -5.668 -4.567 4.745 1.00 0.00 H new ATOM 0 HE1 MET A 88 -2.147 -5.778 2.203 1.00 0.00 H new ATOM 0 HE2 MET A 88 -2.487 -6.146 3.911 1.00 0.00 H new ATOM 0 HE3 MET A 88 -3.152 -7.184 2.628 1.00 0.00 H new ATOM 1418 N GLU A 89 -4.729 -1.397 6.452 1.00 0.00 N ATOM 1419 CA GLU A 89 -5.753 -0.567 7.049 1.00 0.00 C ATOM 1420 C GLU A 89 -5.724 0.834 6.449 1.00 0.00 C ATOM 1421 O GLU A 89 -6.793 1.404 6.219 1.00 0.00 O ATOM 1422 CB GLU A 89 -5.589 -0.635 8.569 1.00 0.00 C ATOM 1423 CG GLU A 89 -6.041 -2.031 9.009 1.00 0.00 C ATOM 1424 CD GLU A 89 -5.973 -2.243 10.520 1.00 0.00 C ATOM 1425 OE1 GLU A 89 -6.857 -1.713 11.235 1.00 0.00 O ATOM 1426 OE2 GLU A 89 -5.135 -3.047 10.995 1.00 0.00 O ATOM 0 H GLU A 89 -4.016 -1.684 7.123 1.00 0.00 H new ATOM 0 HA GLU A 89 -6.756 -0.929 6.824 1.00 0.00 H new ATOM 0 HB2 GLU A 89 -4.551 -0.459 8.853 1.00 0.00 H new ATOM 0 HB3 GLU A 89 -6.188 0.135 9.056 1.00 0.00 H new ATOM 0 HG2 GLU A 89 -7.064 -2.196 8.672 1.00 0.00 H new ATOM 0 HG3 GLU A 89 -5.419 -2.778 8.516 1.00 0.00 H new ATOM 1433 N LYS A 90 -4.540 1.364 6.118 1.00 0.00 N ATOM 1434 CA LYS A 90 -4.410 2.675 5.493 1.00 0.00 C ATOM 1435 C LYS A 90 -5.122 2.657 4.151 1.00 0.00 C ATOM 1436 O LYS A 90 -5.742 3.649 3.779 1.00 0.00 O ATOM 1437 CB LYS A 90 -2.937 3.060 5.269 1.00 0.00 C ATOM 1438 CG LYS A 90 -2.269 3.605 6.529 1.00 0.00 C ATOM 1439 CD LYS A 90 -2.776 5.016 6.845 1.00 0.00 C ATOM 1440 CE LYS A 90 -2.177 5.570 8.136 1.00 0.00 C ATOM 1441 NZ LYS A 90 -0.820 6.110 7.945 1.00 0.00 N ATOM 0 H LYS A 90 -3.650 0.893 6.278 1.00 0.00 H new ATOM 0 HA LYS A 90 -4.855 3.411 6.162 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -2.387 2.186 4.921 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -2.878 3.809 4.479 1.00 0.00 H new ATOM 0 HG2 LYS A 90 -2.474 2.943 7.370 1.00 0.00 H new ATOM 0 HG3 LYS A 90 -1.188 3.624 6.394 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -2.530 5.682 6.018 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -3.863 4.999 6.929 1.00 0.00 H new ATOM 0 HE2 LYS A 90 -2.825 6.355 8.525 1.00 0.00 H new ATOM 0 HE3 LYS A 90 -2.147 4.780 8.887 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 -0.460 6.473 8.851 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 -0.192 5.356 7.600 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 -0.849 6.883 7.249 1.00 0.00 H new ATOM 1455 N HIS A 91 -5.031 1.545 3.417 1.00 0.00 N ATOM 1456 CA HIS A 91 -5.690 1.478 2.121 1.00 0.00 C ATOM 1457 C HIS A 91 -7.199 1.443 2.294 1.00 0.00 C ATOM 1458 O HIS A 91 -7.927 2.094 1.543 1.00 0.00 O ATOM 1459 CB HIS A 91 -5.125 0.317 1.321 1.00 0.00 C ATOM 1460 CG HIS A 91 -5.785 0.114 -0.018 1.00 0.00 C ATOM 1461 ND1 HIS A 91 -5.311 0.602 -1.210 1.00 0.00 N ATOM 1462 CD2 HIS A 91 -6.961 -0.542 -0.268 1.00 0.00 C ATOM 1463 CE1 HIS A 91 -6.203 0.278 -2.160 1.00 0.00 C ATOM 1464 NE2 HIS A 91 -7.221 -0.429 -1.639 1.00 0.00 N ATOM 0 H HIS A 91 -4.522 0.705 3.691 1.00 0.00 H new ATOM 0 HA HIS A 91 -5.485 2.378 1.541 1.00 0.00 H new ATOM 0 HB2 HIS A 91 -4.058 0.481 1.167 1.00 0.00 H new ATOM 0 HB3 HIS A 91 -5.226 -0.597 1.906 1.00 0.00 H new ATOM 0 HD1 HIS A 91 -4.441 1.116 -1.349 1.00 0.00 H new ATOM 0 HD2 HIS A 91 -7.575 -1.053 0.459 1.00 0.00 H new ATOM 0 HE1 HIS A 91 -6.115 0.549 -3.202 1.00 0.00 H new ATOM 1472 N LEU A 92 -7.680 0.725 3.309 1.00 0.00 N ATOM 1473 CA LEU A 92 -9.108 0.642 3.559 1.00 0.00 C ATOM 1474 C LEU A 92 -9.669 2.012 3.907 1.00 0.00 C ATOM 1475 O LEU A 92 -10.831 2.253 3.570 1.00 0.00 O ATOM 1476 CB LEU A 92 -9.437 -0.350 4.688 1.00 0.00 C ATOM 1477 CG LEU A 92 -8.893 -1.758 4.425 1.00 0.00 C ATOM 1478 CD1 LEU A 92 -9.084 -2.670 5.635 1.00 0.00 C ATOM 1479 CD2 LEU A 92 -9.503 -2.416 3.183 1.00 0.00 C ATOM 0 H LEU A 92 -7.102 0.198 3.964 1.00 0.00 H new ATOM 0 HA LEU A 92 -9.573 0.279 2.642 1.00 0.00 H new ATOM 0 HB2 LEU A 92 -9.024 0.024 5.625 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -10.518 -0.402 4.815 1.00 0.00 H new ATOM 0 HG LEU A 92 -7.827 -1.627 4.239 1.00 0.00 H new ATOM 0 HD11 LEU A 92 -8.686 -3.660 5.411 1.00 0.00 H new ATOM 0 HD12 LEU A 92 -8.556 -2.252 6.492 1.00 0.00 H new ATOM 0 HD13 LEU A 92 -10.146 -2.750 5.866 1.00 0.00 H new ATOM 0 HD21 LEU A 92 -9.077 -3.411 3.052 1.00 0.00 H new ATOM 0 HD22 LEU A 92 -10.583 -2.498 3.308 1.00 0.00 H new ATOM 0 HD23 LEU A 92 -9.284 -1.809 2.305 1.00 0.00 H new ATOM 1491 N VAL A 93 -8.919 2.887 4.598 1.00 0.00 N ATOM 1492 CA VAL A 93 -9.460 4.195 4.941 1.00 0.00 C ATOM 1493 C VAL A 93 -9.378 5.081 3.714 1.00 0.00 C ATOM 1494 O VAL A 93 -10.392 5.657 3.342 1.00 0.00 O ATOM 1495 CB VAL A 93 -8.836 4.797 6.222 1.00 0.00 C ATOM 1496 CG1 VAL A 93 -7.309 4.873 6.239 1.00 0.00 C ATOM 1497 CG2 VAL A 93 -9.393 6.193 6.529 1.00 0.00 C ATOM 0 H VAL A 93 -7.966 2.713 4.918 1.00 0.00 H new ATOM 0 HA VAL A 93 -10.510 4.099 5.216 1.00 0.00 H new ATOM 0 HB VAL A 93 -9.126 4.084 6.993 1.00 0.00 H new ATOM 0 HG11 VAL A 93 -6.977 5.310 7.181 1.00 0.00 H new ATOM 0 HG12 VAL A 93 -6.894 3.870 6.138 1.00 0.00 H new ATOM 0 HG13 VAL A 93 -6.966 5.493 5.411 1.00 0.00 H new ATOM 0 HG21 VAL A 93 -8.928 6.579 7.436 1.00 0.00 H new ATOM 0 HG22 VAL A 93 -9.175 6.863 5.697 1.00 0.00 H new ATOM 0 HG23 VAL A 93 -10.472 6.131 6.672 1.00 0.00 H new ATOM 1507 N LEU A 94 -8.229 5.132 3.037 1.00 0.00 N ATOM 1508 CA LEU A 94 -8.049 5.974 1.865 1.00 0.00 C ATOM 1509 C LEU A 94 -9.100 5.732 0.780 1.00 0.00 C ATOM 1510 O LEU A 94 -9.582 6.707 0.198 1.00 0.00 O ATOM 1511 CB LEU A 94 -6.587 5.909 1.395 1.00 0.00 C ATOM 1512 CG LEU A 94 -6.274 4.980 0.228 1.00 0.00 C ATOM 1513 CD1 LEU A 94 -6.435 5.716 -1.104 1.00 0.00 C ATOM 1514 CD2 LEU A 94 -4.813 4.506 0.303 1.00 0.00 C ATOM 0 H LEU A 94 -7.402 4.590 3.289 1.00 0.00 H new ATOM 0 HA LEU A 94 -8.236 7.011 2.143 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -6.275 6.916 1.119 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -5.972 5.606 2.243 1.00 0.00 H new ATOM 0 HG LEU A 94 -6.963 4.137 0.288 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -6.207 5.036 -1.925 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -7.461 6.072 -1.201 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -5.752 6.565 -1.136 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -4.602 3.843 -0.536 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -4.148 5.369 0.260 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -4.652 3.970 1.238 1.00 0.00 H new ATOM 1526 N LEU A 95 -9.476 4.474 0.509 1.00 0.00 N ATOM 1527 CA LEU A 95 -10.487 4.180 -0.501 1.00 0.00 C ATOM 1528 C LEU A 95 -11.860 4.500 0.058 1.00 0.00 C ATOM 1529 O LEU A 95 -12.641 5.154 -0.624 1.00 0.00 O ATOM 1530 CB LEU A 95 -10.433 2.721 -0.996 1.00 0.00 C ATOM 1531 CG LEU A 95 -9.690 2.603 -2.340 1.00 0.00 C ATOM 1532 CD1 LEU A 95 -8.204 2.894 -2.189 1.00 0.00 C ATOM 1533 CD2 LEU A 95 -9.919 1.238 -2.979 1.00 0.00 C ATOM 0 H LEU A 95 -9.094 3.652 0.976 1.00 0.00 H new ATOM 0 HA LEU A 95 -10.279 4.806 -1.369 1.00 0.00 H new ATOM 0 HB2 LEU A 95 -9.936 2.102 -0.250 1.00 0.00 H new ATOM 0 HB3 LEU A 95 -11.447 2.336 -1.106 1.00 0.00 H new ATOM 0 HG LEU A 95 -10.105 3.360 -3.006 1.00 0.00 H new ATOM 0 HD11 LEU A 95 -7.715 2.801 -3.158 1.00 0.00 H new ATOM 0 HD12 LEU A 95 -8.068 3.907 -1.810 1.00 0.00 H new ATOM 0 HD13 LEU A 95 -7.763 2.183 -1.490 1.00 0.00 H new ATOM 0 HD21 LEU A 95 -9.382 1.185 -3.926 1.00 0.00 H new ATOM 0 HD22 LEU A 95 -9.554 0.458 -2.311 1.00 0.00 H new ATOM 0 HD23 LEU A 95 -10.985 1.094 -3.158 1.00 0.00 H new ATOM 1545 N ALA A 96 -12.175 4.051 1.276 1.00 0.00 N ATOM 1546 CA ALA A 96 -13.478 4.316 1.869 1.00 0.00 C ATOM 1547 C ALA A 96 -13.756 5.811 2.020 1.00 0.00 C ATOM 1548 O ALA A 96 -14.916 6.218 1.962 1.00 0.00 O ATOM 1549 CB ALA A 96 -13.547 3.665 3.250 1.00 0.00 C ATOM 0 H ALA A 96 -11.545 3.505 1.864 1.00 0.00 H new ATOM 0 HA ALA A 96 -14.230 3.899 1.199 1.00 0.00 H new ATOM 0 HB1 ALA A 96 -14.522 3.862 3.697 1.00 0.00 H new ATOM 0 HB2 ALA A 96 -13.403 2.589 3.153 1.00 0.00 H new ATOM 0 HB3 ALA A 96 -12.766 4.079 3.887 1.00 0.00 H new ATOM 1555 N GLU A 97 -12.716 6.631 2.206 1.00 0.00 N ATOM 1556 CA GLU A 97 -12.893 8.071 2.397 1.00 0.00 C ATOM 1557 C GLU A 97 -13.197 8.816 1.097 1.00 0.00 C ATOM 1558 O GLU A 97 -13.723 9.931 1.133 1.00 0.00 O ATOM 1559 CB GLU A 97 -11.649 8.636 3.105 1.00 0.00 C ATOM 1560 CG GLU A 97 -11.919 9.879 3.966 1.00 0.00 C ATOM 1561 CD GLU A 97 -12.997 9.599 5.018 1.00 0.00 C ATOM 1562 OE1 GLU A 97 -12.768 8.766 5.929 1.00 0.00 O ATOM 1563 OE2 GLU A 97 -14.132 10.090 4.828 1.00 0.00 O ATOM 0 H GLU A 97 -11.745 6.321 2.228 1.00 0.00 H new ATOM 0 HA GLU A 97 -13.771 8.227 3.023 1.00 0.00 H new ATOM 0 HB2 GLU A 97 -11.220 7.858 3.736 1.00 0.00 H new ATOM 0 HB3 GLU A 97 -10.900 8.885 2.353 1.00 0.00 H new ATOM 0 HG2 GLU A 97 -10.998 10.191 4.459 1.00 0.00 H new ATOM 0 HG3 GLU A 97 -12.235 10.705 3.329 1.00 0.00 H new ATOM 1570 N LEU A 98 -12.905 8.203 -0.050 1.00 0.00 N ATOM 1571 CA LEU A 98 -13.134 8.779 -1.372 1.00 0.00 C ATOM 1572 C LEU A 98 -14.182 7.988 -2.145 1.00 0.00 C ATOM 1573 O LEU A 98 -14.535 8.385 -3.256 1.00 0.00 O ATOM 1574 CB LEU A 98 -11.821 8.796 -2.173 1.00 0.00 C ATOM 1575 CG LEU A 98 -10.929 10.024 -1.929 1.00 0.00 C ATOM 1576 CD1 LEU A 98 -10.437 10.153 -0.483 1.00 0.00 C ATOM 1577 CD2 LEU A 98 -9.741 9.898 -2.881 1.00 0.00 C ATOM 0 H LEU A 98 -12.493 7.271 -0.085 1.00 0.00 H new ATOM 0 HA LEU A 98 -13.498 9.797 -1.234 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -11.253 7.898 -1.930 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -12.060 8.744 -3.235 1.00 0.00 H new ATOM 0 HG LEU A 98 -11.515 10.925 -2.111 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -9.814 11.042 -0.389 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -11.293 10.237 0.186 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -9.854 9.272 -0.217 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -9.075 10.750 -2.746 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -9.200 8.976 -2.667 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -10.100 9.877 -3.910 1.00 0.00 H new ATOM 1589 N LEU A 99 -14.703 6.891 -1.592 1.00 0.00 N ATOM 1590 CA LEU A 99 -15.686 6.067 -2.284 1.00 0.00 C ATOM 1591 C LEU A 99 -16.923 5.787 -1.433 1.00 0.00 C ATOM 1592 O LEU A 99 -17.172 4.624 -1.091 1.00 0.00 O ATOM 1593 CB LEU A 99 -15.032 4.769 -2.783 1.00 0.00 C ATOM 1594 CG LEU A 99 -13.783 4.929 -3.665 1.00 0.00 C ATOM 1595 CD1 LEU A 99 -13.084 3.569 -3.771 1.00 0.00 C ATOM 1596 CD2 LEU A 99 -14.128 5.460 -5.062 1.00 0.00 C ATOM 0 H LEU A 99 -14.456 6.554 -0.661 1.00 0.00 H new ATOM 0 HA LEU A 99 -16.040 6.631 -3.147 1.00 0.00 H new ATOM 0 HB2 LEU A 99 -14.763 4.166 -1.915 1.00 0.00 H new ATOM 0 HB3 LEU A 99 -15.777 4.205 -3.344 1.00 0.00 H new ATOM 0 HG LEU A 99 -13.122 5.662 -3.203 1.00 0.00 H new ATOM 0 HD11 LEU A 99 -12.195 3.665 -4.394 1.00 0.00 H new ATOM 0 HD12 LEU A 99 -12.795 3.230 -2.776 1.00 0.00 H new ATOM 0 HD13 LEU A 99 -13.764 2.844 -4.218 1.00 0.00 H new ATOM 0 HD21 LEU A 99 -13.215 5.557 -5.650 1.00 0.00 H new ATOM 0 HD22 LEU A 99 -14.807 4.766 -5.558 1.00 0.00 H new ATOM 0 HD23 LEU A 99 -14.607 6.435 -4.973 1.00 0.00 H new ATOM 1608 N PRO A 100 -17.727 6.815 -1.108 1.00 0.00 N ATOM 1609 CA PRO A 100 -18.945 6.615 -0.332 1.00 0.00 C ATOM 1610 C PRO A 100 -19.935 5.766 -1.142 1.00 0.00 C ATOM 1611 O PRO A 100 -20.739 5.019 -0.585 1.00 0.00 O ATOM 1612 CB PRO A 100 -19.497 8.021 -0.060 1.00 0.00 C ATOM 1613 CG PRO A 100 -18.905 8.885 -1.172 1.00 0.00 C ATOM 1614 CD PRO A 100 -17.556 8.223 -1.446 1.00 0.00 C ATOM 0 HA PRO A 100 -18.766 6.085 0.603 1.00 0.00 H new ATOM 0 HB2 PRO A 100 -20.587 8.032 -0.086 1.00 0.00 H new ATOM 0 HB3 PRO A 100 -19.198 8.381 0.924 1.00 0.00 H new ATOM 0 HG2 PRO A 100 -19.539 8.890 -2.059 1.00 0.00 H new ATOM 0 HG3 PRO A 100 -18.788 9.922 -0.858 1.00 0.00 H new ATOM 0 HD2 PRO A 100 -17.267 8.342 -2.490 1.00 0.00 H new ATOM 0 HD3 PRO A 100 -16.769 8.677 -0.844 1.00 0.00 H new ATOM 1622 N ASP A 101 -19.832 5.850 -2.467 1.00 0.00 N ATOM 1623 CA ASP A 101 -20.622 5.164 -3.476 1.00 0.00 C ATOM 1624 C ASP A 101 -20.127 3.733 -3.728 1.00 0.00 C ATOM 1625 O ASP A 101 -20.675 3.065 -4.603 1.00 0.00 O ATOM 1626 CB ASP A 101 -20.564 5.992 -4.771 1.00 0.00 C ATOM 1627 CG ASP A 101 -21.310 7.309 -4.611 1.00 0.00 C ATOM 1628 OD1 ASP A 101 -22.556 7.245 -4.495 1.00 0.00 O ATOM 1629 OD2 ASP A 101 -20.643 8.369 -4.540 1.00 0.00 O ATOM 0 H ASP A 101 -19.130 6.454 -2.895 1.00 0.00 H new ATOM 0 HA ASP A 101 -21.649 5.075 -3.122 1.00 0.00 H new ATOM 0 HB2 ASP A 101 -19.525 6.188 -5.035 1.00 0.00 H new ATOM 0 HB3 ASP A 101 -20.999 5.421 -5.591 1.00 0.00 H new ATOM 1634 N TRP A 102 -19.090 3.251 -3.023 1.00 0.00 N ATOM 1635 CA TRP A 102 -18.556 1.903 -3.189 1.00 0.00 C ATOM 1636 C TRP A 102 -18.634 1.126 -1.882 1.00 0.00 C ATOM 1637 O TRP A 102 -19.233 0.049 -1.863 1.00 0.00 O ATOM 1638 CB TRP A 102 -17.125 1.928 -3.755 1.00 0.00 C ATOM 1639 CG TRP A 102 -16.629 0.645 -4.352 1.00 0.00 C ATOM 1640 CD1 TRP A 102 -17.363 -0.144 -5.161 1.00 0.00 C ATOM 1641 CD2 TRP A 102 -15.323 -0.016 -4.240 1.00 0.00 C ATOM 1642 NE1 TRP A 102 -16.610 -1.222 -5.561 1.00 0.00 N ATOM 1643 CE2 TRP A 102 -15.319 -1.154 -5.102 1.00 0.00 C ATOM 1644 CE3 TRP A 102 -14.150 0.190 -3.482 1.00 0.00 C ATOM 1645 CZ2 TRP A 102 -14.186 -1.956 -5.308 1.00 0.00 C ATOM 1646 CZ3 TRP A 102 -13.028 -0.652 -3.624 1.00 0.00 C ATOM 1647 CH2 TRP A 102 -13.019 -1.686 -4.576 1.00 0.00 C ATOM 0 H TRP A 102 -18.599 3.798 -2.316 1.00 0.00 H new ATOM 0 HA TRP A 102 -19.176 1.384 -3.920 1.00 0.00 H new ATOM 0 HB2 TRP A 102 -17.071 2.705 -4.518 1.00 0.00 H new ATOM 0 HB3 TRP A 102 -16.445 2.220 -2.955 1.00 0.00 H new ATOM 0 HD1 TRP A 102 -18.387 0.042 -5.451 1.00 0.00 H new ATOM 0 HE1 TRP A 102 -16.970 -1.985 -6.134 1.00 0.00 H new ATOM 0 HE3 TRP A 102 -14.111 1.009 -2.779 1.00 0.00 H new ATOM 0 HZ2 TRP A 102 -14.211 -2.769 -6.019 1.00 0.00 H new ATOM 0 HZ3 TRP A 102 -12.165 -0.501 -2.993 1.00 0.00 H new ATOM 0 HH2 TRP A 102 -12.124 -2.267 -4.743 1.00 0.00 H new ATOM 1658 N LEU A 103 -17.977 1.617 -0.825 1.00 0.00 N ATOM 1659 CA LEU A 103 -17.964 0.980 0.487 1.00 0.00 C ATOM 1660 C LEU A 103 -18.934 1.729 1.385 1.00 0.00 C ATOM 1661 O LEU A 103 -18.959 2.962 1.367 1.00 0.00 O ATOM 1662 CB LEU A 103 -16.562 1.031 1.132 1.00 0.00 C ATOM 1663 CG LEU A 103 -15.518 0.112 0.473 1.00 0.00 C ATOM 1664 CD1 LEU A 103 -14.097 0.650 0.683 1.00 0.00 C ATOM 1665 CD2 LEU A 103 -15.608 -1.311 1.043 1.00 0.00 C ATOM 0 H LEU A 103 -17.434 2.479 -0.862 1.00 0.00 H new ATOM 0 HA LEU A 103 -18.247 -0.066 0.368 1.00 0.00 H new ATOM 0 HB2 LEU A 103 -16.197 2.058 1.096 1.00 0.00 H new ATOM 0 HB3 LEU A 103 -16.651 0.761 2.184 1.00 0.00 H new ATOM 0 HG LEU A 103 -15.734 0.088 -0.595 1.00 0.00 H new ATOM 0 HD11 LEU A 103 -13.380 -0.019 0.207 1.00 0.00 H new ATOM 0 HD12 LEU A 103 -14.015 1.643 0.241 1.00 0.00 H new ATOM 0 HD13 LEU A 103 -13.884 0.709 1.750 1.00 0.00 H new ATOM 0 HD21 LEU A 103 -14.861 -1.943 0.563 1.00 0.00 H new ATOM 0 HD22 LEU A 103 -15.425 -1.285 2.117 1.00 0.00 H new ATOM 0 HD23 LEU A 103 -16.602 -1.716 0.854 1.00 0.00 H new ATOM 1677 N SER A 104 -19.674 0.978 2.190 1.00 0.00 N ATOM 1678 CA SER A 104 -20.645 1.482 3.154 1.00 0.00 C ATOM 1679 C SER A 104 -20.502 0.693 4.457 1.00 0.00 C ATOM 1680 O SER A 104 -20.161 -0.493 4.424 1.00 0.00 O ATOM 1681 CB SER A 104 -22.061 1.349 2.595 1.00 0.00 C ATOM 1682 OG SER A 104 -22.362 2.396 1.689 1.00 0.00 O ATOM 0 H SER A 104 -19.612 -0.040 2.190 1.00 0.00 H new ATOM 0 HA SER A 104 -20.459 2.538 3.349 1.00 0.00 H new ATOM 0 HB2 SER A 104 -22.165 0.389 2.090 1.00 0.00 H new ATOM 0 HB3 SER A 104 -22.779 1.358 3.415 1.00 0.00 H new ATOM 0 HG SER A 104 -23.274 2.282 1.348 1.00 0.00 H new ATOM 1688 N LEU A 105 -20.763 1.330 5.602 1.00 0.00 N ATOM 1689 CA LEU A 105 -20.676 0.721 6.929 1.00 0.00 C ATOM 1690 C LEU A 105 -22.084 0.588 7.482 1.00 0.00 C ATOM 1691 O LEU A 105 -22.887 1.518 7.364 1.00 0.00 O ATOM 1692 CB LEU A 105 -19.870 1.619 7.882 1.00 0.00 C ATOM 1693 CG LEU A 105 -18.360 1.603 7.596 1.00 0.00 C ATOM 1694 CD1 LEU A 105 -17.721 2.942 7.975 1.00 0.00 C ATOM 1695 CD2 LEU A 105 -17.682 0.483 8.389 1.00 0.00 C ATOM 0 H LEU A 105 -21.048 2.309 5.631 1.00 0.00 H new ATOM 0 HA LEU A 105 -20.185 -0.249 6.848 1.00 0.00 H new ATOM 0 HB2 LEU A 105 -20.237 2.642 7.804 1.00 0.00 H new ATOM 0 HB3 LEU A 105 -20.042 1.296 8.909 1.00 0.00 H new ATOM 0 HG LEU A 105 -18.223 1.431 6.528 1.00 0.00 H new ATOM 0 HD11 LEU A 105 -16.652 2.908 7.764 1.00 0.00 H new ATOM 0 HD12 LEU A 105 -18.180 3.742 7.394 1.00 0.00 H new ATOM 0 HD13 LEU A 105 -17.875 3.131 9.037 1.00 0.00 H new ATOM 0 HD21 LEU A 105 -16.613 0.483 8.177 1.00 0.00 H new ATOM 0 HD22 LEU A 105 -17.841 0.645 9.455 1.00 0.00 H new ATOM 0 HD23 LEU A 105 -18.109 -0.477 8.100 1.00 0.00 H new ATOM 1707 N HIS A 106 -22.393 -0.543 8.113 1.00 0.00 N ATOM 1708 CA HIS A 106 -23.696 -0.784 8.693 1.00 0.00 C ATOM 1709 C HIS A 106 -23.554 -1.674 9.923 1.00 0.00 C ATOM 1710 O HIS A 106 -23.280 -2.868 9.810 1.00 0.00 O ATOM 1711 CB HIS A 106 -24.666 -1.339 7.635 1.00 0.00 C ATOM 1712 CG HIS A 106 -24.344 -2.676 7.011 1.00 0.00 C ATOM 1713 ND1 HIS A 106 -25.223 -3.728 6.882 1.00 0.00 N ATOM 1714 CD2 HIS A 106 -23.162 -3.057 6.435 1.00 0.00 C ATOM 1715 CE1 HIS A 106 -24.563 -4.735 6.291 1.00 0.00 C ATOM 1716 NE2 HIS A 106 -23.309 -4.373 5.998 1.00 0.00 N ATOM 0 H HIS A 106 -21.738 -1.316 8.232 1.00 0.00 H new ATOM 0 HA HIS A 106 -24.135 0.154 9.033 1.00 0.00 H new ATOM 0 HB2 HIS A 106 -25.653 -1.413 8.092 1.00 0.00 H new ATOM 0 HB3 HIS A 106 -24.741 -0.605 6.833 1.00 0.00 H new ATOM 0 HD2 HIS A 106 -22.275 -2.448 6.337 1.00 0.00 H new ATOM 0 HE1 HIS A 106 -24.986 -5.706 6.080 1.00 0.00 H new ATOM 0 HE2 HIS A 106 -22.599 -4.947 5.544 1.00 0.00 H new ATOM 1724 N ARG A 107 -23.630 -1.083 11.124 1.00 0.00 N ATOM 1725 CA ARG A 107 -23.549 -1.898 12.332 1.00 0.00 C ATOM 1726 C ARG A 107 -24.905 -2.579 12.473 1.00 0.00 C ATOM 1727 O ARG A 107 -25.941 -2.014 12.114 1.00 0.00 O ATOM 1728 CB ARG A 107 -23.124 -1.092 13.577 1.00 0.00 C ATOM 1729 CG ARG A 107 -23.062 -1.977 14.838 1.00 0.00 C ATOM 1730 CD ARG A 107 -22.771 -1.207 16.125 1.00 0.00 C ATOM 1731 NE ARG A 107 -21.339 -0.922 16.315 1.00 0.00 N ATOM 1732 CZ ARG A 107 -20.824 0.260 16.676 1.00 0.00 C ATOM 1733 NH1 ARG A 107 -21.564 1.361 16.675 1.00 0.00 N ATOM 1734 NH2 ARG A 107 -19.562 0.350 17.068 1.00 0.00 N ATOM 0 H ARG A 107 -23.743 -0.081 11.278 1.00 0.00 H new ATOM 0 HA ARG A 107 -22.760 -2.645 12.247 1.00 0.00 H new ATOM 0 HB2 ARG A 107 -22.148 -0.640 13.402 1.00 0.00 H new ATOM 0 HB3 ARG A 107 -23.828 -0.276 13.740 1.00 0.00 H new ATOM 0 HG2 ARG A 107 -24.011 -2.502 14.948 1.00 0.00 H new ATOM 0 HG3 ARG A 107 -22.292 -2.736 14.699 1.00 0.00 H new ATOM 0 HD2 ARG A 107 -23.324 -0.268 16.113 1.00 0.00 H new ATOM 0 HD3 ARG A 107 -23.137 -1.781 16.976 1.00 0.00 H new ATOM 0 HE ARG A 107 -20.685 -1.689 16.159 1.00 0.00 H new ATOM 0 HH11 ARG A 107 -22.544 1.317 16.396 1.00 0.00 H new ATOM 0 HH12 ARG A 107 -21.153 2.252 16.953 1.00 0.00 H new ATOM 0 HH21 ARG A 107 -18.976 -0.484 17.096 1.00 0.00 H new ATOM 0 HH22 ARG A 107 -19.176 1.254 17.342 1.00 0.00 H new ATOM 1748 N ILE A 108 -24.878 -3.810 12.952 1.00 0.00 N ATOM 1749 CA ILE A 108 -25.996 -4.689 13.203 1.00 0.00 C ATOM 1750 C ILE A 108 -25.940 -4.966 14.698 1.00 0.00 C ATOM 1751 O ILE A 108 -24.850 -4.961 15.289 1.00 0.00 O ATOM 1752 CB ILE A 108 -25.823 -6.022 12.427 1.00 0.00 C ATOM 1753 CG1 ILE A 108 -25.184 -5.909 11.029 1.00 0.00 C ATOM 1754 CG2 ILE A 108 -27.152 -6.787 12.340 1.00 0.00 C ATOM 1755 CD1 ILE A 108 -26.005 -5.147 9.991 1.00 0.00 C ATOM 0 H ILE A 108 -23.993 -4.255 13.195 1.00 0.00 H new ATOM 0 HA ILE A 108 -26.941 -4.246 12.887 1.00 0.00 H new ATOM 0 HB ILE A 108 -25.101 -6.580 13.023 1.00 0.00 H new ATOM 0 HG12 ILE A 108 -24.215 -5.421 11.130 1.00 0.00 H new ATOM 0 HG13 ILE A 108 -24.997 -6.914 10.652 1.00 0.00 H new ATOM 0 HG21 ILE A 108 -27.001 -7.717 11.791 1.00 0.00 H new ATOM 0 HG22 ILE A 108 -27.508 -7.013 13.345 1.00 0.00 H new ATOM 0 HG23 ILE A 108 -27.891 -6.175 11.822 1.00 0.00 H new ATOM 0 HD11 ILE A 108 -25.465 -5.126 9.044 1.00 0.00 H new ATOM 0 HD12 ILE A 108 -26.965 -5.643 9.851 1.00 0.00 H new ATOM 0 HD13 ILE A 108 -26.171 -4.127 10.336 1.00 0.00 H new ATOM 1767 N ARG A 109 -27.082 -5.332 15.287 1.00 0.00 N ATOM 1768 CA ARG A 109 -27.166 -5.655 16.709 1.00 0.00 C ATOM 1769 C ARG A 109 -26.056 -6.639 17.094 1.00 0.00 C ATOM 1770 O ARG A 109 -25.412 -6.470 18.129 1.00 0.00 O ATOM 1771 CB ARG A 109 -28.580 -6.151 17.074 1.00 0.00 C ATOM 1772 CG ARG A 109 -28.967 -7.482 16.401 1.00 0.00 C ATOM 1773 CD ARG A 109 -30.391 -7.935 16.735 1.00 0.00 C ATOM 1774 NE ARG A 109 -31.420 -7.128 16.058 1.00 0.00 N ATOM 1775 CZ ARG A 109 -32.060 -7.461 14.927 1.00 0.00 C ATOM 1776 NH1 ARG A 109 -31.680 -8.498 14.184 1.00 0.00 N ATOM 1777 NH2 ARG A 109 -33.096 -6.736 14.523 1.00 0.00 N ATOM 0 H ARG A 109 -27.970 -5.412 14.791 1.00 0.00 H new ATOM 0 HA ARG A 109 -27.002 -4.753 17.299 1.00 0.00 H new ATOM 0 HB2 ARG A 109 -28.645 -6.270 18.156 1.00 0.00 H new ATOM 0 HB3 ARG A 109 -29.306 -5.388 16.793 1.00 0.00 H new ATOM 0 HG2 ARG A 109 -28.870 -7.377 15.320 1.00 0.00 H new ATOM 0 HG3 ARG A 109 -28.264 -8.256 16.710 1.00 0.00 H new ATOM 0 HD2 ARG A 109 -30.511 -8.981 16.451 1.00 0.00 H new ATOM 0 HD3 ARG A 109 -30.542 -7.878 17.813 1.00 0.00 H new ATOM 0 HE ARG A 109 -31.668 -6.237 16.487 1.00 0.00 H new ATOM 0 HH11 ARG A 109 -30.882 -9.065 14.470 1.00 0.00 H new ATOM 0 HH12 ARG A 109 -32.187 -8.726 13.329 1.00 0.00 H new ATOM 0 HH21 ARG A 109 -33.401 -5.932 15.071 1.00 0.00 H new ATOM 0 HH22 ARG A 109 -33.587 -6.983 13.664 1.00 0.00 H new ATOM 1791 N THR A 110 -25.766 -7.590 16.209 1.00 0.00 N ATOM 1792 CA THR A 110 -24.789 -8.630 16.282 1.00 0.00 C ATOM 1793 C THR A 110 -23.354 -8.069 16.260 1.00 0.00 C ATOM 1794 O THR A 110 -22.554 -8.498 17.093 1.00 0.00 O ATOM 1795 CB THR A 110 -25.150 -9.521 15.082 1.00 0.00 C ATOM 1796 OG1 THR A 110 -26.530 -9.874 15.138 1.00 0.00 O ATOM 1797 CG2 THR A 110 -24.344 -10.796 15.021 1.00 0.00 C ATOM 0 H THR A 110 -26.280 -7.639 15.329 1.00 0.00 H new ATOM 0 HA THR A 110 -24.803 -9.195 17.214 1.00 0.00 H new ATOM 0 HB THR A 110 -24.922 -8.935 14.192 1.00 0.00 H new ATOM 0 HG1 THR A 110 -26.754 -10.440 14.370 1.00 0.00 H new ATOM 0 HG21 THR A 110 -24.649 -11.378 14.151 1.00 0.00 H new ATOM 0 HG22 THR A 110 -23.284 -10.553 14.942 1.00 0.00 H new ATOM 0 HG23 THR A 110 -24.516 -11.379 15.926 1.00 0.00 H new ATOM 1805 N ASP A 111 -22.999 -7.163 15.332 1.00 0.00 N ATOM 1806 CA ASP A 111 -21.664 -6.550 15.205 1.00 0.00 C ATOM 1807 C ASP A 111 -21.605 -5.570 14.020 1.00 0.00 C ATOM 1808 O ASP A 111 -22.621 -5.356 13.365 1.00 0.00 O ATOM 1809 CB ASP A 111 -20.547 -7.593 14.980 1.00 0.00 C ATOM 1810 CG ASP A 111 -19.169 -7.025 15.326 1.00 0.00 C ATOM 1811 OD1 ASP A 111 -19.103 -6.022 16.081 1.00 0.00 O ATOM 1812 OD2 ASP A 111 -18.150 -7.550 14.834 1.00 0.00 O ATOM 0 H ASP A 111 -23.654 -6.826 14.627 1.00 0.00 H new ATOM 0 HA ASP A 111 -21.500 -6.033 16.150 1.00 0.00 H new ATOM 0 HB2 ASP A 111 -20.742 -8.474 15.592 1.00 0.00 H new ATOM 0 HB3 ASP A 111 -20.556 -7.919 13.940 1.00 0.00 H new ATOM 1817 N THR A 112 -20.452 -4.961 13.731 1.00 0.00 N ATOM 1818 CA THR A 112 -20.220 -4.042 12.624 1.00 0.00 C ATOM 1819 C THR A 112 -19.982 -4.861 11.346 1.00 0.00 C ATOM 1820 O THR A 112 -19.226 -5.837 11.370 1.00 0.00 O ATOM 1821 CB THR A 112 -18.987 -3.162 12.895 1.00 0.00 C ATOM 1822 OG1 THR A 112 -19.041 -2.547 14.168 1.00 0.00 O ATOM 1823 CG2 THR A 112 -18.857 -2.049 11.846 1.00 0.00 C ATOM 0 H THR A 112 -19.614 -5.106 14.295 1.00 0.00 H new ATOM 0 HA THR A 112 -21.090 -3.396 12.511 1.00 0.00 H new ATOM 0 HB THR A 112 -18.128 -3.831 12.849 1.00 0.00 H new ATOM 0 HG1 THR A 112 -18.239 -1.999 14.301 1.00 0.00 H new ATOM 0 HG21 THR A 112 -17.977 -1.444 12.064 1.00 0.00 H new ATOM 0 HG22 THR A 112 -18.756 -2.493 10.855 1.00 0.00 H new ATOM 0 HG23 THR A 112 -19.746 -1.419 11.872 1.00 0.00 H new ATOM 1831 N TYR A 113 -20.602 -4.470 10.230 1.00 0.00 N ATOM 1832 CA TYR A 113 -20.461 -5.127 8.934 1.00 0.00 C ATOM 1833 C TYR A 113 -20.241 -4.031 7.882 1.00 0.00 C ATOM 1834 O TYR A 113 -20.487 -2.843 8.148 1.00 0.00 O ATOM 1835 CB TYR A 113 -21.711 -5.974 8.595 1.00 0.00 C ATOM 1836 CG TYR A 113 -21.894 -7.269 9.382 1.00 0.00 C ATOM 1837 CD1 TYR A 113 -22.163 -7.223 10.757 1.00 0.00 C ATOM 1838 CD2 TYR A 113 -21.815 -8.527 8.753 1.00 0.00 C ATOM 1839 CE1 TYR A 113 -22.297 -8.388 11.526 1.00 0.00 C ATOM 1840 CE2 TYR A 113 -21.934 -9.709 9.511 1.00 0.00 C ATOM 1841 CZ TYR A 113 -22.135 -9.647 10.912 1.00 0.00 C ATOM 1842 OH TYR A 113 -22.139 -10.785 11.663 1.00 0.00 O ATOM 0 H TYR A 113 -21.231 -3.667 10.205 1.00 0.00 H new ATOM 0 HA TYR A 113 -19.614 -5.813 8.952 1.00 0.00 H new ATOM 0 HB2 TYR A 113 -22.594 -5.354 8.749 1.00 0.00 H new ATOM 0 HB3 TYR A 113 -21.677 -6.222 7.534 1.00 0.00 H new ATOM 0 HD1 TYR A 113 -22.270 -6.262 11.238 1.00 0.00 H new ATOM 0 HD2 TYR A 113 -21.663 -8.586 7.685 1.00 0.00 H new ATOM 0 HE1 TYR A 113 -22.522 -8.321 12.580 1.00 0.00 H new ATOM 0 HE2 TYR A 113 -21.872 -10.669 9.020 1.00 0.00 H new ATOM 0 HH TYR A 113 -22.016 -11.563 11.079 1.00 0.00 H new ATOM 1852 N VAL A 114 -19.761 -4.408 6.697 1.00 0.00 N ATOM 1853 CA VAL A 114 -19.523 -3.507 5.579 1.00 0.00 C ATOM 1854 C VAL A 114 -20.285 -4.079 4.386 1.00 0.00 C ATOM 1855 O VAL A 114 -20.585 -5.274 4.314 1.00 0.00 O ATOM 1856 CB VAL A 114 -18.003 -3.325 5.338 1.00 0.00 C ATOM 1857 CG1 VAL A 114 -17.590 -2.843 3.933 1.00 0.00 C ATOM 1858 CG2 VAL A 114 -17.429 -2.294 6.314 1.00 0.00 C ATOM 0 H VAL A 114 -19.522 -5.377 6.487 1.00 0.00 H new ATOM 0 HA VAL A 114 -19.889 -2.499 5.773 1.00 0.00 H new ATOM 0 HB VAL A 114 -17.611 -4.333 5.475 1.00 0.00 H new ATOM 0 HG11 VAL A 114 -16.505 -2.753 3.884 1.00 0.00 H new ATOM 0 HG12 VAL A 114 -17.928 -3.562 3.187 1.00 0.00 H new ATOM 0 HG13 VAL A 114 -18.044 -1.873 3.733 1.00 0.00 H new ATOM 0 HG21 VAL A 114 -16.361 -2.177 6.133 1.00 0.00 H new ATOM 0 HG22 VAL A 114 -17.929 -1.337 6.168 1.00 0.00 H new ATOM 0 HG23 VAL A 114 -17.588 -2.634 7.337 1.00 0.00 H new ATOM 1868 N LYS A 115 -20.610 -3.194 3.449 1.00 0.00 N ATOM 1869 CA LYS A 115 -21.312 -3.446 2.201 1.00 0.00 C ATOM 1870 C LYS A 115 -20.393 -2.927 1.111 1.00 0.00 C ATOM 1871 O LYS A 115 -19.730 -1.907 1.317 1.00 0.00 O ATOM 1872 CB LYS A 115 -22.654 -2.694 2.225 1.00 0.00 C ATOM 1873 CG LYS A 115 -23.753 -3.525 2.911 1.00 0.00 C ATOM 1874 CD LYS A 115 -24.863 -3.981 1.960 1.00 0.00 C ATOM 1875 CE LYS A 115 -24.299 -4.784 0.781 1.00 0.00 C ATOM 1876 NZ LYS A 115 -25.343 -5.223 -0.164 1.00 0.00 N ATOM 0 H LYS A 115 -20.370 -2.208 3.553 1.00 0.00 H new ATOM 0 HA LYS A 115 -21.539 -4.500 2.038 1.00 0.00 H new ATOM 0 HB2 LYS A 115 -22.532 -1.746 2.749 1.00 0.00 H new ATOM 0 HB3 LYS A 115 -22.958 -2.457 1.205 1.00 0.00 H new ATOM 0 HG2 LYS A 115 -23.299 -4.402 3.372 1.00 0.00 H new ATOM 0 HG3 LYS A 115 -24.194 -2.935 3.714 1.00 0.00 H new ATOM 0 HD2 LYS A 115 -25.583 -4.591 2.506 1.00 0.00 H new ATOM 0 HD3 LYS A 115 -25.402 -3.111 1.584 1.00 0.00 H new ATOM 0 HE2 LYS A 115 -23.567 -4.175 0.250 1.00 0.00 H new ATOM 0 HE3 LYS A 115 -23.770 -5.657 1.162 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 -24.906 -5.760 -0.940 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 -26.029 -5.827 0.332 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 -25.832 -4.391 -0.552 1.00 0.00 H new ATOM 1890 N LEU A 116 -20.317 -3.641 -0.012 1.00 0.00 N ATOM 1891 CA LEU A 116 -19.479 -3.254 -1.141 1.00 0.00 C ATOM 1892 C LEU A 116 -20.249 -3.440 -2.431 1.00 0.00 C ATOM 1893 O LEU A 116 -21.243 -4.169 -2.458 1.00 0.00 O ATOM 1894 CB LEU A 116 -18.172 -4.049 -1.111 1.00 0.00 C ATOM 1895 CG LEU A 116 -17.025 -3.544 -2.001 1.00 0.00 C ATOM 1896 CD1 LEU A 116 -16.842 -4.283 -3.333 1.00 0.00 C ATOM 1897 CD2 LEU A 116 -16.918 -2.027 -2.112 1.00 0.00 C ATOM 0 H LEU A 116 -20.837 -4.506 -0.162 1.00 0.00 H new ATOM 0 HA LEU A 116 -19.213 -2.199 -1.073 1.00 0.00 H new ATOM 0 HB2 LEU A 116 -17.815 -4.075 -0.081 1.00 0.00 H new ATOM 0 HB3 LEU A 116 -18.395 -5.077 -1.397 1.00 0.00 H new ATOM 0 HG LEU A 116 -16.145 -3.836 -1.429 1.00 0.00 H new ATOM 0 HD11 LEU A 116 -16.007 -3.846 -3.880 1.00 0.00 H new ATOM 0 HD12 LEU A 116 -16.638 -5.336 -3.140 1.00 0.00 H new ATOM 0 HD13 LEU A 116 -17.752 -4.193 -3.927 1.00 0.00 H new ATOM 0 HD21 LEU A 116 -16.081 -1.768 -2.760 1.00 0.00 H new ATOM 0 HD22 LEU A 116 -17.840 -1.627 -2.534 1.00 0.00 H new ATOM 0 HD23 LEU A 116 -16.757 -1.600 -1.122 1.00 0.00 H new ATOM 1909 N ASP A 117 -19.770 -2.834 -3.508 1.00 0.00 N ATOM 1910 CA ASP A 117 -20.416 -2.876 -4.820 1.00 0.00 C ATOM 1911 C ASP A 117 -19.504 -3.496 -5.860 1.00 0.00 C ATOM 1912 O ASP A 117 -18.655 -2.844 -6.464 1.00 0.00 O ATOM 1913 CB ASP A 117 -20.899 -1.475 -5.269 1.00 0.00 C ATOM 1914 CG ASP A 117 -22.423 -1.298 -5.248 1.00 0.00 C ATOM 1915 OD1 ASP A 117 -23.168 -2.196 -4.787 1.00 0.00 O ATOM 1916 OD2 ASP A 117 -22.900 -0.329 -5.875 1.00 0.00 O ATOM 0 H ASP A 117 -18.908 -2.289 -3.499 1.00 0.00 H new ATOM 0 HA ASP A 117 -21.298 -3.509 -4.724 1.00 0.00 H new ATOM 0 HB2 ASP A 117 -20.448 -0.723 -4.621 1.00 0.00 H new ATOM 0 HB3 ASP A 117 -20.536 -1.285 -6.279 1.00 0.00 H new ATOM 1921 N LYS A 118 -19.652 -4.792 -6.098 1.00 0.00 N ATOM 1922 CA LYS A 118 -18.827 -5.465 -7.098 1.00 0.00 C ATOM 1923 C LYS A 118 -19.245 -5.079 -8.521 1.00 0.00 C ATOM 1924 O LYS A 118 -18.490 -5.363 -9.451 1.00 0.00 O ATOM 1925 CB LYS A 118 -18.967 -6.982 -6.943 1.00 0.00 C ATOM 1926 CG LYS A 118 -18.527 -7.512 -5.565 1.00 0.00 C ATOM 1927 CD LYS A 118 -19.162 -8.877 -5.281 1.00 0.00 C ATOM 1928 CE LYS A 118 -20.647 -8.711 -4.963 1.00 0.00 C ATOM 1929 NZ LYS A 118 -21.393 -9.977 -5.052 1.00 0.00 N ATOM 0 H LYS A 118 -20.324 -5.393 -5.622 1.00 0.00 H new ATOM 0 HA LYS A 118 -17.794 -5.156 -6.939 1.00 0.00 H new ATOM 0 HB2 LYS A 118 -20.007 -7.260 -7.113 1.00 0.00 H new ATOM 0 HB3 LYS A 118 -18.375 -7.472 -7.716 1.00 0.00 H new ATOM 0 HG2 LYS A 118 -17.441 -7.597 -5.533 1.00 0.00 H new ATOM 0 HG3 LYS A 118 -18.815 -6.803 -4.789 1.00 0.00 H new ATOM 0 HD2 LYS A 118 -19.038 -9.531 -6.144 1.00 0.00 H new ATOM 0 HD3 LYS A 118 -18.654 -9.355 -4.443 1.00 0.00 H new ATOM 0 HE2 LYS A 118 -20.756 -8.300 -3.959 1.00 0.00 H new ATOM 0 HE3 LYS A 118 -21.083 -7.988 -5.652 1.00 0.00 H new ATOM 0 HZ1 LYS A 118 -22.394 -9.807 -4.827 1.00 0.00 H new ATOM 0 HZ2 LYS A 118 -21.315 -10.359 -6.016 1.00 0.00 H new ATOM 0 HZ3 LYS A 118 -20.998 -10.661 -4.376 1.00 0.00 H new ATOM 1943 N ALA A 119 -20.410 -4.453 -8.710 1.00 0.00 N ATOM 1944 CA ALA A 119 -20.921 -4.095 -10.030 1.00 0.00 C ATOM 1945 C ALA A 119 -20.337 -2.830 -10.662 1.00 0.00 C ATOM 1946 O ALA A 119 -20.639 -2.569 -11.832 1.00 0.00 O ATOM 1947 CB ALA A 119 -22.447 -3.997 -9.962 1.00 0.00 C ATOM 0 H ALA A 119 -21.027 -4.180 -7.945 1.00 0.00 H new ATOM 0 HA ALA A 119 -20.592 -4.895 -10.693 1.00 0.00 H new ATOM 0 HB1 ALA A 119 -22.839 -3.730 -10.944 1.00 0.00 H new ATOM 0 HB2 ALA A 119 -22.860 -4.958 -9.656 1.00 0.00 H new ATOM 0 HB3 ALA A 119 -22.731 -3.233 -9.238 1.00 0.00 H new ATOM 1953 N VAL A 120 -19.522 -2.059 -9.944 1.00 0.00 N ATOM 1954 CA VAL A 120 -18.936 -0.828 -10.469 1.00 0.00 C ATOM 1955 C VAL A 120 -17.838 -1.097 -11.503 1.00 0.00 C ATOM 1956 O VAL A 120 -17.282 -2.203 -11.569 1.00 0.00 O ATOM 1957 CB VAL A 120 -18.446 0.018 -9.280 1.00 0.00 C ATOM 1958 CG1 VAL A 120 -17.234 -0.618 -8.602 1.00 0.00 C ATOM 1959 CG2 VAL A 120 -18.104 1.464 -9.650 1.00 0.00 C ATOM 0 H VAL A 120 -19.250 -2.270 -8.984 1.00 0.00 H new ATOM 0 HA VAL A 120 -19.694 -0.267 -11.016 1.00 0.00 H new ATOM 0 HB VAL A 120 -19.290 0.044 -8.591 1.00 0.00 H new ATOM 0 HG11 VAL A 120 -16.915 0.006 -7.767 1.00 0.00 H new ATOM 0 HG12 VAL A 120 -17.501 -1.608 -8.233 1.00 0.00 H new ATOM 0 HG13 VAL A 120 -16.420 -0.706 -9.321 1.00 0.00 H new ATOM 0 HG21 VAL A 120 -17.766 1.997 -8.761 1.00 0.00 H new ATOM 0 HG22 VAL A 120 -17.312 1.470 -10.399 1.00 0.00 H new ATOM 0 HG23 VAL A 120 -18.989 1.955 -10.053 1.00 0.00 H new ATOM 1969 N ASP A 121 -17.530 -0.102 -12.338 1.00 0.00 N ATOM 1970 CA ASP A 121 -16.483 -0.202 -13.346 1.00 0.00 C ATOM 1971 C ASP A 121 -15.133 0.027 -12.669 1.00 0.00 C ATOM 1972 O ASP A 121 -14.724 1.165 -12.424 1.00 0.00 O ATOM 1973 CB ASP A 121 -16.647 0.798 -14.495 1.00 0.00 C ATOM 1974 CG ASP A 121 -15.436 0.718 -15.430 1.00 0.00 C ATOM 1975 OD1 ASP A 121 -14.845 -0.380 -15.555 1.00 0.00 O ATOM 1976 OD2 ASP A 121 -15.069 1.745 -16.044 1.00 0.00 O ATOM 0 H ASP A 121 -18.006 0.800 -12.330 1.00 0.00 H new ATOM 0 HA ASP A 121 -16.549 -1.197 -13.786 1.00 0.00 H new ATOM 0 HB2 ASP A 121 -17.561 0.582 -15.049 1.00 0.00 H new ATOM 0 HB3 ASP A 121 -16.746 1.809 -14.098 1.00 0.00 H new ATOM 1981 N LEU A 122 -14.422 -1.059 -12.365 1.00 0.00 N ATOM 1982 CA LEU A 122 -13.113 -0.988 -11.723 1.00 0.00 C ATOM 1983 C LEU A 122 -12.109 -0.223 -12.593 1.00 0.00 C ATOM 1984 O LEU A 122 -11.132 0.311 -12.076 1.00 0.00 O ATOM 1985 CB LEU A 122 -12.609 -2.404 -11.411 1.00 0.00 C ATOM 1986 CG LEU A 122 -11.820 -2.557 -10.095 1.00 0.00 C ATOM 1987 CD1 LEU A 122 -10.546 -1.725 -10.028 1.00 0.00 C ATOM 1988 CD2 LEU A 122 -12.685 -2.313 -8.851 1.00 0.00 C ATOM 0 H LEU A 122 -14.738 -2.010 -12.557 1.00 0.00 H new ATOM 0 HA LEU A 122 -13.214 -0.439 -10.787 1.00 0.00 H new ATOM 0 HB2 LEU A 122 -13.466 -3.076 -11.380 1.00 0.00 H new ATOM 0 HB3 LEU A 122 -11.975 -2.734 -12.234 1.00 0.00 H new ATOM 0 HG LEU A 122 -11.510 -3.602 -10.096 1.00 0.00 H new ATOM 0 HD11 LEU A 122 -10.053 -1.891 -9.070 1.00 0.00 H new ATOM 0 HD12 LEU A 122 -9.877 -2.019 -10.837 1.00 0.00 H new ATOM 0 HD13 LEU A 122 -10.796 -0.669 -10.129 1.00 0.00 H new ATOM 0 HD21 LEU A 122 -12.076 -2.434 -7.955 1.00 0.00 H new ATOM 0 HD22 LEU A 122 -13.088 -1.301 -8.881 1.00 0.00 H new ATOM 0 HD23 LEU A 122 -13.506 -3.030 -8.832 1.00 0.00 H new ATOM 2000 N ALA A 123 -12.323 -0.156 -13.907 1.00 0.00 N ATOM 2001 CA ALA A 123 -11.419 0.570 -14.791 1.00 0.00 C ATOM 2002 C ALA A 123 -11.471 2.065 -14.449 1.00 0.00 C ATOM 2003 O ALA A 123 -10.416 2.696 -14.336 1.00 0.00 O ATOM 2004 CB ALA A 123 -11.735 0.291 -16.261 1.00 0.00 C ATOM 0 H ALA A 123 -13.113 -0.595 -14.379 1.00 0.00 H new ATOM 0 HA ALA A 123 -10.398 0.221 -14.634 1.00 0.00 H new ATOM 0 HB1 ALA A 123 -11.043 0.847 -16.894 1.00 0.00 H new ATOM 0 HB2 ALA A 123 -11.631 -0.776 -16.459 1.00 0.00 H new ATOM 0 HB3 ALA A 123 -12.757 0.602 -16.479 1.00 0.00 H new ATOM 2010 N GLY A 124 -12.670 2.618 -14.229 1.00 0.00 N ATOM 2011 CA GLY A 124 -12.868 4.024 -13.880 1.00 0.00 C ATOM 2012 C GLY A 124 -12.344 4.315 -12.477 1.00 0.00 C ATOM 2013 O GLY A 124 -11.892 5.428 -12.191 1.00 0.00 O ATOM 0 H GLY A 124 -13.541 2.091 -14.290 1.00 0.00 H new ATOM 0 HA2 GLY A 124 -12.355 4.658 -14.603 1.00 0.00 H new ATOM 0 HA3 GLY A 124 -13.928 4.271 -13.935 1.00 0.00 H new ATOM 2017 N LEU A 125 -12.398 3.310 -11.597 1.00 0.00 N ATOM 2018 CA LEU A 125 -11.908 3.413 -10.230 1.00 0.00 C ATOM 2019 C LEU A 125 -10.384 3.431 -10.298 1.00 0.00 C ATOM 2020 O LEU A 125 -9.764 4.362 -9.791 1.00 0.00 O ATOM 2021 CB LEU A 125 -12.491 2.292 -9.360 1.00 0.00 C ATOM 2022 CG LEU A 125 -14.005 2.465 -9.104 1.00 0.00 C ATOM 2023 CD1 LEU A 125 -14.475 1.491 -8.025 1.00 0.00 C ATOM 2024 CD2 LEU A 125 -14.421 3.873 -8.661 1.00 0.00 C ATOM 0 H LEU A 125 -12.788 2.395 -11.822 1.00 0.00 H new ATOM 0 HA LEU A 125 -12.237 4.332 -9.745 1.00 0.00 H new ATOM 0 HB2 LEU A 125 -12.316 1.332 -9.845 1.00 0.00 H new ATOM 0 HB3 LEU A 125 -11.965 2.267 -8.405 1.00 0.00 H new ATOM 0 HG LEU A 125 -14.472 2.269 -10.069 1.00 0.00 H new ATOM 0 HD11 LEU A 125 -15.543 1.624 -7.855 1.00 0.00 H new ATOM 0 HD12 LEU A 125 -14.284 0.468 -8.350 1.00 0.00 H new ATOM 0 HD13 LEU A 125 -13.933 1.685 -7.099 1.00 0.00 H new ATOM 0 HD21 LEU A 125 -15.499 3.901 -8.505 1.00 0.00 H new ATOM 0 HD22 LEU A 125 -13.913 4.127 -7.731 1.00 0.00 H new ATOM 0 HD23 LEU A 125 -14.147 4.593 -9.432 1.00 0.00 H new ATOM 2036 N THR A 126 -9.766 2.462 -10.979 1.00 0.00 N ATOM 2037 CA THR A 126 -8.318 2.408 -11.156 1.00 0.00 C ATOM 2038 C THR A 126 -7.834 3.735 -11.770 1.00 0.00 C ATOM 2039 O THR A 126 -6.752 4.208 -11.429 1.00 0.00 O ATOM 2040 CB THR A 126 -7.958 1.217 -12.067 1.00 0.00 C ATOM 2041 OG1 THR A 126 -8.219 -0.006 -11.409 1.00 0.00 O ATOM 2042 CG2 THR A 126 -6.491 1.225 -12.492 1.00 0.00 C ATOM 0 H THR A 126 -10.262 1.690 -11.424 1.00 0.00 H new ATOM 0 HA THR A 126 -7.826 2.268 -10.194 1.00 0.00 H new ATOM 0 HB THR A 126 -8.579 1.318 -12.957 1.00 0.00 H new ATOM 0 HG1 THR A 126 -8.299 -0.724 -12.072 1.00 0.00 H new ATOM 0 HG21 THR A 126 -6.293 0.365 -13.132 1.00 0.00 H new ATOM 0 HG22 THR A 126 -6.276 2.142 -13.040 1.00 0.00 H new ATOM 0 HG23 THR A 126 -5.856 1.174 -11.608 1.00 0.00 H new ATOM 2050 N ALA A 127 -8.628 4.349 -12.656 1.00 0.00 N ATOM 2051 CA ALA A 127 -8.284 5.601 -13.302 1.00 0.00 C ATOM 2052 C ALA A 127 -8.208 6.716 -12.263 1.00 0.00 C ATOM 2053 O ALA A 127 -7.129 7.250 -12.025 1.00 0.00 O ATOM 2054 CB ALA A 127 -9.292 5.915 -14.416 1.00 0.00 C ATOM 0 H ALA A 127 -9.535 3.979 -12.941 1.00 0.00 H new ATOM 0 HA ALA A 127 -7.302 5.517 -13.768 1.00 0.00 H new ATOM 0 HB1 ALA A 127 -9.024 6.857 -14.894 1.00 0.00 H new ATOM 0 HB2 ALA A 127 -9.277 5.115 -15.156 1.00 0.00 H new ATOM 0 HB3 ALA A 127 -10.292 5.996 -13.990 1.00 0.00 H new ATOM 2060 N ARG A 128 -9.326 7.065 -11.612 1.00 0.00 N ATOM 2061 CA ARG A 128 -9.320 8.143 -10.616 1.00 0.00 C ATOM 2062 C ARG A 128 -8.311 7.897 -9.494 1.00 0.00 C ATOM 2063 O ARG A 128 -7.732 8.859 -8.984 1.00 0.00 O ATOM 2064 CB ARG A 128 -10.738 8.463 -10.125 1.00 0.00 C ATOM 2065 CG ARG A 128 -11.403 7.398 -9.233 1.00 0.00 C ATOM 2066 CD ARG A 128 -11.240 7.647 -7.726 1.00 0.00 C ATOM 2067 NE ARG A 128 -11.769 8.964 -7.308 1.00 0.00 N ATOM 2068 CZ ARG A 128 -13.033 9.270 -6.971 1.00 0.00 C ATOM 2069 NH1 ARG A 128 -13.992 8.346 -6.984 1.00 0.00 N ATOM 2070 NH2 ARG A 128 -13.335 10.511 -6.614 1.00 0.00 N ATOM 0 H ARG A 128 -10.234 6.623 -11.755 1.00 0.00 H new ATOM 0 HA ARG A 128 -8.967 9.048 -11.110 1.00 0.00 H new ATOM 0 HB2 ARG A 128 -10.706 9.402 -9.572 1.00 0.00 H new ATOM 0 HB3 ARG A 128 -11.373 8.627 -10.995 1.00 0.00 H new ATOM 0 HG2 ARG A 128 -12.466 7.355 -9.470 1.00 0.00 H new ATOM 0 HG3 ARG A 128 -10.982 6.422 -9.476 1.00 0.00 H new ATOM 0 HD2 ARG A 128 -11.754 6.861 -7.174 1.00 0.00 H new ATOM 0 HD3 ARG A 128 -10.184 7.583 -7.463 1.00 0.00 H new ATOM 0 HE ARG A 128 -11.095 9.729 -7.271 1.00 0.00 H new ATOM 0 HH11 ARG A 128 -13.773 7.387 -7.253 1.00 0.00 H new ATOM 0 HH12 ARG A 128 -14.946 8.597 -6.725 1.00 0.00 H new ATOM 0 HH21 ARG A 128 -12.609 11.228 -6.596 1.00 0.00 H new ATOM 0 HH22 ARG A 128 -14.293 10.749 -6.357 1.00 0.00 H new ATOM 2084 N LEU A 129 -8.084 6.635 -9.120 1.00 0.00 N ATOM 2085 CA LEU A 129 -7.123 6.272 -8.088 1.00 0.00 C ATOM 2086 C LEU A 129 -5.726 6.645 -8.575 1.00 0.00 C ATOM 2087 O LEU A 129 -5.030 7.386 -7.892 1.00 0.00 O ATOM 2088 CB LEU A 129 -7.175 4.762 -7.787 1.00 0.00 C ATOM 2089 CG LEU A 129 -8.222 4.346 -6.746 1.00 0.00 C ATOM 2090 CD1 LEU A 129 -8.422 2.823 -6.794 1.00 0.00 C ATOM 2091 CD2 LEU A 129 -7.794 4.726 -5.323 1.00 0.00 C ATOM 0 H LEU A 129 -8.567 5.836 -9.530 1.00 0.00 H new ATOM 0 HA LEU A 129 -7.367 6.808 -7.171 1.00 0.00 H new ATOM 0 HB2 LEU A 129 -7.375 4.228 -8.716 1.00 0.00 H new ATOM 0 HB3 LEU A 129 -6.192 4.441 -7.441 1.00 0.00 H new ATOM 0 HG LEU A 129 -9.146 4.871 -6.988 1.00 0.00 H new ATOM 0 HD11 LEU A 129 -9.166 2.530 -6.053 1.00 0.00 H new ATOM 0 HD12 LEU A 129 -8.764 2.532 -7.787 1.00 0.00 H new ATOM 0 HD13 LEU A 129 -7.477 2.325 -6.576 1.00 0.00 H new ATOM 0 HD21 LEU A 129 -8.563 4.414 -4.616 1.00 0.00 H new ATOM 0 HD22 LEU A 129 -6.855 4.229 -5.080 1.00 0.00 H new ATOM 0 HD23 LEU A 129 -7.660 5.806 -5.260 1.00 0.00 H new ATOM 2103 N ALA A 130 -5.332 6.172 -9.762 1.00 0.00 N ATOM 2104 CA ALA A 130 -4.024 6.422 -10.354 1.00 0.00 C ATOM 2105 C ALA A 130 -3.778 7.901 -10.595 1.00 0.00 C ATOM 2106 O ALA A 130 -2.656 8.378 -10.446 1.00 0.00 O ATOM 2107 CB ALA A 130 -3.902 5.689 -11.692 1.00 0.00 C ATOM 0 H ALA A 130 -5.932 5.591 -10.348 1.00 0.00 H new ATOM 0 HA ALA A 130 -3.282 6.056 -9.645 1.00 0.00 H new ATOM 0 HB1 ALA A 130 -2.921 5.883 -12.125 1.00 0.00 H new ATOM 0 HB2 ALA A 130 -4.023 4.618 -11.532 1.00 0.00 H new ATOM 0 HB3 ALA A 130 -4.676 6.044 -12.373 1.00 0.00 H new ATOM 2113 N HIS A 131 -4.826 8.618 -10.990 1.00 0.00 N ATOM 2114 CA HIS A 131 -4.756 10.038 -11.255 1.00 0.00 C ATOM 2115 C HIS A 131 -4.614 10.837 -9.953 1.00 0.00 C ATOM 2116 O HIS A 131 -4.350 12.035 -10.031 1.00 0.00 O ATOM 2117 CB HIS A 131 -6.032 10.499 -11.977 1.00 0.00 C ATOM 2118 CG HIS A 131 -6.386 9.849 -13.293 1.00 0.00 C ATOM 2119 ND1 HIS A 131 -7.637 9.889 -13.877 1.00 0.00 N ATOM 2120 CD2 HIS A 131 -5.582 9.072 -14.089 1.00 0.00 C ATOM 2121 CE1 HIS A 131 -7.586 9.149 -14.992 1.00 0.00 C ATOM 2122 NE2 HIS A 131 -6.361 8.627 -15.166 1.00 0.00 N ATOM 0 H HIS A 131 -5.753 8.219 -11.134 1.00 0.00 H new ATOM 0 HA HIS A 131 -3.881 10.217 -11.880 1.00 0.00 H new ATOM 0 HB2 HIS A 131 -6.871 10.350 -11.297 1.00 0.00 H new ATOM 0 HB3 HIS A 131 -5.947 11.572 -12.149 1.00 0.00 H new ATOM 0 HD2 HIS A 131 -4.540 8.845 -13.917 1.00 0.00 H new ATOM 0 HE1 HIS A 131 -8.419 8.993 -15.662 1.00 0.00 H new ATOM 0 HE2 HIS A 131 -6.057 8.025 -15.931 1.00 0.00 H new ATOM 2130 N HIS A 132 -4.831 10.237 -8.770 1.00 0.00 N ATOM 2131 CA HIS A 132 -4.740 10.915 -7.476 1.00 0.00 C ATOM 2132 C HIS A 132 -5.571 12.211 -7.455 1.00 0.00 C ATOM 2133 O HIS A 132 -5.222 13.139 -6.731 1.00 0.00 O ATOM 2134 CB HIS A 132 -3.253 11.120 -7.124 1.00 0.00 C ATOM 2135 CG HIS A 132 -2.498 9.831 -6.907 1.00 0.00 C ATOM 2136 ND1 HIS A 132 -1.200 9.580 -7.288 1.00 0.00 N ATOM 2137 CD2 HIS A 132 -2.960 8.714 -6.262 1.00 0.00 C ATOM 2138 CE1 HIS A 132 -0.886 8.345 -6.873 1.00 0.00 C ATOM 2139 NE2 HIS A 132 -1.919 7.781 -6.228 1.00 0.00 N ATOM 0 H HIS A 132 -5.078 9.251 -8.690 1.00 0.00 H new ATOM 0 HA HIS A 132 -5.180 10.294 -6.696 1.00 0.00 H new ATOM 0 HB2 HIS A 132 -2.773 11.681 -7.926 1.00 0.00 H new ATOM 0 HB3 HIS A 132 -3.183 11.728 -6.222 1.00 0.00 H new ATOM 0 HD1 HIS A 132 -0.587 10.219 -7.795 1.00 0.00 H new ATOM 0 HD2 HIS A 132 -3.950 8.578 -5.853 1.00 0.00 H new ATOM 0 HE1 HIS A 132 0.069 7.868 -7.036 1.00 0.00 H new ATOM 2147 N VAL A 133 -6.684 12.265 -8.205 1.00 0.00 N ATOM 2148 CA VAL A 133 -7.570 13.428 -8.322 1.00 0.00 C ATOM 2149 C VAL A 133 -7.945 13.989 -6.951 1.00 0.00 C ATOM 2150 O VAL A 133 -7.839 15.197 -6.742 1.00 0.00 O ATOM 2151 CB VAL A 133 -8.834 13.136 -9.163 1.00 0.00 C ATOM 2152 CG1 VAL A 133 -9.363 14.429 -9.803 1.00 0.00 C ATOM 2153 CG2 VAL A 133 -8.618 12.110 -10.281 1.00 0.00 C ATOM 0 H VAL A 133 -7.000 11.472 -8.764 1.00 0.00 H new ATOM 0 HA VAL A 133 -7.002 14.189 -8.858 1.00 0.00 H new ATOM 0 HB VAL A 133 -9.552 12.714 -8.460 1.00 0.00 H new ATOM 0 HG11 VAL A 133 -10.253 14.206 -10.392 1.00 0.00 H new ATOM 0 HG12 VAL A 133 -9.615 15.145 -9.021 1.00 0.00 H new ATOM 0 HG13 VAL A 133 -8.597 14.854 -10.451 1.00 0.00 H new ATOM 0 HG21 VAL A 133 -9.552 11.961 -10.824 1.00 0.00 H new ATOM 0 HG22 VAL A 133 -7.854 12.475 -10.967 1.00 0.00 H new ATOM 0 HG23 VAL A 133 -8.295 11.163 -9.848 1.00 0.00 H new ATOM 2163 N HIS A 134 -8.427 13.144 -6.035 1.00 0.00 N ATOM 2164 CA HIS A 134 -8.789 13.566 -4.680 1.00 0.00 C ATOM 2165 C HIS A 134 -7.847 12.930 -3.652 1.00 0.00 C ATOM 2166 O HIS A 134 -8.063 13.072 -2.449 1.00 0.00 O ATOM 2167 CB HIS A 134 -10.279 13.326 -4.381 1.00 0.00 C ATOM 2168 CG HIS A 134 -10.845 14.388 -3.469 1.00 0.00 C ATOM 2169 ND1 HIS A 134 -10.320 14.769 -2.256 1.00 0.00 N ATOM 2170 CD2 HIS A 134 -11.898 15.220 -3.739 1.00 0.00 C ATOM 2171 CE1 HIS A 134 -11.014 15.827 -1.814 1.00 0.00 C ATOM 2172 NE2 HIS A 134 -12.007 16.124 -2.676 1.00 0.00 N ATOM 0 H HIS A 134 -8.577 12.151 -6.212 1.00 0.00 H new ATOM 0 HA HIS A 134 -8.655 14.645 -4.605 1.00 0.00 H new ATOM 0 HB2 HIS A 134 -10.840 13.313 -5.316 1.00 0.00 H new ATOM 0 HB3 HIS A 134 -10.404 12.346 -3.920 1.00 0.00 H new ATOM 0 HD1 HIS A 134 -9.538 14.323 -1.776 1.00 0.00 H new ATOM 0 HD2 HIS A 134 -12.530 15.185 -4.614 1.00 0.00 H new ATOM 0 HE1 HIS A 134 -10.808 16.364 -0.900 1.00 0.00 H new ATOM 2180 N ALA A 135 -6.864 12.139 -4.105 1.00 0.00 N ATOM 2181 CA ALA A 135 -5.913 11.524 -3.199 1.00 0.00 C ATOM 2182 C ALA A 135 -4.992 12.622 -2.681 1.00 0.00 C ATOM 2183 O ALA A 135 -4.980 13.755 -3.181 1.00 0.00 O ATOM 2184 CB ALA A 135 -5.089 10.430 -3.876 1.00 0.00 C ATOM 0 H ALA A 135 -6.716 11.917 -5.090 1.00 0.00 H new ATOM 0 HA ALA A 135 -6.458 11.045 -2.386 1.00 0.00 H new ATOM 0 HB1 ALA A 135 -4.392 10.001 -3.156 1.00 0.00 H new ATOM 0 HB2 ALA A 135 -5.754 9.650 -4.246 1.00 0.00 H new ATOM 0 HB3 ALA A 135 -4.532 10.857 -4.710 1.00 0.00 H new ATOM 2190 N GLU A 136 -4.217 12.282 -1.659 1.00 0.00 N ATOM 2191 CA GLU A 136 -3.299 13.240 -1.063 1.00 0.00 C ATOM 2192 C GLU A 136 -2.030 12.501 -0.680 1.00 0.00 C ATOM 2193 O GLU A 136 -1.023 12.634 -1.378 1.00 0.00 O ATOM 2194 CB GLU A 136 -3.935 14.054 0.088 1.00 0.00 C ATOM 2195 CG GLU A 136 -5.466 13.964 0.218 1.00 0.00 C ATOM 2196 CD GLU A 136 -6.014 15.155 0.983 1.00 0.00 C ATOM 2197 OE1 GLU A 136 -6.065 15.092 2.237 1.00 0.00 O ATOM 2198 OE2 GLU A 136 -6.356 16.170 0.331 1.00 0.00 O ATOM 0 H GLU A 136 -4.206 11.357 -1.229 1.00 0.00 H new ATOM 0 HA GLU A 136 -3.043 14.009 -1.792 1.00 0.00 H new ATOM 0 HB2 GLU A 136 -3.491 13.724 1.027 1.00 0.00 H new ATOM 0 HB3 GLU A 136 -3.663 15.101 -0.042 1.00 0.00 H new ATOM 0 HG2 GLU A 136 -5.918 13.924 -0.773 1.00 0.00 H new ATOM 0 HG3 GLU A 136 -5.738 13.041 0.730 1.00 0.00 H new ATOM 2205 N GLY A 137 -2.095 11.644 0.338 1.00 0.00 N ATOM 2206 CA GLY A 137 -0.937 10.896 0.796 1.00 0.00 C ATOM 2207 C GLY A 137 -1.256 9.860 1.866 1.00 0.00 C ATOM 2208 O GLY A 137 -0.448 9.688 2.783 1.00 0.00 O ATOM 0 H GLY A 137 -2.949 11.453 0.862 1.00 0.00 H new ATOM 0 HA2 GLY A 137 -0.480 10.394 -0.057 1.00 0.00 H new ATOM 0 HA3 GLY A 137 -0.198 11.594 1.189 1.00 0.00 H new ATOM 2212 N LEU A 138 -2.467 9.300 1.881 1.00 0.00 N ATOM 2213 CA LEU A 138 -2.821 8.257 2.848 1.00 0.00 C ATOM 2214 C LEU A 138 -2.081 7.007 2.391 1.00 0.00 C ATOM 2215 O LEU A 138 -1.672 6.233 3.282 1.00 0.00 O ATOM 2216 CB LEU A 138 -4.341 8.019 2.904 1.00 0.00 C ATOM 2217 CG LEU A 138 -5.087 9.244 3.466 1.00 0.00 C ATOM 2218 CD1 LEU A 138 -6.558 9.222 3.059 1.00 0.00 C ATOM 2219 CD2 LEU A 138 -4.956 9.328 4.989 1.00 0.00 C ATOM 0 H LEU A 138 -3.218 9.550 1.237 1.00 0.00 H new ATOM 0 HA LEU A 138 -2.536 8.546 3.860 1.00 0.00 H new ATOM 0 HB2 LEU A 138 -4.712 7.794 1.904 1.00 0.00 H new ATOM 0 HB3 LEU A 138 -4.551 7.148 3.525 1.00 0.00 H new ATOM 0 HG LEU A 138 -4.623 10.133 3.038 1.00 0.00 H new ATOM 0 HD11 LEU A 138 -7.062 10.097 3.468 1.00 0.00 H new ATOM 0 HD12 LEU A 138 -6.635 9.234 1.972 1.00 0.00 H new ATOM 0 HD13 LEU A 138 -7.029 8.318 3.446 1.00 0.00 H new ATOM 0 HD21 LEU A 138 -5.494 10.204 5.353 1.00 0.00 H new ATOM 0 HD22 LEU A 138 -5.377 8.430 5.441 1.00 0.00 H new ATOM 0 HD23 LEU A 138 -3.903 9.411 5.260 1.00 0.00 H new