USER MOD reduce.3.24.130724 H: found=0, std=0, add=676, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 674 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 124 SER OG : rot 180:sc= 0.00926 USER MOD Set 1.2: A 128 GLN : amide:sc= 0.0121 X(o=0.021,f=-0.18) USER MOD Set 2.1: A 79 SER OG : rot 180:sc= 0 USER MOD Set 2.2: A 83 ASN : amide:sc= -0.0818 X(o=-0.082,f=-0.17) USER MOD Set 3.1: A 41 MET CE :methyl -154:sc= -0.2 (180deg=-1.06) USER MOD Set 3.2: A 116 CYS SG : rot 76:sc= 0.898 USER MOD Set 4.1: A 33 SER OG : rot -177:sc= -3.43! USER MOD Set 4.2: A 37 LYS NZ :NH3+ 179:sc= -0.553 (180deg=-0.734) USER MOD Single : A 39 LYS NZ :NH3+ 176:sc= 0.0286 (180deg=0.0129) USER MOD Single : A 47 HIS : no HE2:sc= 1.01 K(o=1,f=-4.5!) USER MOD Single : A 48 LYS NZ :NH3+ -161:sc= 0.502! (180deg=-0.996!) USER MOD Single : A 49 HIS : no HD1:sc= -2.7 K(o=-2.7,f=-5.1!) USER MOD Single : A 57 SER OG : rot 31:sc= -1.79! USER MOD Single : A 60 TYR OH : rot 180:sc= 0 USER MOD Single : A 62 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 TYR OH : rot 180:sc= 0 USER MOD Single : A 81 CYS SG : rot 171:sc= -0.541! USER MOD Single : A 84 GLN : amide:sc= -17.5! C(o=-18!,f=-18!) USER MOD Single : A 87 SER OG : rot 180:sc= 0 USER MOD Single : A 89 MET CE :methyl -154:sc= -0.184 (180deg=-0.995) USER MOD Single : A 92 TYR OH : rot 180:sc= 0 USER MOD Single : A 94 GLN : amide:sc= -0.287 K(o=-0.29,f=-2.8!) USER MOD Single : A 98 HIS : no HE2:sc= 0.484! C(o=0.48!,f=-9.5!) USER MOD Single : A 105 THR OG1 : rot -30:sc= 0.0581 USER MOD Single : A 106 THR OG1 : rot -82:sc= -4.47! USER MOD Single : A 114 GLN : amide:sc= -0.244 X(o=-0.24,f=-0.35) USER MOD Single : A 120 LYS NZ :NH3+ -163:sc= 0.9 (180deg=0.389) USER MOD Single : A 127 GLN : amide:sc= -0.568 K(o=-0.57,f=-4.6!) USER MOD Single : A 129 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 133 N SER A 33 -0.111 -12.689 8.476 1.00 0.00 N ATOM 134 CA SER A 33 -0.505 -12.526 9.862 1.00 0.00 C ATOM 135 C SER A 33 -1.783 -13.284 10.173 1.00 0.00 C ATOM 136 O SER A 33 -1.852 -14.027 11.154 1.00 0.00 O ATOM 137 CB SER A 33 -0.700 -11.042 10.180 1.00 0.00 C ATOM 138 OG SER A 33 -2.026 -10.656 9.838 1.00 0.00 O ATOM 0 HA SER A 33 0.292 -12.935 10.483 1.00 0.00 H new ATOM 0 HB2 SER A 33 -0.518 -10.859 11.239 1.00 0.00 H new ATOM 0 HB3 SER A 33 0.020 -10.442 9.624 1.00 0.00 H new ATOM 0 HG SER A 33 -2.139 -9.696 9.997 1.00 0.00 H new ATOM 144 N LEU A 34 -2.802 -13.074 9.353 1.00 0.00 N ATOM 145 CA LEU A 34 -4.087 -13.726 9.568 1.00 0.00 C ATOM 146 C LEU A 34 -3.887 -15.155 10.054 1.00 0.00 C ATOM 147 O LEU A 34 -4.600 -15.623 10.942 1.00 0.00 O ATOM 148 CB LEU A 34 -4.886 -13.733 8.264 1.00 0.00 C ATOM 149 CG LEU A 34 -6.224 -14.443 8.484 1.00 0.00 C ATOM 150 CD1 LEU A 34 -7.002 -13.743 9.603 1.00 0.00 C ATOM 151 CD2 LEU A 34 -7.040 -14.399 7.191 1.00 0.00 C ATOM 0 H LEU A 34 -2.766 -12.462 8.538 1.00 0.00 H new ATOM 0 HA LEU A 34 -4.636 -13.172 10.329 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -5.057 -12.711 7.925 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -4.319 -14.238 7.482 1.00 0.00 H new ATOM 0 HG LEU A 34 -6.042 -15.480 8.766 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -7.954 -14.251 9.757 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -6.421 -13.774 10.525 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -7.185 -12.705 9.325 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -7.994 -14.904 7.345 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -7.220 -13.361 6.910 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -6.488 -14.900 6.395 1.00 0.00 H new ATOM 163 N GLU A 35 -2.913 -15.842 9.472 1.00 0.00 N ATOM 164 CA GLU A 35 -2.629 -17.217 9.860 1.00 0.00 C ATOM 165 C GLU A 35 -2.116 -17.278 11.296 1.00 0.00 C ATOM 166 O GLU A 35 -2.538 -18.129 12.079 1.00 0.00 O ATOM 167 CB GLU A 35 -1.586 -17.816 8.917 1.00 0.00 C ATOM 168 CG GLU A 35 -1.266 -19.248 9.349 1.00 0.00 C ATOM 169 CD GLU A 35 -0.277 -19.878 8.375 1.00 0.00 C ATOM 170 OE1 GLU A 35 -0.712 -20.653 7.539 1.00 0.00 O ATOM 171 OE2 GLU A 35 0.901 -19.578 8.480 1.00 0.00 O ATOM 0 H GLU A 35 -2.311 -15.474 8.736 1.00 0.00 H new ATOM 0 HA GLU A 35 -3.553 -17.792 9.795 1.00 0.00 H new ATOM 0 HB2 GLU A 35 -1.960 -17.809 7.893 1.00 0.00 H new ATOM 0 HB3 GLU A 35 -0.680 -17.211 8.929 1.00 0.00 H new ATOM 0 HG2 GLU A 35 -0.848 -19.248 10.356 1.00 0.00 H new ATOM 0 HG3 GLU A 35 -2.181 -19.839 9.384 1.00 0.00 H new ATOM 178 N GLU A 36 -1.208 -16.370 11.635 1.00 0.00 N ATOM 179 CA GLU A 36 -0.647 -16.332 12.981 1.00 0.00 C ATOM 180 C GLU A 36 -1.723 -15.986 14.003 1.00 0.00 C ATOM 181 O GLU A 36 -1.775 -16.573 15.083 1.00 0.00 O ATOM 182 CB GLU A 36 0.475 -15.297 13.049 1.00 0.00 C ATOM 183 CG GLU A 36 1.724 -15.847 12.352 1.00 0.00 C ATOM 184 CD GLU A 36 2.839 -14.803 12.349 1.00 0.00 C ATOM 185 OE1 GLU A 36 2.634 -13.748 11.771 1.00 0.00 O ATOM 186 OE2 GLU A 36 3.874 -15.068 12.938 1.00 0.00 O ATOM 0 H GLU A 36 -0.847 -15.656 11.003 1.00 0.00 H new ATOM 0 HA GLU A 36 -0.247 -17.319 13.214 1.00 0.00 H new ATOM 0 HB2 GLU A 36 0.158 -14.370 12.571 1.00 0.00 H new ATOM 0 HB3 GLU A 36 0.701 -15.059 14.088 1.00 0.00 H new ATOM 0 HG2 GLU A 36 2.064 -16.749 12.861 1.00 0.00 H new ATOM 0 HG3 GLU A 36 1.481 -16.131 11.328 1.00 0.00 H new ATOM 193 N LYS A 37 -2.584 -15.035 13.657 1.00 0.00 N ATOM 194 CA LYS A 37 -3.653 -14.630 14.563 1.00 0.00 C ATOM 195 C LYS A 37 -4.519 -15.823 14.942 1.00 0.00 C ATOM 196 O LYS A 37 -4.821 -16.030 16.117 1.00 0.00 O ATOM 197 CB LYS A 37 -4.526 -13.564 13.886 1.00 0.00 C ATOM 198 CG LYS A 37 -3.978 -12.170 14.193 1.00 0.00 C ATOM 199 CD LYS A 37 -4.458 -11.184 13.132 1.00 0.00 C ATOM 200 CE LYS A 37 -3.522 -11.253 11.928 1.00 0.00 C ATOM 201 NZ LYS A 37 -4.224 -10.731 10.717 1.00 0.00 N ATOM 0 H LYS A 37 -2.564 -14.536 12.768 1.00 0.00 H new ATOM 0 HA LYS A 37 -3.203 -14.222 15.468 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -4.545 -13.728 12.809 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -5.554 -13.646 14.239 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -4.310 -11.847 15.180 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -2.888 -12.194 14.215 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -5.478 -11.423 12.830 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -4.475 -10.173 13.538 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -2.623 -10.668 12.120 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -3.203 -12.282 11.761 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 -3.580 -10.763 9.901 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -5.060 -11.317 10.521 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -4.522 -9.749 10.885 1.00 0.00 H new ATOM 215 N ILE A 38 -4.910 -16.606 13.947 1.00 0.00 N ATOM 216 CA ILE A 38 -5.741 -17.775 14.198 1.00 0.00 C ATOM 217 C ILE A 38 -4.985 -18.791 15.051 1.00 0.00 C ATOM 218 O ILE A 38 -5.537 -19.359 15.993 1.00 0.00 O ATOM 219 CB ILE A 38 -6.147 -18.419 12.873 1.00 0.00 C ATOM 220 CG1 ILE A 38 -7.075 -17.470 12.111 1.00 0.00 C ATOM 221 CG2 ILE A 38 -6.886 -19.729 13.148 1.00 0.00 C ATOM 222 CD1 ILE A 38 -7.266 -17.982 10.683 1.00 0.00 C ATOM 0 H ILE A 38 -4.668 -16.456 12.967 1.00 0.00 H new ATOM 0 HA ILE A 38 -6.635 -17.458 14.735 1.00 0.00 H new ATOM 0 HB ILE A 38 -5.255 -18.619 12.279 1.00 0.00 H new ATOM 0 HG12 ILE A 38 -8.038 -17.402 12.616 1.00 0.00 H new ATOM 0 HG13 ILE A 38 -6.652 -16.465 12.095 1.00 0.00 H new ATOM 0 HG21 ILE A 38 -7.176 -20.189 12.203 1.00 0.00 H new ATOM 0 HG22 ILE A 38 -6.232 -20.407 13.696 1.00 0.00 H new ATOM 0 HG23 ILE A 38 -7.778 -19.526 13.741 1.00 0.00 H new ATOM 0 HD11 ILE A 38 -7.927 -17.307 10.140 1.00 0.00 H new ATOM 0 HD12 ILE A 38 -6.300 -18.027 10.180 1.00 0.00 H new ATOM 0 HD13 ILE A 38 -7.708 -18.978 10.710 1.00 0.00 H new ATOM 234 N LYS A 39 -3.719 -19.010 14.716 1.00 0.00 N ATOM 235 CA LYS A 39 -2.895 -19.957 15.457 1.00 0.00 C ATOM 236 C LYS A 39 -2.771 -19.528 16.913 1.00 0.00 C ATOM 237 O LYS A 39 -2.813 -20.360 17.820 1.00 0.00 O ATOM 238 CB LYS A 39 -1.505 -20.044 14.820 1.00 0.00 C ATOM 239 CG LYS A 39 -1.588 -20.830 13.509 1.00 0.00 C ATOM 240 CD LYS A 39 -0.237 -20.778 12.792 1.00 0.00 C ATOM 241 CE LYS A 39 -0.269 -21.702 11.573 1.00 0.00 C ATOM 242 NZ LYS A 39 1.035 -21.620 10.856 1.00 0.00 N ATOM 0 H LYS A 39 -3.243 -18.548 13.941 1.00 0.00 H new ATOM 0 HA LYS A 39 -3.370 -20.937 15.421 1.00 0.00 H new ATOM 0 HB2 LYS A 39 -1.117 -19.043 14.631 1.00 0.00 H new ATOM 0 HB3 LYS A 39 -0.810 -20.531 15.504 1.00 0.00 H new ATOM 0 HG2 LYS A 39 -1.864 -21.865 13.711 1.00 0.00 H new ATOM 0 HG3 LYS A 39 -2.366 -20.411 12.871 1.00 0.00 H new ATOM 0 HD2 LYS A 39 -0.017 -19.757 12.481 1.00 0.00 H new ATOM 0 HD3 LYS A 39 0.559 -21.083 13.471 1.00 0.00 H new ATOM 0 HE2 LYS A 39 -0.461 -22.728 11.886 1.00 0.00 H new ATOM 0 HE3 LYS A 39 -1.082 -21.415 10.906 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 1.040 -22.297 10.067 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 1.168 -20.657 10.487 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 1.808 -21.849 11.513 1.00 0.00 H new ATOM 256 N LEU A 40 -2.614 -18.227 17.131 1.00 0.00 N ATOM 257 CA LEU A 40 -2.487 -17.707 18.487 1.00 0.00 C ATOM 258 C LEU A 40 -3.789 -17.883 19.265 1.00 0.00 C ATOM 259 O LEU A 40 -3.789 -18.364 20.398 1.00 0.00 O ATOM 260 CB LEU A 40 -2.119 -16.222 18.438 1.00 0.00 C ATOM 261 CG LEU A 40 -2.010 -15.671 19.862 1.00 0.00 C ATOM 262 CD1 LEU A 40 -0.970 -16.476 20.646 1.00 0.00 C ATOM 263 CD2 LEU A 40 -1.584 -14.203 19.809 1.00 0.00 C ATOM 0 H LEU A 40 -2.572 -17.521 16.396 1.00 0.00 H new ATOM 0 HA LEU A 40 -1.702 -18.266 18.995 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -1.173 -16.089 17.913 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -2.874 -15.668 17.880 1.00 0.00 H new ATOM 0 HG LEU A 40 -2.978 -15.752 20.356 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -0.894 -16.082 21.660 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -1.273 -17.522 20.685 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -0.001 -16.397 20.152 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -1.506 -13.810 20.823 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -0.617 -14.123 19.313 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -2.325 -13.629 19.253 1.00 0.00 H new ATOM 275 N MET A 41 -4.894 -17.489 18.645 1.00 0.00 N ATOM 276 CA MET A 41 -6.200 -17.600 19.280 1.00 0.00 C ATOM 277 C MET A 41 -6.578 -19.064 19.459 1.00 0.00 C ATOM 278 O MET A 41 -7.286 -19.424 20.399 1.00 0.00 O ATOM 279 CB MET A 41 -7.256 -16.884 18.438 1.00 0.00 C ATOM 280 CG MET A 41 -7.127 -15.370 18.623 1.00 0.00 C ATOM 281 SD MET A 41 -7.530 -14.926 20.332 1.00 0.00 S ATOM 282 CE MET A 41 -9.315 -15.204 20.231 1.00 0.00 C ATOM 0 H MET A 41 -4.912 -17.091 17.706 1.00 0.00 H new ATOM 0 HA MET A 41 -6.152 -17.129 20.262 1.00 0.00 H new ATOM 0 HB2 MET A 41 -7.133 -17.143 17.386 1.00 0.00 H new ATOM 0 HB3 MET A 41 -8.253 -17.212 18.732 1.00 0.00 H new ATOM 0 HG2 MET A 41 -6.113 -15.050 18.384 1.00 0.00 H new ATOM 0 HG3 MET A 41 -7.795 -14.852 17.935 1.00 0.00 H new ATOM 0 HE1 MET A 41 -9.822 -14.585 20.971 1.00 0.00 H new ATOM 0 HE2 MET A 41 -9.668 -14.941 19.234 1.00 0.00 H new ATOM 0 HE3 MET A 41 -9.531 -16.254 20.427 1.00 0.00 H new ATOM 292 N ARG A 42 -6.108 -19.902 18.546 1.00 0.00 N ATOM 293 CA ARG A 42 -6.409 -21.325 18.610 1.00 0.00 C ATOM 294 C ARG A 42 -5.795 -21.947 19.857 1.00 0.00 C ATOM 295 O ARG A 42 -6.191 -23.033 20.278 1.00 0.00 O ATOM 296 CB ARG A 42 -5.879 -22.042 17.357 1.00 0.00 C ATOM 297 CG ARG A 42 -6.957 -22.081 16.266 1.00 0.00 C ATOM 298 CD ARG A 42 -6.676 -23.243 15.322 1.00 0.00 C ATOM 299 NE ARG A 42 -5.380 -23.079 14.666 1.00 0.00 N ATOM 300 CZ ARG A 42 -5.284 -22.761 13.379 1.00 0.00 C ATOM 301 NH1 ARG A 42 -4.109 -22.623 12.827 1.00 0.00 N ATOM 302 NH2 ARG A 42 -6.364 -22.587 12.668 1.00 0.00 N ATOM 0 H ARG A 42 -5.522 -19.625 17.759 1.00 0.00 H new ATOM 0 HA ARG A 42 -7.492 -21.442 18.655 1.00 0.00 H new ATOM 0 HB2 ARG A 42 -4.993 -21.528 16.984 1.00 0.00 H new ATOM 0 HB3 ARG A 42 -5.575 -23.057 17.613 1.00 0.00 H new ATOM 0 HG2 ARG A 42 -7.943 -22.194 16.717 1.00 0.00 H new ATOM 0 HG3 ARG A 42 -6.965 -21.142 15.713 1.00 0.00 H new ATOM 0 HD2 ARG A 42 -6.691 -24.180 15.878 1.00 0.00 H new ATOM 0 HD3 ARG A 42 -7.463 -23.305 14.571 1.00 0.00 H new ATOM 0 HE ARG A 42 -4.527 -23.212 15.210 1.00 0.00 H new ATOM 0 HH11 ARG A 42 -3.265 -22.759 13.383 1.00 0.00 H new ATOM 0 HH12 ARG A 42 -4.035 -22.379 11.839 1.00 0.00 H new ATOM 0 HH21 ARG A 42 -7.282 -22.695 13.100 1.00 0.00 H new ATOM 0 HH22 ARG A 42 -6.291 -22.343 11.680 1.00 0.00 H new ATOM 316 N LEU A 43 -4.828 -21.255 20.440 1.00 0.00 N ATOM 317 CA LEU A 43 -4.171 -21.749 21.643 1.00 0.00 C ATOM 318 C LEU A 43 -4.825 -21.170 22.890 1.00 0.00 C ATOM 319 O LEU A 43 -4.956 -21.851 23.907 1.00 0.00 O ATOM 320 CB LEU A 43 -2.690 -21.380 21.617 1.00 0.00 C ATOM 321 CG LEU A 43 -1.990 -22.147 20.494 1.00 0.00 C ATOM 322 CD1 LEU A 43 -0.528 -21.708 20.420 1.00 0.00 C ATOM 323 CD2 LEU A 43 -2.062 -23.656 20.771 1.00 0.00 C ATOM 0 H LEU A 43 -4.482 -20.356 20.104 1.00 0.00 H new ATOM 0 HA LEU A 43 -4.272 -22.834 21.670 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -2.575 -20.307 21.465 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -2.229 -21.617 22.576 1.00 0.00 H new ATOM 0 HG LEU A 43 -2.485 -21.935 19.546 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -0.025 -22.252 19.621 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -0.479 -20.638 20.217 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -0.036 -21.920 21.369 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -1.562 -24.198 19.968 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -1.570 -23.876 21.718 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -3.105 -23.967 20.823 1.00 0.00 H new ATOM 335 N VAL A 44 -5.227 -19.908 22.809 1.00 0.00 N ATOM 336 CA VAL A 44 -5.858 -19.247 23.945 1.00 0.00 C ATOM 337 C VAL A 44 -7.172 -19.939 24.299 1.00 0.00 C ATOM 338 O VAL A 44 -7.446 -20.209 25.469 1.00 0.00 O ATOM 339 CB VAL A 44 -6.122 -17.776 23.611 1.00 0.00 C ATOM 340 CG1 VAL A 44 -6.739 -17.057 24.822 1.00 0.00 C ATOM 341 CG2 VAL A 44 -4.804 -17.095 23.229 1.00 0.00 C ATOM 0 H VAL A 44 -5.129 -19.326 21.977 1.00 0.00 H new ATOM 0 HA VAL A 44 -5.186 -19.307 24.801 1.00 0.00 H new ATOM 0 HB VAL A 44 -6.820 -17.722 22.775 1.00 0.00 H new ATOM 0 HG11 VAL A 44 -6.921 -16.012 24.571 1.00 0.00 H new ATOM 0 HG12 VAL A 44 -7.681 -17.536 25.088 1.00 0.00 H new ATOM 0 HG13 VAL A 44 -6.052 -17.112 25.667 1.00 0.00 H new ATOM 0 HG21 VAL A 44 -4.991 -16.048 22.991 1.00 0.00 H new ATOM 0 HG22 VAL A 44 -4.106 -17.158 24.064 1.00 0.00 H new ATOM 0 HG23 VAL A 44 -4.375 -17.594 22.360 1.00 0.00 H new ATOM 351 N VAL A 45 -7.978 -20.220 23.284 1.00 0.00 N ATOM 352 CA VAL A 45 -9.260 -20.877 23.496 1.00 0.00 C ATOM 353 C VAL A 45 -9.052 -22.283 24.046 1.00 0.00 C ATOM 354 O VAL A 45 -9.771 -22.725 24.938 1.00 0.00 O ATOM 355 CB VAL A 45 -10.045 -20.941 22.188 1.00 0.00 C ATOM 356 CG1 VAL A 45 -11.269 -21.839 22.369 1.00 0.00 C ATOM 357 CG2 VAL A 45 -10.505 -19.531 21.804 1.00 0.00 C ATOM 0 H VAL A 45 -7.768 -20.004 22.309 1.00 0.00 H new ATOM 0 HA VAL A 45 -9.829 -20.296 24.222 1.00 0.00 H new ATOM 0 HB VAL A 45 -9.409 -21.348 21.402 1.00 0.00 H new ATOM 0 HG11 VAL A 45 -11.829 -21.884 21.435 1.00 0.00 H new ATOM 0 HG12 VAL A 45 -10.946 -22.842 22.647 1.00 0.00 H new ATOM 0 HG13 VAL A 45 -11.906 -21.432 23.154 1.00 0.00 H new ATOM 0 HG21 VAL A 45 -11.066 -19.573 20.870 1.00 0.00 H new ATOM 0 HG22 VAL A 45 -11.142 -19.129 22.592 1.00 0.00 H new ATOM 0 HG23 VAL A 45 -9.635 -18.887 21.676 1.00 0.00 H new ATOM 367 N ARG A 46 -8.070 -22.983 23.496 1.00 0.00 N ATOM 368 CA ARG A 46 -7.778 -24.342 23.932 1.00 0.00 C ATOM 369 C ARG A 46 -7.277 -24.348 25.372 1.00 0.00 C ATOM 370 O ARG A 46 -7.220 -25.397 26.014 1.00 0.00 O ATOM 371 CB ARG A 46 -6.722 -24.970 23.019 1.00 0.00 C ATOM 372 CG ARG A 46 -6.807 -26.497 23.108 1.00 0.00 C ATOM 373 CD ARG A 46 -7.837 -27.012 22.099 1.00 0.00 C ATOM 374 NE ARG A 46 -7.964 -28.460 22.202 1.00 0.00 N ATOM 375 CZ ARG A 46 -8.709 -29.147 21.342 1.00 0.00 C ATOM 376 NH1 ARG A 46 -8.807 -30.443 21.454 1.00 0.00 N ATOM 377 NH2 ARG A 46 -9.342 -28.525 20.385 1.00 0.00 N ATOM 0 H ARG A 46 -7.465 -22.636 22.752 1.00 0.00 H new ATOM 0 HA ARG A 46 -8.697 -24.925 23.877 1.00 0.00 H new ATOM 0 HB2 ARG A 46 -6.878 -24.647 21.990 1.00 0.00 H new ATOM 0 HB3 ARG A 46 -5.727 -24.634 23.312 1.00 0.00 H new ATOM 0 HG2 ARG A 46 -5.831 -26.938 22.905 1.00 0.00 H new ATOM 0 HG3 ARG A 46 -7.089 -26.798 24.117 1.00 0.00 H new ATOM 0 HD2 ARG A 46 -8.803 -26.541 22.282 1.00 0.00 H new ATOM 0 HD3 ARG A 46 -7.535 -26.737 21.088 1.00 0.00 H new ATOM 0 HE ARG A 46 -7.473 -28.955 22.947 1.00 0.00 H new ATOM 0 HH11 ARG A 46 -8.312 -30.929 22.202 1.00 0.00 H new ATOM 0 HH12 ARG A 46 -9.379 -30.970 20.794 1.00 0.00 H new ATOM 0 HH21 ARG A 46 -9.265 -27.512 20.297 1.00 0.00 H new ATOM 0 HH22 ARG A 46 -9.914 -29.052 19.725 1.00 0.00 H new ATOM 391 N HIS A 47 -6.909 -23.172 25.872 1.00 0.00 N ATOM 392 CA HIS A 47 -6.409 -23.052 27.241 1.00 0.00 C ATOM 393 C HIS A 47 -7.159 -21.956 27.993 1.00 0.00 C ATOM 394 O HIS A 47 -6.614 -21.325 28.896 1.00 0.00 O ATOM 395 CB HIS A 47 -4.915 -22.732 27.220 1.00 0.00 C ATOM 396 CG HIS A 47 -4.169 -23.861 26.560 1.00 0.00 C ATOM 397 ND1 HIS A 47 -3.779 -23.810 25.232 1.00 0.00 N ATOM 398 CD2 HIS A 47 -3.737 -25.076 27.031 1.00 0.00 C ATOM 399 CE1 HIS A 47 -3.142 -24.962 24.951 1.00 0.00 C ATOM 400 NE2 HIS A 47 -3.089 -25.770 26.013 1.00 0.00 N ATOM 0 H HIS A 47 -6.946 -22.293 25.355 1.00 0.00 H new ATOM 0 HA HIS A 47 -6.571 -24.000 27.754 1.00 0.00 H new ATOM 0 HB2 HIS A 47 -4.739 -21.801 26.681 1.00 0.00 H new ATOM 0 HB3 HIS A 47 -4.549 -22.585 28.236 1.00 0.00 H new ATOM 0 HD1 HIS A 47 -3.944 -23.039 24.585 1.00 0.00 H new ATOM 0 HD2 HIS A 47 -3.878 -25.438 28.038 1.00 0.00 H new ATOM 0 HE1 HIS A 47 -2.725 -25.203 23.985 1.00 0.00 H new ATOM 407 N LYS A 48 -8.412 -21.735 27.612 1.00 0.00 N ATOM 408 CA LYS A 48 -9.235 -20.715 28.250 1.00 0.00 C ATOM 409 C LYS A 48 -9.602 -21.134 29.671 1.00 0.00 C ATOM 410 O LYS A 48 -9.789 -20.292 30.550 1.00 0.00 O ATOM 411 CB LYS A 48 -10.505 -20.500 27.415 1.00 0.00 C ATOM 412 CG LYS A 48 -11.322 -21.771 27.375 1.00 0.00 C ATOM 413 CD LYS A 48 -12.555 -21.537 26.502 1.00 0.00 C ATOM 414 CE LYS A 48 -13.378 -22.820 26.439 1.00 0.00 C ATOM 415 NZ LYS A 48 -14.584 -22.598 25.595 1.00 0.00 N ATOM 0 H LYS A 48 -8.880 -22.248 26.865 1.00 0.00 H new ATOM 0 HA LYS A 48 -8.673 -19.783 28.307 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -11.098 -19.691 27.842 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -10.237 -20.199 26.402 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -10.726 -22.590 26.974 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -11.622 -22.059 28.383 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -13.156 -20.725 26.912 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -12.253 -21.235 25.499 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -12.777 -23.630 26.026 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -13.675 -23.123 27.443 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -15.293 -23.330 25.803 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -14.984 -21.661 25.801 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -14.319 -22.648 24.591 1.00 0.00 H new ATOM 429 N HIS A 49 -9.699 -22.441 29.889 1.00 0.00 N ATOM 430 CA HIS A 49 -10.042 -22.966 31.207 1.00 0.00 C ATOM 431 C HIS A 49 -8.800 -23.496 31.913 1.00 0.00 C ATOM 432 O HIS A 49 -8.367 -24.622 31.670 1.00 0.00 O ATOM 433 CB HIS A 49 -11.071 -24.092 31.068 1.00 0.00 C ATOM 434 CG HIS A 49 -12.451 -23.505 30.952 1.00 0.00 C ATOM 435 ND1 HIS A 49 -13.075 -23.308 29.730 1.00 0.00 N ATOM 436 CD2 HIS A 49 -13.340 -23.065 31.902 1.00 0.00 C ATOM 437 CE1 HIS A 49 -14.284 -22.771 29.974 1.00 0.00 C ATOM 438 NE2 HIS A 49 -14.497 -22.602 31.281 1.00 0.00 N ATOM 0 H HIS A 49 -9.546 -23.153 29.175 1.00 0.00 H new ATOM 0 HA HIS A 49 -10.466 -22.156 31.801 1.00 0.00 H new ATOM 0 HB2 HIS A 49 -10.847 -24.696 30.189 1.00 0.00 H new ATOM 0 HB3 HIS A 49 -11.018 -24.755 31.932 1.00 0.00 H new ATOM 0 HD2 HIS A 49 -13.168 -23.076 32.968 1.00 0.00 H new ATOM 0 HE1 HIS A 49 -14.996 -22.508 29.206 1.00 0.00 H new ATOM 0 HE2 HIS A 49 -15.329 -22.217 31.729 1.00 0.00 H new ATOM 445 N GLU A 50 -8.235 -22.675 32.790 1.00 0.00 N ATOM 446 CA GLU A 50 -7.043 -23.062 33.533 1.00 0.00 C ATOM 447 C GLU A 50 -7.006 -22.372 34.889 1.00 0.00 C ATOM 448 O GLU A 50 -7.884 -21.572 35.213 1.00 0.00 O ATOM 449 CB GLU A 50 -5.783 -22.705 32.742 1.00 0.00 C ATOM 450 CG GLU A 50 -5.621 -23.674 31.570 1.00 0.00 C ATOM 451 CD GLU A 50 -4.349 -23.348 30.797 1.00 0.00 C ATOM 452 OE1 GLU A 50 -3.708 -22.366 31.135 1.00 0.00 O ATOM 453 OE2 GLU A 50 -4.031 -24.089 29.881 1.00 0.00 O ATOM 0 H GLU A 50 -8.582 -21.740 33.003 1.00 0.00 H new ATOM 0 HA GLU A 50 -7.077 -24.141 33.687 1.00 0.00 H new ATOM 0 HB2 GLU A 50 -5.850 -21.681 32.374 1.00 0.00 H new ATOM 0 HB3 GLU A 50 -4.908 -22.754 33.391 1.00 0.00 H new ATOM 0 HG2 GLU A 50 -5.580 -24.699 31.938 1.00 0.00 H new ATOM 0 HG3 GLU A 50 -6.485 -23.607 30.909 1.00 0.00 H new ATOM 567 N SER A 57 0.308 -13.135 35.449 1.00 0.00 N ATOM 568 CA SER A 57 0.238 -13.363 34.010 1.00 0.00 C ATOM 569 C SER A 57 0.550 -14.821 33.694 1.00 0.00 C ATOM 570 O SER A 57 0.787 -15.184 32.542 1.00 0.00 O ATOM 571 CB SER A 57 1.225 -12.450 33.283 1.00 0.00 C ATOM 572 OG SER A 57 0.858 -11.094 33.503 1.00 0.00 O ATOM 0 HA SER A 57 -0.772 -13.135 33.669 1.00 0.00 H new ATOM 0 HB2 SER A 57 2.238 -12.628 33.645 1.00 0.00 H new ATOM 0 HB3 SER A 57 1.224 -12.671 32.216 1.00 0.00 H new ATOM 0 HG SER A 57 0.432 -11.009 34.382 1.00 0.00 H new ATOM 578 N GLU A 58 0.552 -15.648 34.734 1.00 0.00 N ATOM 579 CA GLU A 58 0.837 -17.069 34.579 1.00 0.00 C ATOM 580 C GLU A 58 0.133 -17.633 33.350 1.00 0.00 C ATOM 581 O GLU A 58 0.573 -18.626 32.773 1.00 0.00 O ATOM 582 CB GLU A 58 0.373 -17.824 35.825 1.00 0.00 C ATOM 583 CG GLU A 58 0.669 -19.314 35.666 1.00 0.00 C ATOM 584 CD GLU A 58 0.276 -20.060 36.934 1.00 0.00 C ATOM 585 OE1 GLU A 58 -0.345 -19.451 37.790 1.00 0.00 O ATOM 586 OE2 GLU A 58 0.601 -21.232 37.031 1.00 0.00 O ATOM 0 H GLU A 58 0.359 -15.358 35.693 1.00 0.00 H new ATOM 0 HA GLU A 58 1.912 -17.193 34.450 1.00 0.00 H new ATOM 0 HB2 GLU A 58 0.881 -17.435 36.708 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -0.695 -17.670 35.978 1.00 0.00 H new ATOM 0 HG2 GLU A 58 0.119 -19.714 34.814 1.00 0.00 H new ATOM 0 HG3 GLU A 58 1.729 -19.463 35.460 1.00 0.00 H new ATOM 593 N PHE A 59 -0.963 -16.995 32.958 1.00 0.00 N ATOM 594 CA PHE A 59 -1.719 -17.445 31.796 1.00 0.00 C ATOM 595 C PHE A 59 -1.046 -16.990 30.505 1.00 0.00 C ATOM 596 O PHE A 59 -0.550 -17.807 29.729 1.00 0.00 O ATOM 597 CB PHE A 59 -3.143 -16.890 31.853 1.00 0.00 C ATOM 598 CG PHE A 59 -3.847 -17.180 30.551 1.00 0.00 C ATOM 599 CD1 PHE A 59 -4.096 -18.504 30.170 1.00 0.00 C ATOM 600 CD2 PHE A 59 -4.253 -16.125 29.724 1.00 0.00 C ATOM 601 CE1 PHE A 59 -4.752 -18.774 28.963 1.00 0.00 C ATOM 602 CE2 PHE A 59 -4.909 -16.395 28.517 1.00 0.00 C ATOM 603 CZ PHE A 59 -5.158 -17.719 28.137 1.00 0.00 C ATOM 0 H PHE A 59 -1.346 -16.172 33.423 1.00 0.00 H new ATOM 0 HA PHE A 59 -1.751 -18.534 31.809 1.00 0.00 H new ATOM 0 HB2 PHE A 59 -3.688 -17.341 32.682 1.00 0.00 H new ATOM 0 HB3 PHE A 59 -3.119 -15.816 32.035 1.00 0.00 H new ATOM 0 HD1 PHE A 59 -3.782 -19.317 30.807 1.00 0.00 H new ATOM 0 HD2 PHE A 59 -4.060 -15.104 30.017 1.00 0.00 H new ATOM 0 HE1 PHE A 59 -4.945 -19.795 28.669 1.00 0.00 H new ATOM 0 HE2 PHE A 59 -5.223 -15.582 27.879 1.00 0.00 H new ATOM 0 HZ PHE A 59 -5.664 -17.927 27.206 1.00 0.00 H new ATOM 613 N TYR A 60 -1.035 -15.682 30.283 1.00 0.00 N ATOM 614 CA TYR A 60 -0.429 -15.124 29.083 1.00 0.00 C ATOM 615 C TYR A 60 1.035 -15.550 28.982 1.00 0.00 C ATOM 616 O TYR A 60 1.579 -15.687 27.885 1.00 0.00 O ATOM 617 CB TYR A 60 -0.520 -13.599 29.124 1.00 0.00 C ATOM 618 CG TYR A 60 -1.926 -13.179 29.449 1.00 0.00 C ATOM 619 CD1 TYR A 60 -2.262 -12.841 30.765 1.00 0.00 C ATOM 620 CD2 TYR A 60 -2.898 -13.128 28.443 1.00 0.00 C ATOM 621 CE1 TYR A 60 -3.570 -12.452 31.076 1.00 0.00 C ATOM 622 CE2 TYR A 60 -4.207 -12.739 28.753 1.00 0.00 C ATOM 623 CZ TYR A 60 -4.543 -12.401 30.070 1.00 0.00 C ATOM 624 OH TYR A 60 -5.830 -12.016 30.373 1.00 0.00 O ATOM 0 H TYR A 60 -1.437 -14.991 30.916 1.00 0.00 H new ATOM 0 HA TYR A 60 -0.965 -15.497 28.210 1.00 0.00 H new ATOM 0 HB2 TYR A 60 0.169 -13.205 29.871 1.00 0.00 H new ATOM 0 HB3 TYR A 60 -0.220 -13.182 28.163 1.00 0.00 H new ATOM 0 HD1 TYR A 60 -1.512 -12.880 31.541 1.00 0.00 H new ATOM 0 HD2 TYR A 60 -2.638 -13.389 27.428 1.00 0.00 H new ATOM 0 HE1 TYR A 60 -3.829 -12.191 32.092 1.00 0.00 H new ATOM 0 HE2 TYR A 60 -4.957 -12.700 27.977 1.00 0.00 H new ATOM 0 HH TYR A 60 -6.377 -12.034 29.560 1.00 0.00 H new ATOM 634 N ALA A 61 1.665 -15.761 30.133 1.00 0.00 N ATOM 635 CA ALA A 61 3.063 -16.176 30.167 1.00 0.00 C ATOM 636 C ALA A 61 3.216 -17.593 29.620 1.00 0.00 C ATOM 637 O ALA A 61 4.302 -17.994 29.201 1.00 0.00 O ATOM 638 CB ALA A 61 3.594 -16.117 31.600 1.00 0.00 C ATOM 0 H ALA A 61 1.232 -15.652 31.050 1.00 0.00 H new ATOM 0 HA ALA A 61 3.639 -15.494 29.541 1.00 0.00 H new ATOM 0 HB1 ALA A 61 4.638 -16.429 31.614 1.00 0.00 H new ATOM 0 HB2 ALA A 61 3.515 -15.097 31.976 1.00 0.00 H new ATOM 0 HB3 ALA A 61 3.008 -16.783 32.233 1.00 0.00 H new ATOM 644 N LYS A 62 2.124 -18.347 29.632 1.00 0.00 N ATOM 645 CA LYS A 62 2.148 -19.716 29.135 1.00 0.00 C ATOM 646 C LYS A 62 1.789 -19.758 27.654 1.00 0.00 C ATOM 647 O LYS A 62 2.317 -20.576 26.901 1.00 0.00 O ATOM 648 CB LYS A 62 1.163 -20.576 29.928 1.00 0.00 C ATOM 649 CG LYS A 62 1.606 -22.042 29.881 1.00 0.00 C ATOM 650 CD LYS A 62 0.701 -22.887 30.784 1.00 0.00 C ATOM 651 CE LYS A 62 1.091 -22.686 32.252 1.00 0.00 C ATOM 652 NZ LYS A 62 0.450 -23.741 33.083 1.00 0.00 N ATOM 0 H LYS A 62 1.216 -18.036 29.978 1.00 0.00 H new ATOM 0 HA LYS A 62 3.157 -20.110 29.261 1.00 0.00 H new ATOM 0 HB2 LYS A 62 1.116 -20.233 30.962 1.00 0.00 H new ATOM 0 HB3 LYS A 62 0.160 -20.475 29.512 1.00 0.00 H new ATOM 0 HG2 LYS A 62 1.561 -22.412 28.857 1.00 0.00 H new ATOM 0 HG3 LYS A 62 2.643 -22.129 30.206 1.00 0.00 H new ATOM 0 HD2 LYS A 62 -0.341 -22.605 30.634 1.00 0.00 H new ATOM 0 HD3 LYS A 62 0.788 -23.940 30.517 1.00 0.00 H new ATOM 0 HE2 LYS A 62 2.175 -22.730 32.361 1.00 0.00 H new ATOM 0 HE3 LYS A 62 0.776 -21.699 32.591 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 0.714 -23.606 34.080 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 -0.584 -23.678 32.987 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 0.771 -24.677 32.764 1.00 0.00 H new ATOM 666 N ILE A 63 0.876 -18.883 27.246 1.00 0.00 N ATOM 667 CA ILE A 63 0.444 -18.845 25.853 1.00 0.00 C ATOM 668 C ILE A 63 1.607 -18.479 24.941 1.00 0.00 C ATOM 669 O ILE A 63 1.830 -19.124 23.917 1.00 0.00 O ATOM 670 CB ILE A 63 -0.672 -17.809 25.688 1.00 0.00 C ATOM 671 CG1 ILE A 63 -1.899 -18.242 26.499 1.00 0.00 C ATOM 672 CG2 ILE A 63 -1.053 -17.693 24.210 1.00 0.00 C ATOM 673 CD1 ILE A 63 -2.381 -19.625 26.044 1.00 0.00 C ATOM 0 H ILE A 63 0.425 -18.198 27.852 1.00 0.00 H new ATOM 0 HA ILE A 63 0.076 -19.833 25.578 1.00 0.00 H new ATOM 0 HB ILE A 63 -0.321 -16.842 26.048 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -1.651 -18.268 27.560 1.00 0.00 H new ATOM 0 HG13 ILE A 63 -2.700 -17.513 26.376 1.00 0.00 H new ATOM 0 HG21 ILE A 63 -1.847 -16.955 24.096 1.00 0.00 H new ATOM 0 HG22 ILE A 63 -0.182 -17.381 23.633 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -1.401 -18.660 23.847 1.00 0.00 H new ATOM 0 HD11 ILE A 63 -3.253 -19.917 26.630 1.00 0.00 H new ATOM 0 HD12 ILE A 63 -2.649 -19.588 24.988 1.00 0.00 H new ATOM 0 HD13 ILE A 63 -1.584 -20.354 26.190 1.00 0.00 H new ATOM 685 N ALA A 64 2.351 -17.448 25.322 1.00 0.00 N ATOM 686 CA ALA A 64 3.493 -17.011 24.530 1.00 0.00 C ATOM 687 C ALA A 64 4.593 -18.066 24.556 1.00 0.00 C ATOM 688 O ALA A 64 5.506 -18.046 23.731 1.00 0.00 O ATOM 689 CB ALA A 64 4.032 -15.688 25.076 1.00 0.00 C ATOM 0 H ALA A 64 2.186 -16.903 26.168 1.00 0.00 H new ATOM 0 HA ALA A 64 3.167 -16.868 23.500 1.00 0.00 H new ATOM 0 HB1 ALA A 64 4.886 -15.368 24.478 1.00 0.00 H new ATOM 0 HB2 ALA A 64 3.251 -14.929 25.028 1.00 0.00 H new ATOM 0 HB3 ALA A 64 4.344 -15.822 26.112 1.00 0.00 H new ATOM 695 N ARG A 65 4.500 -18.986 25.511 1.00 0.00 N ATOM 696 CA ARG A 65 5.493 -20.047 25.635 1.00 0.00 C ATOM 697 C ARG A 65 5.190 -21.186 24.666 1.00 0.00 C ATOM 698 O ARG A 65 6.080 -21.683 23.976 1.00 0.00 O ATOM 699 CB ARG A 65 5.510 -20.580 27.068 1.00 0.00 C ATOM 700 CG ARG A 65 6.617 -21.626 27.209 1.00 0.00 C ATOM 701 CD ARG A 65 6.661 -22.130 28.652 1.00 0.00 C ATOM 702 NE ARG A 65 7.104 -21.065 29.547 1.00 0.00 N ATOM 703 CZ ARG A 65 6.662 -20.988 30.798 1.00 0.00 C ATOM 704 NH1 ARG A 65 7.073 -20.025 31.577 1.00 0.00 N ATOM 705 NH2 ARG A 65 5.817 -21.875 31.247 1.00 0.00 N ATOM 0 H ARG A 65 3.753 -19.019 26.205 1.00 0.00 H new ATOM 0 HA ARG A 65 6.471 -19.633 25.390 1.00 0.00 H new ATOM 0 HB2 ARG A 65 5.676 -19.762 27.770 1.00 0.00 H new ATOM 0 HB3 ARG A 65 4.544 -21.021 27.315 1.00 0.00 H new ATOM 0 HG2 ARG A 65 6.436 -22.457 26.528 1.00 0.00 H new ATOM 0 HG3 ARG A 65 7.579 -21.193 26.934 1.00 0.00 H new ATOM 0 HD2 ARG A 65 5.673 -22.480 28.953 1.00 0.00 H new ATOM 0 HD3 ARG A 65 7.337 -22.982 28.727 1.00 0.00 H new ATOM 0 HE ARG A 65 7.765 -20.367 29.206 1.00 0.00 H new ATOM 0 HH11 ARG A 65 7.733 -19.332 31.226 1.00 0.00 H new ATOM 0 HH12 ARG A 65 6.734 -19.966 32.537 1.00 0.00 H new ATOM 0 HH21 ARG A 65 5.496 -22.627 30.638 1.00 0.00 H new ATOM 0 HH22 ARG A 65 5.478 -21.816 32.207 1.00 0.00 H new ATOM 719 N ILE A 66 3.926 -21.596 24.623 1.00 0.00 N ATOM 720 CA ILE A 66 3.510 -22.675 23.737 1.00 0.00 C ATOM 721 C ILE A 66 3.266 -22.148 22.328 1.00 0.00 C ATOM 722 O ILE A 66 3.258 -22.908 21.365 1.00 0.00 O ATOM 723 CB ILE A 66 2.238 -23.334 24.271 1.00 0.00 C ATOM 724 CG1 ILE A 66 2.544 -24.022 25.604 1.00 0.00 C ATOM 725 CG2 ILE A 66 1.738 -24.374 23.265 1.00 0.00 C ATOM 726 CD1 ILE A 66 1.236 -24.448 26.271 1.00 0.00 C ATOM 0 H ILE A 66 3.176 -21.199 25.189 1.00 0.00 H new ATOM 0 HA ILE A 66 4.309 -23.416 23.700 1.00 0.00 H new ATOM 0 HB ILE A 66 1.470 -22.574 24.419 1.00 0.00 H new ATOM 0 HG12 ILE A 66 3.180 -24.892 25.439 1.00 0.00 H new ATOM 0 HG13 ILE A 66 3.094 -23.344 26.257 1.00 0.00 H new ATOM 0 HG21 ILE A 66 0.831 -24.843 23.647 1.00 0.00 H new ATOM 0 HG22 ILE A 66 1.522 -23.886 22.315 1.00 0.00 H new ATOM 0 HG23 ILE A 66 2.505 -25.134 23.116 1.00 0.00 H new ATOM 0 HD11 ILE A 66 1.454 -24.938 27.220 1.00 0.00 H new ATOM 0 HD12 ILE A 66 0.616 -23.570 26.450 1.00 0.00 H new ATOM 0 HD13 ILE A 66 0.704 -25.141 25.619 1.00 0.00 H new ATOM 738 N GLY A 67 3.063 -20.840 22.215 1.00 0.00 N ATOM 739 CA GLY A 67 2.816 -20.225 20.916 1.00 0.00 C ATOM 740 C GLY A 67 4.115 -20.072 20.131 1.00 0.00 C ATOM 741 O GLY A 67 4.105 -19.846 18.924 1.00 0.00 O ATOM 0 H GLY A 67 3.064 -20.189 23.001 1.00 0.00 H new ATOM 0 HA2 GLY A 67 2.113 -20.834 20.348 1.00 0.00 H new ATOM 0 HA3 GLY A 67 2.352 -19.248 21.054 1.00 0.00 H new ATOM 745 N TYR A 68 5.239 -20.192 20.822 1.00 0.00 N ATOM 746 CA TYR A 68 6.541 -20.067 20.172 1.00 0.00 C ATOM 747 C TYR A 68 7.286 -21.396 20.208 1.00 0.00 C ATOM 748 O TYR A 68 8.347 -21.540 19.602 1.00 0.00 O ATOM 749 CB TYR A 68 7.370 -18.989 20.869 1.00 0.00 C ATOM 750 CG TYR A 68 8.801 -19.070 20.395 1.00 0.00 C ATOM 751 CD1 TYR A 68 9.099 -18.920 19.035 1.00 0.00 C ATOM 752 CD2 TYR A 68 9.831 -19.297 21.316 1.00 0.00 C ATOM 753 CE1 TYR A 68 10.426 -18.996 18.596 1.00 0.00 C ATOM 754 CE2 TYR A 68 11.158 -19.372 20.877 1.00 0.00 C ATOM 755 CZ TYR A 68 11.456 -19.222 19.518 1.00 0.00 C ATOM 756 OH TYR A 68 12.764 -19.297 19.085 1.00 0.00 O ATOM 0 H TYR A 68 5.279 -20.374 21.825 1.00 0.00 H new ATOM 0 HA TYR A 68 6.384 -19.783 19.131 1.00 0.00 H new ATOM 0 HB2 TYR A 68 6.959 -18.003 20.653 1.00 0.00 H new ATOM 0 HB3 TYR A 68 7.325 -19.123 21.950 1.00 0.00 H new ATOM 0 HD1 TYR A 68 8.305 -18.746 18.324 1.00 0.00 H new ATOM 0 HD2 TYR A 68 9.602 -19.414 22.365 1.00 0.00 H new ATOM 0 HE1 TYR A 68 10.656 -18.880 17.547 1.00 0.00 H new ATOM 0 HE2 TYR A 68 11.952 -19.546 21.588 1.00 0.00 H new ATOM 0 HH TYR A 68 13.354 -19.457 19.851 1.00 0.00 H new ATOM 766 N GLU A 69 6.725 -22.366 20.923 1.00 0.00 N ATOM 767 CA GLU A 69 7.347 -23.682 21.035 1.00 0.00 C ATOM 768 C GLU A 69 6.544 -24.723 20.264 1.00 0.00 C ATOM 769 O GLU A 69 6.867 -25.910 20.289 1.00 0.00 O ATOM 770 CB GLU A 69 7.441 -24.090 22.505 1.00 0.00 C ATOM 771 CG GLU A 69 8.444 -23.183 23.223 1.00 0.00 C ATOM 772 CD GLU A 69 8.480 -23.520 24.709 1.00 0.00 C ATOM 773 OE1 GLU A 69 7.766 -24.425 25.109 1.00 0.00 O ATOM 774 OE2 GLU A 69 9.221 -22.869 25.427 1.00 0.00 O ATOM 0 H GLU A 69 5.846 -22.267 21.431 1.00 0.00 H new ATOM 0 HA GLU A 69 8.349 -23.627 20.609 1.00 0.00 H new ATOM 0 HB2 GLU A 69 6.462 -24.014 22.978 1.00 0.00 H new ATOM 0 HB3 GLU A 69 7.754 -25.131 22.585 1.00 0.00 H new ATOM 0 HG2 GLU A 69 9.436 -23.309 22.789 1.00 0.00 H new ATOM 0 HG3 GLU A 69 8.166 -22.138 23.085 1.00 0.00 H new ATOM 781 N ASP A 70 5.496 -24.271 19.580 1.00 0.00 N ATOM 782 CA ASP A 70 4.653 -25.174 18.802 1.00 0.00 C ATOM 783 C ASP A 70 4.187 -24.499 17.516 1.00 0.00 C ATOM 784 O ASP A 70 4.245 -25.090 16.437 1.00 0.00 O ATOM 785 CB ASP A 70 3.436 -25.598 19.628 1.00 0.00 C ATOM 786 CG ASP A 70 3.858 -26.583 20.713 1.00 0.00 C ATOM 787 OD1 ASP A 70 4.942 -27.131 20.599 1.00 0.00 O ATOM 788 OD2 ASP A 70 3.091 -26.775 21.642 1.00 0.00 O ATOM 0 H ASP A 70 5.212 -23.292 19.548 1.00 0.00 H new ATOM 0 HA ASP A 70 5.241 -26.055 18.544 1.00 0.00 H new ATOM 0 HB2 ASP A 70 2.971 -24.722 20.081 1.00 0.00 H new ATOM 0 HB3 ASP A 70 2.689 -26.056 18.980 1.00 0.00 H new ATOM 793 N GLU A 71 3.727 -23.258 17.636 1.00 0.00 N ATOM 794 CA GLU A 71 3.256 -22.514 16.472 1.00 0.00 C ATOM 795 C GLU A 71 4.419 -21.833 15.765 1.00 0.00 C ATOM 796 O GLU A 71 4.332 -21.506 14.582 1.00 0.00 O ATOM 797 CB GLU A 71 2.219 -21.471 16.897 1.00 0.00 C ATOM 798 CG GLU A 71 0.949 -22.174 17.363 1.00 0.00 C ATOM 799 CD GLU A 71 0.280 -22.884 16.191 1.00 0.00 C ATOM 800 OE1 GLU A 71 0.711 -22.663 15.071 1.00 0.00 O ATOM 801 OE2 GLU A 71 -0.652 -23.636 16.427 1.00 0.00 O ATOM 0 H GLU A 71 3.670 -22.750 18.518 1.00 0.00 H new ATOM 0 HA GLU A 71 2.792 -23.216 15.780 1.00 0.00 H new ATOM 0 HB2 GLU A 71 2.619 -20.851 17.699 1.00 0.00 H new ATOM 0 HB3 GLU A 71 1.994 -20.806 16.063 1.00 0.00 H new ATOM 0 HG2 GLU A 71 1.189 -22.894 18.145 1.00 0.00 H new ATOM 0 HG3 GLU A 71 0.262 -21.449 17.798 1.00 0.00 H new ATOM 808 N GLY A 72 5.512 -21.634 16.491 1.00 0.00 N ATOM 809 CA GLY A 72 6.694 -21.006 15.915 1.00 0.00 C ATOM 810 C GLY A 72 6.373 -19.639 15.328 1.00 0.00 C ATOM 811 O GLY A 72 6.739 -19.341 14.191 1.00 0.00 O ATOM 0 H GLY A 72 5.605 -21.896 17.472 1.00 0.00 H new ATOM 0 HA2 GLY A 72 7.462 -20.902 16.682 1.00 0.00 H new ATOM 0 HA3 GLY A 72 7.106 -21.649 15.137 1.00 0.00 H new ATOM 893 N GLU A 78 5.522 -11.629 27.941 1.00 0.00 N ATOM 894 CA GLU A 78 4.359 -11.528 28.814 1.00 0.00 C ATOM 895 C GLU A 78 3.514 -10.316 28.437 1.00 0.00 C ATOM 896 O GLU A 78 2.348 -10.451 28.072 1.00 0.00 O ATOM 897 CB GLU A 78 4.812 -11.401 30.270 1.00 0.00 C ATOM 898 CG GLU A 78 5.458 -12.712 30.721 1.00 0.00 C ATOM 899 CD GLU A 78 5.992 -12.570 32.142 1.00 0.00 C ATOM 900 OE1 GLU A 78 6.550 -13.532 32.643 1.00 0.00 O ATOM 901 OE2 GLU A 78 5.835 -11.501 32.709 1.00 0.00 O ATOM 0 HA GLU A 78 3.757 -12.429 28.696 1.00 0.00 H new ATOM 0 HB2 GLU A 78 5.522 -10.580 30.370 1.00 0.00 H new ATOM 0 HB3 GLU A 78 3.960 -11.165 30.908 1.00 0.00 H new ATOM 0 HG2 GLU A 78 4.728 -13.520 30.677 1.00 0.00 H new ATOM 0 HG3 GLU A 78 6.270 -12.979 30.044 1.00 0.00 H new ATOM 908 N SER A 79 4.112 -9.132 28.521 1.00 0.00 N ATOM 909 CA SER A 79 3.396 -7.907 28.185 1.00 0.00 C ATOM 910 C SER A 79 2.831 -7.987 26.770 1.00 0.00 C ATOM 911 O SER A 79 1.645 -7.742 26.553 1.00 0.00 O ATOM 912 CB SER A 79 4.352 -6.718 28.274 1.00 0.00 C ATOM 913 OG SER A 79 3.772 -5.598 27.619 1.00 0.00 O ATOM 0 H SER A 79 5.079 -8.995 28.815 1.00 0.00 H new ATOM 0 HA SER A 79 2.573 -7.781 28.889 1.00 0.00 H new ATOM 0 HB2 SER A 79 4.556 -6.478 29.318 1.00 0.00 H new ATOM 0 HB3 SER A 79 5.307 -6.969 27.812 1.00 0.00 H new ATOM 0 HG SER A 79 4.383 -4.834 27.676 1.00 0.00 H new ATOM 919 N ALA A 80 3.682 -8.344 25.815 1.00 0.00 N ATOM 920 CA ALA A 80 3.249 -8.459 24.426 1.00 0.00 C ATOM 921 C ALA A 80 2.105 -9.463 24.308 1.00 0.00 C ATOM 922 O ALA A 80 1.267 -9.364 23.412 1.00 0.00 O ATOM 923 CB ALA A 80 4.433 -8.903 23.550 1.00 0.00 C ATOM 0 H ALA A 80 4.667 -8.557 25.974 1.00 0.00 H new ATOM 0 HA ALA A 80 2.894 -7.487 24.084 1.00 0.00 H new ATOM 0 HB1 ALA A 80 4.107 -8.988 22.513 1.00 0.00 H new ATOM 0 HB2 ALA A 80 5.233 -8.166 23.619 1.00 0.00 H new ATOM 0 HB3 ALA A 80 4.799 -9.870 23.896 1.00 0.00 H new ATOM 929 N CYS A 81 2.076 -10.427 25.218 1.00 0.00 N ATOM 930 CA CYS A 81 1.033 -11.441 25.205 1.00 0.00 C ATOM 931 C CYS A 81 -0.299 -10.848 25.651 1.00 0.00 C ATOM 932 O CYS A 81 -1.346 -11.485 25.531 1.00 0.00 O ATOM 933 CB CYS A 81 1.421 -12.592 26.125 1.00 0.00 C ATOM 934 SG CYS A 81 0.336 -14.009 25.805 1.00 0.00 S ATOM 0 H CYS A 81 2.758 -10.527 25.970 1.00 0.00 H new ATOM 0 HA CYS A 81 0.923 -11.813 24.186 1.00 0.00 H new ATOM 0 HB2 CYS A 81 2.461 -12.871 25.958 1.00 0.00 H new ATOM 0 HB3 CYS A 81 1.337 -12.284 27.167 1.00 0.00 H new ATOM 0 HG CYS A 81 0.776 -15.047 26.452 1.00 0.00 H new ATOM 940 N ARG A 82 -0.252 -9.622 26.162 1.00 0.00 N ATOM 941 CA ARG A 82 -1.459 -8.946 26.618 1.00 0.00 C ATOM 942 C ARG A 82 -1.869 -7.868 25.631 1.00 0.00 C ATOM 943 O ARG A 82 -3.027 -7.490 25.582 1.00 0.00 O ATOM 944 CB ARG A 82 -1.231 -8.317 27.991 1.00 0.00 C ATOM 945 CG ARG A 82 -1.114 -9.422 29.041 1.00 0.00 C ATOM 946 CD ARG A 82 -1.071 -8.797 30.436 1.00 0.00 C ATOM 947 NE ARG A 82 0.158 -8.034 30.617 1.00 0.00 N ATOM 948 CZ ARG A 82 1.270 -8.618 31.048 1.00 0.00 C ATOM 949 NH1 ARG A 82 2.359 -7.916 31.201 1.00 0.00 N ATOM 950 NH2 ARG A 82 1.274 -9.895 31.320 1.00 0.00 N ATOM 0 H ARG A 82 0.605 -9.079 26.270 1.00 0.00 H new ATOM 0 HA ARG A 82 -2.256 -9.686 26.690 1.00 0.00 H new ATOM 0 HB2 ARG A 82 -0.324 -7.712 27.980 1.00 0.00 H new ATOM 0 HB3 ARG A 82 -2.056 -7.650 28.239 1.00 0.00 H new ATOM 0 HG2 ARG A 82 -1.960 -10.104 28.962 1.00 0.00 H new ATOM 0 HG3 ARG A 82 -0.213 -10.010 28.866 1.00 0.00 H new ATOM 0 HD2 ARG A 82 -1.934 -8.146 30.576 1.00 0.00 H new ATOM 0 HD3 ARG A 82 -1.135 -9.579 31.193 1.00 0.00 H new ATOM 0 HE ARG A 82 0.164 -7.035 30.409 1.00 0.00 H new ATOM 0 HH11 ARG A 82 2.356 -6.918 30.990 1.00 0.00 H new ATOM 0 HH12 ARG A 82 3.213 -8.365 31.532 1.00 0.00 H new ATOM 0 HH21 ARG A 82 0.423 -10.444 31.201 1.00 0.00 H new ATOM 0 HH22 ARG A 82 2.128 -10.343 31.651 1.00 0.00 H new ATOM 964 N ASN A 83 -0.912 -7.376 24.852 1.00 0.00 N ATOM 965 CA ASN A 83 -1.198 -6.337 23.865 1.00 0.00 C ATOM 966 C ASN A 83 -1.690 -6.954 22.557 1.00 0.00 C ATOM 967 O ASN A 83 -2.669 -6.495 21.969 1.00 0.00 O ATOM 968 CB ASN A 83 0.062 -5.513 23.603 1.00 0.00 C ATOM 969 CG ASN A 83 0.578 -4.929 24.916 1.00 0.00 C ATOM 970 OD1 ASN A 83 -0.190 -4.355 25.688 1.00 0.00 O ATOM 971 ND2 ASN A 83 1.843 -5.044 25.215 1.00 0.00 N ATOM 0 H ASN A 83 0.062 -7.676 24.883 1.00 0.00 H new ATOM 0 HA ASN A 83 -1.982 -5.691 24.260 1.00 0.00 H new ATOM 0 HB2 ASN A 83 0.829 -6.139 23.146 1.00 0.00 H new ATOM 0 HB3 ASN A 83 -0.157 -4.711 22.898 1.00 0.00 H new ATOM 0 HD21 ASN A 83 2.197 -4.658 26.090 1.00 0.00 H new ATOM 0 HD22 ASN A 83 2.477 -5.520 24.574 1.00 0.00 H new ATOM 978 N GLN A 84 -0.993 -7.992 22.104 1.00 0.00 N ATOM 979 CA GLN A 84 -1.353 -8.661 20.859 1.00 0.00 C ATOM 980 C GLN A 84 -2.783 -9.184 20.919 1.00 0.00 C ATOM 981 O GLN A 84 -3.635 -8.784 20.125 1.00 0.00 O ATOM 982 CB GLN A 84 -0.400 -9.830 20.608 1.00 0.00 C ATOM 983 CG GLN A 84 0.903 -9.297 20.036 1.00 0.00 C ATOM 984 CD GLN A 84 1.484 -8.218 20.944 1.00 0.00 C ATOM 985 OE1 GLN A 84 0.918 -7.131 21.061 1.00 0.00 O ATOM 986 NE2 GLN A 84 2.581 -8.460 21.609 1.00 0.00 N ATOM 0 H GLN A 84 -0.180 -8.386 22.578 1.00 0.00 H new ATOM 0 HA GLN A 84 -1.277 -7.938 20.047 1.00 0.00 H new ATOM 0 HB2 GLN A 84 -0.211 -10.367 21.538 1.00 0.00 H new ATOM 0 HB3 GLN A 84 -0.851 -10.541 19.916 1.00 0.00 H new ATOM 0 HG2 GLN A 84 1.619 -10.112 19.926 1.00 0.00 H new ATOM 0 HG3 GLN A 84 0.730 -8.888 19.041 1.00 0.00 H new ATOM 0 HE21 GLN A 84 3.049 -9.361 21.511 1.00 0.00 H new ATOM 0 HE22 GLN A 84 2.970 -7.748 22.227 1.00 0.00 H new ATOM 995 N ILE A 85 -3.038 -10.074 21.871 1.00 0.00 N ATOM 996 CA ILE A 85 -4.368 -10.651 22.033 1.00 0.00 C ATOM 997 C ILE A 85 -5.396 -9.546 22.215 1.00 0.00 C ATOM 998 O ILE A 85 -6.496 -9.614 21.667 1.00 0.00 O ATOM 999 CB ILE A 85 -4.393 -11.586 23.239 1.00 0.00 C ATOM 1000 CG1 ILE A 85 -3.541 -12.822 22.941 1.00 0.00 C ATOM 1001 CG2 ILE A 85 -5.833 -12.014 23.520 1.00 0.00 C ATOM 1002 CD1 ILE A 85 -3.342 -13.624 24.228 1.00 0.00 C ATOM 0 H ILE A 85 -2.345 -10.411 22.540 1.00 0.00 H new ATOM 0 HA ILE A 85 -4.614 -11.222 21.138 1.00 0.00 H new ATOM 0 HB ILE A 85 -3.991 -11.069 24.111 1.00 0.00 H new ATOM 0 HG12 ILE A 85 -4.028 -13.440 22.186 1.00 0.00 H new ATOM 0 HG13 ILE A 85 -2.576 -12.522 22.533 1.00 0.00 H new ATOM 0 HG21 ILE A 85 -5.853 -12.682 24.381 1.00 0.00 H new ATOM 0 HG22 ILE A 85 -6.440 -11.133 23.730 1.00 0.00 H new ATOM 0 HG23 ILE A 85 -6.235 -12.532 22.650 1.00 0.00 H new ATOM 0 HD11 ILE A 85 -2.735 -14.505 24.018 1.00 0.00 H new ATOM 0 HD12 ILE A 85 -2.837 -13.004 24.969 1.00 0.00 H new ATOM 0 HD13 ILE A 85 -4.312 -13.936 24.616 1.00 0.00 H new ATOM 1014 N ILE A 86 -5.035 -8.523 22.973 1.00 0.00 N ATOM 1015 CA ILE A 86 -5.945 -7.403 23.188 1.00 0.00 C ATOM 1016 C ILE A 86 -6.262 -6.703 21.873 1.00 0.00 C ATOM 1017 O ILE A 86 -7.402 -6.352 21.607 1.00 0.00 O ATOM 1018 CB ILE A 86 -5.327 -6.389 24.179 1.00 0.00 C ATOM 1019 CG1 ILE A 86 -5.759 -6.717 25.630 1.00 0.00 C ATOM 1020 CG2 ILE A 86 -5.723 -4.941 23.824 1.00 0.00 C ATOM 1021 CD1 ILE A 86 -5.523 -5.489 26.533 1.00 0.00 C ATOM 0 H ILE A 86 -4.134 -8.442 23.444 1.00 0.00 H new ATOM 0 HA ILE A 86 -6.870 -7.798 23.608 1.00 0.00 H new ATOM 0 HB ILE A 86 -4.243 -6.472 24.103 1.00 0.00 H new ATOM 0 HG12 ILE A 86 -6.812 -6.999 25.651 1.00 0.00 H new ATOM 0 HG13 ILE A 86 -5.193 -7.570 26.004 1.00 0.00 H new ATOM 0 HG21 ILE A 86 -5.272 -4.254 24.540 1.00 0.00 H new ATOM 0 HG22 ILE A 86 -5.370 -4.703 22.821 1.00 0.00 H new ATOM 0 HG23 ILE A 86 -6.808 -4.841 23.860 1.00 0.00 H new ATOM 0 HD11 ILE A 86 -5.828 -5.723 27.553 1.00 0.00 H new ATOM 0 HD12 ILE A 86 -4.465 -5.227 26.522 1.00 0.00 H new ATOM 0 HD13 ILE A 86 -6.109 -4.648 26.163 1.00 0.00 H new ATOM 1033 N SER A 87 -5.244 -6.458 21.076 1.00 0.00 N ATOM 1034 CA SER A 87 -5.448 -5.759 19.820 1.00 0.00 C ATOM 1035 C SER A 87 -6.443 -6.510 18.949 1.00 0.00 C ATOM 1036 O SER A 87 -7.341 -5.912 18.354 1.00 0.00 O ATOM 1037 CB SER A 87 -4.123 -5.629 19.085 1.00 0.00 C ATOM 1038 OG SER A 87 -4.376 -5.264 17.735 1.00 0.00 O ATOM 0 H SER A 87 -4.279 -6.727 21.269 1.00 0.00 H new ATOM 0 HA SER A 87 -5.847 -4.767 20.033 1.00 0.00 H new ATOM 0 HB2 SER A 87 -3.497 -4.878 19.567 1.00 0.00 H new ATOM 0 HB3 SER A 87 -3.577 -6.571 19.124 1.00 0.00 H new ATOM 0 HG SER A 87 -3.526 -5.177 17.255 1.00 0.00 H new ATOM 1044 N ILE A 88 -6.282 -7.824 18.885 1.00 0.00 N ATOM 1045 CA ILE A 88 -7.174 -8.652 18.088 1.00 0.00 C ATOM 1046 C ILE A 88 -8.622 -8.437 18.515 1.00 0.00 C ATOM 1047 O ILE A 88 -9.541 -8.567 17.706 1.00 0.00 O ATOM 1048 CB ILE A 88 -6.803 -10.129 18.249 1.00 0.00 C ATOM 1049 CG1 ILE A 88 -5.425 -10.378 17.630 1.00 0.00 C ATOM 1050 CG2 ILE A 88 -7.843 -11.001 17.544 1.00 0.00 C ATOM 1051 CD1 ILE A 88 -4.944 -11.783 17.999 1.00 0.00 C ATOM 0 H ILE A 88 -5.547 -8.337 19.372 1.00 0.00 H new ATOM 0 HA ILE A 88 -7.068 -8.367 17.041 1.00 0.00 H new ATOM 0 HB ILE A 88 -6.779 -10.382 19.309 1.00 0.00 H new ATOM 0 HG12 ILE A 88 -5.477 -10.273 16.546 1.00 0.00 H new ATOM 0 HG13 ILE A 88 -4.714 -9.633 17.988 1.00 0.00 H new ATOM 0 HG21 ILE A 88 -7.576 -12.051 17.660 1.00 0.00 H new ATOM 0 HG22 ILE A 88 -8.824 -10.825 17.985 1.00 0.00 H new ATOM 0 HG23 ILE A 88 -7.871 -10.749 16.484 1.00 0.00 H new ATOM 0 HD11 ILE A 88 -3.963 -11.959 17.558 1.00 0.00 H new ATOM 0 HD12 ILE A 88 -4.875 -11.871 19.083 1.00 0.00 H new ATOM 0 HD13 ILE A 88 -5.651 -12.521 17.619 1.00 0.00 H new ATOM 1063 N MET A 89 -8.823 -8.119 19.792 1.00 0.00 N ATOM 1064 CA MET A 89 -10.173 -7.900 20.306 1.00 0.00 C ATOM 1065 C MET A 89 -10.782 -6.629 19.719 1.00 0.00 C ATOM 1066 O MET A 89 -11.895 -6.649 19.194 1.00 0.00 O ATOM 1067 CB MET A 89 -10.133 -7.776 21.831 1.00 0.00 C ATOM 1068 CG MET A 89 -9.903 -9.150 22.456 1.00 0.00 C ATOM 1069 SD MET A 89 -11.329 -10.211 22.126 1.00 0.00 S ATOM 1070 CE MET A 89 -12.485 -9.390 23.251 1.00 0.00 C ATOM 0 H MET A 89 -8.080 -8.008 20.482 1.00 0.00 H new ATOM 0 HA MET A 89 -10.788 -8.752 20.016 1.00 0.00 H new ATOM 0 HB2 MET A 89 -9.337 -7.093 22.129 1.00 0.00 H new ATOM 0 HB3 MET A 89 -11.069 -7.353 22.195 1.00 0.00 H new ATOM 0 HG2 MET A 89 -8.999 -9.601 22.046 1.00 0.00 H new ATOM 0 HG3 MET A 89 -9.751 -9.051 23.531 1.00 0.00 H new ATOM 0 HE1 MET A 89 -13.250 -10.099 23.568 1.00 0.00 H new ATOM 0 HE2 MET A 89 -11.945 -9.024 24.124 1.00 0.00 H new ATOM 0 HE3 MET A 89 -12.958 -8.552 22.739 1.00 0.00 H new ATOM 1080 N ARG A 90 -10.041 -5.529 19.802 1.00 0.00 N ATOM 1081 CA ARG A 90 -10.524 -4.257 19.279 1.00 0.00 C ATOM 1082 C ARG A 90 -11.027 -4.432 17.851 1.00 0.00 C ATOM 1083 O ARG A 90 -12.063 -3.887 17.476 1.00 0.00 O ATOM 1084 CB ARG A 90 -9.391 -3.224 19.299 1.00 0.00 C ATOM 1085 CG ARG A 90 -9.928 -1.866 18.845 1.00 0.00 C ATOM 1086 CD ARG A 90 -8.782 -0.855 18.771 1.00 0.00 C ATOM 1087 NE ARG A 90 -7.877 -1.201 17.680 1.00 0.00 N ATOM 1088 CZ ARG A 90 -6.931 -0.358 17.279 1.00 0.00 C ATOM 1089 NH1 ARG A 90 -6.135 -0.688 16.299 1.00 0.00 N ATOM 1090 NH2 ARG A 90 -6.797 0.800 17.867 1.00 0.00 N ATOM 0 H ARG A 90 -9.112 -5.492 20.222 1.00 0.00 H new ATOM 0 HA ARG A 90 -11.345 -3.909 19.906 1.00 0.00 H new ATOM 0 HB2 ARG A 90 -8.975 -3.145 20.303 1.00 0.00 H new ATOM 0 HB3 ARG A 90 -8.581 -3.544 18.643 1.00 0.00 H new ATOM 0 HG2 ARG A 90 -10.405 -1.961 17.870 1.00 0.00 H new ATOM 0 HG3 ARG A 90 -10.691 -1.515 19.540 1.00 0.00 H new ATOM 0 HD2 ARG A 90 -9.181 0.148 18.619 1.00 0.00 H new ATOM 0 HD3 ARG A 90 -8.237 -0.841 19.715 1.00 0.00 H new ATOM 0 HE ARG A 90 -7.972 -2.105 17.217 1.00 0.00 H new ATOM 0 HH11 ARG A 90 -6.239 -1.593 15.840 1.00 0.00 H new ATOM 0 HH12 ARG A 90 -5.409 -0.041 15.992 1.00 0.00 H new ATOM 0 HH21 ARG A 90 -7.418 1.057 18.634 1.00 0.00 H new ATOM 0 HH22 ARG A 90 -6.071 1.447 17.559 1.00 0.00 H new ATOM 1104 N VAL A 91 -10.289 -5.196 17.062 1.00 0.00 N ATOM 1105 CA VAL A 91 -10.665 -5.441 15.676 1.00 0.00 C ATOM 1106 C VAL A 91 -11.925 -6.298 15.606 1.00 0.00 C ATOM 1107 O VAL A 91 -12.805 -6.065 14.776 1.00 0.00 O ATOM 1108 CB VAL A 91 -9.519 -6.130 14.932 1.00 0.00 C ATOM 1109 CG1 VAL A 91 -9.774 -6.025 13.421 1.00 0.00 C ATOM 1110 CG2 VAL A 91 -8.174 -5.450 15.297 1.00 0.00 C ATOM 0 H VAL A 91 -9.428 -5.657 17.355 1.00 0.00 H new ATOM 0 HA VAL A 91 -10.871 -4.482 15.200 1.00 0.00 H new ATOM 0 HB VAL A 91 -9.467 -7.180 15.220 1.00 0.00 H new ATOM 0 HG11 VAL A 91 -8.963 -6.513 12.880 1.00 0.00 H new ATOM 0 HG12 VAL A 91 -10.718 -6.512 13.177 1.00 0.00 H new ATOM 0 HG13 VAL A 91 -9.822 -4.975 13.132 1.00 0.00 H new ATOM 0 HG21 VAL A 91 -7.361 -5.944 14.765 1.00 0.00 H new ATOM 0 HG22 VAL A 91 -8.209 -4.399 15.012 1.00 0.00 H new ATOM 0 HG23 VAL A 91 -8.006 -5.529 16.371 1.00 0.00 H new ATOM 1120 N TYR A 92 -11.998 -7.294 16.482 1.00 0.00 N ATOM 1121 CA TYR A 92 -13.149 -8.182 16.520 1.00 0.00 C ATOM 1122 C TYR A 92 -14.411 -7.401 16.851 1.00 0.00 C ATOM 1123 O TYR A 92 -15.453 -7.623 16.249 1.00 0.00 O ATOM 1124 CB TYR A 92 -12.933 -9.287 17.556 1.00 0.00 C ATOM 1125 CG TYR A 92 -14.191 -10.116 17.680 1.00 0.00 C ATOM 1126 CD1 TYR A 92 -14.519 -11.049 16.689 1.00 0.00 C ATOM 1127 CD2 TYR A 92 -15.028 -9.951 18.790 1.00 0.00 C ATOM 1128 CE1 TYR A 92 -15.683 -11.816 16.808 1.00 0.00 C ATOM 1129 CE2 TYR A 92 -16.192 -10.718 18.909 1.00 0.00 C ATOM 1130 CZ TYR A 92 -16.520 -11.651 17.918 1.00 0.00 C ATOM 1131 OH TYR A 92 -17.669 -12.408 18.035 1.00 0.00 O ATOM 0 H TYR A 92 -11.276 -7.504 17.171 1.00 0.00 H new ATOM 0 HA TYR A 92 -13.265 -8.637 15.536 1.00 0.00 H new ATOM 0 HB2 TYR A 92 -12.096 -9.919 17.260 1.00 0.00 H new ATOM 0 HB3 TYR A 92 -12.676 -8.850 18.521 1.00 0.00 H new ATOM 0 HD1 TYR A 92 -13.873 -11.177 15.833 1.00 0.00 H new ATOM 0 HD2 TYR A 92 -14.775 -9.231 19.555 1.00 0.00 H new ATOM 0 HE1 TYR A 92 -15.936 -12.536 16.043 1.00 0.00 H new ATOM 0 HE2 TYR A 92 -16.838 -10.590 19.765 1.00 0.00 H new ATOM 0 HH TYR A 92 -18.135 -12.170 18.864 1.00 0.00 H new ATOM 1141 N GLU A 93 -14.307 -6.491 17.814 1.00 0.00 N ATOM 1142 CA GLU A 93 -15.453 -5.681 18.218 1.00 0.00 C ATOM 1143 C GLU A 93 -15.792 -4.645 17.150 1.00 0.00 C ATOM 1144 O GLU A 93 -16.963 -4.346 16.910 1.00 0.00 O ATOM 1145 CB GLU A 93 -15.154 -4.978 19.542 1.00 0.00 C ATOM 1146 CG GLU A 93 -14.989 -6.024 20.648 1.00 0.00 C ATOM 1147 CD GLU A 93 -16.299 -6.779 20.854 1.00 0.00 C ATOM 1148 OE1 GLU A 93 -17.326 -6.267 20.440 1.00 0.00 O ATOM 1149 OE2 GLU A 93 -16.255 -7.856 21.425 1.00 0.00 O ATOM 0 H GLU A 93 -13.447 -6.296 18.327 1.00 0.00 H new ATOM 0 HA GLU A 93 -16.311 -6.342 18.343 1.00 0.00 H new ATOM 0 HB2 GLU A 93 -14.246 -4.381 19.453 1.00 0.00 H new ATOM 0 HB3 GLU A 93 -15.963 -4.292 19.793 1.00 0.00 H new ATOM 0 HG2 GLU A 93 -14.195 -6.723 20.383 1.00 0.00 H new ATOM 0 HG3 GLU A 93 -14.690 -5.539 21.577 1.00 0.00 H new ATOM 1156 N GLN A 94 -14.760 -4.097 16.516 1.00 0.00 N ATOM 1157 CA GLN A 94 -14.961 -3.092 15.477 1.00 0.00 C ATOM 1158 C GLN A 94 -15.684 -3.691 14.276 1.00 0.00 C ATOM 1159 O GLN A 94 -16.713 -3.176 13.839 1.00 0.00 O ATOM 1160 CB GLN A 94 -13.610 -2.527 15.032 1.00 0.00 C ATOM 1161 CG GLN A 94 -13.125 -1.492 16.048 1.00 0.00 C ATOM 1162 CD GLN A 94 -11.711 -1.039 15.697 1.00 0.00 C ATOM 1163 OE1 GLN A 94 -10.920 -1.822 15.172 1.00 0.00 O ATOM 1164 NE2 GLN A 94 -11.345 0.186 15.958 1.00 0.00 N ATOM 0 H GLN A 94 -13.784 -4.329 16.701 1.00 0.00 H new ATOM 0 HA GLN A 94 -15.575 -2.291 15.889 1.00 0.00 H new ATOM 0 HB2 GLN A 94 -12.880 -3.332 14.941 1.00 0.00 H new ATOM 0 HB3 GLN A 94 -13.703 -2.069 14.047 1.00 0.00 H new ATOM 0 HG2 GLN A 94 -13.799 -0.635 16.056 1.00 0.00 H new ATOM 0 HG3 GLN A 94 -13.140 -1.919 17.051 1.00 0.00 H new ATOM 0 HE21 GLN A 94 -12.003 0.833 16.393 1.00 0.00 H new ATOM 0 HE22 GLN A 94 -10.401 0.497 15.727 1.00 0.00 H new ATOM 1173 N ARG A 95 -15.143 -4.783 13.749 1.00 0.00 N ATOM 1174 CA ARG A 95 -15.746 -5.444 12.597 1.00 0.00 C ATOM 1175 C ARG A 95 -17.057 -6.118 12.997 1.00 0.00 C ATOM 1176 O ARG A 95 -17.836 -6.548 12.147 1.00 0.00 O ATOM 1177 CB ARG A 95 -14.772 -6.475 12.018 1.00 0.00 C ATOM 1178 CG ARG A 95 -15.362 -7.077 10.740 1.00 0.00 C ATOM 1179 CD ARG A 95 -14.333 -7.994 10.083 1.00 0.00 C ATOM 1180 NE ARG A 95 -14.829 -8.461 8.793 1.00 0.00 N ATOM 1181 CZ ARG A 95 -15.548 -9.574 8.695 1.00 0.00 C ATOM 1182 NH1 ARG A 95 -15.978 -9.972 7.529 1.00 0.00 N ATOM 1183 NH2 ARG A 95 -15.824 -10.270 9.764 1.00 0.00 N ATOM 0 H ARG A 95 -14.294 -5.227 14.098 1.00 0.00 H new ATOM 0 HA ARG A 95 -15.962 -4.696 11.834 1.00 0.00 H new ATOM 0 HB2 ARG A 95 -13.814 -6.003 11.801 1.00 0.00 H new ATOM 0 HB3 ARG A 95 -14.582 -7.261 12.749 1.00 0.00 H new ATOM 0 HG2 ARG A 95 -16.267 -7.638 10.974 1.00 0.00 H new ATOM 0 HG3 ARG A 95 -15.649 -6.283 10.051 1.00 0.00 H new ATOM 0 HD2 ARG A 95 -13.392 -7.460 9.948 1.00 0.00 H new ATOM 0 HD3 ARG A 95 -14.126 -8.845 10.732 1.00 0.00 H new ATOM 0 HE ARG A 95 -14.620 -7.924 7.952 1.00 0.00 H new ATOM 0 HH11 ARG A 95 -15.762 -9.429 6.693 1.00 0.00 H new ATOM 0 HH12 ARG A 95 -16.530 -10.826 7.453 1.00 0.00 H new ATOM 0 HH21 ARG A 95 -15.488 -9.960 10.676 1.00 0.00 H new ATOM 0 HH22 ARG A 95 -16.376 -11.124 9.688 1.00 0.00 H new ATOM 1197 N LEU A 96 -17.295 -6.202 14.300 1.00 0.00 N ATOM 1198 CA LEU A 96 -18.519 -6.815 14.805 1.00 0.00 C ATOM 1199 C LEU A 96 -19.696 -5.853 14.703 1.00 0.00 C ATOM 1200 O LEU A 96 -20.827 -6.265 14.447 1.00 0.00 O ATOM 1201 CB LEU A 96 -18.332 -7.256 16.256 1.00 0.00 C ATOM 1202 CG LEU A 96 -19.648 -7.791 16.812 1.00 0.00 C ATOM 1203 CD1 LEU A 96 -20.155 -8.922 15.917 1.00 0.00 C ATOM 1204 CD2 LEU A 96 -19.414 -8.328 18.226 1.00 0.00 C ATOM 0 H LEU A 96 -16.663 -5.857 15.022 1.00 0.00 H new ATOM 0 HA LEU A 96 -18.735 -7.689 14.190 1.00 0.00 H new ATOM 0 HB2 LEU A 96 -17.563 -8.026 16.314 1.00 0.00 H new ATOM 0 HB3 LEU A 96 -17.988 -6.416 16.859 1.00 0.00 H new ATOM 0 HG LEU A 96 -20.388 -6.991 16.840 1.00 0.00 H new ATOM 0 HD11 LEU A 96 -21.095 -9.306 16.313 1.00 0.00 H new ATOM 0 HD12 LEU A 96 -20.314 -8.544 14.907 1.00 0.00 H new ATOM 0 HD13 LEU A 96 -19.418 -9.724 15.892 1.00 0.00 H new ATOM 0 HD21 LEU A 96 -20.351 -8.712 18.629 1.00 0.00 H new ATOM 0 HD22 LEU A 96 -18.677 -9.131 18.193 1.00 0.00 H new ATOM 0 HD23 LEU A 96 -19.047 -7.524 18.864 1.00 0.00 H new ATOM 1216 N ALA A 97 -19.424 -4.571 14.922 1.00 0.00 N ATOM 1217 CA ALA A 97 -20.471 -3.560 14.869 1.00 0.00 C ATOM 1218 C ALA A 97 -20.723 -3.124 13.431 1.00 0.00 C ATOM 1219 O ALA A 97 -21.828 -2.708 13.083 1.00 0.00 O ATOM 1220 CB ALA A 97 -20.065 -2.345 15.706 1.00 0.00 C ATOM 0 H ALA A 97 -18.494 -4.210 15.136 1.00 0.00 H new ATOM 0 HA ALA A 97 -21.387 -3.992 15.272 1.00 0.00 H new ATOM 0 HB1 ALA A 97 -20.853 -1.593 15.662 1.00 0.00 H new ATOM 0 HB2 ALA A 97 -19.913 -2.651 16.741 1.00 0.00 H new ATOM 0 HB3 ALA A 97 -19.140 -1.925 15.312 1.00 0.00 H new ATOM 1226 N HIS A 98 -19.690 -3.220 12.600 1.00 0.00 N ATOM 1227 CA HIS A 98 -19.811 -2.829 11.201 1.00 0.00 C ATOM 1228 C HIS A 98 -20.503 -3.922 10.394 1.00 0.00 C ATOM 1229 O HIS A 98 -20.077 -5.077 10.398 1.00 0.00 O ATOM 1230 CB HIS A 98 -18.425 -2.561 10.613 1.00 0.00 C ATOM 1231 CG HIS A 98 -17.849 -1.318 11.232 1.00 0.00 C ATOM 1232 ND1 HIS A 98 -17.162 -1.341 12.435 1.00 0.00 N ATOM 1233 CD2 HIS A 98 -17.850 -0.006 10.827 1.00 0.00 C ATOM 1234 CE1 HIS A 98 -16.780 -0.081 12.710 1.00 0.00 C ATOM 1235 NE2 HIS A 98 -17.174 0.773 11.761 1.00 0.00 N ATOM 0 H HIS A 98 -18.767 -3.562 12.868 1.00 0.00 H new ATOM 0 HA HIS A 98 -20.412 -1.921 11.149 1.00 0.00 H new ATOM 0 HB2 HIS A 98 -17.769 -3.411 10.800 1.00 0.00 H new ATOM 0 HB3 HIS A 98 -18.494 -2.443 9.532 1.00 0.00 H new ATOM 0 HD1 HIS A 98 -16.979 -2.165 13.008 1.00 0.00 H new ATOM 0 HD2 HIS A 98 -18.306 0.365 9.921 1.00 0.00 H new ATOM 0 HE1 HIS A 98 -16.223 0.205 13.590 1.00 0.00 H new ATOM 1343 N THR A 105 -17.808 -13.331 2.211 1.00 0.00 N ATOM 1344 CA THR A 105 -17.445 -14.102 3.391 1.00 0.00 C ATOM 1345 C THR A 105 -16.207 -14.952 3.121 1.00 0.00 C ATOM 1346 O THR A 105 -15.838 -15.180 1.968 1.00 0.00 O ATOM 1347 CB THR A 105 -18.606 -15.010 3.801 1.00 0.00 C ATOM 1348 OG1 THR A 105 -18.862 -15.946 2.763 1.00 0.00 O ATOM 1349 CG2 THR A 105 -19.854 -14.162 4.046 1.00 0.00 C ATOM 0 HA THR A 105 -17.224 -13.405 4.199 1.00 0.00 H new ATOM 0 HB THR A 105 -18.347 -15.544 4.715 1.00 0.00 H new ATOM 0 HG1 THR A 105 -18.627 -15.548 1.899 1.00 0.00 H new ATOM 0 HG21 THR A 105 -20.682 -14.808 4.338 1.00 0.00 H new ATOM 0 HG22 THR A 105 -19.656 -13.444 4.842 1.00 0.00 H new ATOM 0 HG23 THR A 105 -20.116 -13.628 3.133 1.00 0.00 H new ATOM 1357 N THR A 106 -15.572 -15.426 4.190 1.00 0.00 N ATOM 1358 CA THR A 106 -14.382 -16.255 4.046 1.00 0.00 C ATOM 1359 C THR A 106 -14.262 -17.238 5.217 1.00 0.00 C ATOM 1360 O THR A 106 -14.794 -16.999 6.301 1.00 0.00 O ATOM 1361 CB THR A 106 -13.125 -15.370 3.972 1.00 0.00 C ATOM 1362 OG1 THR A 106 -13.367 -14.147 4.648 1.00 0.00 O ATOM 1363 CG2 THR A 106 -12.783 -15.077 2.510 1.00 0.00 C ATOM 0 H THR A 106 -15.858 -15.252 5.154 1.00 0.00 H new ATOM 0 HA THR A 106 -14.471 -16.826 3.122 1.00 0.00 H new ATOM 0 HB THR A 106 -12.292 -15.892 4.442 1.00 0.00 H new ATOM 0 HG1 THR A 106 -13.847 -13.534 4.053 1.00 0.00 H new ATOM 0 HG21 THR A 106 -11.892 -14.450 2.463 1.00 0.00 H new ATOM 0 HG22 THR A 106 -12.595 -16.014 1.985 1.00 0.00 H new ATOM 0 HG23 THR A 106 -13.617 -14.558 2.038 1.00 0.00 H new ATOM 1371 N PRO A 107 -13.588 -18.340 5.009 1.00 0.00 N ATOM 1372 CA PRO A 107 -13.395 -19.379 6.065 1.00 0.00 C ATOM 1373 C PRO A 107 -12.405 -18.945 7.145 1.00 0.00 C ATOM 1374 O PRO A 107 -12.588 -19.244 8.324 1.00 0.00 O ATOM 1375 CB PRO A 107 -12.860 -20.584 5.286 1.00 0.00 C ATOM 1376 CG PRO A 107 -12.205 -20.015 4.071 1.00 0.00 C ATOM 1377 CD PRO A 107 -12.929 -18.712 3.747 1.00 0.00 C ATOM 0 HA PRO A 107 -14.319 -19.584 6.606 1.00 0.00 H new ATOM 0 HB2 PRO A 107 -12.149 -21.154 5.884 1.00 0.00 H new ATOM 0 HB3 PRO A 107 -13.666 -21.265 5.014 1.00 0.00 H new ATOM 0 HG2 PRO A 107 -11.146 -19.833 4.253 1.00 0.00 H new ATOM 0 HG3 PRO A 107 -12.270 -20.711 3.235 1.00 0.00 H new ATOM 0 HD2 PRO A 107 -12.232 -17.940 3.419 1.00 0.00 H new ATOM 0 HD3 PRO A 107 -13.654 -18.848 2.945 1.00 0.00 H new ATOM 1385 N GLU A 108 -11.353 -18.243 6.733 1.00 0.00 N ATOM 1386 CA GLU A 108 -10.341 -17.783 7.678 1.00 0.00 C ATOM 1387 C GLU A 108 -10.916 -16.724 8.609 1.00 0.00 C ATOM 1388 O GLU A 108 -10.764 -16.806 9.828 1.00 0.00 O ATOM 1389 CB GLU A 108 -9.144 -17.201 6.921 1.00 0.00 C ATOM 1390 CG GLU A 108 -8.444 -18.307 6.124 1.00 0.00 C ATOM 1391 CD GLU A 108 -9.096 -18.461 4.755 1.00 0.00 C ATOM 1392 OE1 GLU A 108 -10.095 -17.801 4.519 1.00 0.00 O ATOM 1393 OE2 GLU A 108 -8.587 -19.236 3.962 1.00 0.00 O ATOM 0 H GLU A 108 -11.180 -17.983 5.762 1.00 0.00 H new ATOM 0 HA GLU A 108 -10.016 -18.636 8.274 1.00 0.00 H new ATOM 0 HB2 GLU A 108 -9.477 -16.411 6.248 1.00 0.00 H new ATOM 0 HB3 GLU A 108 -8.444 -16.748 7.623 1.00 0.00 H new ATOM 0 HG2 GLU A 108 -7.387 -18.068 6.007 1.00 0.00 H new ATOM 0 HG3 GLU A 108 -8.499 -19.249 6.669 1.00 0.00 H new ATOM 1400 N GLU A 109 -11.578 -15.732 8.029 1.00 0.00 N ATOM 1401 CA GLU A 109 -12.171 -14.663 8.820 1.00 0.00 C ATOM 1402 C GLU A 109 -13.255 -15.222 9.735 1.00 0.00 C ATOM 1403 O GLU A 109 -13.457 -14.736 10.848 1.00 0.00 O ATOM 1404 CB GLU A 109 -12.768 -13.593 7.895 1.00 0.00 C ATOM 1405 CG GLU A 109 -14.102 -14.075 7.316 1.00 0.00 C ATOM 1406 CD GLU A 109 -14.714 -12.988 6.443 1.00 0.00 C ATOM 1407 OE1 GLU A 109 -15.704 -13.282 5.794 1.00 0.00 O ATOM 1408 OE2 GLU A 109 -14.196 -11.883 6.436 1.00 0.00 O ATOM 0 H GLU A 109 -11.717 -15.645 7.022 1.00 0.00 H new ATOM 0 HA GLU A 109 -11.393 -14.209 9.433 1.00 0.00 H new ATOM 0 HB2 GLU A 109 -12.918 -12.666 8.449 1.00 0.00 H new ATOM 0 HB3 GLU A 109 -12.071 -13.372 7.086 1.00 0.00 H new ATOM 0 HG2 GLU A 109 -13.947 -14.980 6.729 1.00 0.00 H new ATOM 0 HG3 GLU A 109 -14.787 -14.332 8.124 1.00 0.00 H new ATOM 1415 N ASP A 110 -13.966 -16.236 9.245 1.00 0.00 N ATOM 1416 CA ASP A 110 -15.038 -16.847 10.019 1.00 0.00 C ATOM 1417 C ASP A 110 -14.481 -17.538 11.257 1.00 0.00 C ATOM 1418 O ASP A 110 -14.998 -17.366 12.360 1.00 0.00 O ATOM 1419 CB ASP A 110 -15.794 -17.866 9.155 1.00 0.00 C ATOM 1420 CG ASP A 110 -16.865 -17.164 8.323 1.00 0.00 C ATOM 1421 OD1 ASP A 110 -17.052 -15.974 8.517 1.00 0.00 O ATOM 1422 OD2 ASP A 110 -17.484 -17.827 7.507 1.00 0.00 O ATOM 0 H ASP A 110 -13.819 -16.647 8.323 1.00 0.00 H new ATOM 0 HA ASP A 110 -15.724 -16.061 10.336 1.00 0.00 H new ATOM 0 HB2 ASP A 110 -15.096 -18.385 8.498 1.00 0.00 H new ATOM 0 HB3 ASP A 110 -16.255 -18.621 9.791 1.00 0.00 H new ATOM 1427 N GLU A 111 -13.421 -18.315 11.067 1.00 0.00 N ATOM 1428 CA GLU A 111 -12.804 -19.030 12.178 1.00 0.00 C ATOM 1429 C GLU A 111 -12.336 -18.053 13.250 1.00 0.00 C ATOM 1430 O GLU A 111 -12.648 -18.216 14.430 1.00 0.00 O ATOM 1431 CB GLU A 111 -11.607 -19.838 11.675 1.00 0.00 C ATOM 1432 CG GLU A 111 -11.003 -20.631 12.836 1.00 0.00 C ATOM 1433 CD GLU A 111 -9.831 -21.471 12.339 1.00 0.00 C ATOM 1434 OE1 GLU A 111 -9.397 -21.245 11.222 1.00 0.00 O ATOM 1435 OE2 GLU A 111 -9.386 -22.328 13.084 1.00 0.00 O ATOM 0 H GLU A 111 -12.974 -18.465 10.163 1.00 0.00 H new ATOM 0 HA GLU A 111 -13.546 -19.701 12.609 1.00 0.00 H new ATOM 0 HB2 GLU A 111 -11.920 -20.516 10.881 1.00 0.00 H new ATOM 0 HB3 GLU A 111 -10.858 -19.171 11.248 1.00 0.00 H new ATOM 0 HG2 GLU A 111 -10.667 -19.949 13.617 1.00 0.00 H new ATOM 0 HG3 GLU A 111 -11.761 -21.276 13.280 1.00 0.00 H new ATOM 1442 N LEU A 112 -11.591 -17.036 12.834 1.00 0.00 N ATOM 1443 CA LEU A 112 -11.085 -16.046 13.775 1.00 0.00 C ATOM 1444 C LEU A 112 -12.230 -15.446 14.580 1.00 0.00 C ATOM 1445 O LEU A 112 -12.123 -15.275 15.795 1.00 0.00 O ATOM 1446 CB LEU A 112 -10.364 -14.928 13.013 1.00 0.00 C ATOM 1447 CG LEU A 112 -9.865 -13.868 13.999 1.00 0.00 C ATOM 1448 CD1 LEU A 112 -8.938 -14.520 15.028 1.00 0.00 C ATOM 1449 CD2 LEU A 112 -9.101 -12.782 13.238 1.00 0.00 C ATOM 0 H LEU A 112 -11.326 -16.876 11.862 1.00 0.00 H new ATOM 0 HA LEU A 112 -10.389 -16.537 14.455 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -9.525 -15.340 12.452 1.00 0.00 H new ATOM 0 HB3 LEU A 112 -11.040 -14.474 12.288 1.00 0.00 H new ATOM 0 HG LEU A 112 -10.717 -13.421 14.512 1.00 0.00 H new ATOM 0 HD11 LEU A 112 -8.584 -13.764 15.729 1.00 0.00 H new ATOM 0 HD12 LEU A 112 -9.483 -15.292 15.571 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -8.086 -14.969 14.517 1.00 0.00 H new ATOM 0 HD21 LEU A 112 -8.746 -12.027 13.940 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -8.250 -13.228 12.724 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -9.762 -12.316 12.508 1.00 0.00 H new ATOM 1461 N ASP A 113 -13.329 -15.138 13.904 1.00 0.00 N ATOM 1462 CA ASP A 113 -14.487 -14.558 14.575 1.00 0.00 C ATOM 1463 C ASP A 113 -15.006 -15.511 15.650 1.00 0.00 C ATOM 1464 O ASP A 113 -15.318 -15.089 16.764 1.00 0.00 O ATOM 1465 CB ASP A 113 -15.595 -14.283 13.552 1.00 0.00 C ATOM 1466 CG ASP A 113 -15.379 -12.921 12.891 1.00 0.00 C ATOM 1467 OD1 ASP A 113 -14.667 -12.114 13.465 1.00 0.00 O ATOM 1468 OD2 ASP A 113 -15.925 -12.710 11.821 1.00 0.00 O ATOM 0 H ASP A 113 -13.444 -15.278 12.900 1.00 0.00 H new ATOM 0 HA ASP A 113 -14.188 -13.622 15.046 1.00 0.00 H new ATOM 0 HB2 ASP A 113 -15.602 -15.066 12.794 1.00 0.00 H new ATOM 0 HB3 ASP A 113 -16.568 -14.306 14.044 1.00 0.00 H new ATOM 1473 N GLN A 114 -15.098 -16.791 15.311 1.00 0.00 N ATOM 1474 CA GLN A 114 -15.581 -17.787 16.260 1.00 0.00 C ATOM 1475 C GLN A 114 -14.656 -17.877 17.467 1.00 0.00 C ATOM 1476 O GLN A 114 -15.111 -17.902 18.610 1.00 0.00 O ATOM 1477 CB GLN A 114 -15.661 -19.155 15.581 1.00 0.00 C ATOM 1478 CG GLN A 114 -16.728 -19.124 14.486 1.00 0.00 C ATOM 1479 CD GLN A 114 -18.102 -18.886 15.104 1.00 0.00 C ATOM 1480 OE1 GLN A 114 -18.503 -19.603 16.020 1.00 0.00 O ATOM 1481 NE2 GLN A 114 -18.850 -17.916 14.654 1.00 0.00 N ATOM 0 H GLN A 114 -14.847 -17.162 14.395 1.00 0.00 H new ATOM 0 HA GLN A 114 -16.572 -17.485 16.598 1.00 0.00 H new ATOM 0 HB2 GLN A 114 -14.693 -19.416 15.152 1.00 0.00 H new ATOM 0 HB3 GLN A 114 -15.902 -19.923 16.316 1.00 0.00 H new ATOM 0 HG2 GLN A 114 -16.501 -18.336 13.768 1.00 0.00 H new ATOM 0 HG3 GLN A 114 -16.725 -20.066 13.937 1.00 0.00 H new ATOM 0 HE21 GLN A 114 -18.514 -17.323 13.895 1.00 0.00 H new ATOM 0 HE22 GLN A 114 -19.770 -17.750 15.062 1.00 0.00 H new ATOM 1490 N LEU A 115 -13.355 -17.921 17.207 1.00 0.00 N ATOM 1491 CA LEU A 115 -12.379 -18.015 18.281 1.00 0.00 C ATOM 1492 C LEU A 115 -12.500 -16.813 19.212 1.00 0.00 C ATOM 1493 O LEU A 115 -12.435 -16.954 20.433 1.00 0.00 O ATOM 1494 CB LEU A 115 -10.968 -18.059 17.696 1.00 0.00 C ATOM 1495 CG LEU A 115 -10.773 -19.358 16.909 1.00 0.00 C ATOM 1496 CD1 LEU A 115 -9.424 -19.321 16.184 1.00 0.00 C ATOM 1497 CD2 LEU A 115 -10.809 -20.554 17.867 1.00 0.00 C ATOM 0 H LEU A 115 -12.955 -17.893 16.269 1.00 0.00 H new ATOM 0 HA LEU A 115 -12.570 -18.927 18.847 1.00 0.00 H new ATOM 0 HB2 LEU A 115 -10.808 -17.200 17.044 1.00 0.00 H new ATOM 0 HB3 LEU A 115 -10.231 -17.994 18.496 1.00 0.00 H new ATOM 0 HG LEU A 115 -11.575 -19.459 16.178 1.00 0.00 H new ATOM 0 HD11 LEU A 115 -9.286 -20.246 15.624 1.00 0.00 H new ATOM 0 HD12 LEU A 115 -9.403 -18.475 15.497 1.00 0.00 H new ATOM 0 HD13 LEU A 115 -8.621 -19.216 16.914 1.00 0.00 H new ATOM 0 HD21 LEU A 115 -10.670 -21.476 17.303 1.00 0.00 H new ATOM 0 HD22 LEU A 115 -10.011 -20.455 18.603 1.00 0.00 H new ATOM 0 HD23 LEU A 115 -11.772 -20.583 18.377 1.00 0.00 H new ATOM 1509 N CYS A 116 -12.682 -15.634 18.630 1.00 0.00 N ATOM 1510 CA CYS A 116 -12.817 -14.418 19.423 1.00 0.00 C ATOM 1511 C CYS A 116 -14.070 -14.485 20.293 1.00 0.00 C ATOM 1512 O CYS A 116 -14.053 -14.076 21.454 1.00 0.00 O ATOM 1513 CB CYS A 116 -12.904 -13.202 18.499 1.00 0.00 C ATOM 1514 SG CYS A 116 -11.332 -12.994 17.627 1.00 0.00 S ATOM 0 H CYS A 116 -12.739 -15.494 17.621 1.00 0.00 H new ATOM 0 HA CYS A 116 -11.943 -14.326 20.067 1.00 0.00 H new ATOM 0 HB2 CYS A 116 -13.715 -13.333 17.783 1.00 0.00 H new ATOM 0 HB3 CYS A 116 -13.132 -12.307 19.078 1.00 0.00 H new ATOM 0 HG CYS A 116 -11.241 -13.879 16.679 1.00 0.00 H new ATOM 1520 N ASP A 117 -15.154 -15.004 19.725 1.00 0.00 N ATOM 1521 CA ASP A 117 -16.407 -15.118 20.461 1.00 0.00 C ATOM 1522 C ASP A 117 -16.233 -16.024 21.676 1.00 0.00 C ATOM 1523 O ASP A 117 -16.683 -15.698 22.775 1.00 0.00 O ATOM 1524 CB ASP A 117 -17.497 -15.689 19.551 1.00 0.00 C ATOM 1525 CG ASP A 117 -18.804 -15.826 20.324 1.00 0.00 C ATOM 1526 OD1 ASP A 117 -19.320 -14.810 20.761 1.00 0.00 O ATOM 1527 OD2 ASP A 117 -19.271 -16.944 20.467 1.00 0.00 O ATOM 0 H ASP A 117 -15.190 -15.349 18.766 1.00 0.00 H new ATOM 0 HA ASP A 117 -16.699 -14.124 20.800 1.00 0.00 H new ATOM 0 HB2 ASP A 117 -17.641 -15.037 18.690 1.00 0.00 H new ATOM 0 HB3 ASP A 117 -17.189 -16.661 19.167 1.00 0.00 H new ATOM 1532 N GLU A 118 -15.577 -17.162 21.472 1.00 0.00 N ATOM 1533 CA GLU A 118 -15.353 -18.106 22.560 1.00 0.00 C ATOM 1534 C GLU A 118 -14.492 -17.474 23.648 1.00 0.00 C ATOM 1535 O GLU A 118 -14.799 -17.580 24.835 1.00 0.00 O ATOM 1536 CB GLU A 118 -14.669 -19.364 22.022 1.00 0.00 C ATOM 1537 CG GLU A 118 -14.602 -20.422 23.124 1.00 0.00 C ATOM 1538 CD GLU A 118 -14.319 -21.790 22.514 1.00 0.00 C ATOM 1539 OE1 GLU A 118 -14.151 -21.857 21.308 1.00 0.00 O ATOM 1540 OE2 GLU A 118 -14.276 -22.753 23.263 1.00 0.00 O ATOM 0 H GLU A 118 -15.194 -17.451 20.572 1.00 0.00 H new ATOM 0 HA GLU A 118 -16.317 -18.375 22.992 1.00 0.00 H new ATOM 0 HB2 GLU A 118 -15.220 -19.751 21.165 1.00 0.00 H new ATOM 0 HB3 GLU A 118 -13.665 -19.123 21.673 1.00 0.00 H new ATOM 0 HG2 GLU A 118 -13.821 -20.165 23.840 1.00 0.00 H new ATOM 0 HG3 GLU A 118 -15.543 -20.447 23.674 1.00 0.00 H new ATOM 1547 N TRP A 119 -13.419 -16.810 23.234 1.00 0.00 N ATOM 1548 CA TRP A 119 -12.524 -16.156 24.182 1.00 0.00 C ATOM 1549 C TRP A 119 -13.249 -15.029 24.911 1.00 0.00 C ATOM 1550 O TRP A 119 -13.067 -14.835 26.114 1.00 0.00 O ATOM 1551 CB TRP A 119 -11.304 -15.597 23.449 1.00 0.00 C ATOM 1552 CG TRP A 119 -10.513 -14.737 24.381 1.00 0.00 C ATOM 1553 CD1 TRP A 119 -10.433 -13.388 24.315 1.00 0.00 C ATOM 1554 CD2 TRP A 119 -9.692 -15.141 25.515 1.00 0.00 C ATOM 1555 NE1 TRP A 119 -9.615 -12.939 25.336 1.00 0.00 N ATOM 1556 CE2 TRP A 119 -9.134 -13.982 26.103 1.00 0.00 C ATOM 1557 CE3 TRP A 119 -9.380 -16.389 26.084 1.00 0.00 C ATOM 1558 CZ2 TRP A 119 -8.297 -14.057 27.217 1.00 0.00 C ATOM 1559 CZ3 TRP A 119 -8.538 -16.469 27.205 1.00 0.00 C ATOM 1560 CH2 TRP A 119 -7.998 -15.305 27.770 1.00 0.00 C ATOM 0 H TRP A 119 -13.149 -16.710 22.256 1.00 0.00 H new ATOM 0 HA TRP A 119 -12.197 -16.894 24.915 1.00 0.00 H new ATOM 0 HB2 TRP A 119 -10.685 -16.413 23.076 1.00 0.00 H new ATOM 0 HB3 TRP A 119 -11.621 -15.017 22.583 1.00 0.00 H new ATOM 0 HD1 TRP A 119 -10.927 -12.764 23.585 1.00 0.00 H new ATOM 0 HE1 TRP A 119 -9.394 -11.957 25.502 1.00 0.00 H new ATOM 0 HE3 TRP A 119 -9.791 -17.292 25.656 1.00 0.00 H new ATOM 0 HZ2 TRP A 119 -7.883 -13.157 27.648 1.00 0.00 H new ATOM 0 HZ3 TRP A 119 -8.305 -17.432 27.634 1.00 0.00 H new ATOM 0 HH2 TRP A 119 -7.351 -15.373 28.632 1.00 0.00 H new ATOM 1571 N LYS A 120 -14.066 -14.285 24.174 1.00 0.00 N ATOM 1572 CA LYS A 120 -14.814 -13.179 24.758 1.00 0.00 C ATOM 1573 C LYS A 120 -15.764 -13.687 25.837 1.00 0.00 C ATOM 1574 O LYS A 120 -15.958 -13.034 26.863 1.00 0.00 O ATOM 1575 CB LYS A 120 -15.611 -12.453 23.671 1.00 0.00 C ATOM 1576 CG LYS A 120 -16.288 -11.219 24.271 1.00 0.00 C ATOM 1577 CD LYS A 120 -17.039 -10.463 23.172 1.00 0.00 C ATOM 1578 CE LYS A 120 -17.704 -9.222 23.769 1.00 0.00 C ATOM 1579 NZ LYS A 120 -18.420 -8.477 22.695 1.00 0.00 N ATOM 0 H LYS A 120 -14.226 -14.427 23.177 1.00 0.00 H new ATOM 0 HA LYS A 120 -14.106 -12.485 25.211 1.00 0.00 H new ATOM 0 HB2 LYS A 120 -14.950 -12.158 22.856 1.00 0.00 H new ATOM 0 HB3 LYS A 120 -16.360 -13.122 23.247 1.00 0.00 H new ATOM 0 HG2 LYS A 120 -16.979 -11.518 25.059 1.00 0.00 H new ATOM 0 HG3 LYS A 120 -15.543 -10.569 24.730 1.00 0.00 H new ATOM 0 HD2 LYS A 120 -16.350 -10.173 22.379 1.00 0.00 H new ATOM 0 HD3 LYS A 120 -17.791 -11.110 22.720 1.00 0.00 H new ATOM 0 HE2 LYS A 120 -18.403 -9.513 24.553 1.00 0.00 H new ATOM 0 HE3 LYS A 120 -16.954 -8.582 24.232 1.00 0.00 H new ATOM 0 HZ1 LYS A 120 -18.623 -7.510 23.019 1.00 0.00 H new ATOM 0 HZ2 LYS A 120 -17.825 -8.439 21.843 1.00 0.00 H new ATOM 0 HZ3 LYS A 120 -19.313 -8.962 22.472 1.00 0.00 H new ATOM 1593 N ALA A 121 -16.355 -14.854 25.598 1.00 0.00 N ATOM 1594 CA ALA A 121 -17.285 -15.441 26.557 1.00 0.00 C ATOM 1595 C ALA A 121 -16.568 -15.796 27.851 1.00 0.00 C ATOM 1596 O ALA A 121 -17.066 -15.530 28.944 1.00 0.00 O ATOM 1597 CB ALA A 121 -17.920 -16.698 25.967 1.00 0.00 C ATOM 0 H ALA A 121 -16.208 -15.409 24.755 1.00 0.00 H new ATOM 0 HA ALA A 121 -18.062 -14.707 26.773 1.00 0.00 H new ATOM 0 HB1 ALA A 121 -18.613 -17.129 26.690 1.00 0.00 H new ATOM 0 HB2 ALA A 121 -18.460 -16.440 25.056 1.00 0.00 H new ATOM 0 HB3 ALA A 121 -17.141 -17.424 25.733 1.00 0.00 H new ATOM 1603 N ARG A 122 -15.390 -16.387 27.725 1.00 0.00 N ATOM 1604 CA ARG A 122 -14.620 -16.756 28.898 1.00 0.00 C ATOM 1605 C ARG A 122 -14.320 -15.518 29.736 1.00 0.00 C ATOM 1606 O ARG A 122 -14.419 -15.549 30.962 1.00 0.00 O ATOM 1607 CB ARG A 122 -13.309 -17.455 28.464 1.00 0.00 C ATOM 1608 CG ARG A 122 -12.091 -16.914 29.272 1.00 0.00 C ATOM 1609 CD ARG A 122 -11.102 -18.014 29.602 1.00 0.00 C ATOM 1610 NE ARG A 122 -10.399 -17.683 30.816 1.00 0.00 N ATOM 1611 CZ ARG A 122 -9.580 -16.638 30.874 1.00 0.00 C ATOM 1612 NH1 ARG A 122 -8.940 -16.372 31.980 1.00 0.00 N ATOM 1613 NH2 ARG A 122 -9.417 -15.878 29.827 1.00 0.00 N ATOM 0 H ARG A 122 -14.952 -16.618 26.833 1.00 0.00 H new ATOM 0 HA ARG A 122 -15.199 -17.450 29.507 1.00 0.00 H new ATOM 0 HB2 ARG A 122 -13.400 -18.531 28.614 1.00 0.00 H new ATOM 0 HB3 ARG A 122 -13.143 -17.294 27.399 1.00 0.00 H new ATOM 0 HG2 ARG A 122 -11.590 -16.135 28.697 1.00 0.00 H new ATOM 0 HG3 ARG A 122 -12.443 -16.452 30.195 1.00 0.00 H new ATOM 0 HD2 ARG A 122 -11.624 -18.963 29.719 1.00 0.00 H new ATOM 0 HD3 ARG A 122 -10.394 -18.139 28.782 1.00 0.00 H new ATOM 0 HE ARG A 122 -10.533 -18.261 31.646 1.00 0.00 H new ATOM 0 HH11 ARG A 122 -9.069 -16.966 32.799 1.00 0.00 H new ATOM 0 HH12 ARG A 122 -8.311 -15.570 32.025 1.00 0.00 H new ATOM 0 HH21 ARG A 122 -9.918 -16.085 28.963 1.00 0.00 H new ATOM 0 HH22 ARG A 122 -8.788 -15.076 29.872 1.00 0.00 H new ATOM 1627 N LEU A 123 -13.907 -14.453 29.073 1.00 0.00 N ATOM 1628 CA LEU A 123 -13.554 -13.232 29.773 1.00 0.00 C ATOM 1629 C LEU A 123 -14.752 -12.698 30.536 1.00 0.00 C ATOM 1630 O LEU A 123 -14.621 -12.226 31.664 1.00 0.00 O ATOM 1631 CB LEU A 123 -13.051 -12.182 28.781 1.00 0.00 C ATOM 1632 CG LEU A 123 -11.677 -12.595 28.234 1.00 0.00 C ATOM 1633 CD1 LEU A 123 -11.254 -11.621 27.125 1.00 0.00 C ATOM 1634 CD2 LEU A 123 -10.639 -12.571 29.368 1.00 0.00 C ATOM 0 H LEU A 123 -13.808 -14.409 28.059 1.00 0.00 H new ATOM 0 HA LEU A 123 -12.758 -13.455 30.483 1.00 0.00 H new ATOM 0 HB2 LEU A 123 -13.761 -12.074 27.961 1.00 0.00 H new ATOM 0 HB3 LEU A 123 -12.980 -11.211 29.271 1.00 0.00 H new ATOM 0 HG LEU A 123 -11.738 -13.604 27.826 1.00 0.00 H new ATOM 0 HD11 LEU A 123 -10.279 -11.914 26.736 1.00 0.00 H new ATOM 0 HD12 LEU A 123 -11.988 -11.646 26.320 1.00 0.00 H new ATOM 0 HD13 LEU A 123 -11.195 -10.611 27.531 1.00 0.00 H new ATOM 0 HD21 LEU A 123 -9.665 -12.865 28.976 1.00 0.00 H new ATOM 0 HD22 LEU A 123 -10.575 -11.565 29.782 1.00 0.00 H new ATOM 0 HD23 LEU A 123 -10.940 -13.267 30.151 1.00 0.00 H new ATOM 1646 N SER A 124 -15.916 -12.780 29.913 1.00 0.00 N ATOM 1647 CA SER A 124 -17.143 -12.314 30.541 1.00 0.00 C ATOM 1648 C SER A 124 -17.504 -13.186 31.741 1.00 0.00 C ATOM 1649 O SER A 124 -17.945 -12.684 32.775 1.00 0.00 O ATOM 1650 CB SER A 124 -18.286 -12.326 29.529 1.00 0.00 C ATOM 1651 OG SER A 124 -19.523 -12.207 30.219 1.00 0.00 O ATOM 0 H SER A 124 -16.038 -13.164 28.976 1.00 0.00 H new ATOM 0 HA SER A 124 -16.982 -11.294 30.891 1.00 0.00 H new ATOM 0 HB2 SER A 124 -18.170 -11.505 28.822 1.00 0.00 H new ATOM 0 HB3 SER A 124 -18.266 -13.250 28.951 1.00 0.00 H new ATOM 0 HG SER A 124 -20.260 -12.213 29.573 1.00 0.00 H new ATOM 1657 N GLU A 125 -17.322 -14.495 31.592 1.00 0.00 N ATOM 1658 CA GLU A 125 -17.641 -15.429 32.666 1.00 0.00 C ATOM 1659 C GLU A 125 -16.820 -15.111 33.910 1.00 0.00 C ATOM 1660 O GLU A 125 -17.332 -15.139 35.028 1.00 0.00 O ATOM 1661 CB GLU A 125 -17.353 -16.862 32.213 1.00 0.00 C ATOM 1662 CG GLU A 125 -17.747 -17.838 33.323 1.00 0.00 C ATOM 1663 CD GLU A 125 -17.477 -19.271 32.877 1.00 0.00 C ATOM 1664 OE1 GLU A 125 -16.396 -19.519 32.368 1.00 0.00 O ATOM 1665 OE2 GLU A 125 -18.355 -20.100 33.052 1.00 0.00 O ATOM 0 H GLU A 125 -16.958 -14.930 30.744 1.00 0.00 H new ATOM 0 HA GLU A 125 -18.699 -15.331 32.908 1.00 0.00 H new ATOM 0 HB2 GLU A 125 -17.910 -17.086 31.303 1.00 0.00 H new ATOM 0 HB3 GLU A 125 -16.295 -16.974 31.975 1.00 0.00 H new ATOM 0 HG2 GLU A 125 -17.183 -17.618 34.229 1.00 0.00 H new ATOM 0 HG3 GLU A 125 -18.802 -17.717 33.567 1.00 0.00 H new ATOM 1672 N LEU A 126 -15.546 -14.802 33.706 1.00 0.00 N ATOM 1673 CA LEU A 126 -14.659 -14.469 34.815 1.00 0.00 C ATOM 1674 C LEU A 126 -15.076 -13.149 35.457 1.00 0.00 C ATOM 1675 O LEU A 126 -14.969 -12.977 36.671 1.00 0.00 O ATOM 1676 CB LEU A 126 -13.213 -14.379 34.329 1.00 0.00 C ATOM 1677 CG LEU A 126 -12.735 -15.771 33.904 1.00 0.00 C ATOM 1678 CD1 LEU A 126 -11.346 -15.662 33.277 1.00 0.00 C ATOM 1679 CD2 LEU A 126 -12.675 -16.698 35.127 1.00 0.00 C ATOM 0 H LEU A 126 -15.104 -14.775 32.787 1.00 0.00 H new ATOM 0 HA LEU A 126 -14.733 -15.259 35.562 1.00 0.00 H new ATOM 0 HB2 LEU A 126 -13.141 -13.686 33.491 1.00 0.00 H new ATOM 0 HB3 LEU A 126 -12.574 -13.989 35.121 1.00 0.00 H new ATOM 0 HG LEU A 126 -13.433 -16.184 33.176 1.00 0.00 H new ATOM 0 HD11 LEU A 126 -11.005 -16.652 32.974 1.00 0.00 H new ATOM 0 HD12 LEU A 126 -11.391 -15.011 32.404 1.00 0.00 H new ATOM 0 HD13 LEU A 126 -10.650 -15.245 34.005 1.00 0.00 H new ATOM 0 HD21 LEU A 126 -12.334 -17.686 34.818 1.00 0.00 H new ATOM 0 HD22 LEU A 126 -11.981 -16.288 35.861 1.00 0.00 H new ATOM 0 HD23 LEU A 126 -13.667 -16.779 35.571 1.00 0.00 H new ATOM 1691 N GLN A 127 -15.543 -12.219 34.631 1.00 0.00 N ATOM 1692 CA GLN A 127 -15.972 -10.915 35.126 1.00 0.00 C ATOM 1693 C GLN A 127 -17.196 -11.051 36.024 1.00 0.00 C ATOM 1694 O GLN A 127 -17.283 -10.408 37.071 1.00 0.00 O ATOM 1695 CB GLN A 127 -16.298 -9.992 33.951 1.00 0.00 C ATOM 1696 CG GLN A 127 -15.001 -9.541 33.277 1.00 0.00 C ATOM 1697 CD GLN A 127 -15.319 -8.728 32.027 1.00 0.00 C ATOM 1698 OE1 GLN A 127 -15.911 -9.249 31.081 1.00 0.00 O ATOM 1699 NE2 GLN A 127 -14.958 -7.476 31.964 1.00 0.00 N ATOM 0 H GLN A 127 -15.634 -12.342 33.623 1.00 0.00 H new ATOM 0 HA GLN A 127 -15.157 -10.487 35.711 1.00 0.00 H new ATOM 0 HB2 GLN A 127 -16.931 -10.512 33.232 1.00 0.00 H new ATOM 0 HB3 GLN A 127 -16.858 -9.125 34.301 1.00 0.00 H new ATOM 0 HG2 GLN A 127 -14.410 -8.942 33.970 1.00 0.00 H new ATOM 0 HG3 GLN A 127 -14.398 -10.409 33.012 1.00 0.00 H new ATOM 0 HE21 GLN A 127 -14.468 -7.046 32.749 1.00 0.00 H new ATOM 0 HE22 GLN A 127 -15.166 -6.927 31.130 1.00 0.00 H new ATOM 1708 N GLN A 128 -18.138 -11.891 35.611 1.00 0.00 N ATOM 1709 CA GLN A 128 -19.354 -12.102 36.387 1.00 0.00 C ATOM 1710 C GLN A 128 -19.010 -12.574 37.796 1.00 0.00 C ATOM 1711 O GLN A 128 -19.656 -12.183 38.767 1.00 0.00 O ATOM 1712 CB GLN A 128 -20.242 -13.139 35.696 1.00 0.00 C ATOM 1713 CG GLN A 128 -20.797 -12.552 34.396 1.00 0.00 C ATOM 1714 CD GLN A 128 -21.649 -13.593 33.677 1.00 0.00 C ATOM 1715 OE1 GLN A 128 -22.502 -14.232 34.293 1.00 0.00 O ATOM 1716 NE2 GLN A 128 -21.468 -13.802 32.401 1.00 0.00 N ATOM 0 H GLN A 128 -18.084 -12.434 34.749 1.00 0.00 H new ATOM 0 HA GLN A 128 -19.892 -11.156 36.454 1.00 0.00 H new ATOM 0 HB2 GLN A 128 -19.668 -14.041 35.484 1.00 0.00 H new ATOM 0 HB3 GLN A 128 -21.060 -13.429 36.355 1.00 0.00 H new ATOM 0 HG2 GLN A 128 -21.395 -11.667 34.613 1.00 0.00 H new ATOM 0 HG3 GLN A 128 -19.977 -12.233 33.752 1.00 0.00 H new ATOM 0 HE21 GLN A 128 -20.761 -13.271 31.893 1.00 0.00 H new ATOM 0 HE22 GLN A 128 -22.034 -14.496 31.913 1.00 0.00 H new ATOM 1725 N TYR A 129 -17.986 -13.413 37.897 1.00 0.00 N ATOM 1726 CA TYR A 129 -17.554 -13.928 39.192 1.00 0.00 C ATOM 1727 C TYR A 129 -16.841 -12.844 39.993 1.00 0.00 C ATOM 1728 O TYR A 129 -16.949 -12.790 41.214 1.00 0.00 O ATOM 1729 CB TYR A 129 -16.622 -15.125 38.997 1.00 0.00 C ATOM 1730 CG TYR A 129 -17.446 -16.372 38.776 1.00 0.00 C ATOM 1731 CD1 TYR A 129 -18.310 -16.455 37.678 1.00 0.00 C ATOM 1732 CD2 TYR A 129 -17.343 -17.445 39.669 1.00 0.00 C ATOM 1733 CE1 TYR A 129 -19.072 -17.612 37.473 1.00 0.00 C ATOM 1734 CE2 TYR A 129 -18.104 -18.602 39.464 1.00 0.00 C ATOM 1735 CZ TYR A 129 -18.969 -18.685 38.366 1.00 0.00 C ATOM 1736 OH TYR A 129 -19.720 -19.825 38.164 1.00 0.00 O ATOM 0 H TYR A 129 -17.442 -13.750 37.103 1.00 0.00 H new ATOM 0 HA TYR A 129 -18.437 -14.246 39.746 1.00 0.00 H new ATOM 0 HB2 TYR A 129 -15.966 -14.954 38.144 1.00 0.00 H new ATOM 0 HB3 TYR A 129 -15.983 -15.248 39.871 1.00 0.00 H new ATOM 0 HD1 TYR A 129 -18.389 -15.627 36.989 1.00 0.00 H new ATOM 0 HD2 TYR A 129 -16.676 -17.380 40.516 1.00 0.00 H new ATOM 0 HE1 TYR A 129 -19.739 -17.676 36.626 1.00 0.00 H new ATOM 0 HE2 TYR A 129 -18.024 -19.430 40.152 1.00 0.00 H new ATOM 0 HH TYR A 129 -19.529 -20.473 38.874 1.00 0.00 H new ATOM 1746 N ARG A 130 -16.105 -11.988 39.296 1.00 0.00 N ATOM 1747 CA ARG A 130 -15.371 -10.911 39.951 1.00 0.00 C ATOM 1748 C ARG A 130 -16.329 -9.962 40.662 1.00 0.00 C ATOM 1749 O ARG A 130 -16.050 -9.492 41.765 1.00 0.00 O ATOM 1750 CB ARG A 130 -14.548 -10.135 38.924 1.00 0.00 C ATOM 1751 CG ARG A 130 -13.709 -9.073 39.638 1.00 0.00 C ATOM 1752 CD ARG A 130 -12.873 -8.307 38.612 1.00 0.00 C ATOM 1753 NE ARG A 130 -13.743 -7.569 37.703 1.00 0.00 N ATOM 1754 CZ ARG A 130 -14.160 -6.342 37.996 1.00 0.00 C ATOM 1755 NH1 ARG A 130 -14.938 -5.701 37.167 1.00 0.00 N ATOM 1756 NH2 ARG A 130 -13.791 -5.776 39.113 1.00 0.00 N ATOM 0 H ARG A 130 -16.000 -12.017 38.282 1.00 0.00 H new ATOM 0 HA ARG A 130 -14.702 -11.353 40.690 1.00 0.00 H new ATOM 0 HB2 ARG A 130 -13.899 -10.816 38.373 1.00 0.00 H new ATOM 0 HB3 ARG A 130 -15.207 -9.663 38.196 1.00 0.00 H new ATOM 0 HG2 ARG A 130 -14.358 -8.385 40.180 1.00 0.00 H new ATOM 0 HG3 ARG A 130 -13.058 -9.544 40.375 1.00 0.00 H new ATOM 0 HD2 ARG A 130 -12.200 -7.618 39.122 1.00 0.00 H new ATOM 0 HD3 ARG A 130 -12.251 -9.002 38.048 1.00 0.00 H new ATOM 0 HE ARG A 130 -14.036 -8.002 36.827 1.00 0.00 H new ATOM 0 HH11 ARG A 130 -15.226 -6.142 36.294 1.00 0.00 H new ATOM 0 HH12 ARG A 130 -15.258 -4.759 37.393 1.00 0.00 H new ATOM 0 HH21 ARG A 130 -13.182 -6.276 39.761 1.00 0.00 H new ATOM 0 HH22 ARG A 130 -14.111 -4.834 39.338 1.00 0.00 H new ATOM 1770 N GLU A 131 -17.456 -9.677 40.019 1.00 0.00 N ATOM 1771 CA GLU A 131 -18.446 -8.775 40.594 1.00 0.00 C ATOM 1772 C GLU A 131 -18.823 -9.219 42.005 1.00 0.00 C ATOM 1773 O GLU A 131 -19.256 -8.411 42.824 1.00 0.00 O ATOM 1774 CB GLU A 131 -19.700 -8.749 39.717 1.00 0.00 C ATOM 1775 CG GLU A 131 -19.372 -8.089 38.376 1.00 0.00 C ATOM 1776 CD GLU A 131 -20.590 -8.135 37.461 1.00 0.00 C ATOM 1777 OE1 GLU A 131 -21.613 -8.640 37.893 1.00 0.00 O ATOM 1778 OE2 GLU A 131 -20.482 -7.665 36.340 1.00 0.00 O ATOM 0 H GLU A 131 -17.706 -10.055 39.105 1.00 0.00 H new ATOM 0 HA GLU A 131 -18.013 -7.776 40.642 1.00 0.00 H new ATOM 0 HB2 GLU A 131 -20.065 -9.763 39.555 1.00 0.00 H new ATOM 0 HB3 GLU A 131 -20.497 -8.200 40.219 1.00 0.00 H new ATOM 0 HG2 GLU A 131 -19.065 -7.055 38.535 1.00 0.00 H new ATOM 0 HG3 GLU A 131 -18.533 -8.601 37.905 1.00 0.00 H new